A0A3B3UX16_9TELE Loading...

5-hydroxytryptamine (serotonin) receptor 5A, genome duplicate a

AlphaFold DB , UniProt , Accession A0A3B3UX16, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 346 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M33.5Very low32.4Very low242 Ų242144.2 Ų144.2100%1.19284%0.843SS**  0118.10-64.1176.3-162.300106.2
2T30.8Very low32.4Very low135 Ų135144.7 Ų144.783%0.82884%0.839SS**  cis-162.2149.91.3-400000106
3Y28.9Very low32.3Very low216 Ų216148.2 Ų148.285%0.84784%0.839SS**  trans-60.1152.3179.8-79.7-104.4000115
4S32.3Very low32.4Very low125 Ų125146.1 Ų146.187%0.87484%0.839SS**  -159.6116.3124.3-22.60000112.7
5N35.8Very low32.4Very low149 Ų149139.9 Ų139.980%0.79782%0.818SS**  trans-82.1152161.3-112.9-14.2000109.3
6S31.1Very low32.4Very low122 Ų122137.5 Ų137.585%0.85382%0.82SS**  trans-154.7100.1143.529.90000111.2
7S32.8Very low32.5Very low105 Ų105138.7 Ų138.773%0.73482%0.82SS**  trans-68.5134.7158.642.40000111.8
8S30.3Very low32.5Very low108 Ų108138.9 Ų138.976%0.75582%0.817SS**  trans159.4118149.846.80000106.9
9L32.6Very low32.3Very low169 Ų169136.1 Ų136.189%0.88582%0.82SS**  -155127.464.4-84.7143.8000110.7
10T32.4Very low32.5Very low129 Ų129140.1 Ų140.179%0.79182%0.821SS**  trans-62136.4165.639.60000112.3
11A36.5Very low32.6Very low86 Ų86140.3 Ų140.371%0.71182%0.82SS**  trans31.8109.1130.700000118.3
12N31.7Very low32.8Very low150 Ų150133.1 Ų133.180%0.80279%0.793SS**  trans-172.598.5134-101.6-10.5000109.8
13F30.9Very low33.2Very low191 Ų191130.7 Ų130.784%0.83880%0.795SS**  trans-158.665.5142.9-139.8-96.4000110.5G15F13-G15 PolarHBondContact O-N 3.48Å
14S34.4Very low33.4Very low119 Ų119123.7 Ų123.783%0.83279%0.789SS**  trans-67.8104.6152.810.40000107.4
15G32.4Very low33.8Very low52 Ų52124.2 Ų124.254%0.53678%0.781SS.*  trans164.563.1175.700000115.3F13F13-G15 PolarHBondContact O-N 3.48Å
16A31.4Very low34.3Very low102 Ų102124.3 Ų124.384%0.84378%0.781SS**  trans177.671.7146.100000109.2
17L34.2Very low35.3Very low158 Ų158128 Ų12883%0.82778%0.778SS**  trans-66.1128.2160.9-88153.9000108.6
18D33Very low36.5Very low142 Ų142133 Ų13376%0.75978%0.781SS**  trans44.394.6137.8-61.2-30.9000118.1
19G28.3Very low38.2Very low85 Ų85133.6 Ų133.688%0.87678%0.782SS**  trans-111.965.1152.300000110.2D21G19-D21 PolarHBondContact O-N 3.43Å
20Y35.8Very low40.1Very low216 Ų216131.5 Ų131.585%0.84777%0.766SS**  trans-8295.7160.3-168.7-94000107.1
21D35.7Very low42.7Very low146 Ų146128.6 Ų128.678%0.78175%0.751SS**  trans-140.498.2159.3-148.26.3000110.9G19G19-D21 PolarHBondContact O-N 3.43Å
22S37.1Very low45.2Very low90 Ų90129.9 Ų129.963%0.62975%0.749SS**  40.6123.2125.9-37.30000120.2
23G38.8Very low47.8Very low84 Ų84129.8 Ų129.887%0.86674%0.742SS**  trans89.411.8138.700000118.6N25G23-N25 PolarHBondContact O-N 2.83Å
24G33Very low50.5Low70 Ų70122.8 Ų122.872%0.72272%0.717SS**  trans-79.896.5170.600000111.8L26G24-L26 PolarHBondContact O-N 3.21Å
25N42.6Very low53.2Low135 Ų135120.5 Ų120.572%0.72270%0.698SS**  trans-57.591.6151.7-101.3-25.8000106.7G23 Y27G23-N25 PolarHBondContact O-N 2.83Å; N25-Y27 HydrophobicContact CB-CD2 4.01Å; N25-Y27 HydrophobicContact CB-CE2 3.82Å; N25-Y27 WeakPolarHBondContact O-CD2 3.43Å; N25-Y27 PolarHBondContact O-N 3.06Å
26L46.2Very low56Low152 Ų152123.2 Ų123.280%0.79670%0.7SS**  trans-70.779.1174.4-163.978000106.9G24 R28G24-L26 PolarHBondContact O-N 3.21Å; L26-R28 PolarHBondContact O-N 3.19Å
27Y50.2Low58.9Low198 Ų198121 Ų12178%0.77668%0.675SS**  trans-59.790.4163-76.6-86.6000106.2N25 P29N25-Y27 HydrophobicContact CB-CD2 4.01Å; N25-Y27 HydrophobicContact CB-CE2 3.82Å; N25-Y27 WeakPolarHBondContact O-CD2 3.43Å; N25-Y27 PolarHBondContact O-N 3.06Å; Y27-P29 WeakPolarHBondContact O-CD 3.36Å
28R59Low61.7Low212 Ų212114.7 Ų114.780%0.864%0.643SS**  trans-56.1113.1163.8-85.4-173.8174.5172.6-0.7105.5L26 F30L26-R28 PolarHBondContact O-N 3.19Å; R28-F30 PolarHBondContact O-N 2.76Å
29P66.6Low64.6Low120 Ų120111.1 Ų111.178%0.77963%0.626SS**PPolyproline II helixtrans-59.6130.2178.424.3-31.8000107.6Y27 S31Y27-P29 WeakPolarHBondContact O-CD 3.36Å; P29-S31 PolarHBondContact O-N 3.01Å; P29-S31 VanDerWaalsContact O-N 3.13Å
30F72.4Confident67.8Low125 Ų125112.2 Ų112.255%0.54861%0.611SS.*PPolyproline II helixtrans-58.4122.6174.4-75.1-78.5000108.1R28 V35 L38R28-F30 PolarHBondContact O-N 2.76Å; F30-V35 HydrophobicContact CB-CG2 3.69Å; F30-L38 HydrophobicContact CD1-CD1 4.19Å; F30-L38 HydrophobicContact CE1-CD1 4.04Å
31S86.2Confident70.6Confident68 Ų68102.7 Ų102.748%0.47658%0.575SS.*PPolyproline II helixtrans-58.5145.1170.1175.80000108.9P29 F33 S34 V35P29-S31 PolarHBondContact O-N 3.01Å; P29-S31 VanDerWaalsContact O-N 3.13Å; S31-F33 PolarHBondContact O-N 3.38Å; S31-F33 VanDerWaalsContact O-N 3.11Å; S31-F33 PolarHBondContact OG-N 3.28Å; S31-S34 WeakPolarHBondContact O-CA 3.44Å; S31-S34 WeakPolarHBondContact O-CB 3.39Å; S31-S34 PolarHBondContact O-N 3.27Å; S31-V35 PolarHBondContact O-N 3.03Å
32V88.4Confident73.5Confident112 Ų11297.8 Ų97.868%0.67955%0.554SS**Hα-helixtrans-50.1-39.3174.3177.50000110.5V35 L36V32-V35 PolarHBondContact O-N 3.21Å; V32-L36 HydrophobicContact CG1-CD1 4.02Å; V32-L36 HydrophobicContact CG1-CG 4.45Å; V32-L36 WeakPolarHBondContact O-CB 3.49Å; V32-L36 WeakPolarHBondContact O-CG 3.46Å; V32-L36 PolarHBondContact O-N 2.88Å
33F87.5Confident76.3Confident148 Ų14899.1 Ų99.165%0.64955%0.552SS**Hα-helixtrans-59-47.1174.3-179.8-99.6000112.4S31 V35 L36 T37S31-F33 PolarHBondContact O-N 3.38Å; S31-F33 VanDerWaalsContact O-N 3.11Å; S31-F33 PolarHBondContact OG-N 3.28Å; F33-V35 PolarHBondContact O-N 3.22Å; F33-L36 PolarHBondContact O-N 3.12Å; F33-T37 PolarHBondContact O-N 2.94Å; F33-T37 PolarHBondContact O-OG1 3.43Å
34S87.1Confident79Confident45 Ų4596.7 Ų96.732%0.31552%0.519SS..Hα-helixtrans-62.7-40.6178.1-57.20000112.1S31 T37 L38S31-S34 WeakPolarHBondContact O-CA 3.44Å; S31-S34 WeakPolarHBondContact O-CB 3.39Å; S31-S34 PolarHBondContact O-N 3.27Å; S34-T37 PolarHBondContact O-N 3.5Å; S34-L38 WeakPolarHBondContact O-CB 3.16Å; S34-L38 WeakPolarHBondContact O-CD1 3.36Å; S34-L38 WeakPolarHBondContact O-CG 3.4Å; S34-L38 PolarHBondContact O-N 2.98Å
35V91.1Very high82Confident71 Ų7194.1 Ų94.143%0.4349%0.489SS..Hα-helixtrans-63-47175.6179.90000110.6F30 S31 V32 F33 T37 L38 T39F30-V35 HydrophobicContact CB-CG2 3.69Å; S31-V35 PolarHBondContact O-N 3.03Å; V32-V35 PolarHBondContact O-N 3.21Å; F33-V35 PolarHBondContact O-N 3.22Å; V35-T37 PolarHBondContact O-N 3.19Å; V35-L38 PolarHBondContact O-N 3.33Å; V35-T39 HydrophobicContact CG1-CG2 4.32Å; V35-T39 WeakPolarHBondContact O-CB 3.24Å; V35-T39 VanDerWaalsContact O-CG2 3.25Å; V35-T39 WeakPolarHBondContact O-CG2 3.41Å; V35-T39 PolarHBondContact O-N 2.83Å; V35-T39 PolarHBondContact O-OG1 3.45Å
36L92.4Very high84.5Confident109 Ų10990.4 Ų90.457%0.57148%0.477SS*.Hα-helixtrans-60.3-43.8176.8-72.6170.5000111.9V32 F33 T39 L40V32-L36 HydrophobicContact CG1-CD1 4.02Å; V32-L36 HydrophobicContact CG1-CG 4.45Å; V32-L36 WeakPolarHBondContact O-CB 3.49Å; V32-L36 WeakPolarHBondContact O-CG 3.46Å; V32-L36 PolarHBondContact O-N 2.88Å; F33-L36 PolarHBondContact O-N 3.12Å; L36-T39 WeakPolarHBondContact CA-OG1 3.35Å; L36-T39 PolarHBondContact O-OG1 3.05Å; L36-L40 WeakPolarHBondContact O-CB 3.27Å; L36-L40 PolarHBondContact O-N 3.39Å
37T91.2Very high86.8Confident54 Ų5485 Ų8533%0.33146%0.455SS..Hα-helixtrans-61.9-50.5176-54.90000111.3F33 S34 V35 T39 L40 L41F33-T37 PolarHBondContact O-N 2.94Å; F33-T37 PolarHBondContact O-OG1 3.43Å; S34-T37 PolarHBondContact O-N 3.5Å; V35-T37 PolarHBondContact O-N 3.19Å; T37-T39 VanDerWaalsContact C-N 3.33Å; T37-T39 PolarHBondContact O-N 3.09Å; T37-L40 PolarHBondContact O-N 3.11Å; T37-L40 VanDerWaalsContact O-N 3.16Å; T37-L41 HydrophobicContact CG2-CD1 4.13Å; T37-L41 HydrophobicContact CG2-CG 4.32Å; T37-L41 VanDerWaalsContact O-CG 3.3Å; T37-L41 WeakPolarHBondContact O-CG 3.46Å; T37-L41 PolarHBondContact O-N 2.88Å
38L93.4Very high88.9Confident27 Ų2775.6 Ų75.614%0.14142%0.418CS..Hα-helixtrans-62.5-39.4-178.2-71.5165.3000112.5F30 S34 V35 L41 A42 L92 E95 L96F30-L38 HydrophobicContact CD1-CD1 4.19Å; F30-L38 HydrophobicContact CE1-CD1 4.04Å; S34-L38 WeakPolarHBondContact O-CB 3.16Å; S34-L38 WeakPolarHBondContact O-CD1 3.36Å; S34-L38 WeakPolarHBondContact O-CG 3.4Å; S34-L38 PolarHBondContact O-N 2.98Å; V35-L38 PolarHBondContact O-N 3.33Å; L38-L41 PolarHBondContact O-N 3.1Å; L38-A42 WeakPolarHBondContact O-CB 3.48Å; L38-A42 PolarHBondContact O-N 3.37Å; L38-L92 HydrophobicContact CD2-CD1 3.97Å; L38-E95 HydrophobicContact CD2-CB 3.97Å; L38-L96 HydrophobicContact CD1-CD2 3.57Å; L38-L96 HydrophobicContact CD2-CD2 3.9Å; L38-L96 HydrophobicContact CD2-CG 4.09Å; L38-L96 HydrophobicContact CG-CD2 4.24Å
39T94Very high90.7Very high67 Ų6769.1 Ų69.141%0.41140%0.395SS..Hα-helixtrans-64.4-42.5174.354.30000111.6V35 L36 T37 A42 M43V35-T39 HydrophobicContact CG1-CG2 4.32Å; V35-T39 WeakPolarHBondContact O-CB 3.24Å; V35-T39 VanDerWaalsContact O-CG2 3.25Å; V35-T39 WeakPolarHBondContact O-CG2 3.41Å; V35-T39 PolarHBondContact O-N 2.83Å; V35-T39 PolarHBondContact O-OG1 3.45Å; L36-T39 WeakPolarHBondContact CA-OG1 3.35Å; L36-T39 PolarHBondContact O-OG1 3.05Å; T37-T39 VanDerWaalsContact C-N 3.33Å; T37-T39 PolarHBondContact O-N 3.09Å; T39-A42 PolarHBondContact O-N 2.92Å; T39-M43 WeakPolarHBondContact O-CG 3.46Å; T39-M43 PolarHBondContact O-N 3.21Å
40L95.2Very high92Very high107 Ų10767.1 Ų67.156%0.5638%0.381SS*.Hα-helixtrans-62.6-42.6175-176.5130.5000112.3L36 T37 M43 L44L36-L40 WeakPolarHBondContact O-CB 3.27Å; L36-L40 PolarHBondContact O-N 3.39Å; T37-L40 PolarHBondContact O-N 3.11Å; T37-L40 VanDerWaalsContact O-N 3.16Å; L40-M43 HydrophobicContact CB-CE 4.39Å; L40-M43 PolarHBondContact O-N 2.95Å; L40-L44 PolarHBondContact O-N 2.91Å
41L95.2Very high92.8Very high17 Ų1765.7 Ų65.79%0.08937%0.372CS..Hα-helixtrans-63.3-44.8175.4-65.4179.7000111.2T37 L38 M43 L44 V45 L92 W314T37-L41 HydrophobicContact CG2-CD1 4.13Å; T37-L41 HydrophobicContact CG2-CG 4.32Å; T37-L41 VanDerWaalsContact O-CG 3.3Å; T37-L41 WeakPolarHBondContact O-CG 3.46Å; T37-L41 PolarHBondContact O-N 2.88Å; L38-L41 PolarHBondContact O-N 3.1Å; L41-M43 VanDerWaalsContact C-N 3.33Å; L41-M43 PolarHBondContact O-N 3.37Å; L41-L44 WeakPolarHBondContact O-CB 3.28Å; L41-L44 PolarHBondContact O-N 3.24Å; L41-L44 VanDerWaalsContact O-N 3.14Å; L41-V45 WeakPolarHBondContact O-CG2 3.41Å; L41-V45 PolarHBondContact O-N 3.34Å; L41-L92 HydrophobicContact CB-CD1 3.97Å; L41-W314 HydrophobicContact CB-CH2 3.98Å; L41-W314 HydrophobicContact CB-CZ2 4.23Å; L41-W314 HydrophobicContact CB-CZ3 4.13Å; L41-W314 HydrophobicContact CD1-CD2 4.05Å; L41-W314 HydrophobicContact CD1-CG 4.4Å; L41-W314 HydrophobicContact CD1-CH2 4.46Å; L41-W314 HydrophobicContact CD1-CZ2 3.89Å; L41-W314 HydrophobicContact CD2-CB 4.31Å; L41-W314 HydrophobicContact CD2-CD2 3.55Å; L41-W314 HydrophobicContact CD2-CE3 3.58Å; L41-W314 HydrophobicContact CD2-CG 3.89Å; L41-W314 HydrophobicContact CD2-CH2 4.5Å; L41-W314 HydrophobicContact CD2-CZ3 4.06Å; L41-W314 HydrophobicContact CG-CD2 4.28Å; L41-W314 HydrophobicContact CG-CE3 4.42Å; L41-W314 HydrophobicContact CG-CZ2 4.42Å
42A96Very high93.1Very high42 Ų4262.5 Ų62.535%0.34735%0.35SS..Hα-helixtrans-60.9-41.4176.200000112.4L38 T39 L44 V45 A46 L92L38-A42 WeakPolarHBondContact O-CB 3.48Å; L38-A42 PolarHBondContact O-N 3.37Å; T39-A42 PolarHBondContact O-N 2.92Å; A42-L44 VanDerWaalsContact C-N 3.35Å; A42-V45 PolarHBondContact O-N 3.28Å; A42-A46 PolarHBondContact O-N 3.32Å; A42-L92 HydrophobicContact CB-CD2 4.02Å
43M95.9Very high93.3Very high118 Ų11860.5 Ų60.558%0.58134%0.335SS*.Hα-helixtrans-62.4-41.5173.6-72.8-172.1-65.900111.8T39 L40 L41 A46 A47T39-M43 WeakPolarHBondContact O-CG 3.46Å; T39-M43 PolarHBondContact O-N 3.21Å; L40-M43 HydrophobicContact CB-CE 4.39Å; L40-M43 PolarHBondContact O-N 2.95Å; L41-M43 VanDerWaalsContact C-N 3.33Å; L41-M43 PolarHBondContact O-N 3.37Å; M43-A46 PolarHBondContact O-N 3.47Å; M43-A47 VanDerWaalsContact O-CB 3.23Å; M43-A47 WeakPolarHBondContact O-CB 3.37Å; M43-A47 PolarHBondContact O-N 3.48Å
44L95.1Very high93.4Very high33 Ų3356.4 Ų56.417%0.17332%0.319CS..Hα-helixtrans-60.3-45.3175.1178.667.3000111.3L40 L41 A42 A47 T48 W314 F321L40-L44 PolarHBondContact O-N 2.91Å; L41-L44 WeakPolarHBondContact O-CB 3.28Å; L41-L44 PolarHBondContact O-N 3.24Å; L41-L44 VanDerWaalsContact O-N 3.14Å; A42-L44 VanDerWaalsContact C-N 3.35Å; L44-A47 PolarHBondContact O-N 3.03Å; L44-T48 VanDerWaalsContact O-CB 3.3Å; L44-T48 WeakPolarHBondContact O-CB 3.31Å; L44-T48 PolarHBondContact O-N 3.09Å; L44-T48 PolarHBondContact O-OG1 2.94Å; L44-W314 HydrophobicContact CD2-CE3 4.26Å; L44-F321 HydrophobicContact CD1-CB 3.95Å; L44-F321 HydrophobicContact CD1-CD1 4.3Å; L44-F321 HydrophobicContact CD1-CD2 4.41Å; L44-F321 HydrophobicContact CD1-CG 3.97Å
45V96.1Very high93.5Very high17 Ų1754.3 Ų54.310%0.10331%0.305CS..Hα-helixtrans-59.1-51.2176.9178.60000110.8L41 A42 A47 T48 F49 M88 P89 W314L41-V45 WeakPolarHBondContact O-CG2 3.41Å; L41-V45 PolarHBondContact O-N 3.34Å; A42-V45 PolarHBondContact O-N 3.28Å; V45-A47 PolarHBondContact O-N 3.18Å; V45-T48 PolarHBondContact O-N 2.94Å; V45-F49 PolarHBondContact O-N 2.95Å; V45-M88 HydrophobicContact CB-CB 4.42Å; V45-M88 HydrophobicContact CB-SD 4.49Å; V45-M88 HydrophobicContact CG1-CB 4.08Å; V45-M88 HydrophobicContact CG2-CB 3.55Å; V45-M88 HydrophobicContact CG2-CG 4.38Å; V45-M88 HydrophobicContact CG2-SD 3.97Å; V45-P89 HydrophobicContact CG1-CG 4.34Å; V45-W314 HydrophobicContact CG2-CH2 3.89Å; V45-W314 HydrophobicContact CG2-CZ3 3.9Å
46A96.3Very high93.4Very high56 Ų5652.3 Ų52.346%0.46329%0.291SS..Hα-helixtrans-61.4-46.2-179.300000111.9A42 M43 T48 F49 V50A42-A46 PolarHBondContact O-N 3.32Å; M43-A46 PolarHBondContact O-N 3.47Å; A46-T48 PolarHBondContact O-N 3Å; A46-F49 PolarHBondContact O-N 3.23Å; A46-V50 WeakPolarHBondContact O-CB 2.94Å; A46-V50 VanDerWaalsContact O-CG2 3.31Å; A46-V50 WeakPolarHBondContact O-CG2 3.27Å; A46-V50 PolarHBondContact O-N 2.96Å
47A94.4Very high93.2Very high39 Ų3949.5 Ų49.532%0.32228%0.279SS..Hα-helixtrans-61.9-43.7177.800000111.7M43 L44 V45 F49 W51 F321M43-A47 VanDerWaalsContact O-CB 3.23Å; M43-A47 WeakPolarHBondContact O-CB 3.37Å; M43-A47 PolarHBondContact O-N 3.48Å; L44-A47 PolarHBondContact O-N 3.03Å; V45-A47 PolarHBondContact O-N 3.18Å; A47-F49 PolarHBondContact O-N 2.87Å; A47-W51 WeakPolarHBondContact O-CB 3.32Å; A47-W51 PolarHBondContact O-N 2.97Å; A47-F321 HydrophobicContact CB-CD2 4.28Å; A47-F321 HydrophobicContact CB-CE2 3.93Å
48T94.6Very high92.9Very high0 Ų047 Ų470%026%0.263CS..Hα-helixtrans-61.4-45.5178.1-55.40000111.3L44 V45 A46 N52 A84 M88L44-T48 VanDerWaalsContact O-CB 3.3Å; L44-T48 WeakPolarHBondContact O-CB 3.31Å; L44-T48 PolarHBondContact O-N 3.09Å; L44-T48 PolarHBondContact O-OG1 2.94Å; V45-T48 PolarHBondContact O-N 2.94Å; A46-T48 PolarHBondContact O-N 3Å; T48-N52 WeakPolarHBondContact O-CB 3.33Å; T48-N52 PolarHBondContact O-N 2.98Å; T48-N52 VanDerWaalsContact O-N 3.1Å; T48-N52 PolarHBondContact O-ND2 3.4Å; T48-A84 HydrophobicContact CG2-CB 3.97Å; T48-M88 HydrophobicContact CG2-CE 3.91Å
49F95.2Very high92.4Very high76 Ų7646 Ų4633%0.33326%0.258SS..Hα-helixtrans-63.2-53.3178.7-178-98.5000111.7V45 A46 A47 W51 L53 V81 A84 A85V45-F49 PolarHBondContact O-N 2.95Å; A46-F49 PolarHBondContact O-N 3.23Å; A47-F49 PolarHBondContact O-N 2.87Å; F49-W51 VanDerWaalsContact C-N 3.33Å; F49-W51 PolarHBondContact O-N 3.2Å; F49-L53 HydrophobicContact CE1-CD2 4.02Å; F49-L53 HydrophobicContact CZ-CD2 4.35Å; F49-L53 WeakPolarHBondContact O-CB 3.4Å; F49-L53 PolarHBondContact O-N 3.23Å; F49-V81 HydrophobicContact CD2-CG1 4.28Å; F49-V81 HydrophobicContact CE2-CG1 3.94Å; F49-A84 HydrophobicContact CB-CB 3.88Å; F49-A84 HydrophobicContact CD2-CB 4.33Å; F49-A85 HydrophobicContact CD2-CB 4.16Å; F49-A85 HydrophobicContact CE2-CB 3.97Å
50V93.7Very high91.9Very high79 Ų7948 Ų4848%0.47927%0.266SS..Hα-helixtrans-59.3-46.6-178.3171.10000110.6A46 L53 L54A46-V50 WeakPolarHBondContact O-CB 2.94Å; A46-V50 VanDerWaalsContact O-CG2 3.31Å; A46-V50 WeakPolarHBondContact O-CG2 3.27Å; A46-V50 PolarHBondContact O-N 2.96Å; V50-L53 PolarHBondContact O-N 3.39Å; V50-L54 HydrophobicContact CG1-CD1 3.94Å; V50-L54 HydrophobicContact CG1-CG 4.41Å; V50-L54 WeakPolarHBondContact O-CB 3.49Å; V50-L54 VanDerWaalsContact O-CG 3.25Å; V50-L54 WeakPolarHBondContact O-CG 3.49Å; V50-L54 PolarHBondContact O-N 3.32Å
51W90.4Very high91.3Very high95 Ų9552 Ų5236%0.3627%0.273SS..Hα-helixtrans-71.4-41.6-173.1-160-67.2000112.4A47 F49 L54 V55 P324 L325 T328A47-W51 WeakPolarHBondContact O-CB 3.32Å; A47-W51 PolarHBondContact O-N 2.97Å; F49-W51 VanDerWaalsContact C-N 3.33Å; F49-W51 PolarHBondContact O-N 3.2Å; W51-L54 PolarHBondContact O-N 3.09Å; W51-V55 WeakPolarHBondContact O-CG2 3.3Å; W51-V55 PolarHBondContact O-N 2.92Å; W51-V55 VanDerWaalsContact O-N 3.07Å; W51-P324 HydrophobicContact CG-CB 4.14Å; W51-L325 HydrophobicContact CH2-CD2 4.25Å; W51-L325 HydrophobicContact CZ2-CD2 3.81Å; W51-T328 HydrophobicContact CZ2-CG2 4.42Å
52N92.6Very high90.6Very high1 Ų153.1 Ų53.11%0.00528%0.281CS..Hα-helixtrans-68.2-35174.4-77.9-74.5000112.3T48 V55 L56 D80 V81 S320 P324T48-N52 WeakPolarHBondContact O-CB 3.33Å; T48-N52 PolarHBondContact O-N 2.98Å; T48-N52 VanDerWaalsContact O-N 3.1Å; T48-N52 PolarHBondContact O-ND2 3.4Å; N52-V55 WeakPolarHBondContact O-CB 3.36Å; N52-V55 PolarHBondContact O-N 3.25Å; N52-L56 WeakPolarHBondContact O-CB 3.09Å; N52-L56 PolarHBondContact O-N 3.5Å; N52-D80 HydrophobicContact CB-CB 4.34Å; N52-D80 WeakPolarHBondContact OD1-CB 3.37Å; N52-V81 HydrophobicContact CB-CG2 3.68Å; N52-S320 PolarHBondContact ND2-O 3.47Å; N52-P324 HydrophobicContact CB-CG 4.49Å; N52-P324 VanDerWaalsContact CG-CG 3.5Å; N52-P324 WeakPolarHBondContact OD1-CD 3.48Å; N52-P324 WeakPolarHBondContact OD1-CG 3.17Å
53L92.7Very high89.2Confident70 Ų7061.6 Ų61.637%0.36630%0.304SS..Hα-helixtrans-63.8-43.3173.5-176.663000111.5F49 V50 V55 L56 V57F49-L53 HydrophobicContact CE1-CD2 4.02Å; F49-L53 HydrophobicContact CZ-CD2 4.35Å; F49-L53 WeakPolarHBondContact O-CB 3.4Å; F49-L53 PolarHBondContact O-N 3.23Å; V50-L53 PolarHBondContact O-N 3.39Å; L53-V55 VanDerWaalsContact C-N 3.34Å; L53-V55 PolarHBondContact O-N 3.44Å; L53-L56 PolarHBondContact O-N 2.91Å; L53-V57 HydrophobicContact CD1-CG2 4.31Å; L53-V57 HydrophobicContact CG-CG2 4.41Å; L53-V57 WeakPolarHBondContact O-CB 3.13Å; L53-V57 VanDerWaalsContact O-CG2 3.29Å; L53-V57 WeakPolarHBondContact O-CG2 3.31Å; L53-V57 PolarHBondContact O-N 2.69Å
54L89.9Confident87.8Confident61 Ų6161 Ų6132%0.31931%0.307SS..Hα-helixtrans-60.5-42.5175.5-74.8171.4000112.1V50 W51 T58 F342V50-L54 HydrophobicContact CG1-CD1 3.94Å; V50-L54 HydrophobicContact CG1-CG 4.41Å; V50-L54 WeakPolarHBondContact O-CB 3.49Å; V50-L54 VanDerWaalsContact O-CG 3.25Å; V50-L54 WeakPolarHBondContact O-CG 3.49Å; V50-L54 PolarHBondContact O-N 3.32Å; W51-L54 PolarHBondContact O-N 3.09Å; L54-T58 VanDerWaalsContact O-CB 3.29Å; L54-T58 WeakPolarHBondContact O-CB 3.39Å; L54-T58 PolarHBondContact O-N 3.22Å; L54-T58 PolarHBondContact O-OG1 2.86Å; L54-F342 HydrophobicContact CD1-CZ 4.5Å; L54-F342 HydrophobicContact CD2-CZ 4.21Å
55V87.9Confident86.5Confident2 Ų259.9 Ų59.91%0.01230%0.301CS..Hα-helixtrans-58-51172.9161.90000110.5W51 N52 L53 V57 T58 I59 A77 P324 Y334W51-V55 WeakPolarHBondContact O-CG2 3.3Å; W51-V55 PolarHBondContact O-N 2.92Å; W51-V55 VanDerWaalsContact O-N 3.07Å; N52-V55 WeakPolarHBondContact O-CB 3.36Å; N52-V55 PolarHBondContact O-N 3.25Å; L53-V55 VanDerWaalsContact C-N 3.34Å; L53-V55 PolarHBondContact O-N 3.44Å; V55-V57 PolarHBondContact O-N 2.83Å; V55-T58 PolarHBondContact O-N 3.47Å; V55-I59 HydrophobicContact CG1-CD1 4.04Å; V55-I59 WeakPolarHBondContact O-CG1 3.38Å; V55-I59 PolarHBondContact O-N 2.91Å; V55-A77 HydrophobicContact CG1-CB 3.91Å; V55-P324 HydrophobicContact CG2-CB 3.75Å; V55-P324 HydrophobicContact CG2-CG 4.1Å; V55-Y334 VanDerWaalsContact C-OH 3.27Å; V55-Y334 WeakPolarHBondContact CA-OH 3.34Å; V55-Y334 HydrophobicContact CB-CE1 4.49Å; V55-Y334 WeakPolarHBondContact CB-OH 3.39Å; V55-Y334 WeakPolarHBondContact CG1-OH 3.24Å; V55-Y334 HydrophobicContact CG2-CE1 4.02Å; V55-Y334 PolarHBondContact O-OH 3.23Å
56L89.2Confident85.1Confident28 Ų2863.3 Ų63.315%0.14732%0.316CS..Hα-helixtrans-60.7-48.7-179-174.660.5000111.6N52 L53 T58 I59 L60 A74 A77 I78N52-L56 WeakPolarHBondContact O-CB 3.09Å; N52-L56 PolarHBondContact O-N 3.5Å; L53-L56 PolarHBondContact O-N 2.91Å; L56-T58 VanDerWaalsContact C-N 3.31Å; L56-T58 PolarHBondContact O-N 2.99Å; L56-I59 PolarHBondContact O-N 3.46Å; L56-L60 HydrophobicContact CD1-CD1 4.26Å; L56-L60 HydrophobicContact CD1-CG 4.41Å; L56-L60 HydrophobicContact CG-CD1 4.03Å; L56-L60 VanDerWaalsContact O-CG 3.28Å; L56-L60 WeakPolarHBondContact O-CG 3.46Å; L56-L60 PolarHBondContact O-N 3.48Å; L56-A74 HydrophobicContact CD1-CB 4.26Å; L56-A77 HydrophobicContact CB-CB 4.47Å; L56-I78 HydrophobicContact CD1-CD1 4.38Å; L56-I78 HydrophobicContact CD1-CG1 3.94Å; L56-I78 HydrophobicContact CD2-CG1 4.04Å
57V88.5Confident83.8Confident51 Ų5167.9 Ų67.931%0.30932%0.321SS..Hα-helixtrans-59.3-41.7176.9170.80000111.4L53 V55 I59 L60 R61L53-V57 HydrophobicContact CD1-CG2 4.31Å; L53-V57 HydrophobicContact CG-CG2 4.41Å; L53-V57 WeakPolarHBondContact O-CB 3.13Å; L53-V57 VanDerWaalsContact O-CG2 3.29Å; L53-V57 WeakPolarHBondContact O-CG2 3.31Å; L53-V57 PolarHBondContact O-N 2.69Å; V55-V57 PolarHBondContact O-N 2.83Å; V57-I59 PolarHBondContact O-N 3Å; V57-L60 PolarHBondContact O-N 2.8Å; V57-R61 HydrophobicContact CG1-CG 4.26Å; V57-R61 WeakPolarHBondContact O-CB 3.4Å; V57-R61 WeakPolarHBondContact O-CG 3.46Å; V57-R61 PolarHBondContact O-N 3.14Å
58T84.5Confident82.4Confident1 Ų166.2 Ų66.21%0.00631%0.307CS..Hα-helixtrans-62-43.3178.7-600000111.6L54 V55 L56 V62 F65 Y334 A337 L341L54-T58 VanDerWaalsContact O-CB 3.29Å; L54-T58 WeakPolarHBondContact O-CB 3.39Å; L54-T58 PolarHBondContact O-N 3.22Å; L54-T58 PolarHBondContact O-OG1 2.86Å; V55-T58 PolarHBondContact O-N 3.47Å; L56-T58 VanDerWaalsContact C-N 3.31Å; L56-T58 PolarHBondContact O-N 2.99Å; T58-V62 WeakPolarHBondContact O-CG2 3.29Å; T58-V62 PolarHBondContact O-N 3.13Å; T58-F65 HydrophobicContact CG2-CE2 4.19Å; T58-Y334 HydrophobicContact CG2-CE1 4.08Å; T58-A337 HydrophobicContact CG2-CB 3.83Å; T58-L341 HydrophobicContact CG2-CD1 3.87Å; T58-L341 VanDerWaalsContact OG1-CD1 3.27Å; T58-L341 WeakPolarHBondContact OG1-CD1 3.37Å
59I83.9Confident81Confident5 Ų568.2 Ų68.23%0.02632%0.32CS..Hα-helixtrans-66.5-42.6178.1-68.1162.3000111V55 L56 V57 H66 H70 V73 A74 Y334V55-I59 HydrophobicContact CG1-CD1 4.04Å; V55-I59 WeakPolarHBondContact O-CG1 3.38Å; V55-I59 PolarHBondContact O-N 2.91Å; L56-I59 PolarHBondContact O-N 3.46Å; V57-I59 PolarHBondContact O-N 3Å; I59-H66 PolarHBondContact O-NE2 3.34Å; I59-H70 HydrophobicContact CG2-CB 4.16Å; I59-V73 HydrophobicContact CD1-CB 4.46Å; I59-V73 HydrophobicContact CD1-CG1 3.95Å; I59-A74 HydrophobicContact CD1-CB 4.25Å; I59-A74 HydrophobicContact CG2-CB 4.14Å; I59-Y334 HydrophobicContact CD1-CE2 4.21Å; I59-Y334 WeakPolarHBondContact CD1-OH 3.33Å; I59-Y334 HydrophobicContact CG1-CE2 3.91Å; I59-Y334 VanDerWaalsContact CG1-OH 3.27Å; I59-Y334 WeakPolarHBondContact CG1-OH 3.2Å
60L83.4Confident80.3Confident111 Ų11165.7 Ų65.758%0.58131%0.309SS*.Hα-helixtrans-70-33-178.3-67.4174.8000113.3L56 V57 H66L56-L60 HydrophobicContact CD1-CD1 4.26Å; L56-L60 HydrophobicContact CD1-CG 4.41Å; L56-L60 HydrophobicContact CG-CD1 4.03Å; L56-L60 VanDerWaalsContact O-CG 3.28Å; L56-L60 WeakPolarHBondContact O-CG 3.46Å; L56-L60 PolarHBondContact O-N 3.48Å; V57-L60 PolarHBondContact O-N 2.8Å; L60-H66 PolarHBondContact O-NE2 3.1Å
61R82.8Confident80Confident189 Ų18963.8 Ų63.871%0.71330%0.296SS*.Hα-helixtrans-80.9-33.9-179.7-73.2-142.4179.9170.9-0.1113.5V57 R63V57-R61 HydrophobicContact CG1-CG 4.26Å; V57-R61 WeakPolarHBondContact O-CB 3.4Å; V57-R61 WeakPolarHBondContact O-CG 3.46Å; V57-R61 PolarHBondContact O-N 3.14Å; R61-R63 PolarHBondContact O-N 3.08Å
62V79Confident80Confident42 Ų4259.2 Ų59.226%0.25528%0.279SS..  trans-95.499.1-174.3179.20000109.8T58 T64 F65 A337T58-V62 WeakPolarHBondContact O-CG2 3.29Å; T58-V62 PolarHBondContact O-N 3.13Å; V62-T64 PolarHBondContact O-N 2.84Å; V62-F65 HydrophobicContact CB-CD2 3.45Å; V62-F65 VanDerWaalsContact CB-CD2 3.45Å; V62-F65 HydrophobicContact CB-CE2 3.8Å; V62-F65 HydrophobicContact CB-CG 4.29Å; V62-F65 HydrophobicContact CG1-CD2 3.54Å; V62-F65 HydrophobicContact CG1-CE2 3.66Å; V62-F65 HydrophobicContact CG1-CG 4.1Å; V62-F65 HydrophobicContact CG1-CZ 4.38Å; V62-F65 HydrophobicContact CG2-CD2 4.2Å; V62-F65 HydrophobicContact CG2-CE2 4.13Å; V62-F65 WeakPolarHBondContact O-CA 3.29Å; V62-F65 WeakPolarHBondContact O-CB 3.48Å; V62-F65 PolarHBondContact O-N 2.86Å; V62-A337 HydrophobicContact CG2-CB 4.28Å
63R66.7Low79.8Confident220 Ų22059.8 Ų59.883%0.8328%0.282SS*.G310 helixtrans-53.3-31.3179.9-69.3-177.4179.7152.8-0.2114R61 F65 H66R61-R63 PolarHBondContact O-N 3.08Å; R63-F65 PolarHBondContact O-N 2.92Å; R63-H66 WeakPolarHBondContact O-CB 3.45Å; R63-H66 PolarHBondContact O-N 3.5Å
64T67.4Low79.7Confident104 Ų10457 Ų5764%0.63827%0.269SS*.G310 helixtrans-60.4-24.4175.6-49.20000112.6V62V62-T64 PolarHBondContact O-N 2.84Å
65F66.9Low79.9Confident10 Ų1054.4 Ų54.44%0.04426%0.256CS..G310 helixtrans-86.2-0.7174.9-63-42.3000114.1T58 V62 R63 R67 H70 N333 A337T58-F65 HydrophobicContact CG2-CE2 4.19Å; V62-F65 HydrophobicContact CB-CD2 3.45Å; V62-F65 VanDerWaalsContact CB-CD2 3.45Å; V62-F65 HydrophobicContact CB-CE2 3.8Å; V62-F65 HydrophobicContact CB-CG 4.29Å; V62-F65 HydrophobicContact CG1-CD2 3.54Å; V62-F65 HydrophobicContact CG1-CE2 3.66Å; V62-F65 HydrophobicContact CG1-CG 4.1Å; V62-F65 HydrophobicContact CG1-CZ 4.38Å; V62-F65 HydrophobicContact CG2-CD2 4.2Å; V62-F65 HydrophobicContact CG2-CE2 4.13Å; V62-F65 WeakPolarHBondContact O-CA 3.29Å; V62-F65 WeakPolarHBondContact O-CB 3.48Å; V62-F65 PolarHBondContact O-N 2.86Å; R63-F65 PolarHBondContact O-N 2.92Å; F65-R67 PolarHBondContact O-N 3.49Å; F65-H70 HydrophobicContact CB-CB 4.22Å; F65-H70 AromaticContact CD1-CD2 3.82Å; F65-H70 AromaticContact CD1-CE1 3.41Å; F65-H70 VanDerWaalsContact CD1-CE1 3.41Å; F65-H70 WeakPolarHBondContact CD1-CE1 3.17Å; F65-H70 AromaticContact CD1-ND1 3.98Å; F65-H70 AromaticContact CD1-NE2 3.31Å; F65-H70 VanDerWaalsContact CD1-NE2 3.31Å; F65-H70 WeakPolarHBondContact CD1-NE2 3.09Å; F65-H70 AromaticContact CE1-CE1 3.92Å; F65-H70 WeakPolarHBondContact O-CB 3.27Å; F65-H70 PolarHBondContact O-CD2 3.43Å; F65-H70 VanDerWaalsContact O-CG 3.26Å; F65-N333 HydrophobicContact CE1-CB 3.95Å; F65-N333 HydrophobicContact CZ-CB 4.16Å; F65-A337 HydrophobicContact CE2-CB 3.48Å; F65-A337 VanDerWaalsContact CE2-CB 3.48Å; F65-A337 HydrophobicContact CZ-CB 3.8Å
66H66.9Low80.1Confident90 Ų9054.3 Ų54.342%0.41726%0.256SS..  trans-74.224.8177.8-67.2-154.6000113.5I59 L60 R63I59-H66 PolarHBondContact O-NE2 3.34Å; L60-H66 PolarHBondContact O-NE2 3.1Å; R63-H66 WeakPolarHBondContact O-CB 3.45Å; R63-H66 PolarHBondContact O-N 3.5Å
67R69.3Low80.3Confident152 Ų15253.1 Ų53.157%0.57425%0.25SC*.SBendtrans-91.6161.9174.8-63.7-172.9179.8-174.91109.7F65 P69 H70 N71F65-R67 PolarHBondContact O-N 3.49Å; R67-P69 WeakPolarHBondContact O-CD 3.34Å; R67-H70 PolarHBondContact O-N 2.7Å; R67-N71 PolarHBondContact O-N 3.46Å
68V64.1Low80.6Confident4 Ų454 Ų542%0.02425%0.252CS..Hα-helixtrans-56.9-32.3-168.5-1710000117.6H70 R148 K149V68-H70 PolarHBondContact O-N 2.87Å; V68-R148 HydrophobicContact CB-CG 3.62Å; V68-R148 HydrophobicContact CG1-CG 3.52Å; V68-R148 HydrophobicContact CG2-CB 4.11Å; V68-R148 HydrophobicContact CG2-CG 3.71Å; V68-K149 VanDerWaalsContact CG2-CA 3.43Å; V68-K149 HydrophobicContact CG2-CB 3.71Å; V68-K149 HydrophobicContact CG2-CG 4.41Å
69P65.4Low81.1Confident42 Ų4254 Ų5427%0.27325%0.252SS..Hα-helixtrans-67.2-29.517625.2-26.9000111.5R67 V73R67-P69 WeakPolarHBondContact O-CD 3.34Å; P69-V73 WeakPolarHBondContact O-CG2 3.22Å; P69-V73 PolarHBondContact O-N 3.15Å
70H81.9Confident81.6Confident23 Ų2353.8 Ų53.811%0.10625%0.251CS..Hα-helixtrans-86.8-25.9-174.8-59.8-71.3000113.1I59 F65 R67 V68 L72 V73 A74I59-H70 HydrophobicContact CG2-CB 4.16Å; F65-H70 HydrophobicContact CB-CB 4.22Å; F65-H70 AromaticContact CD1-CD2 3.82Å; F65-H70 AromaticContact CD1-CE1 3.41Å; F65-H70 VanDerWaalsContact CD1-CE1 3.41Å; F65-H70 WeakPolarHBondContact CD1-CE1 3.17Å; F65-H70 AromaticContact CD1-ND1 3.98Å; F65-H70 AromaticContact CD1-NE2 3.31Å; F65-H70 VanDerWaalsContact CD1-NE2 3.31Å; F65-H70 WeakPolarHBondContact CD1-NE2 3.09Å; F65-H70 AromaticContact CE1-CE1 3.92Å; F65-H70 WeakPolarHBondContact O-CB 3.27Å; F65-H70 PolarHBondContact O-CD2 3.43Å; F65-H70 VanDerWaalsContact O-CG 3.26Å; R67-H70 PolarHBondContact O-N 2.7Å; V68-H70 PolarHBondContact O-N 2.87Å; H70-L72 VanDerWaalsContact C-N 3.34Å; H70-V73 PolarHBondContact O-N 3.25Å; H70-A74 VanDerWaalsContact O-CB 3.22Å; H70-A74 WeakPolarHBondContact O-CB 3.46Å; H70-A74 PolarHBondContact O-N 3.43Å
71N87.3Confident82.2Confident38 Ų3849.7 Ų49.720%0.20323%0.23CC..Hα-helixtrans-63.9-42.2172.2-75.212.1000111.1R67 A74 S75 I156R67-N71 PolarHBondContact O-N 3.46Å; N71-A74 PolarHBondContact O-N 2.86Å; N71-S75 PolarHBondContact O-N 2.95Å; N71-I156 HydrophobicContact CB-CD1 4.34Å
72L89.7Confident82.9Confident0 Ų042.6 Ų42.60%021%0.206CC..Hα-helixtrans-65.4-43.2174.6-66.3172.6000111.5H70 A74 S75 M76 A128 I129 D132 S152 M155 I156H70-L72 VanDerWaalsContact C-N 3.34Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 3.47Å; L72-S75 WeakPolarHBondContact O-CB 3.35Å; L72-S75 PolarHBondContact O-N 3.46Å; L72-M76 PolarHBondContact O-N 3Å; L72-A128 HydrophobicContact CD2-CB 3.91Å; L72-I129 HydrophobicContact CB-CD1 4.44Å; L72-I129 HydrophobicContact CB-CG1 3.68Å; L72-I129 HydrophobicContact CD1-CG1 4.25Å; L72-D132 HydrophobicContact CD1-CB 3.74Å; L72-S152 WeakPolarHBondContact CD2-OG 3.36Å; L72-S152 WeakPolarHBondContact CG-OG 2.99Å; L72-M155 HydrophobicContact CD1-CE 4.15Å; L72-M155 HydrophobicContact CD2-CE 4.39Å; L72-I156 HydrophobicContact CD2-CD1 4.03Å; L72-I156 HydrophobicContact CD2-CG1 3.69Å
73V89Confident83.7Confident12 Ų1240.9 Ų40.97%0.07320%0.195CC..Hα-helixtrans-64.7-35.4174.9172.70000111.7I59 P69 H70 M76 A77 I129 Y327I59-V73 HydrophobicContact CD1-CB 4.46Å; I59-V73 HydrophobicContact CD1-CG1 3.95Å; P69-V73 WeakPolarHBondContact O-CG2 3.22Å; P69-V73 PolarHBondContact O-N 3.15Å; H70-V73 PolarHBondContact O-N 3.25Å; V73-M76 PolarHBondContact O-N 3.13Å; V73-A77 WeakPolarHBondContact O-CB 3.47Å; V73-A77 PolarHBondContact O-N 3.41Å; V73-I129 HydrophobicContact CG2-CD1 4.18Å; V73-Y327 HydrophobicContact CG1-CD2 3.8Å; V73-Y327 HydrophobicContact CG1-CE1 4.44Å; V73-Y327 HydrophobicContact CG1-CE2 3.71Å; V73-Y327 HydrophobicContact CG1-CG 4.25Å; V73-Y327 HydrophobicContact CG2-CD1 4.39Å; V73-Y327 HydrophobicContact CG2-CE1 3.9Å; V73-Y327 HydrophobicContact CG2-CE2 4.46Å
74A90.9Very high85.1Confident13 Ų1330.5 Ų30.511%0.10716%0.157CC..Hα-helixtrans-67.1-42.517500000111.5L56 I59 H70 N71 L72 M76 A77 I78L56-A74 HydrophobicContact CD1-CB 4.26Å; I59-A74 HydrophobicContact CD1-CB 4.25Å; I59-A74 HydrophobicContact CG2-CB 4.14Å; H70-A74 VanDerWaalsContact O-CB 3.22Å; H70-A74 WeakPolarHBondContact O-CB 3.46Å; H70-A74 PolarHBondContact O-N 3.43Å; N71-A74 PolarHBondContact O-N 2.86Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 3.47Å; A74-M76 VanDerWaalsContact C-N 3.31Å; A74-M76 PolarHBondContact O-N 3.23Å; A74-A77 PolarHBondContact O-N 3.38Å; A74-I78 VanDerWaalsContact O-CG1 3.28Å; A74-I78 WeakPolarHBondContact O-CG1 3.42Å; A74-I78 PolarHBondContact O-N 2.9Å
75S93.6Very high86.4Confident6 Ų627.7 Ų27.74%0.04214%0.144CC..Hα-helixtrans-57.9-43.9173-1790000111.4N71 L72 I78 S79 N125 W160N71-S75 PolarHBondContact O-N 2.95Å; L72-S75 WeakPolarHBondContact O-CB 3.35Å; L72-S75 PolarHBondContact O-N 3.46Å; S75-I78 PolarHBondContact O-N 3.44Å; S75-S79 PolarHBondContact O-N 3.39Å; S75-S79 VanDerWaalsContact O-N 3.15Å; S75-N125 WeakPolarHBondContact CB-OD1 3.22Å; S75-N125 PolarHBondContact OG-ND2 3.37Å; S75-N125 PolarHBondContact OG-OD1 3.07Å; S75-W160 PolarHBondContact OG-NE1 3.47Å; S75-W160 VanDerWaalsContact OG-NE1 3.14Å
76M91.3Very high87.8Confident0 Ų030.7 Ų30.70%016%0.16CC..Hα-helixtrans-62.8-46.3173.4-177.5176.9-77.500112.6L72 V73 A74 I78 S79 D80 N125 V126 I129 N323 Y327L72-M76 PolarHBondContact O-N 3Å; V73-M76 PolarHBondContact O-N 3.13Å; A74-M76 VanDerWaalsContact C-N 3.31Å; A74-M76 PolarHBondContact O-N 3.23Å; M76-I78 PolarHBondContact O-N 2.9Å; M76-S79 WeakPolarHBondContact CA-OG 3.41Å; M76-S79 PolarHBondContact O-N 2.74Å; M76-S79 VanDerWaalsContact O-N 3.09Å; M76-S79 PolarHBondContact O-OG 3.4Å; M76-D80 PolarHBondContact O-N 2.95Å; M76-N125 HydrophobicContact CB-CB 4.07Å; M76-N125 HydrophobicContact CE-CB 4.01Å; M76-V126 HydrophobicContact CE-CB 4.06Å; M76-V126 HydrophobicContact CE-CG2 3.24Å; M76-I129 HydrophobicContact CE-CD1 4.02Å; M76-N323 HydrophobicContact SD-CB 4.25Å; M76-Y327 HydrophobicContact SD-CE2 4.15Å; M76-Y327 PolarHBondContact SD-OH 3.13Å
77A93.1Very high89.2Confident3 Ų326.4 Ų26.43%0.02514%0.14CC..Hα-helixtrans-61-35.3178.200000111.9V55 L56 V73 A74 D80 V81V55-A77 HydrophobicContact CG1-CB 3.91Å; L56-A77 HydrophobicContact CB-CB 4.47Å; V73-A77 WeakPolarHBondContact O-CB 3.47Å; V73-A77 PolarHBondContact O-N 3.41Å; A74-A77 PolarHBondContact O-N 3.38Å; A77-D80 PolarHBondContact O-N 2.78Å; A77-V81 WeakPolarHBondContact O-CB 3.44Å; A77-V81 VanDerWaalsContact O-CG2 3.31Å; A77-V81 WeakPolarHBondContact O-CG2 3.39Å; A77-V81 PolarHBondContact O-N 3.09Å
78I95Very high90.4Very high70 Ų7019.2 Ų19.236%0.35911%0.113SC..Hα-helixtrans-62.4-47.8173.1-69.7163.1000110.3L56 A74 S75 M76 D80 V81 M82 W160L56-I78 HydrophobicContact CD1-CD1 4.38Å; L56-I78 HydrophobicContact CD1-CG1 3.94Å; L56-I78 HydrophobicContact CD2-CG1 4.04Å; A74-I78 VanDerWaalsContact O-CG1 3.28Å; A74-I78 WeakPolarHBondContact O-CG1 3.42Å; A74-I78 PolarHBondContact O-N 2.9Å; S75-I78 PolarHBondContact O-N 3.44Å; M76-I78 PolarHBondContact O-N 2.9Å; I78-D80 VanDerWaalsContact C-N 3.32Å; I78-D80 PolarHBondContact O-N 2.86Å; I78-V81 PolarHBondContact O-N 3.43Å; I78-M82 HydrophobicContact CG2-SD 4.21Å; I78-M82 WeakPolarHBondContact O-CG 3.48Å; I78-M82 PolarHBondContact O-N 3.07Å; I78-W160 HydrophobicContact CB-CZ2 4.49Å; I78-W160 HydrophobicContact CG2-CH2 4.11Å; I78-W160 HydrophobicContact CG2-CZ2 4.02Å
79S95.4Very high91.9Very high0 Ų021.2 Ų21.20%013%0.127CC..Hα-helixtrans-60.1-41.7176.251.80000112.3S75 M76 M82 V83S75-S79 PolarHBondContact O-N 3.39Å; S75-S79 VanDerWaalsContact O-N 3.15Å; M76-S79 WeakPolarHBondContact CA-OG 3.41Å; M76-S79 PolarHBondContact O-N 2.74Å; M76-S79 VanDerWaalsContact O-N 3.09Å; M76-S79 PolarHBondContact O-OG 3.4Å; S79-M82 WeakPolarHBondContact O-CB 3.47Å; S79-M82 PolarHBondContact O-N 3.48Å; S79-V83 WeakPolarHBondContact O-CG2 3.18Å; S79-V83 PolarHBondContact O-N 3.02Å
80D95.2Very high93.3Very high1 Ų120.9 Ų20.91%0.00512%0.122CC..Hα-helixtrans-69.1-36.7-179.9-70.1-30.4000112.7N52 M76 A77 I78 M82 V83 A84 S320 N323N52-D80 HydrophobicContact CB-CB 4.34Å; N52-D80 WeakPolarHBondContact OD1-CB 3.37Å; M76-D80 PolarHBondContact O-N 2.95Å; A77-D80 PolarHBondContact O-N 2.78Å; I78-D80 VanDerWaalsContact C-N 3.32Å; I78-D80 PolarHBondContact O-N 2.86Å; D80-M82 VanDerWaalsContact C-N 3.33Å; D80-V83 PolarHBondContact O-N 3.31Å; D80-A84 PolarHBondContact O-N 3.45Å; D80-S320 VanDerWaalsContact OD1-CB 3.26Å; D80-S320 WeakPolarHBondContact OD1-CB 3.4Å; D80-S320 PolarHBondContact OD1-OG 2.96Å; D80-N323 PolarHBondContact OD1-ND2 3.18Å; D80-N323 PolarHBondContact OD2-ND2 3.21Å
81V95.7Very high93.9Very high25 Ų2519.8 Ų19.815%0.15212%0.117CC..Hα-helixtrans-62-42.2170.7168.40000110.6F49 N52 A77 I78 A84 A85F49-V81 HydrophobicContact CD2-CG1 4.28Å; F49-V81 HydrophobicContact CE2-CG1 3.94Å; N52-V81 HydrophobicContact CB-CG2 3.68Å; A77-V81 WeakPolarHBondContact O-CB 3.44Å; A77-V81 VanDerWaalsContact O-CG2 3.31Å; A77-V81 WeakPolarHBondContact O-CG2 3.39Å; A77-V81 PolarHBondContact O-N 3.09Å; I78-V81 PolarHBondContact O-N 3.43Å; V81-A84 PolarHBondContact O-N 3.49Å; V81-A85 WeakPolarHBondContact O-CB 3.23Å; V81-A85 PolarHBondContact O-N 3.41Å
82M96.2Very high94.3Very high40 Ų4019.4 Ų19.420%0.19712%0.115CC..Hα-helixtrans-62.8-41.1176.3-7017466.500111.7I78 S79 D80 A85 L86 F114 L117 C118 W160I78-M82 HydrophobicContact CG2-SD 4.21Å; I78-M82 WeakPolarHBondContact O-CG 3.48Å; I78-M82 PolarHBondContact O-N 3.07Å; S79-M82 WeakPolarHBondContact O-CB 3.47Å; S79-M82 PolarHBondContact O-N 3.48Å; D80-M82 VanDerWaalsContact C-N 3.33Å; M82-A85 PolarHBondContact O-N 3.46Å; M82-L86 HydrophobicContact CE-CD1 4.46Å; M82-L86 WeakPolarHBondContact O-CB 3.33Å; M82-L86 PolarHBondContact O-N 3.26Å; M82-F114 HydrophobicContact CE-CD1 3.8Å; M82-F114 HydrophobicContact CE-CE1 3.65Å; M82-L117 HydrophobicContact CE-CD2 4.19Å; M82-C118 WeakPolarHBondContact CB-SG 3.28Å; M82-W160 HydrophobicContact CE-CZ3 4.46Å; M82-W160 HydrophobicContact SD-CH2 3.73Å; M82-W160 HydrophobicContact SD-CZ3 4.01Å
83V96.1Very high94.4Very high5 Ų521.9 Ų21.93%0.0313%0.13CC..Iπ-helixtrans-57.9-51.4173.3179.90000110.2S79 D80 A85 V87 M88 C118 Y317S79-V83 WeakPolarHBondContact O-CG2 3.18Å; S79-V83 PolarHBondContact O-N 3.02Å; D80-V83 PolarHBondContact O-N 3.31Å; V83-A85 VanDerWaalsContact C-N 3.32Å; V83-A85 PolarHBondContact O-N 3.35Å; V83-V87 HydrophobicContact CG1-CB 4.24Å; V83-V87 WeakPolarHBondContact O-CA 3.17Å; V83-V87 WeakPolarHBondContact O-CB 3.27Å; V83-V87 PolarHBondContact O-N 3Å; V83-M88 HydrophobicContact CB-CE 4.41Å; V83-M88 HydrophobicContact CG1-CE 3.5Å; V83-M88 HydrophobicContact CG1-CG 3.88Å; V83-M88 PolarHBondContact O-N 2.95Å; V83-C118 HydrophobicContact CG2-CB 3.38Å; V83-Y317 HydrophobicContact CG1-CD1 3.91Å; V83-Y317 HydrophobicContact CG1-CE1 4.25Å
84A96.2Very high94.5Very high3 Ų322.6 Ų22.63%0.02513%0.132CC..Iπ-helixtrans-68.2-28.7-176.900000113.8T48 F49 D80 V81 M88 P89T48-A84 HydrophobicContact CG2-CB 3.97Å; F49-A84 HydrophobicContact CB-CB 3.88Å; F49-A84 HydrophobicContact CD2-CB 4.33Å; D80-A84 PolarHBondContact O-N 3.45Å; V81-A84 PolarHBondContact O-N 3.49Å; A84-M88 HydrophobicContact CB-SD 4.5Å; A84-P89 VanDerWaalsContact O-CD 3.29Å; A84-P89 WeakPolarHBondContact O-CD 3.3Å; A84-P89 WeakPolarHBondContact O-CG 3.46Å
85A95.7Very high94.6Very high45 Ų4523 Ų2337%0.37213%0.132SC..Iπ-helixtrans-90.5-36.7-177.400000113.8F49 V81 M82 V83F49-A85 HydrophobicContact CD2-CB 4.16Å; F49-A85 HydrophobicContact CE2-CB 3.97Å; V81-A85 WeakPolarHBondContact O-CB 3.23Å; V81-A85 PolarHBondContact O-N 3.41Å; M82-A85 PolarHBondContact O-N 3.46Å; V83-A85 VanDerWaalsContact C-N 3.32Å; V83-A85 PolarHBondContact O-N 3.35Å
86L94.9Very high94.4Very high73 Ų7326.6 Ų26.638%0.38215%0.15SC..Iπ-helixtrans-111.8-32.1-170.3-56.1177.9000112.8M82 L90 F114M82-L86 HydrophobicContact CE-CD1 4.46Å; M82-L86 WeakPolarHBondContact O-CB 3.33Å; M82-L86 PolarHBondContact O-N 3.26Å; L86-L90 WeakPolarHBondContact O-CD1 3.4Å; L86-F114 HydrophobicContact CD1-CD1 3.82Å; L86-F114 HydrophobicContact CD1-CD2 4.5Å; L86-F114 HydrophobicContact CD1-CE1 3.72Å; L86-F114 HydrophobicContact CD1-CE2 4.42Å; L86-F114 HydrophobicContact CD1-CG 4.23Å; L86-F114 HydrophobicContact CD1-CZ 4.04Å
87V96.2Very high94.3Very high0 Ų029.1 Ų29.10%016%0.164CC..Iπ-helixtrans-99-57.3-170.5-179.70000111.4V83 P89 L90 S91 W111 F114 D115 Y317V83-V87 HydrophobicContact CG1-CB 4.24Å; V83-V87 WeakPolarHBondContact O-CA 3.17Å; V83-V87 WeakPolarHBondContact O-CB 3.27Å; V83-V87 PolarHBondContact O-N 3Å; V87-P89 VanDerWaalsContact C-CD 3.5Å; V87-L90 PolarHBondContact O-N 3.14Å; V87-S91 PolarHBondContact O-N 2.8Å; V87-W111 PolarHBondContact O-NE1 2.71Å; V87-F114 HydrophobicContact CG2-CB 3.88Å; V87-D115 HydrophobicContact CG1-CB 3.86Å; V87-D115 VanDerWaalsContact CG1-OD1 3.27Å; V87-D115 WeakPolarHBondContact CG1-OD1 3.44Å; V87-D115 HydrophobicContact CG2-CB 4.46Å; V87-Y317 HydrophobicContact CG1-CE1 3.74Å; V87-Y317 HydrophobicContact CG1-CE2 4.39Å; V87-Y317 WeakPolarHBondContact CG1-OH 3.4Å
88M95.8Very high93.9Very high0 Ų031.7 Ų31.70%019%0.191CC..Hα-helixtrans-61.5-36.4-176.3-56.7-173.1-170.800113.9V45 T48 V83 A84 L90 S91 L92 W314 Y317V45-M88 HydrophobicContact CB-CB 4.42Å; V45-M88 HydrophobicContact CB-SD 4.49Å; V45-M88 HydrophobicContact CG1-CB 4.08Å; V45-M88 HydrophobicContact CG2-CB 3.55Å; V45-M88 HydrophobicContact CG2-CG 4.38Å; V45-M88 HydrophobicContact CG2-SD 3.97Å; T48-M88 HydrophobicContact CG2-CE 3.91Å; V83-M88 HydrophobicContact CB-CE 4.41Å; V83-M88 HydrophobicContact CG1-CE 3.5Å; V83-M88 HydrophobicContact CG1-CG 3.88Å; V83-M88 PolarHBondContact O-N 2.95Å; A84-M88 HydrophobicContact CB-SD 4.5Å; M88-L90 PolarHBondContact O-N 3.39Å; M88-S91 PolarHBondContact O-N 3.28Å; M88-L92 WeakPolarHBondContact O-CB 3.45Å; M88-L92 PolarHBondContact O-N 3.41Å; M88-W314 HydrophobicContact CB-CH2 4.45Å; M88-W314 HydrophobicContact CB-CZ3 4.47Å; M88-Y317 HydrophobicContact CE-CG 4.26Å; M88-Y317 VanDerWaalsContact CE-O 3.32Å; M88-Y317 WeakPolarHBondContact CE-O 3.34Å; M88-Y317 HydrophobicContact CG-CD2 4.09Å; M88-Y317 HydrophobicContact CG-CG 4.12Å
89P95.8Very high93.5Very high47 Ų4732.4 Ų32.431%0.30519%0.189SC..Hα-helixtrans-64.3-39.7177.1-25.537.6000112.7V45 A84 V87 L92 V93V45-P89 HydrophobicContact CG1-CG 4.34Å; A84-P89 VanDerWaalsContact O-CD 3.29Å; A84-P89 WeakPolarHBondContact O-CD 3.3Å; A84-P89 WeakPolarHBondContact O-CG 3.46Å; V87-P89 VanDerWaalsContact C-CD 3.5Å; P89-L92 PolarHBondContact O-N 3.27Å; P89-V93 WeakPolarHBondContact O-CG2 3.31Å; P89-V93 PolarHBondContact O-N 3.33Å
90L94.6Very high93.1Very high35 Ų3536.1 Ų36.118%0.18321%0.208CC..Hα-helixtrans-67.6-39.3175.8-65.4178.9000111.2L86 V87 M88 V93 H94 W101 L103 W111L86-L90 WeakPolarHBondContact O-CD1 3.4Å; V87-L90 PolarHBondContact O-N 3.14Å; M88-L90 PolarHBondContact O-N 3.39Å; L90-V93 PolarHBondContact O-N 3.1Å; L90-H94 PolarHBondContact O-N 3.41Å; L90-W101 HydrophobicContact CB-CH2 4.42Å; L90-L103 HydrophobicContact CD2-CD1 4.09Å; L90-W111 HydrophobicContact CB-CB 4.44Å; L90-W111 HydrophobicContact CB-CD2 4.18Å; L90-W111 HydrophobicContact CB-CG 3.92Å; L90-W111 HydrophobicContact CD1-CB 3.73Å; L90-W111 HydrophobicContact CD1-CG 4.04Å
91S94.4Very high92.8Very high0 Ų036.3 Ų36.30%021%0.209CC..Hα-helixtrans-61.7-41172.2-172.80000112.4V87 M88 H94 E95V87-S91 PolarHBondContact O-N 2.8Å; M88-S91 PolarHBondContact O-N 3.28Å; S91-H94 WeakPolarHBondContact O-CB 3.49Å; S91-H94 PolarHBondContact O-N 2.93Å; S91-E95 PolarHBondContact O-N 3.25Å
92L94.6Very high92.4Very high30 Ų3041.6 Ų41.616%0.15723%0.23CC..Hα-helixtrans-64.5-42.6176.5-175.263.4000111.8L38 L41 A42 M88 P89 H94 E95 L96 W314L38-L92 HydrophobicContact CD2-CD1 3.97Å; L41-L92 HydrophobicContact CB-CD1 3.97Å; A42-L92 HydrophobicContact CB-CD2 4.02Å; M88-L92 WeakPolarHBondContact O-CB 3.45Å; M88-L92 PolarHBondContact O-N 3.41Å; P89-L92 PolarHBondContact O-N 3.27Å; L92-H94 VanDerWaalsContact C-N 3.27Å; L92-H94 PolarHBondContact O-N 2.99Å; L92-E95 PolarHBondContact O-N 3.34Å; L92-L96 HydrophobicContact CG-CD1 4.42Å; L92-L96 WeakPolarHBondContact O-CG 3.25Å; L92-L96 PolarHBondContact O-N 3.43Å; L92-W314 HydrophobicContact CB-CH2 4.22Å; L92-W314 HydrophobicContact CB-CZ2 4.22Å; L92-W314 HydrophobicContact CD1-CH2 4.44Å; L92-W314 HydrophobicContact CD1-CZ2 4.35Å
93V93.4Very high92Very high51 Ų5142.8 Ų42.831%0.30924%0.237SC..Hα-helixtrans-63.4-35.4173.8173.40000111.4P89 L90 L96 N97 L103P89-V93 WeakPolarHBondContact O-CG2 3.31Å; P89-V93 PolarHBondContact O-N 3.33Å; L90-V93 PolarHBondContact O-N 3.1Å; V93-L96 PolarHBondContact O-N 3.34Å; V93-N97 WeakPolarHBondContact CG1-ND2 3.48Å; V93-N97 PolarHBondContact O-N 3Å; V93-N97 VanDerWaalsContact O-N 3.07Å; V93-N97 PolarHBondContact O-ND2 3.49Å; V93-L103 HydrophobicContact CG1-CD1 3.93Å; V93-L103 HydrophobicContact CG1-CG 4.5Å
94H91.3Very high91.6Very high27 Ų2744.1 Ų44.113%0.12525%0.251CS..Hα-helixtrans-63.7-42.9173.8-178.665.8000112.1L90 S91 L92 N97 R99 W101 W111L90-H94 PolarHBondContact O-N 3.41Å; S91-H94 WeakPolarHBondContact O-CB 3.49Å; S91-H94 PolarHBondContact O-N 2.93Å; L92-H94 VanDerWaalsContact C-N 3.27Å; L92-H94 PolarHBondContact O-N 2.99Å; H94-N97 PolarHBondContact O-N 3.38Å; H94-R99 PolarHBondContact CE1-O 2.85Å; H94-R99 VanDerWaalsContact O-CA 3.28Å; H94-R99 WeakPolarHBondContact O-CA 3.47Å; H94-R99 PolarHBondContact O-N 3.17Å; H94-W101 HydrophobicContact CB-CE3 4.28Å; H94-W101 HydrophobicContact CB-CZ3 4.36Å; H94-W101 AromaticContact ND1-CE3 3.92Å; H94-W111 HydrophobicContact CB-CH2 3.96Å; H94-W111 HydrophobicContact CB-CZ3 4.23Å; H94-W111 AromaticContact CD2-CH2 4Å; H94-W111 AromaticContact CG-CH2 3.98Å
95E91.3Very high91.1Very high23 Ų2349.3 Ų49.311%0.10727%0.27CS..Hα-helixtrans-63.9-42.3173.4-69.9-60.114500112.4L38 S91 L92 N97 G98 R99 S310L38-E95 HydrophobicContact CD2-CB 3.97Å; S91-E95 PolarHBondContact O-N 3.25Å; L92-E95 PolarHBondContact O-N 3.34Å; E95-N97 PolarHBondContact O-N 2.95Å; E95-G98 PolarHBondContact O-N 3.03Å; E95-R99 IonicContact OE1-NE 3.6Å; E95-R99 IonicContact OE2-CZ 3.44Å; E95-R99 IonicContact OE2-NE 2.87Å; E95-R99 PolarHBondContact OE2-NE 3.39Å; E95-R99 IonicContact OE2-NH2 3.11Å; E95-R99 PolarHBondContact OE2-NH2 3.29Å; E95-R99 VanDerWaalsContact OE2-NH2 3.11Å; E95-S310 WeakPolarHBondContact OE1-CB 3.19Å; E95-S310 PolarHBondContact OE1-OG 2.84Å; E95-S310 PolarHBondContact OE2-OG 3.35Å
96L90.6Very high90.7Very high80 Ų8052.1 Ų52.142%0.41928%0.282SS..Hα-helixtrans-60.3-34.8177.8-75.1168.6000112.6L38 L92 V93 G98L38-L96 HydrophobicContact CD1-CD2 3.57Å; L38-L96 HydrophobicContact CD2-CD2 3.9Å; L38-L96 HydrophobicContact CD2-CG 4.09Å; L38-L96 HydrophobicContact CG-CD2 4.24Å; L92-L96 HydrophobicContact CG-CD1 4.42Å; L92-L96 WeakPolarHBondContact O-CG 3.25Å; L92-L96 PolarHBondContact O-N 3.43Å; V93-L96 PolarHBondContact O-N 3.34Å; L96-G98 PolarHBondContact O-N 3.49Å
97N88.6Confident90.5Very high54 Ų5452.2 Ų52.229%0.28928%0.283SS..THydrogen-bonded Turntrans-80.913.1176.8-75-52.2000113.6V93 H94 E95 L100V93-N97 WeakPolarHBondContact CG1-ND2 3.48Å; V93-N97 PolarHBondContact O-N 3Å; V93-N97 VanDerWaalsContact O-N 3.07Å; V93-N97 PolarHBondContact O-ND2 3.49Å; H94-N97 PolarHBondContact O-N 3.38Å; E95-N97 PolarHBondContact O-N 2.95Å; N97-L100 WeakPolarHBondContact CB-O 3.38Å
98G85.4Confident90.2Very high57 Ų5752.2 Ų52.259%0.58828%0.283SS*.THydrogen-bonded Turntrans71.331.4-179.400000113.1E95 L96 L100E95-G98 PolarHBondContact O-N 3.03Å; L96-G98 PolarHBondContact O-N 3.49Å; G98-L100 VanDerWaalsContact C-N 3.27Å; G98-L100 PolarHBondContact O-N 3.03Å
99R87.1Confident89.9Confident85 Ų8554.9 Ų54.932%0.32130%0.295SS..SBendtrans63.931-177.7-53.1174.5-171.6122.710113.6H94 E95H94-R99 PolarHBondContact CE1-O 2.85Å; H94-R99 VanDerWaalsContact O-CA 3.28Å; H94-R99 WeakPolarHBondContact O-CA 3.47Å; H94-R99 PolarHBondContact O-N 3.17Å; E95-R99 IonicContact OE1-NE 3.6Å; E95-R99 IonicContact OE2-CZ 3.44Å; E95-R99 IonicContact OE2-NE 2.87Å; E95-R99 PolarHBondContact OE2-NE 3.39Å; E95-R99 IonicContact OE2-NH2 3.11Å; E95-R99 PolarHBondContact OE2-NH2 3.29Å; E95-R99 VanDerWaalsContact OE2-NH2 3.11Å
100L86.4Confident89.6Confident78 Ų7855.5 Ų55.541%0.40830%0.298SS..  trans-111132.5171.3-64.9171000109N97 G98N97-L100 WeakPolarHBondContact CB-O 3.38Å; G98-L100 VanDerWaalsContact C-N 3.27Å; G98-L100 PolarHBondContact O-N 3.03Å
101W88.8Confident89.5Confident4 Ų454.2 Ų54.22%0.01529%0.291CS..  trans-89.8110-179.1-173.4-95000111.4L90 H94 L103 G104 L107 C108 W111 Y178 M182 C184L90-W101 HydrophobicContact CB-CH2 4.42Å; H94-W101 HydrophobicContact CB-CE3 4.28Å; H94-W101 HydrophobicContact CB-CZ3 4.36Å; H94-W101 AromaticContact ND1-CE3 3.92Å; W101-L103 HydrophobicContact CH2-CB 4.23Å; W101-L103 HydrophobicContact CH2-CD1 3.77Å; W101-L103 HydrophobicContact CZ2-CB 3.63Å; W101-L103 HydrophobicContact CZ2-CD1 4.06Å; W101-L103 HydrophobicContact CZ2-CG 4.38Å; W101-L103 HydrophobicContact CZ3-CD1 4.13Å; W101-G104 PolarHBondContact NE1-O 3.38Å; W101-L107 VanDerWaalsContact CZ2-C 3.49Å; W101-L107 HydrophobicContact CZ2-CB 3.85Å; W101-C108 HydrophobicContact CD2-CB 4.49Å; W101-C108 HydrophobicContact CZ2-CB 4.04Å; W101-C108 VanDerWaalsContact CZ2-N 3.32Å; W101-W111 AromaticContact CE3-CE3 3.65Å; W101-W111 HydrophobicContact CE3-CE3 3.65Å; W101-W111 AromaticContact CE3-CZ3 3.51Å; W101-W111 HydrophobicContact CE3-CZ3 3.51Å; W101-W111 HydrophobicContact CH2-CB 4.22Å; W101-W111 HydrophobicContact CH2-CD2 4.09Å; W101-W111 AromaticContact CH2-CE3 3.47Å; W101-W111 HydrophobicContact CH2-CE3 3.47Å; W101-W111 VanDerWaalsContact CH2-CE3 3.47Å; W101-W111 HydrophobicContact CH2-CG 4.42Å; W101-W111 HydrophobicContact CH2-CZ3 4.18Å; W101-W111 HydrophobicContact CZ2-CE3 4.36Å; W101-W111 AromaticContact CZ3-CD2 3.93Å; W101-W111 HydrophobicContact CZ3-CD2 3.93Å; W101-W111 AromaticContact CZ3-CE3 3.06Å; W101-W111 HydrophobicContact CZ3-CE3 3.06Å; W101-W111 HydrophobicContact CZ3-CH2 4.32Å; W101-W111 AromaticContact CZ3-CZ3 3.3Å; W101-W111 HydrophobicContact CZ3-CZ3 3.3Å; W101-Y178 AromaticContact CD1-CE2 3.96Å; W101-M182 WeakPolarHBondContact CB-O 3.48Å; W101-M182 PolarHBondContact N-O 3.15Å; W101-C184 HydrophobicContact CB-CB 3.67Å; W101-C184 HydrophobicContact CD2-CB 3.59Å; W101-C184 HydrophobicContact CE3-CB 3.99Å; W101-C184 HydrophobicContact CG-CB 3.44Å; W101-C184 VanDerWaalsContact CG-CB 3.44Å
102K87.2Confident89.4Confident137 Ų13754.7 Ų54.760%0.59629%0.293SS*.  trans-109.5-3.5-178-62.3-176.31801790114.6G104K102-G104 VanDerWaalsContact C-N 3.27Å; K102-G104 PolarHBondContact O-N 3.33Å
103L87Confident89.2Confident65 Ų6554 Ų5434%0.3429%0.291SS..SBendtrans-867.2-172.7-62.3173.8000113.6L90 V93 W101 L107L90-L103 HydrophobicContact CD2-CD1 4.09Å; V93-L103 HydrophobicContact CG1-CD1 3.93Å; V93-L103 HydrophobicContact CG1-CG 4.5Å; W101-L103 HydrophobicContact CH2-CB 4.23Å; W101-L103 HydrophobicContact CH2-CD1 3.77Å; W101-L103 HydrophobicContact CZ2-CB 3.63Å; W101-L103 HydrophobicContact CZ2-CD1 4.06Å; W101-L103 HydrophobicContact CZ2-CG 4.38Å; W101-L103 HydrophobicContact CZ3-CD1 4.13Å; L103-L107 HydrophobicContact CB-CB 4.15Å; L103-L107 HydrophobicContact CB-CD1 3.88Å
104G87.8Confident89.3Confident32 Ų3254.7 Ų54.733%0.3329%0.29SS..Hα-helixtrans81.6171.1177.200000114.9W101 K102 C108W101-G104 PolarHBondContact NE1-O 3.38Å; K102-G104 VanDerWaalsContact C-N 3.27Å; K102-G104 PolarHBondContact O-N 3.33Å; G104-C108 PolarHBondContact O-N 2.94Å
105R86.4Confident89.4Confident112 Ų11253.9 Ų53.942%0.42329%0.287SS..Hα-helixtrans-64.2-43.9-172.8-177.7-177.8-76.8-136.4-1.2113.2C108 Q109 Y178R105-C108 WeakPolarHBondContact O-CB 3.39Å; R105-C108 PolarHBondContact O-N 2.73Å; R105-Q109 PolarHBondContact O-N 2.95Å; R105-Y178 HydrophobicContact CB-CD1 4.23Å; R105-Y178 HydrophobicContact CB-CG 4.3Å; R105-Y178 HydrophobicContact CG-CD1 4.19Å; R105-Y178 HydrophobicContact CG-CG 4.17Å
106V87.9Confident89.4Confident104 Ų10453.7 Ų53.763%0.6329%0.287SS*.Hα-helixtrans-63-48-175.4178.80000111.3C108 Q109 V110V106-C108 VanDerWaalsContact C-N 3.27Å; V106-C108 PolarHBondContact O-N 2.91Å; V106-Q109 PolarHBondContact O-N 3.25Å; V106-V110 HydrophobicContact CG1-CG2 4.48Å; V106-V110 VanDerWaalsContact O-CG2 3.32Å; V106-V110 WeakPolarHBondContact O-CG2 3.31Å; V106-V110 PolarHBondContact O-N 3.42Å
107L90.1Very high89.6Confident75 Ų7550.9 Ų50.939%0.39327%0.272SS..Hα-helixtrans-66.4-30.6177.9-76.9174000112.3W101 L103 W111W101-L107 VanDerWaalsContact CZ2-C 3.49Å; W101-L107 HydrophobicContact CZ2-CB 3.85Å; L103-L107 HydrophobicContact CB-CB 4.15Å; L103-L107 HydrophobicContact CB-CD1 3.88Å; L107-W111 VanDerWaalsContact O-CB 3.26Å; L107-W111 WeakPolarHBondContact O-CB 3.2Å; L107-W111 PolarHBondContact O-N 3Å
108C90.6Very high89.9Confident0 Ų048.3 Ų48.30%026%0.258CS..Hα-helixtrans-64-49.4173.4174.80000110.8W101 G104 R105 V106 V110 W111 I112 T177 Y178 C184W101-C108 HydrophobicContact CD2-CB 4.49Å; W101-C108 HydrophobicContact CZ2-CB 4.04Å; W101-C108 VanDerWaalsContact CZ2-N 3.32Å; G104-C108 PolarHBondContact O-N 2.94Å; R105-C108 WeakPolarHBondContact O-CB 3.39Å; R105-C108 PolarHBondContact O-N 2.73Å; V106-C108 VanDerWaalsContact C-N 3.27Å; V106-C108 PolarHBondContact O-N 2.91Å; C108-V110 VanDerWaalsContact C-N 3.33Å; C108-V110 PolarHBondContact O-N 3.4Å; C108-W111 PolarHBondContact O-N 3.03Å; C108-I112 WeakPolarHBondContact O-CG1 3.49Å; C108-I112 PolarHBondContact O-N 3.08Å; C108-T177 PolarHBondContact SG-O 2.85Å; C108-T177 VanDerWaalsContact SG-O 3.41Å; C108-Y178 HydrophobicContact CB-CD2 4.21Å; C108-C184 WeakPolarHBondContact CA-SG 3.48Å; C108-C184 HydrophobicContact CB-CB 3.86Å; C108-C184 WeakPolarHBondContact CB-SG 3.46Å; C108-C184 WeakPolarHBondContact SG-CA 3.14Å; C108-C184 WeakPolarHBondContact SG-CB 3.38Å; C108-C184 CovalentContact SG-SG 2.02Å; C108-C184 PolarHBondContact SG-SG 3.5Å
109Q88.6Confident90.3Very high56 Ų5646 Ų4626%0.26223%0.233SC..Hα-helixtrans-58.7-46.6177.5-74.7175.3-25.900111.3R105 V106 W111 I112 S113 L171 T177R105-Q109 PolarHBondContact O-N 2.95Å; V106-Q109 PolarHBondContact O-N 3.25Å; Q109-W111 PolarHBondContact O-N 2.98Å; Q109-I112 PolarHBondContact O-N 2.94Å; Q109-S113 VanDerWaalsContact O-CB 3.27Å; Q109-S113 WeakPolarHBondContact O-CB 3.13Å; Q109-S113 PolarHBondContact O-N 2.83Å; Q109-S113 PolarHBondContact O-OG 3.4Å; Q109-L171 HydrophobicContact CB-CD2 4.38Å; Q109-T177 WeakPolarHBondContact CG-OG1 3.2Å
110V89.9Confident90.6Very high60 Ų6042 Ų4236%0.36422%0.218SC..Hα-helixtrans-59.5-48.1176.2170.70000111V106 C108 S113 F114V106-V110 HydrophobicContact CG1-CG2 4.48Å; V106-V110 VanDerWaalsContact O-CG2 3.32Å; V106-V110 WeakPolarHBondContact O-CG2 3.31Å; V106-V110 PolarHBondContact O-N 3.42Å; C108-V110 VanDerWaalsContact C-N 3.33Å; C108-V110 PolarHBondContact O-N 3.4Å; V110-S113 PolarHBondContact O-N 2.83Å; V110-F114 HydrophobicContact CG1-CD2 3.64Å; V110-F114 HydrophobicContact CG1-CE2 3.78Å; V110-F114 VanDerWaalsContact O-CD2 3.28Å; V110-F114 WeakPolarHBondContact O-CD2 3.43Å; V110-F114 PolarHBondContact O-N 2.92Å
111W92.9Very high91.1Very high9 Ų938.2 Ų38.23%0.03420%0.198CC..Hα-helixtrans-58.3-53.1179.717926000111.6V87 L90 H94 W101 L107 C108 Q109 S113 F114 D115 C184 L313V87-W111 PolarHBondContact O-NE1 2.71Å; L90-W111 HydrophobicContact CB-CB 4.44Å; L90-W111 HydrophobicContact CB-CD2 4.18Å; L90-W111 HydrophobicContact CB-CG 3.92Å; L90-W111 HydrophobicContact CD1-CB 3.73Å; L90-W111 HydrophobicContact CD1-CG 4.04Å; H94-W111 HydrophobicContact CB-CH2 3.96Å; H94-W111 HydrophobicContact CB-CZ3 4.23Å; H94-W111 AromaticContact CD2-CH2 4Å; H94-W111 AromaticContact CG-CH2 3.98Å; W101-W111 AromaticContact CE3-CE3 3.65Å; W101-W111 HydrophobicContact CE3-CE3 3.65Å; W101-W111 AromaticContact CE3-CZ3 3.51Å; W101-W111 HydrophobicContact CE3-CZ3 3.51Å; W101-W111 HydrophobicContact CH2-CB 4.22Å; W101-W111 HydrophobicContact CH2-CD2 4.09Å; W101-W111 AromaticContact CH2-CE3 3.47Å; W101-W111 HydrophobicContact CH2-CE3 3.47Å; W101-W111 VanDerWaalsContact CH2-CE3 3.47Å; W101-W111 HydrophobicContact CH2-CG 4.42Å; W101-W111 HydrophobicContact CH2-CZ3 4.18Å; W101-W111 HydrophobicContact CZ2-CE3 4.36Å; W101-W111 AromaticContact CZ3-CD2 3.93Å; W101-W111 HydrophobicContact CZ3-CD2 3.93Å; W101-W111 AromaticContact CZ3-CE3 3.06Å; W101-W111 HydrophobicContact CZ3-CE3 3.06Å; W101-W111 HydrophobicContact CZ3-CH2 4.32Å; W101-W111 AromaticContact CZ3-CZ3 3.3Å; W101-W111 HydrophobicContact CZ3-CZ3 3.3Å; L107-W111 VanDerWaalsContact O-CB 3.26Å; L107-W111 WeakPolarHBondContact O-CB 3.2Å; L107-W111 PolarHBondContact O-N 3Å; C108-W111 PolarHBondContact O-N 3.03Å; Q109-W111 PolarHBondContact O-N 2.98Å; W111-S113 PolarHBondContact O-N 3.45Å; W111-F114 PolarHBondContact O-N 3.46Å; W111-D115 VanDerWaalsContact O-CB 3.27Å; W111-D115 WeakPolarHBondContact O-CB 3.34Å; W111-D115 PolarHBondContact O-N 3.19Å; W111-C184 HydrophobicContact CE3-CB 4.48Å; W111-C184 HydrophobicContact CZ3-CB 4.3Å; W111-L313 HydrophobicContact CZ2-CD2 4.47Å
112I90.9Very high91.3Very high9 Ų938.1 Ų38.15%0.04620%0.198CC..Hα-helixtrans-64.6-41.4-178.8-62.2-61.7000111.3C108 Q109 D115 V116 T177 V186C108-I112 WeakPolarHBondContact O-CG1 3.49Å; C108-I112 PolarHBondContact O-N 3.08Å; Q109-I112 PolarHBondContact O-N 2.94Å; I112-D115 PolarHBondContact O-N 3.21Å; I112-V116 HydrophobicContact CG2-CG2 4.35Å; I112-V116 WeakPolarHBondContact O-CB 3.49Å; I112-V116 VanDerWaalsContact O-CG2 3.3Å; I112-V116 WeakPolarHBondContact O-CG2 3.41Å; I112-V116 PolarHBondContact O-N 3Å; I112-T177 HydrophobicContact CG2-CG2 4.24Å; I112-V186 HydrophobicContact CD1-CG2 4.43Å; I112-V186 HydrophobicContact CG2-CG2 4.06Å
113S91.9Very high91.6Very high16 Ų1631.7 Ų31.711%0.11217%0.17CC..Hα-helixtrans-62.9-44.9177.1-73.20000111.8Q109 V110 W111 L117 S167Q109-S113 VanDerWaalsContact O-CB 3.27Å; Q109-S113 WeakPolarHBondContact O-CB 3.13Å; Q109-S113 PolarHBondContact O-N 2.83Å; Q109-S113 PolarHBondContact O-OG 3.4Å; V110-S113 PolarHBondContact O-N 2.83Å; W111-S113 PolarHBondContact O-N 3.45Å; S113-L117 WeakPolarHBondContact O-CB 3.48Å; S113-L117 PolarHBondContact O-N 2.95Å; S113-S167 VanDerWaalsContact O-CB 3.24Å; S113-S167 WeakPolarHBondContact O-CB 3.5Å; S113-S167 PolarHBondContact OG-O 3.1Å; S113-S167 VanDerWaalsContact OG-O 3.08Å
114F93.9Very high91.9Very high66 Ų6630.6 Ų30.629%0.28916%0.162SC..Hα-helixtrans-67.8-37.1176.3-84.6-70.4000112.6M82 L86 V87 V110 W111 L117 C118M82-F114 HydrophobicContact CE-CD1 3.8Å; M82-F114 HydrophobicContact CE-CE1 3.65Å; L86-F114 HydrophobicContact CD1-CD1 3.82Å; L86-F114 HydrophobicContact CD1-CD2 4.5Å; L86-F114 HydrophobicContact CD1-CE1 3.72Å; L86-F114 HydrophobicContact CD1-CE2 4.42Å; L86-F114 HydrophobicContact CD1-CG 4.23Å; L86-F114 HydrophobicContact CD1-CZ 4.04Å; V87-F114 HydrophobicContact CG2-CB 3.88Å; V110-F114 HydrophobicContact CG1-CD2 3.64Å; V110-F114 HydrophobicContact CG1-CE2 3.78Å; V110-F114 VanDerWaalsContact O-CD2 3.28Å; V110-F114 WeakPolarHBondContact O-CD2 3.43Å; V110-F114 PolarHBondContact O-N 2.92Å; W111-F114 PolarHBondContact O-N 3.46Å; F114-L117 HydrophobicContact CD1-CD2 4.1Å; F114-L117 HydrophobicContact CE1-CD2 4.28Å; F114-L117 PolarHBondContact O-N 2.92Å; F114-C118 VanDerWaalsContact O-CB 3.28Å; F114-C118 WeakPolarHBondContact O-CB 3.46Å; F114-C118 PolarHBondContact O-N 3.19Å; F114-C118 PolarHBondContact O-SG 3.37Å
115D93.5Very high92.2Very high10 Ų1029 Ų295%0.05315%0.146CC..Hα-helixtrans-58.6-53.4175.9-172.247.3000111.1V87 W111 I112 L117 C118 C119 Y317V87-D115 HydrophobicContact CG1-CB 3.86Å; V87-D115 VanDerWaalsContact CG1-OD1 3.27Å; V87-D115 WeakPolarHBondContact CG1-OD1 3.44Å; V87-D115 HydrophobicContact CG2-CB 4.46Å; W111-D115 VanDerWaalsContact O-CB 3.27Å; W111-D115 WeakPolarHBondContact O-CB 3.34Å; W111-D115 PolarHBondContact O-N 3.19Å; I112-D115 PolarHBondContact O-N 3.21Å; D115-L117 PolarHBondContact O-N 3.37Å; D115-C118 PolarHBondContact O-N 3.31Å; D115-C119 VanDerWaalsContact O-CB 3.29Å; D115-C119 WeakPolarHBondContact O-CB 3.28Å; D115-C119 PolarHBondContact O-N 2.89Å; D115-Y317 WeakPolarHBondContact OD1-CE1 3.42Å; D115-Y317 PolarHBondContact OD1-OH 2.87Å
116V92.6Very high92.4Very high18 Ų1823.9 Ų23.911%0.10913%0.127CC..Hα-helixtrans-63.5-44177.4175.80000111.1I112 T120 I166I112-V116 HydrophobicContact CG2-CG2 4.35Å; I112-V116 WeakPolarHBondContact O-CB 3.49Å; I112-V116 VanDerWaalsContact O-CG2 3.3Å; I112-V116 WeakPolarHBondContact O-CG2 3.41Å; I112-V116 PolarHBondContact O-N 3Å; V116-T120 WeakPolarHBondContact O-CB 3.43Å; V116-T120 PolarHBondContact O-N 3.3Å; V116-T120 PolarHBondContact O-OG1 2.88Å; V116-I166 HydrophobicContact CG1-CG2 3.88Å
117L95.1Very high92.7Very high22 Ų2219 Ų1912%0.11510%0.097CC..Hα-helixtrans-58.3-52.4179.4177.871.7000111M82 S113 F114 D115 A121 S167M82-L117 HydrophobicContact CE-CD2 4.19Å; S113-L117 WeakPolarHBondContact O-CB 3.48Å; S113-L117 PolarHBondContact O-N 2.95Å; F114-L117 HydrophobicContact CD1-CD2 4.1Å; F114-L117 HydrophobicContact CE1-CD2 4.28Å; F114-L117 PolarHBondContact O-N 2.92Å; D115-L117 PolarHBondContact O-N 3.37Å; L117-A121 VanDerWaalsContact O-CB 3.25Å; L117-A121 WeakPolarHBondContact O-CB 3.41Å; L117-A121 PolarHBondContact O-N 2.9Å; L117-S167 WeakPolarHBondContact CD1-OG 3.41Å
118C94.8Very high92.8Very high0 Ų015.6 Ų15.60%08%0.08CC..Hα-helixtrans-72.6-39.1-173.7-67.90000112.3M82 V83 F114 D115 A121 S122M82-C118 WeakPolarHBondContact CB-SG 3.28Å; V83-C118 HydrophobicContact CG2-CB 3.38Å; F114-C118 VanDerWaalsContact O-CB 3.28Å; F114-C118 WeakPolarHBondContact O-CB 3.46Å; F114-C118 PolarHBondContact O-N 3.19Å; F114-C118 PolarHBondContact O-SG 3.37Å; D115-C118 PolarHBondContact O-N 3.31Å; C118-A121 PolarHBondContact O-N 3.23Å; C118-S122 WeakPolarHBondContact O-CB 3.25Å; C118-S122 PolarHBondContact O-N 3.47Å
119C92.6Very high92.8Very high7 Ų716.1 Ų16.15%0.0478%0.082CC..Hα-helixtrans-62.2-48174.2178.70000111.1D115 A121 S122 I123 W287D115-C119 VanDerWaalsContact O-CB 3.29Å; D115-C119 WeakPolarHBondContact O-CB 3.28Å; D115-C119 PolarHBondContact O-N 2.89Å; C119-A121 VanDerWaalsContact C-N 3.33Å; C119-A121 PolarHBondContact O-N 3.03Å; C119-S122 PolarHBondContact O-N 3.47Å; C119-I123 PolarHBondContact O-N 3.23Å; C119-W287 HydrophobicContact CB-CH2 3.75Å; C119-W287 HydrophobicContact CB-CZ2 4.01Å; C119-W287 HydrophobicContact CB-CZ3 4.27Å; C119-W287 WeakPolarHBondContact SG-CH2 3.25Å; C119-W287 VanDerWaalsContact SG-CZ2 3.57Å; C119-W287 VanDerWaalsContact SG-CZ3 3.52Å
120T94.6Very high92.8Very high1 Ų113.4 Ų13.41%0.0067%0.07CC..Hα-helixtrans-60.3-45.6177.6-54.10000110.3V116 S122 I123 W124 S163 I166 A200V116-T120 WeakPolarHBondContact O-CB 3.43Å; V116-T120 PolarHBondContact O-N 3.3Å; V116-T120 PolarHBondContact O-OG1 2.88Å; T120-S122 VanDerWaalsContact C-N 3.31Å; T120-S122 PolarHBondContact O-N 3.07Å; T120-I123 WeakPolarHBondContact O-CG2 3.46Å; T120-I123 PolarHBondContact O-N 3.38Å; T120-W124 WeakPolarHBondContact O-CB 3.32Å; T120-W124 PolarHBondContact O-N 3.39Å; T120-W124 VanDerWaalsContact O-N 3.15Å; T120-S163 WeakPolarHBondContact CG2-OG 3.28Å; T120-I166 HydrophobicContact CG2-CD1 4.01Å; T120-A200 HydrophobicContact CG2-CB 4.23Å; T120-A200 WeakPolarHBondContact OG1-CB 3.21Å
121A95.8Very high92.9Very high0 Ų012.4 Ų12.40%06%0.062CC..Hα-helixtrans-61.1-40.1177.700000111.8L117 C118 C119 N125 T159 W160 S163L117-A121 VanDerWaalsContact O-CB 3.25Å; L117-A121 WeakPolarHBondContact O-CB 3.41Å; L117-A121 PolarHBondContact O-N 2.9Å; C118-A121 PolarHBondContact O-N 3.23Å; C119-A121 VanDerWaalsContact C-N 3.33Å; C119-A121 PolarHBondContact O-N 3.03Å; A121-N125 WeakPolarHBondContact O-CB 3.33Å; A121-N125 VanDerWaalsContact O-CG 3.32Å; A121-N125 PolarHBondContact O-N 3.22Å; A121-N125 PolarHBondContact O-ND2 2.73Å; A121-T159 HydrophobicContact CB-CG2 4.25Å; A121-T159 WeakPolarHBondContact O-CG2 3.39Å; A121-W160 HydrophobicContact CB-CE3 4.43Å; A121-W160 HydrophobicContact CB-CH2 4.45Å; A121-W160 HydrophobicContact CB-CZ3 4.32Å; A121-S163 VanDerWaalsContact CA-OG 3.28Å; A121-S163 WeakPolarHBondContact CA-OG 3.49Å; A121-S163 PolarHBondContact N-OG 3.49Å; A121-S163 VanDerWaalsContact N-OG 3.08Å
122S93.3Very high92.7Very high2 Ų212 Ų121%0.0146%0.061CC..Hα-helixtrans-61.1-52.2-179.5-164.70000111.8C118 C119 T120 W124 N125 V126C118-S122 WeakPolarHBondContact O-CB 3.25Å; C118-S122 PolarHBondContact O-N 3.47Å; C119-S122 PolarHBondContact O-N 3.47Å; T120-S122 VanDerWaalsContact C-N 3.31Å; T120-S122 PolarHBondContact O-N 3.07Å; S122-W124 PolarHBondContact O-N 3.42Å; S122-N125 WeakPolarHBondContact O-CB 3.49Å; S122-N125 PolarHBondContact O-N 3.15Å; S122-V126 WeakPolarHBondContact O-CG2 3.48Å; S122-V126 PolarHBondContact O-N 3.08Å
123I92.7Very high92.5Very high1 Ų113.4 Ų13.41%0.0057%0.065CC..Hα-helixtrans-66.8-37.1-179.3-159179.8000113C119 T120 N125 V126 T127 A200 F201 P204 L205 F283C119-I123 PolarHBondContact O-N 3.23Å; T120-I123 WeakPolarHBondContact O-CG2 3.46Å; T120-I123 PolarHBondContact O-N 3.38Å; I123-N125 VanDerWaalsContact C-N 3.31Å; I123-N125 PolarHBondContact O-N 2.93Å; I123-V126 WeakPolarHBondContact O-CB 3.49Å; I123-V126 PolarHBondContact O-N 3.09Å; I123-T127 WeakPolarHBondContact O-CB 3.28Å; I123-T127 PolarHBondContact O-N 3.49Å; I123-T127 PolarHBondContact O-OG1 2.89Å; I123-A200 WeakPolarHBondContact CG2-O 3.41Å; I123-F201 HydrophobicContact CD1-CD2 4Å; I123-F201 HydrophobicContact CD1-CE2 4.45Å; I123-P204 HydrophobicContact CD1-CB 4.03Å; I123-P204 HydrophobicContact CD1-CG 4.02Å; I123-P204 HydrophobicContact CG1-CB 4.17Å; I123-P204 HydrophobicContact CG1-CG 4.49Å; I123-P204 HydrophobicContact CG2-CB 3.85Å; I123-P204 HydrophobicContact CG2-CG 3.58Å; I123-L205 HydrophobicContact CD1-CB 4.25Å; I123-F283 HydrophobicContact CB-CD1 4.49Å; I123-F283 HydrophobicContact CB-CE1 3.7Å; I123-F283 HydrophobicContact CB-CE2 3.85Å; I123-F283 HydrophobicContact CB-CZ 3.38Å; I123-F283 HydrophobicContact CD1-CD1 3.88Å; I123-F283 HydrophobicContact CD1-CE1 3.26Å; I123-F283 HydrophobicContact CD1-CZ 3.9Å; I123-F283 HydrophobicContact CG1-CD1 3.85Å; I123-F283 HydrophobicContact CG1-CE1 3.39Å; I123-F283 HydrophobicContact CG1-CE2 4.24Å; I123-F283 HydrophobicContact CG1-CG 4.49Å; I123-F283 HydrophobicContact CG1-CZ 3.66Å; I123-F283 HydrophobicContact CG2-CZ 4.45Å
124W94.8Very high92.2Very high42 Ų4215.4 Ų15.416%0.1597%0.071CC..Hα-helixtrans-68.9-33.8177.7-83.5110.4000110.9T120 S122 T127 A128 T159 L162 G199 L203 P204T120-W124 WeakPolarHBondContact O-CB 3.32Å; T120-W124 PolarHBondContact O-N 3.39Å; T120-W124 VanDerWaalsContact O-N 3.15Å; S122-W124 PolarHBondContact O-N 3.42Å; W124-T127 HydrophobicContact CE3-CG2 4.49Å; W124-T127 WeakPolarHBondContact O-CB 3.49Å; W124-T127 PolarHBondContact O-N 2.94Å; W124-A128 WeakPolarHBondContact O-CB 3.21Å; W124-A128 PolarHBondContact O-N 2.67Å; W124-T159 HydrophobicContact CB-CG2 3.51Å; W124-L162 HydrophobicContact CZ2-CD1 4.29Å; W124-G199 PolarHBondContact NE1-O 3.09Å; W124-G199 VanDerWaalsContact NE1-O 3.14Å; W124-L203 HydrophobicContact CH2-CD2 4.28Å; W124-L203 HydrophobicContact CH2-CG 4.49Å; W124-L203 HydrophobicContact CZ2-CD2 4.21Å; W124-P204 HydrophobicContact CD2-CB 3.88Å; W124-P204 HydrophobicContact CD2-CG 4.28Å; W124-P204 HydrophobicContact CE3-CB 4.16Å; W124-P204 HydrophobicContact CG-CB 4.37Å; W124-P204 HydrophobicContact CH2-CB 4.28Å; W124-P204 HydrophobicContact CZ2-CB 4Å; W124-P204 HydrophobicContact CZ2-CG 3.98Å; W124-P204 HydrophobicContact CZ3-CB 4.35Å
125N93.4Very high91.9Very high0 Ų015.5 Ų15.50%07%0.069CC..Hα-helixtrans-66-41.5169.3-78.7-59.6000111.7S75 M76 A121 S122 I123 T127 A128 I129S75-N125 WeakPolarHBondContact CB-OD1 3.22Å; S75-N125 PolarHBondContact OG-ND2 3.37Å; S75-N125 PolarHBondContact OG-OD1 3.07Å; M76-N125 HydrophobicContact CB-CB 4.07Å; M76-N125 HydrophobicContact CE-CB 4.01Å; A121-N125 WeakPolarHBondContact O-CB 3.33Å; A121-N125 VanDerWaalsContact O-CG 3.32Å; A121-N125 PolarHBondContact O-N 3.22Å; A121-N125 PolarHBondContact O-ND2 2.73Å; S122-N125 WeakPolarHBondContact O-CB 3.49Å; S122-N125 PolarHBondContact O-N 3.15Å; I123-N125 VanDerWaalsContact C-N 3.31Å; I123-N125 PolarHBondContact O-N 2.93Å; N125-T127 VanDerWaalsContact C-N 3.3Å; N125-T127 PolarHBondContact O-N 3.2Å; N125-A128 PolarHBondContact O-N 2.88Å; N125-I129 VanDerWaalsContact O-CG1 3.28Å; N125-I129 WeakPolarHBondContact O-CG1 3.32Å; N125-I129 PolarHBondContact O-N 2.6Å
126V90.9Very high91.5Very high4 Ų416.3 Ų16.32%0.0248%0.076CC..Hα-helixtrans-57-47.1172.3-178.60000110M76 S122 I123 A128 I129 A130 V208 I280 F283M76-V126 HydrophobicContact CE-CB 4.06Å; M76-V126 HydrophobicContact CE-CG2 3.24Å; S122-V126 WeakPolarHBondContact O-CG2 3.48Å; S122-V126 PolarHBondContact O-N 3.08Å; I123-V126 WeakPolarHBondContact O-CB 3.49Å; I123-V126 PolarHBondContact O-N 3.09Å; V126-A128 PolarHBondContact O-N 2.91Å; V126-I129 WeakPolarHBondContact O-CB 3.24Å; V126-I129 PolarHBondContact O-N 2.94Å; V126-A130 PolarHBondContact O-N 2.92Å; V126-V208 HydrophobicContact CG1-CG2 4.28Å; V126-I280 HydrophobicContact CG1-CG1 3.91Å; V126-F283 HydrophobicContact CG2-CD2 4.31Å
127T92.9Very high90.9Very high1 Ų116.5 Ų16.51%0.0068%0.076CC..Hα-helixtrans-60-44.7178.7-56.60000111.4I123 W124 N125 I129 A130 L131 P204 V207 V208I123-T127 WeakPolarHBondContact O-CB 3.28Å; I123-T127 PolarHBondContact O-N 3.49Å; I123-T127 PolarHBondContact O-OG1 2.89Å; W124-T127 HydrophobicContact CE3-CG2 4.49Å; W124-T127 WeakPolarHBondContact O-CB 3.49Å; W124-T127 PolarHBondContact O-N 2.94Å; N125-T127 VanDerWaalsContact C-N 3.3Å; N125-T127 PolarHBondContact O-N 3.2Å; T127-I129 PolarHBondContact O-N 3.43Å; T127-A130 PolarHBondContact O-N 3.27Å; T127-L131 HydrophobicContact CG2-CD1 4.17Å; T127-L131 WeakPolarHBondContact O-CG 3.31Å; T127-L131 PolarHBondContact O-N 3.49Å; T127-P204 PolarHBondContact OG1-O 2.81Å; T127-V207 HydrophobicContact CG2-CB 4.13Å; T127-V207 HydrophobicContact CG2-CG1 3.61Å; T127-V208 HydrophobicContact CG2-CB 4.46Å
128A93.1Very high90.2Very high4 Ų417.7 Ų17.73%0.0339%0.085CC..Hα-helixtrans-62.7-40.2176.100000112.2L72 W124 N125 V126 L131 D132 M155L72-A128 HydrophobicContact CD2-CB 3.91Å; W124-A128 WeakPolarHBondContact O-CB 3.21Å; W124-A128 PolarHBondContact O-N 2.67Å; N125-A128 PolarHBondContact O-N 2.88Å; V126-A128 PolarHBondContact O-N 2.91Å; A128-L131 PolarHBondContact O-N 3.21Å; A128-D132 VanDerWaalsContact O-CB 3.27Å; A128-D132 WeakPolarHBondContact O-CB 3.41Å; A128-D132 PolarHBondContact O-N 3.38Å; A128-M155 HydrophobicContact CB-CB 3.99Å; A128-M155 HydrophobicContact CB-CE 4.21Å; A128-M155 HydrophobicContact CB-SD 4.03Å
129I89.9Confident89.6Confident10 Ų1024.2 Ų24.25%0.05111%0.109CC..Hα-helixtrans-61-46.3173.3-67.4165.7000109.9L72 V73 M76 N125 V126 T127 D132 R133 V276L72-I129 HydrophobicContact CB-CD1 4.44Å; L72-I129 HydrophobicContact CB-CG1 3.68Å; L72-I129 HydrophobicContact CD1-CG1 4.25Å; V73-I129 HydrophobicContact CG2-CD1 4.18Å; M76-I129 HydrophobicContact CE-CD1 4.02Å; N125-I129 VanDerWaalsContact O-CG1 3.28Å; N125-I129 WeakPolarHBondContact O-CG1 3.32Å; N125-I129 PolarHBondContact O-N 2.6Å; V126-I129 WeakPolarHBondContact O-CB 3.24Å; V126-I129 PolarHBondContact O-N 2.94Å; T127-I129 PolarHBondContact O-N 3.43Å; I129-D132 PolarHBondContact O-N 2.87Å; I129-R133 VanDerWaalsContact O-CG 3.32Å; I129-R133 WeakPolarHBondContact O-CG 3.46Å; I129-R133 PolarHBondContact O-N 3.2Å; I129-V276 HydrophobicContact CG2-CG2 3.9Å
130A89.4Confident88.6Confident0 Ų030 Ų300%014%0.135CC..Hα-helixtrans-62.7-43.7179.100000112.6V126 T127 R133 Y134 V208 V211 V276V126-A130 PolarHBondContact O-N 2.92Å; T127-A130 PolarHBondContact O-N 3.27Å; A130-R133 PolarHBondContact O-N 3.48Å; A130-Y134 WeakPolarHBondContact O-CB 3.42Å; A130-Y134 PolarHBondContact O-N 3.16Å; A130-V208 HydrophobicContact CB-CG2 3.63Å; A130-V211 HydrophobicContact CB-CG1 4.13Å; A130-V276 HydrophobicContact CB-CG1 3.88Å
131L91.6Very high87.5Confident38 Ų3836.8 Ų36.820%0.19917%0.171CC..Hα-helixtrans-62.6-46.1176.1-77.3168.5000112.1T127 A128 R133 Y134 W135 M155 V211T127-L131 HydrophobicContact CG2-CD1 4.17Å; T127-L131 WeakPolarHBondContact O-CG 3.31Å; T127-L131 PolarHBondContact O-N 3.49Å; A128-L131 PolarHBondContact O-N 3.21Å; L131-R133 VanDerWaalsContact C-N 3.26Å; L131-R133 PolarHBondContact O-N 3.47Å; L131-Y134 PolarHBondContact O-N 2.91Å; L131-Y134 VanDerWaalsContact O-N 3.16Å; L131-W135 HydrophobicContact CB-CE3 4.42Å; L131-W135 HydrophobicContact CB-CH2 4.45Å; L131-W135 HydrophobicContact CB-CZ3 4.18Å; L131-W135 HydrophobicContact CD2-CZ2 4.38Å; L131-W135 PolarHBondContact O-N 3.22Å; L131-M155 HydrophobicContact CB-SD 4.28Å; L131-M155 HydrophobicContact CD1-SD 4.44Å; L131-V211 HydrophobicContact CD2-CG1 4.34Å; L131-V211 HydrophobicContact CD2-CG2 3.49Å; L131-V211 VanDerWaalsContact CD2-CG2 3.49Å; L131-V211 HydrophobicContact CG-CG2 4.14Å
132D89.3Confident86.8Confident1 Ų143.4 Ų43.41%0.00520%0.202CC..Hα-helixtrans-57.3-40.3174.5171.276000111.7L72 A128 I129 S136 Y143 R148 M155L72-D132 HydrophobicContact CD1-CB 3.74Å; A128-D132 VanDerWaalsContact O-CB 3.27Å; A128-D132 WeakPolarHBondContact O-CB 3.41Å; A128-D132 PolarHBondContact O-N 3.38Å; I129-D132 PolarHBondContact O-N 2.87Å; D132-S136 WeakPolarHBondContact O-CB 3.25Å; D132-S136 PolarHBondContact O-N 2.92Å; D132-S136 VanDerWaalsContact O-N 3.1Å; D132-Y143 PolarHBondContact OD1-OH 3.21Å; D132-R148 WeakPolarHBondContact OD1-CG 3.29Å; D132-R148 IonicContact OD1-CZ 3.47Å; D132-R148 IonicContact OD1-NE 2.69Å; D132-R148 PolarHBondContact OD1-NE 3.47Å; D132-R148 IonicContact OD1-NH2 3.41Å; D132-R148 PolarHBondContact OD1-NH2 3.37Å; D132-R148 IonicContact OD2-CZ 3.46Å; D132-R148 IonicContact OD2-NE 3.48Å; D132-R148 PolarHBondContact OD2-NE 3.48Å; D132-R148 IonicContact OD2-NH2 2.71Å; D132-R148 PolarHBondContact OD2-NH2 3.48Å; D132-M155 HydrophobicContact CB-CE 4.22Å
133R85.6Confident86.3Confident38 Ų3844.4 Ų44.414%0.14321%0.205CC..Hα-helixtrans-68.7-43.2174.6-64.9-54.572.8-126.8-16.1112.2I129 A130 L131 S136 I137 I215 V276I129-R133 VanDerWaalsContact O-CG 3.32Å; I129-R133 WeakPolarHBondContact O-CG 3.46Å; I129-R133 PolarHBondContact O-N 3.2Å; A130-R133 PolarHBondContact O-N 3.48Å; L131-R133 VanDerWaalsContact C-N 3.26Å; L131-R133 PolarHBondContact O-N 3.47Å; R133-S136 PolarHBondContact NH1-OG 3.45Å; R133-S136 PolarHBondContact NH2-OG 2.86Å; R133-S136 PolarHBondContact O-N 3.19Å; R133-I137 VanDerWaalsContact O-CG1 3.3Å; R133-I137 WeakPolarHBondContact O-CG1 3.34Å; R133-I137 PolarHBondContact O-N 3.48Å; R133-I215 HydrophobicContact CB-CD1 4.46Å; R133-V276 HydrophobicContact CG-CG2 3.75Å
134Y87.1Confident85.9Confident59 Ų5947.7 Ų47.723%0.23123%0.225CC..Hα-helixtrans-59.1-49.6178.2174.4-112.2000112.4A130 L131 S136 I137 T138 V211 K214 I215A130-Y134 WeakPolarHBondContact O-CB 3.42Å; A130-Y134 PolarHBondContact O-N 3.16Å; L131-Y134 PolarHBondContact O-N 2.91Å; L131-Y134 VanDerWaalsContact O-N 3.16Å; Y134-S136 PolarHBondContact O-N 3.15Å; Y134-I137 PolarHBondContact O-N 2.95Å; Y134-T138 HydrophobicContact CD2-CG2 3.84Å; Y134-T138 HydrophobicContact CE2-CG2 3.39Å; Y134-T138 WeakPolarHBondContact O-CB 3.35Å; Y134-T138 WeakPolarHBondContact O-CG2 3.33Å; Y134-T138 PolarHBondContact O-N 3.36Å; Y134-T138 PolarHBondContact O-OG1 3.45Å; Y134-V211 HydrophobicContact CG-CG1 4.11Å; Y134-K214 HydrophobicContact CD2-CB 4.1Å; Y134-K214 HydrophobicContact CE2-CB 3.59Å; Y134-I215 HydrophobicContact CD2-CG1 3.8Å; Y134-I215 HydrophobicContact CG-CG1 4.33Å
135W87.9Confident85.3Confident67 Ų6750.6 Ų50.625%0.25424%0.244SC..Hα-helixtrans-67.1-36.6178.4-69.5-37.3000112.8L131 I137 T138 R139 Y143 I151 M155L131-W135 HydrophobicContact CB-CE3 4.42Å; L131-W135 HydrophobicContact CB-CH2 4.45Å; L131-W135 HydrophobicContact CB-CZ3 4.18Å; L131-W135 HydrophobicContact CD2-CZ2 4.38Å; L131-W135 PolarHBondContact O-N 3.22Å; W135-I137 VanDerWaalsContact C-N 3.29Å; W135-I137 PolarHBondContact O-N 3.25Å; W135-T138 PolarHBondContact O-N 3.36Å; W135-R139 WeakPolarHBondContact O-CA 3.33Å; W135-R139 PolarHBondContact O-N 3.31Å; W135-Y143 HydrophobicContact CB-CD1 4.26Å; W135-Y143 HydrophobicContact CB-CD2 4.07Å; W135-Y143 HydrophobicContact CB-CE1 4.14Å; W135-Y143 HydrophobicContact CB-CE2 3.97Å; W135-Y143 HydrophobicContact CB-CG 4.22Å; W135-Y143 HydrophobicContact CE3-CE2 4.16Å; W135-I151 HydrophobicContact CE3-CG2 4.33Å; W135-I151 HydrophobicContact CZ3-CG2 3.7Å; W135-M155 HydrophobicContact CZ3-SD 4.01Å
136S83.3Confident84.9Confident28 Ų2859.2 Ų59.220%0.19628%0.281CS..Hα-helixtrans-62.5-34.7175-177.10000113.2D132 R133 Y134D132-S136 WeakPolarHBondContact O-CB 3.25Å; D132-S136 PolarHBondContact O-N 2.92Å; D132-S136 VanDerWaalsContact O-N 3.1Å; R133-S136 PolarHBondContact NH1-OG 3.45Å; R133-S136 PolarHBondContact NH2-OG 2.86Å; R133-S136 PolarHBondContact O-N 3.19Å; Y134-S136 PolarHBondContact O-N 3.15Å
137I79.8Confident84.7Confident21 Ų2161.9 Ų61.911%0.10830%0.297CS..Hα-helixtrans-81.7-40.9179.9-67.7166.5000111R133 Y134 W135 I215 R222R133-I137 VanDerWaalsContact O-CG1 3.3Å; R133-I137 WeakPolarHBondContact O-CG1 3.34Å; R133-I137 PolarHBondContact O-N 3.48Å; Y134-I137 PolarHBondContact O-N 2.95Å; W135-I137 VanDerWaalsContact C-N 3.29Å; W135-I137 PolarHBondContact O-N 3.25Å; I137-I215 HydrophobicContact CD1-CG2 4.13Å; I137-R222 PolarHBondContact O-NH2 3.02Å
138T81.9Confident84.4Confident48 Ų4863 Ų6329%0.29430%0.301SS..Hα-helixtrans-82.9-37.2-174.552.90000113.6Y134 W135Y134-T138 HydrophobicContact CD2-CG2 3.84Å; Y134-T138 HydrophobicContact CE2-CG2 3.39Å; Y134-T138 WeakPolarHBondContact O-CB 3.35Å; Y134-T138 WeakPolarHBondContact O-CG2 3.33Å; Y134-T138 PolarHBondContact O-N 3.36Å; Y134-T138 PolarHBondContact O-OG1 3.45Å; W135-T138 PolarHBondContact O-N 3.36Å
139R80.9Confident84.1Confident137 Ų13767.8 Ų67.852%0.51732%0.322SS..  trans-118.551-173.9-59.6-171.4-175-175.20.9112.3W135 L141 E142 Y143W135-R139 WeakPolarHBondContact O-CA 3.33Å; W135-R139 PolarHBondContact O-N 3.31Å; R139-L141 PolarHBondContact O-N 3.45Å; R139-L141 VanDerWaalsContact O-N 3.1Å; R139-E142 PolarHBondContact O-N 2.69Å; R139-Y143 WeakPolarHBondContact O-CB 3.39Å; R139-Y143 PolarHBondContact O-N 2.92Å
140H72.8Confident84.1Confident127 Ų12775.1 Ų75.159%0.58835%0.353SS*.THydrogen-bonded Turntrans-54.5-29.8-174.966-69.9000115.3
141L72.1Confident84.2Confident144 Ų14477.8 Ų77.875%0.75437%0.367SS*.THydrogen-bonded Turntrans-89.8-35.9-179-66.6167.4000114R139R139-L141 PolarHBondContact O-N 3.45Å; R139-L141 VanDerWaalsContact O-N 3.1Å
142E79.8Confident84.2Confident140 Ų14076 Ų7665%0.65436%0.357SS*.THydrogen-bonded Turntrans-85.6-29.2-179.3-63174.4176.900112.2R139 T144R139-E142 PolarHBondContact O-N 2.69Å; E142-T144 VanDerWaalsContact C-N 3.26Å; E142-T144 PolarHBondContact O-N 3.45Å
143Y83.4Confident84.3Confident23 Ų2379.6 Ų79.69%0.0938%0.377CS..  trans-85.863.4-175.7-158.1-115.1000111.9D132 W135 R139 R148 I151D132-Y143 PolarHBondContact OD1-OH 3.21Å; W135-Y143 HydrophobicContact CB-CD1 4.26Å; W135-Y143 HydrophobicContact CB-CD2 4.07Å; W135-Y143 HydrophobicContact CB-CE1 4.14Å; W135-Y143 HydrophobicContact CB-CE2 3.97Å; W135-Y143 HydrophobicContact CB-CG 4.22Å; W135-Y143 HydrophobicContact CE3-CE2 4.16Å; R139-Y143 WeakPolarHBondContact O-CB 3.39Å; R139-Y143 PolarHBondContact O-N 2.92Å; Y143-R148 HydrophobicContact CD1-CB 4.05Å; Y143-R148 HydrophobicContact CD1-CG 4.02Å; Y143-R148 HydrophobicContact CE1-CB 3.63Å; Y143-R148 VanDerWaalsContact CE1-CD 3.47Å; Y143-R148 HydrophobicContact CE1-CG 3.25Å; Y143-R148 HydrophobicContact CE2-CB 4.39Å; Y143-I151 HydrophobicContact CD2-CD1 4.47Å; Y143-I151 HydrophobicContact CE2-CD1 3.74Å
144T84.4Confident84.7Confident69 Ų6981.6 Ų81.642%0.42339%0.393SS..  trans-62.6160.5178.2730000112.3E142 K146 T147 R148E142-T144 VanDerWaalsContact C-N 3.26Å; E142-T144 PolarHBondContact O-N 3.45Å; T144-K146 PolarHBondContact O-N 3.02Å; T144-T147 PolarHBondContact O-N 3.18Å; T144-T147 PolarHBondContact OG1-N 2.87Å; T144-T147 PolarHBondContact OG1-OG1 2.95Å; T144-R148 WeakPolarHBondContact O-CB 3.17Å; T144-R148 PolarHBondContact O-N 3.41Å
145L82.4Confident85.1Confident104 Ų10479.8 Ų79.855%0.54539%0.387SS..Hα-helixtrans-57.6-34.1178.6-71.3174000113.6K149L145-K149 WeakPolarHBondContact O-CB 3.3Å; L145-K149 PolarHBondContact O-N 3.49Å
146K84.8Confident85.4Confident180 Ų18078 Ų7878%0.78338%0.382SS*.Hα-helixtrans-69.7-49.5179-172.5178.4-179.3-179.20111T144 R148 K149 K150T144-K146 PolarHBondContact O-N 3.02Å; K146-R148 VanDerWaalsContact C-N 3.33Å; K146-R148 PolarHBondContact O-N 2.63Å; K146-K149 PolarHBondContact O-N 2.97Å; K146-K150 PolarHBondContact O-N 2.91Å; K146-K150 VanDerWaalsContact O-N 3.12Å
147T86.2Confident86Confident60 Ų6079.6 Ų79.637%0.36840%0.396SS..Hα-helixtrans-60.6-45.6176.6-56.10000110.8T144 K149 K150 I151T144-T147 PolarHBondContact O-N 3.18Å; T144-T147 PolarHBondContact OG1-N 2.87Å; T144-T147 PolarHBondContact OG1-OG1 2.95Å; T147-K149 VanDerWaalsContact C-N 3.34Å; T147-K149 PolarHBondContact O-N 3.31Å; T147-K150 PolarHBondContact O-N 2.85Å; T147-I151 HydrophobicContact CG2-CD1 3.69Å; T147-I151 HydrophobicContact CG2-CG1 4.44Å; T147-I151 WeakPolarHBondContact O-CG1 3.39Å; T147-I151 PolarHBondContact O-N 3.38Å
148R86.8Confident86.8Confident24 Ų2482.8 Ų82.89%0.09141%0.414CS..Hα-helixtrans-56.2-44.7176.1-174.9175.9175.9-148.8-11.4111.9V68 D132 Y143 T144 K146 I151 S152V68-R148 HydrophobicContact CB-CG 3.62Å; V68-R148 HydrophobicContact CG1-CG 3.52Å; V68-R148 HydrophobicContact CG2-CB 4.11Å; V68-R148 HydrophobicContact CG2-CG 3.71Å; D132-R148 WeakPolarHBondContact OD1-CG 3.29Å; D132-R148 IonicContact OD1-CZ 3.47Å; D132-R148 IonicContact OD1-NE 2.69Å; D132-R148 PolarHBondContact OD1-NE 3.47Å; D132-R148 IonicContact OD1-NH2 3.41Å; D132-R148 PolarHBondContact OD1-NH2 3.37Å; D132-R148 IonicContact OD2-CZ 3.46Å; D132-R148 IonicContact OD2-NE 3.48Å; D132-R148 PolarHBondContact OD2-NE 3.48Å; D132-R148 IonicContact OD2-NH2 2.71Å; D132-R148 PolarHBondContact OD2-NH2 3.48Å; Y143-R148 HydrophobicContact CD1-CB 4.05Å; Y143-R148 HydrophobicContact CD1-CG 4.02Å; Y143-R148 HydrophobicContact CE1-CB 3.63Å; Y143-R148 VanDerWaalsContact CE1-CD 3.47Å; Y143-R148 HydrophobicContact CE1-CG 3.25Å; Y143-R148 HydrophobicContact CE2-CB 4.39Å; T144-R148 WeakPolarHBondContact O-CB 3.17Å; T144-R148 PolarHBondContact O-N 3.41Å; K146-R148 VanDerWaalsContact C-N 3.33Å; K146-R148 PolarHBondContact O-N 2.63Å; R148-I151 PolarHBondContact O-N 3.11Å; R148-S152 WeakPolarHBondContact O-CB 3.47Å; R148-S152 PolarHBondContact O-N 2.87Å
149K87.5Confident87.5Confident106 Ų10680.7 Ų80.746%0.46140%0.401SS..Hα-helixtrans-64.8-42.9178.8-173.9176.4178.8178.80111.8V68 L145 K146 T147 S152 N153V68-K149 VanDerWaalsContact CG2-CA 3.43Å; V68-K149 HydrophobicContact CG2-CB 3.71Å; V68-K149 HydrophobicContact CG2-CG 4.41Å; L145-K149 WeakPolarHBondContact O-CB 3.3Å; L145-K149 PolarHBondContact O-N 3.49Å; K146-K149 PolarHBondContact O-N 2.97Å; T147-K149 VanDerWaalsContact C-N 3.34Å; T147-K149 PolarHBondContact O-N 3.31Å; K149-S152 PolarHBondContact O-N 2.89Å; K149-N153 PolarHBondContact O-N 3.26Å; K149-N153 VanDerWaalsContact O-N 3.09Å
150K89.6Confident88.2Confident164 Ų16477 Ų7771%0.71339%0.386SS*.Hα-helixtrans-62.5-48.6178-159.5-179.7-176.3-174.90110.9K146 T147 N153 V154K146-K150 PolarHBondContact O-N 2.91Å; K146-K150 VanDerWaalsContact O-N 3.12Å; T147-K150 PolarHBondContact O-N 2.85Å; K150-N153 PolarHBondContact O-N 3.18Å; K150-V154 WeakPolarHBondContact O-CG2 3.35Å; K150-V154 PolarHBondContact O-N 2.86Å; K150-V154 VanDerWaalsContact O-N 3.14Å
151I91.2Very high89.4Confident55 Ų5575.6 Ų75.628%0.28238%0.383SS..Hα-helixtrans-63.6-43.2179.3-68.3170.3000111.3W135 Y143 T147 R148 N153 V154 M155W135-I151 HydrophobicContact CE3-CG2 4.33Å; W135-I151 HydrophobicContact CZ3-CG2 3.7Å; Y143-I151 HydrophobicContact CD2-CD1 4.47Å; Y143-I151 HydrophobicContact CE2-CD1 3.74Å; T147-I151 HydrophobicContact CG2-CD1 3.69Å; T147-I151 HydrophobicContact CG2-CG1 4.44Å; T147-I151 WeakPolarHBondContact O-CG1 3.39Å; T147-I151 PolarHBondContact O-N 3.38Å; R148-I151 PolarHBondContact O-N 3.11Å; I151-N153 PolarHBondContact O-N 3.46Å; I151-V154 WeakPolarHBondContact O-CB 3.31Å; I151-V154 PolarHBondContact O-N 3.37Å; I151-M155 HydrophobicContact CG2-CE 4.18Å; I151-M155 HydrophobicContact CG2-CG 4.34Å; I151-M155 HydrophobicContact CG2-SD 4.32Å; I151-M155 WeakPolarHBondContact O-CG 3.46Å; I151-M155 PolarHBondContact O-N 3.04Å
152S91.5Very high90.4Very high0 Ų071.9 Ų71.90%036%0.364CS..Hα-helixtrans-62.3-42.1177.5164.50000113.3L72 R148 K149 V154 M155 I156L72-S152 WeakPolarHBondContact CD2-OG 3.36Å; L72-S152 WeakPolarHBondContact CG-OG 2.99Å; R148-S152 WeakPolarHBondContact O-CB 3.47Å; R148-S152 PolarHBondContact O-N 2.87Å; K149-S152 PolarHBondContact O-N 2.89Å; S152-V154 VanDerWaalsContact C-N 3.29Å; S152-V154 PolarHBondContact O-N 3.43Å; S152-M155 PolarHBondContact O-N 3.04Å; S152-I156 VanDerWaalsContact O-CG1 3.3Å; S152-I156 WeakPolarHBondContact O-CG1 3.44Å; S152-I156 PolarHBondContact O-N 2.94Å
153N91.3Very high91.2Very high77 Ų7765.2 Ų65.241%0.41233%0.333SS..Hα-helixtrans-63.8-37.4176-72.7-1.6000111.6K149 K150 I151 I156 A157K149-N153 PolarHBondContact O-N 3.26Å; K149-N153 VanDerWaalsContact O-N 3.09Å; K150-N153 PolarHBondContact O-N 3.18Å; I151-N153 PolarHBondContact O-N 3.46Å; N153-I156 PolarHBondContact O-N 3.32Å; N153-A157 WeakPolarHBondContact O-CB 3.33Å; N153-A157 PolarHBondContact O-N 3.01Å
154V94.6Very high91.8Very high80 Ų8066 Ų6649%0.48534%0.342SS..Hα-helixtrans-64.4-45.6173.3172.20000110.9K150 I151 S152 I156 A157 L158K150-V154 WeakPolarHBondContact O-CG2 3.35Å; K150-V154 PolarHBondContact O-N 2.86Å; K150-V154 VanDerWaalsContact O-N 3.14Å; I151-V154 WeakPolarHBondContact O-CB 3.31Å; I151-V154 PolarHBondContact O-N 3.37Å; S152-V154 VanDerWaalsContact C-N 3.29Å; S152-V154 PolarHBondContact O-N 3.43Å; V154-I156 VanDerWaalsContact C-N 3.33Å; V154-I156 PolarHBondContact O-N 2.87Å; V154-A157 PolarHBondContact O-N 3.02Å; V154-L158 HydrophobicContact CG1-CD1 3.98Å; V154-L158 HydrophobicContact CG1-CG 4.35Å; V154-L158 WeakPolarHBondContact O-CG 3.19Å; V154-L158 PolarHBondContact O-N 3.33Å
155M94.7Very high92.2Very high21 Ų2166.7 Ų66.710%0.10334%0.341CS..Hα-helixtrans-59.2-43.6176.3-69.6-171.5-60.600111.6L72 A128 L131 D132 W135 I151 S152 L158 T159L72-M155 HydrophobicContact CD1-CE 4.15Å; L72-M155 HydrophobicContact CD2-CE 4.39Å; A128-M155 HydrophobicContact CB-CB 3.99Å; A128-M155 HydrophobicContact CB-CE 4.21Å; A128-M155 HydrophobicContact CB-SD 4.03Å; L131-M155 HydrophobicContact CB-SD 4.28Å; L131-M155 HydrophobicContact CD1-SD 4.44Å; D132-M155 HydrophobicContact CB-CE 4.22Å; W135-M155 HydrophobicContact CZ3-SD 4.01Å; I151-M155 HydrophobicContact CG2-CE 4.18Å; I151-M155 HydrophobicContact CG2-CG 4.34Å; I151-M155 HydrophobicContact CG2-SD 4.32Å; I151-M155 WeakPolarHBondContact O-CG 3.46Å; I151-M155 PolarHBondContact O-N 3.04Å; S152-M155 PolarHBondContact O-N 3.04Å; M155-L158 PolarHBondContact O-N 2.97Å; M155-T159 WeakPolarHBondContact O-CB 3.33Å; M155-T159 PolarHBondContact O-N 3.46Å; M155-T159 PolarHBondContact O-OG1 3.4Å
156I95.6Very high92.7Very high31 Ų3162.2 Ų62.216%0.15932%0.318CS..Hα-helixtrans-59.7-49.7175.6-68.1166.2000110.4N71 L72 S152 N153 V154 L158 T159 W160N71-I156 HydrophobicContact CB-CD1 4.34Å; L72-I156 HydrophobicContact CD2-CD1 4.03Å; L72-I156 HydrophobicContact CD2-CG1 3.69Å; S152-I156 VanDerWaalsContact O-CG1 3.3Å; S152-I156 WeakPolarHBondContact O-CG1 3.44Å; S152-I156 PolarHBondContact O-N 2.94Å; N153-I156 PolarHBondContact O-N 3.32Å; V154-I156 VanDerWaalsContact C-N 3.33Å; V154-I156 PolarHBondContact O-N 2.87Å; I156-L158 VanDerWaalsContact C-N 3.31Å; I156-L158 PolarHBondContact O-N 2.65Å; I156-T159 WeakPolarHBondContact O-CB 3.44Å; I156-T159 PolarHBondContact O-N 3.11Å; I156-W160 PolarHBondContact O-N 3.35Å
157A96.1Very high93Very high60 Ų6053.7 Ų53.750%0.49628%0.281SS..Hα-helixtrans-58.5-43.617900000111.9N153 V154 W160 L161N153-A157 WeakPolarHBondContact O-CB 3.33Å; N153-A157 PolarHBondContact O-N 3.01Å; V154-A157 PolarHBondContact O-N 3.02Å; A157-W160 PolarHBondContact O-N 2.99Å; A157-L161 VanDerWaalsContact O-CB 3.23Å; A157-L161 WeakPolarHBondContact O-CB 3.26Å; A157-L161 PolarHBondContact O-N 2.98Å
158L95.6Very high93.2Very high89 Ų8954.3 Ų54.347%0.46628%0.282SS..Hα-helixtrans-63.9-42175.7-70.5174.1000112.1V154 M155 I156 L161 L162V154-L158 HydrophobicContact CG1-CD1 3.98Å; V154-L158 HydrophobicContact CG1-CG 4.35Å; V154-L158 WeakPolarHBondContact O-CG 3.19Å; V154-L158 PolarHBondContact O-N 3.33Å; M155-L158 PolarHBondContact O-N 2.97Å; I156-L158 VanDerWaalsContact C-N 3.31Å; I156-L158 PolarHBondContact O-N 2.65Å; L158-L161 PolarHBondContact O-N 2.9Å; L158-L162 WeakPolarHBondContact O-CB 3.31Å; L158-L162 VanDerWaalsContact O-CG 3.25Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 2.82Å
159T95.8Very high93.3Very high4 Ų453.8 Ų53.83%0.02528%0.282CS..Hα-helixtrans-56.3-52.8176-67.90000111.2A121 W124 M155 I156 S163A121-T159 HydrophobicContact CB-CG2 4.25Å; A121-T159 WeakPolarHBondContact O-CG2 3.39Å; W124-T159 HydrophobicContact CB-CG2 3.51Å; M155-T159 WeakPolarHBondContact O-CB 3.33Å; M155-T159 PolarHBondContact O-N 3.46Å; M155-T159 PolarHBondContact O-OG1 3.4Å; I156-T159 WeakPolarHBondContact O-CB 3.44Å; I156-T159 PolarHBondContact O-N 3.11Å; T159-S163 VanDerWaalsContact O-CB 3.31Å; T159-S163 WeakPolarHBondContact O-CB 3.28Å; T159-S163 PolarHBondContact O-N 3.38Å; T159-S163 PolarHBondContact O-OG 2.9Å
160W97.3Very high93.1Very high58 Ų5849.3 Ų49.322%0.2226%0.264CS..Hα-helixtrans-67.8-37.7-179.5-72.8101.2000112.4S75 I78 M82 A121 I156 A157 S164S75-W160 PolarHBondContact OG-NE1 3.47Å; S75-W160 VanDerWaalsContact OG-NE1 3.14Å; I78-W160 HydrophobicContact CB-CZ2 4.49Å; I78-W160 HydrophobicContact CG2-CH2 4.11Å; I78-W160 HydrophobicContact CG2-CZ2 4.02Å; M82-W160 HydrophobicContact CE-CZ3 4.46Å; M82-W160 HydrophobicContact SD-CH2 3.73Å; M82-W160 HydrophobicContact SD-CZ3 4.01Å; A121-W160 HydrophobicContact CB-CE3 4.43Å; A121-W160 HydrophobicContact CB-CH2 4.45Å; A121-W160 HydrophobicContact CB-CZ3 4.32Å; I156-W160 PolarHBondContact O-N 3.35Å; A157-W160 PolarHBondContact O-N 2.99Å; W160-S164 VanDerWaalsContact O-CB 3.32Å; W160-S164 WeakPolarHBondContact O-CB 3.44Å; W160-S164 PolarHBondContact O-N 3.33Å; W160-S164 PolarHBondContact O-OG 3.32Å
161L96.1Very high92.7Very high98 Ų9846 Ų4651%0.51325%0.253SS..Hα-helixtrans-62.5-52.9176.7179.163.3000111.7A157 L158 S163 S164 I165A157-L161 VanDerWaalsContact O-CB 3.23Å; A157-L161 WeakPolarHBondContact O-CB 3.26Å; A157-L161 PolarHBondContact O-N 2.98Å; L158-L161 PolarHBondContact O-N 2.9Å; L161-S163 VanDerWaalsContact C-N 3.31Å; L161-S163 PolarHBondContact O-N 3.46Å; L161-S164 PolarHBondContact O-N 3.15Å; L161-I165 HydrophobicContact CD1-CD1 4.13Å; L161-I165 HydrophobicContact CD1-CG1 4.47Å; L161-I165 HydrophobicContact CG-CD1 4.01Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.27Å
162L94.8Very high92.4Very high67 Ų6751.7 Ų51.735%0.35128%0.276SS..Hα-helixtrans-60.9-41.9179.2-70.1170.8000111.4W124 L158 S164 I165 I166W124-L162 HydrophobicContact CZ2-CD1 4.29Å; L158-L162 WeakPolarHBondContact O-CB 3.31Å; L158-L162 VanDerWaalsContact O-CG 3.25Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 2.82Å; L162-S164 VanDerWaalsContact C-N 3.32Å; L162-S164 PolarHBondContact O-N 3.18Å; L162-I165 PolarHBondContact O-N 3.11Å; L162-I166 WeakPolarHBondContact O-CG1 3.4Å; L162-I166 PolarHBondContact O-N 3.12Å; L162-I166 VanDerWaalsContact O-N 3.11Å
163S96.4Very high91.6Very high0 Ų054.6 Ų54.60%031%0.307CS..Hα-helixtrans-63.5-39.2177-52.60000112T120 A121 T159 L161 S167T120-S163 WeakPolarHBondContact CG2-OG 3.28Å; A121-S163 VanDerWaalsContact CA-OG 3.28Å; A121-S163 WeakPolarHBondContact CA-OG 3.49Å; A121-S163 PolarHBondContact N-OG 3.49Å; A121-S163 VanDerWaalsContact N-OG 3.08Å; T159-S163 VanDerWaalsContact O-CB 3.31Å; T159-S163 WeakPolarHBondContact O-CB 3.28Å; T159-S163 PolarHBondContact O-N 3.38Å; T159-S163 PolarHBondContact O-OG 2.9Å; L161-S163 VanDerWaalsContact C-N 3.31Å; L161-S163 PolarHBondContact O-N 3.46Å; S163-S167 WeakPolarHBondContact O-CB 3.24Å; S163-S167 PolarHBondContact O-N 2.95Å; S163-S167 PolarHBondContact O-OG 3.09Å
164S95Very high91Very high40 Ų4059.2 Ų59.228%0.2832%0.319SS..Hα-helixtrans-68.8-41.5178.2-57.20000111.6W160 L161 L162 I166 S167 L168W160-S164 VanDerWaalsContact O-CB 3.32Å; W160-S164 WeakPolarHBondContact O-CB 3.44Å; W160-S164 PolarHBondContact O-N 3.33Å; W160-S164 PolarHBondContact O-OG 3.32Å; L161-S164 PolarHBondContact O-N 3.15Å; L162-S164 VanDerWaalsContact C-N 3.32Å; L162-S164 PolarHBondContact O-N 3.18Å; S164-I166 VanDerWaalsContact C-N 3.34Å; S164-I166 PolarHBondContact O-N 3.27Å; S164-S167 WeakPolarHBondContact CA-OG 3.42Å; S164-S167 PolarHBondContact O-N 2.96Å; S164-S167 PolarHBondContact O-OG 3.45Å; S164-L168 VanDerWaalsContact O-CB 3.24Å; S164-L168 WeakPolarHBondContact O-CB 3.44Å; S164-L168 WeakPolarHBondContact O-CG 3.32Å; S164-L168 PolarHBondContact O-N 3.02Å
165I93Very high89.8Confident82 Ų8255.8 Ų55.842%0.42130%0.299SS..Hα-helixtrans-58.4-49.1176.1-69.5165000110L161 L162 S169L161-I165 HydrophobicContact CD1-CD1 4.13Å; L161-I165 HydrophobicContact CD1-CG1 4.47Å; L161-I165 HydrophobicContact CG-CD1 4.01Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.27Å; L162-I165 PolarHBondContact O-N 3.11Å; I165-S169 PolarHBondContact O-N 2.9Å; I165-S169 PolarHBondContact O-OG 3.15Å
166I92.5Very high88.6Confident10 Ų1061.3 Ų61.35%0.05133%0.325CS..Hα-helixtrans-65.8-45.8-178.1-65.2163.9000111.3V116 T120 L162 S164 F195V116-I166 HydrophobicContact CG1-CG2 3.88Å; T120-I166 HydrophobicContact CG2-CD1 4.01Å; L162-I166 WeakPolarHBondContact O-CG1 3.4Å; L162-I166 PolarHBondContact O-N 3.12Å; L162-I166 VanDerWaalsContact O-N 3.11Å; S164-I166 VanDerWaalsContact C-N 3.34Å; S164-I166 PolarHBondContact O-N 3.27Å; I166-F195 HydrophobicContact CG1-CE1 4.01Å; I166-F195 HydrophobicContact CG1-CZ 4.15Å
167S92.3Very high87.4Confident2 Ų260.3 Ų60.31%0.01432%0.32CS..Hα-helixtrans-74.2-27.9-175.853.80000115.5S113 L117 S163 S164S113-S167 VanDerWaalsContact O-CB 3.24Å; S113-S167 WeakPolarHBondContact O-CB 3.5Å; S113-S167 PolarHBondContact OG-O 3.1Å; S113-S167 VanDerWaalsContact OG-O 3.08Å; L117-S167 WeakPolarHBondContact CD1-OG 3.41Å; S163-S167 WeakPolarHBondContact O-CB 3.24Å; S163-S167 PolarHBondContact O-N 2.95Å; S163-S167 PolarHBondContact O-OG 3.09Å; S164-S167 WeakPolarHBondContact CA-OG 3.42Å; S164-S167 PolarHBondContact O-N 2.96Å; S164-S167 PolarHBondContact O-OG 3.45Å
168L90.1Very high86Confident72 Ų7259.3 Ų59.338%0.37730%0.304SS..Hα-helixtrans-91.9-11.7-179.9-60.3173.6000112.6S164 P170 L171 F172S164-L168 VanDerWaalsContact O-CB 3.24Å; S164-L168 WeakPolarHBondContact O-CB 3.44Å; S164-L168 WeakPolarHBondContact O-CG 3.32Å; S164-L168 PolarHBondContact O-N 3.02Å; L168-P170 VanDerWaalsContact C-CD 3.45Å; L168-P170 VanDerWaalsContact C-N 3.31Å; L168-L171 HydrophobicContact CD2-CD1 3.66Å; L168-L171 WeakPolarHBondContact O-CB 3.27Å; L168-L171 PolarHBondContact O-N 3.38Å; L168-F172 HydrophobicContact CB-CE2 4.28Å; L168-F172 WeakPolarHBondContact O-CD2 3.13Å
169S88Confident84.6Confident13 Ų1358.4 Ų58.49%0.09131%0.305CS..G310 helixtrans-50.1-42.3179.2-69.80000113.4I165 L171 F172I165-S169 PolarHBondContact O-N 2.9Å; I165-S169 PolarHBondContact O-OG 3.15Å; S169-L171 VanDerWaalsContact C-N 3.28Å; S169-L171 PolarHBondContact O-N 2.95Å; S169-F172 PolarHBondContact O-N 3.43Å
170P83.9Confident82.9Confident13 Ų1366.4 Ų66.48%0.08434%0.342CS..G310 helixtrans-63.8-27.4176.8-24.436.4000115L168 F172 G173 W174 T177 Y192L168-P170 VanDerWaalsContact C-CD 3.45Å; L168-P170 VanDerWaalsContact C-N 3.31Å; P170-F172 PolarHBondContact O-N 2.88Å; P170-G173 PolarHBondContact O-N 3.27Å; P170-G173 VanDerWaalsContact O-N 3.15Å; P170-W174 WeakPolarHBondContact CA-O 3.24Å; P170-T177 HydrophobicContact CB-CG2 3.9Å; P170-T177 HydrophobicContact CG-CG2 4.27Å; P170-Y192 HydrophobicContact CG-CD2 4.31Å; P170-Y192 HydrophobicContact CG-CE1 4.17Å; P170-Y192 HydrophobicContact CG-CE2 3.5Å; P170-Y192 VanDerWaalsContact CG-CE2 3.5Å; P170-Y192 VanDerWaalsContact CG-CZ 3.4Å; P170-Y192 VanDerWaalsContact CG-OH 3.31Å; P170-Y192 WeakPolarHBondContact CG-OH 3.35Å
171L81.4Confident81.2Confident94 Ų9465.9 Ų65.949%0.49236%0.355SS..G310 helixtrans-70.2-21.1178.8-61.4177.8000112.4Q109 L168 S169 G173Q109-L171 HydrophobicContact CB-CD2 4.38Å; L168-L171 HydrophobicContact CD2-CD1 3.66Å; L168-L171 WeakPolarHBondContact O-CB 3.27Å; L168-L171 PolarHBondContact O-N 3.38Å; S169-L171 VanDerWaalsContact C-N 3.28Å; S169-L171 PolarHBondContact O-N 2.95Å; L171-G173 VanDerWaalsContact C-N 3.26Å
172F84.3Confident79.9Confident174 Ų17465.7 Ų65.776%0.76335%0.352SS*.G310 helixtrans-8810.5174.4-64.5-76.3000113.1L168 S169 P170L168-F172 HydrophobicContact CB-CE2 4.28Å; L168-F172 WeakPolarHBondContact O-CD2 3.13Å; S169-F172 PolarHBondContact O-N 3.43Å; P170-F172 PolarHBondContact O-N 2.88Å
173G75.8Confident79.2Confident62 Ų6268.7 Ų68.764%0.63936%0.362SS*.THydrogen-bonded Turntrans89.712.4177.100000114.9P170 L171 G175P170-G173 PolarHBondContact O-N 3.27Å; P170-G173 VanDerWaalsContact O-N 3.15Å; L171-G173 VanDerWaalsContact C-N 3.26Å; G173-G175 PolarHBondContact O-N 3.49Å
174W78.3Confident78.7Confident174 Ų17469.3 Ų69.366%0.65937%0.367SS*.SBendtrans-92.484.9171.3-80.53.1000110.8P170P170-W174 WeakPolarHBondContact CA-O 3.24Å
175G68.8Low78Confident8 Ų870.6 Ų70.68%0.08237%0.368CS..SBendtrans95.3135.7176.400000114.9G173 S187 E189G173-G175 PolarHBondContact O-N 3.49Å; G175-S187 WeakPolarHBondContact CA-OG 3.14Å; G175-E189 VanDerWaalsContact CA-OE2 3.32Å; G175-E189 WeakPolarHBondContact CA-OE2 3.19Å; G175-E189 PolarHBondContact N-OE2 2.95Å
176E69.9Low77.4Confident137 Ų13767.6 Ų67.664%0.6435%0.353SS*.  trans-87.4123.9174.5-62.4-157.215100111.7S187E176-S187 PolarHBondContact N-OG 2.99Å; E176-S187 VanDerWaalsContact O-CA 3.29Å; E176-S187 WeakPolarHBondContact O-CA 3.43Å; E176-S187 WeakPolarHBondContact O-CB 3.45Å
177T69.6Low76.8Confident9 Ų967.2 Ų67.26%0.05535%0.352CS..SBendtrans-91.9-4.9178.452.80000114C108 Q109 I112 P170 Q185C108-T177 PolarHBondContact SG-O 2.85Å; C108-T177 VanDerWaalsContact SG-O 3.41Å; Q109-T177 WeakPolarHBondContact CG-OG1 3.2Å; I112-T177 HydrophobicContact CG2-CG2 4.24Å; P170-T177 HydrophobicContact CB-CG2 3.9Å; P170-T177 HydrophobicContact CG-CG2 4.27Å; T177-Q185 CarbonylContact C-O 3.43Å; T177-Q185 WeakPolarHBondContact CA-O 3.47Å; T177-Q185 PolarHBondContact O-N 2.89Å
178Y67Low76.1Confident40 Ų4069.9 Ų69.916%0.15736%0.364CS..EExtended strand (participates in β ladder)trans-136.2123.9-177179.9-94.5000110.4W101 R105 C108W101-Y178 AromaticContact CD1-CE2 3.96Å; R105-Y178 HydrophobicContact CB-CD1 4.23Å; R105-Y178 HydrophobicContact CB-CG 4.3Å; R105-Y178 HydrophobicContact CG-CD1 4.19Å; R105-Y178 HydrophobicContact CG-CG 4.17Å; C108-Y178 HydrophobicContact CB-CD2 4.21Å
179S65.5Low75.7Confident69 Ų6970.8 Ų70.848%0.48337%0.366SS..EExtended strand (participates in β ladder)trans-103.4144.3173.1-178.10000110.2G181 M182 K183S179-G181 PolarHBondContact O-N 3.43Å; S179-M182 PolarHBondContact O-N 3.49Å; S179-K183 PolarHBondContact N-O 2.87Å
180E60.2Low75.5Confident173 Ų17373.6 Ų73.681%0.80838%0.384SS*.THydrogen-bonded Turntrans-55-17.7-178.3-67.5-169.9155.100114.1M182E180-M182 PolarHBondContact O-N 3.49Å; E180-M182 VanDerWaalsContact O-N 3.07Å
181G61.7Low75.7Confident47 Ų4777.1 Ų77.149%0.48541%0.409SS..THydrogen-bonded Turntrans-75.826.2174.200000116.6S179 K183S179-G181 PolarHBondContact O-N 3.43Å; G181-K183 PolarHBondContact O-N 3.36Å
182M70.4Confident76Confident93 Ų9373 Ų7346%0.45839%0.387SS..THydrogen-bonded Turntrans57.227.7-179.8-59.3176.2-77.300114.5W101 S179 E180W101-M182 WeakPolarHBondContact CB-O 3.48Å; W101-M182 PolarHBondContact N-O 3.15Å; S179-M182 PolarHBondContact O-N 3.49Å; E180-M182 PolarHBondContact O-N 3.49Å; E180-M182 VanDerWaalsContact O-N 3.07Å
183K79.9Confident76.2Confident131 Ų13164.9 Ų64.957%0.5735%0.352SS*.EExtended strand (participates in β ladder)trans-103.9123.4175.3-67.9-177.9-176.9177.20109.4S179 G181S179-K183 PolarHBondContact N-O 2.87Å; G181-K183 PolarHBondContact O-N 3.36Å
184C84.8Confident76.9Confident13 Ų1365.5 Ų65.59%0.08834%0.34CS..EExtended strand (participates in β ladder)trans-104.7108.8170.7-177.70000108.2W101 C108 W111W101-C184 HydrophobicContact CB-CB 3.67Å; W101-C184 HydrophobicContact CD2-CB 3.59Å; W101-C184 HydrophobicContact CE3-CB 3.99Å; W101-C184 HydrophobicContact CG-CB 3.44Å; W101-C184 VanDerWaalsContact CG-CB 3.44Å; C108-C184 WeakPolarHBondContact CA-SG 3.48Å; C108-C184 HydrophobicContact CB-CB 3.86Å; C108-C184 WeakPolarHBondContact CB-SG 3.46Å; C108-C184 WeakPolarHBondContact SG-CA 3.14Å; C108-C184 WeakPolarHBondContact SG-CB 3.38Å; C108-C184 CovalentContact SG-SG 2.02Å; C108-C184 PolarHBondContact SG-SG 3.5Å; W111-C184 HydrophobicContact CE3-CB 4.48Å; W111-C184 HydrophobicContact CZ3-CB 4.3Å
185Q81.3Confident77.5Confident67 Ų6761.6 Ų61.631%0.31333%0.328SS..  trans-149.2159.5-178.663.4-177.25.900109.8T177 S187T177-Q185 CarbonylContact C-O 3.43Å; T177-Q185 WeakPolarHBondContact CA-O 3.47Å; T177-Q185 PolarHBondContact O-N 2.89Å; Q185-S187 PolarHBondContact O-N 2.88Å
186V80.9Confident78.5Confident18 Ų1861.6 Ų61.611%0.10933%0.327CS..  trans-58140.7175.3-175.80000109.5I112 Q188 Y192I112-V186 HydrophobicContact CD1-CG2 4.43Å; I112-V186 HydrophobicContact CG2-CG2 4.06Å; V186-Q188 PolarHBondContact O-N 3.42Å; V186-Q188 PolarHBondContact O-NE2 3.36Å; V186-Y192 HydrophobicContact CG1-CD1 4.47Å; V186-Y192 HydrophobicContact CG1-CE1 3.69Å
187S79.4Confident79.6Confident3 Ų355.3 Ų55.32%0.02130%0.298CS..  trans-51.5133.4179.41740000110.6G175 E176 Q185 E189 T193G175-S187 WeakPolarHBondContact CA-OG 3.14Å; E176-S187 PolarHBondContact N-OG 2.99Å; E176-S187 VanDerWaalsContact O-CA 3.29Å; E176-S187 WeakPolarHBondContact O-CA 3.43Å; E176-S187 WeakPolarHBondContact O-CB 3.45Å; Q185-S187 PolarHBondContact O-N 2.88Å; S187-E189 VanDerWaalsContact C-N 3.3Å; S187-E189 PolarHBondContact OG-N 3.48Å; S187-T193 PolarHBondContact O-OG1 3.23Å
188Q76.1Confident80.7Confident58 Ų5859.8 Ų59.827%0.27132%0.316SS..  trans-90.76.8-178.9-58.5-69.1-64.500112.1V186 P190 P298V186-Q188 PolarHBondContact O-N 3.42Å; V186-Q188 PolarHBondContact O-NE2 3.36Å; Q188-P190 WeakPolarHBondContact O-CD 3.49Å; Q188-P298 HydrophobicContact CB-CB 4.49Å; Q188-P298 VanDerWaalsContact OE1-CG 3.28Å
189E83.6Confident81.9Confident90 Ų9058.6 Ų58.642%0.42132%0.316SS..  trans-63.2122.3174.4-74.6-166.5166.700110.6G175 S187 S191 Y192 T193G175-E189 VanDerWaalsContact CA-OE2 3.32Å; G175-E189 WeakPolarHBondContact CA-OE2 3.19Å; G175-E189 PolarHBondContact N-OE2 2.95Å; S187-E189 VanDerWaalsContact C-N 3.3Å; S187-E189 PolarHBondContact OG-N 3.48Å; E189-S191 VanDerWaalsContact C-N 3.28Å; E189-S191 PolarHBondContact O-N 2.88Å; E189-S191 VanDerWaalsContact O-N 3.16Å; E189-Y192 PolarHBondContact O-N 3.49Å; E189-Y192 VanDerWaalsContact O-N 3.11Å; E189-T193 PolarHBondContact O-N 2.99Å; E189-T193 PolarHBondContact O-OG1 3.36Å
190P83.8Confident83.1Confident73 Ų7355.5 Ų55.547%0.47429%0.294SS..Hα-helixtrans-57-37.7-171.9-28.334.8000114.3Q188 I194Q188-P190 WeakPolarHBondContact O-CD 3.49Å; P190-I194 WeakPolarHBondContact O-CB 3.45Å; P190-I194 WeakPolarHBondContact O-CD1 3.33Å; P190-I194 WeakPolarHBondContact O-CG1 3.43Å; P190-I194 PolarHBondContact O-N 3.19Å
191S87.2Confident84.7Confident87 Ų8747.3 Ų47.361%0.60826%0.256SS*.Hα-helixtrans-62.9-46.9178.652.20000111.9E189 F195E189-S191 VanDerWaalsContact C-N 3.28Å; E189-S191 PolarHBondContact O-N 2.88Å; E189-S191 VanDerWaalsContact O-N 3.16Å; S191-F195 WeakPolarHBondContact O-CB 3.35Å; S191-F195 PolarHBondContact O-N 3.44Å
192Y87.1Confident86.2Confident7 Ų747.3 Ų47.33%0.02724%0.242CC..Hα-helixtrans-69.2-43.2177.9174.9-99.4000111.7P170 V186 E189 I194 F195 S196P170-Y192 HydrophobicContact CG-CD2 4.31Å; P170-Y192 HydrophobicContact CG-CE1 4.17Å; P170-Y192 HydrophobicContact CG-CE2 3.5Å; P170-Y192 VanDerWaalsContact CG-CE2 3.5Å; P170-Y192 VanDerWaalsContact CG-CZ 3.4Å; P170-Y192 VanDerWaalsContact CG-OH 3.31Å; P170-Y192 WeakPolarHBondContact CG-OH 3.35Å; V186-Y192 HydrophobicContact CG1-CD1 4.47Å; V186-Y192 HydrophobicContact CG1-CE1 3.69Å; E189-Y192 PolarHBondContact O-N 3.49Å; E189-Y192 VanDerWaalsContact O-N 3.11Å; Y192-I194 PolarHBondContact O-N 2.9Å; Y192-F195 PolarHBondContact O-N 2.65Å; Y192-S196 VanDerWaalsContact O-CB 3.26Å; Y192-S196 WeakPolarHBondContact O-CB 3.22Å; Y192-S196 PolarHBondContact O-N 3.08Å; Y192-S196 PolarHBondContact O-OG 2.87Å
193T88.7Confident87.4Confident4 Ų447.3 Ų47.33%0.02524%0.243CC..Hα-helixtrans-58.1-48176.9-58.40000111S187 E189 S196 T197 E294 P298S187-T193 PolarHBondContact O-OG1 3.23Å; E189-T193 PolarHBondContact O-N 2.99Å; E189-T193 PolarHBondContact O-OG1 3.36Å; T193-S196 PolarHBondContact O-OG 2.86Å; T193-T197 HydrophobicContact CG2-CG2 4.13Å; T193-T197 VanDerWaalsContact O-CB 3.3Å; T193-T197 WeakPolarHBondContact O-CB 3.46Å; T193-T197 WeakPolarHBondContact O-CG2 3.45Å; T193-T197 PolarHBondContact O-N 3.35Å; T193-T197 PolarHBondContact O-OG1 3.49Å; T193-E294 VanDerWaalsContact CG2-O 3.28Å; T193-E294 WeakPolarHBondContact CG2-O 3.31Å; T193-P298 HydrophobicContact CG2-CG 3.95Å
194I90.3Very high88Confident75 Ų7541 Ų4139%0.38522%0.216SC..Hα-helixtrans-63.7-49.4180-67.7165.7000110.1P190 Y192 S196 T197 F198P190-I194 WeakPolarHBondContact O-CB 3.45Å; P190-I194 WeakPolarHBondContact O-CD1 3.33Å; P190-I194 WeakPolarHBondContact O-CG1 3.43Å; P190-I194 PolarHBondContact O-N 3.19Å; Y192-I194 PolarHBondContact O-N 2.9Å; I194-S196 PolarHBondContact O-N 3.15Å; I194-T197 PolarHBondContact O-OG1 3.4Å; I194-F198 HydrophobicContact CG2-CD2 3.99Å; I194-F198 HydrophobicContact CG2-CE2 4.23Å; I194-F198 WeakPolarHBondContact O-CB 3.22Å; I194-F198 VanDerWaalsContact O-CD2 3.28Å; I194-F198 WeakPolarHBondContact O-CD2 3.42Å; I194-F198 PolarHBondContact O-N 3.32Å
195F90.9Very high88.4Confident91 Ų9141.3 Ų41.340%0.39922%0.216SC..Hα-helixtrans-59.4-49-179.7172.9-105.5000112.4I166 S191 Y192 G199I166-F195 HydrophobicContact CG1-CE1 4.01Å; I166-F195 HydrophobicContact CG1-CZ 4.15Å; S191-F195 WeakPolarHBondContact O-CB 3.35Å; S191-F195 PolarHBondContact O-N 3.44Å; Y192-F195 PolarHBondContact O-N 2.65Å; F195-G199 PolarHBondContact O-N 3.41Å
196S90.5Very high89.1Confident9 Ų942.1 Ų42.16%0.06323%0.229CC..Hα-helixtrans-68-48.5-177.360.80000111.8Y192 T193 I194 F198 G199 A200Y192-S196 VanDerWaalsContact O-CB 3.26Å; Y192-S196 WeakPolarHBondContact O-CB 3.22Å; Y192-S196 PolarHBondContact O-N 3.08Å; Y192-S196 PolarHBondContact O-OG 2.87Å; T193-S196 PolarHBondContact O-OG 2.86Å; I194-S196 PolarHBondContact O-N 3.15Å; S196-F198 PolarHBondContact O-N 3.43Å; S196-G199 PolarHBondContact O-N 2.89Å; S196-A200 WeakPolarHBondContact O-CA 3.36Å; S196-A200 WeakPolarHBondContact O-CB 3.45Å; S196-A200 PolarHBondContact O-N 3.48Å
197T92.3Very high89.7Confident5 Ų543.5 Ų43.53%0.03124%0.237CC..Hα-helixtrans-65.3-41.3-179.157.40000112.4T193 I194 F201 Y202 F291 E294T193-T197 HydrophobicContact CG2-CG2 4.13Å; T193-T197 VanDerWaalsContact O-CB 3.3Å; T193-T197 WeakPolarHBondContact O-CB 3.46Å; T193-T197 WeakPolarHBondContact O-CG2 3.45Å; T193-T197 PolarHBondContact O-N 3.35Å; T193-T197 PolarHBondContact O-OG1 3.49Å; I194-T197 PolarHBondContact O-OG1 3.4Å; T197-F201 WeakPolarHBondContact O-CB 3.46Å; T197-F201 PolarHBondContact O-N 3.5Å; T197-Y202 WeakPolarHBondContact O-CD2 3.45Å; T197-Y202 PolarHBondContact O-N 3.15Å; T197-F291 HydrophobicContact CG2-CD1 4.35Å; T197-E294 HydrophobicContact CG2-CB 4.4Å
198F93.6Very high90.3Very high103 Ų10343.5 Ų43.545%0.45224%0.237SC..Iπ-helixtrans-68.8-45.5177-84.8-102.5000112.1I194 S196 Y202 L203 L295I194-F198 HydrophobicContact CG2-CD2 3.99Å; I194-F198 HydrophobicContact CG2-CE2 4.23Å; I194-F198 WeakPolarHBondContact O-CB 3.22Å; I194-F198 VanDerWaalsContact O-CD2 3.28Å; I194-F198 WeakPolarHBondContact O-CD2 3.42Å; I194-F198 PolarHBondContact O-N 3.32Å; S196-F198 PolarHBondContact O-N 3.43Å; F198-Y202 HydrophobicContact CD2-CD2 4.23Å; F198-Y202 HydrophobicContact CE2-CD2 4.49Å; F198-Y202 HydrophobicContact CG-CD2 4.36Å; F198-Y202 PolarHBondContact O-N 3.26Å; F198-L203 WeakPolarHBondContact O-CB 3.49Å; F198-L203 PolarHBondContact O-N 2.91Å; F198-L295 HydrophobicContact CE2-CD1 4.48Å
199G91.8Very high91.1Very high14 Ų1444.9 Ų44.914%0.14425%0.246CC..Iπ-helixtrans-68.9-36.2179.300000113.4W124 F195 S196W124-G199 PolarHBondContact NE1-O 3.09Å; W124-G199 VanDerWaalsContact NE1-O 3.14Å; F195-G199 PolarHBondContact O-N 3.41Å; S196-G199 PolarHBondContact O-N 2.89Å
200A91Very high91.6Very high4 Ų446 Ų463%0.03325%0.249CC..Iπ-helixtrans-83.4-27.3-176.600000113.7T120 I123 S196 F291T120-A200 HydrophobicContact CG2-CB 4.23Å; T120-A200 WeakPolarHBondContact OG1-CB 3.21Å; I123-A200 WeakPolarHBondContact CG2-O 3.41Å; S196-A200 WeakPolarHBondContact O-CA 3.36Å; S196-A200 WeakPolarHBondContact O-CB 3.45Å; S196-A200 PolarHBondContact O-N 3.48Å; A200-F291 HydrophobicContact CB-CE1 4.33Å
201F92.8Very high91.9Very high1 Ų142.8 Ų42.80%0.00423%0.229CC..Iπ-helixtrans-137-61.6-172.5-176.8-103.4000114I123 T197 L203 P204 L205 F283 W287 I288 F291I123-F201 HydrophobicContact CD1-CD2 4Å; I123-F201 HydrophobicContact CD1-CE2 4.45Å; T197-F201 WeakPolarHBondContact O-CB 3.46Å; T197-F201 PolarHBondContact O-N 3.5Å; F201-L203 PolarHBondContact O-N 2.9Å; F201-P204 WeakPolarHBondContact O-CD 3.33Å; F201-P204 WeakPolarHBondContact O-CG 3.41Å; F201-L205 HydrophobicContact CD1-CD2 4.44Å; F201-L205 HydrophobicContact CE1-CD2 3.71Å; F201-L205 HydrophobicContact CZ-CD2 3.83Å; F201-L205 WeakPolarHBondContact O-CB 3.23Å; F201-L205 PolarHBondContact O-N 2.95Å; F201-F283 AromaticContact CD2-CE1 3.73Å; F201-F283 HydrophobicContact CD2-CE1 3.73Å; F201-F283 HydrophobicContact CD2-CZ 4.43Å; F201-F283 HydrophobicContact CE2-CD1 4.17Å; F201-F283 AromaticContact CE2-CE1 3.56Å; F201-F283 HydrophobicContact CE2-CE1 3.56Å; F201-W287 HydrophobicContact CD2-CB 4.23Å; F201-W287 HydrophobicContact CE2-CB 3.63Å; F201-W287 HydrophobicContact CZ-CB 4.39Å; F201-I288 HydrophobicContact CE1-CG1 4.08Å; F201-I288 HydrophobicContact CZ-CB 4.49Å; F201-I288 HydrophobicContact CZ-CG1 3.65Å; F201-F291 HydrophobicContact CB-CB 4.48Å; F201-F291 HydrophobicContact CB-CD1 3.61Å; F201-F291 HydrophobicContact CB-CD2 3.68Å; F201-F291 HydrophobicContact CB-CE1 3.62Å; F201-F291 HydrophobicContact CB-CE2 3.69Å; F201-F291 HydrophobicContact CB-CG 3.65Å; F201-F291 HydrophobicContact CB-CZ 3.67Å; F201-F291 HydrophobicContact CD1-CB 3.73Å; F201-F291 HydrophobicContact CD1-CD1 4.43Å; F201-F291 AromaticContact CD1-CD2 3.84Å; F201-F291 HydrophobicContact CD1-CD2 3.84Å; F201-F291 AromaticContact CD1-CG 3.74Å; F201-F291 HydrophobicContact CD1-CG 3.74Å; F201-F291 AromaticContact CD2-CD2 3.25Å; F201-F291 HydrophobicContact CD2-CD2 3.25Å; F201-F291 AromaticContact CD2-CE2 3.39Å; F201-F291 HydrophobicContact CD2-CE2 3.39Å; F201-F291 AromaticContact CD2-CG 3.99Å; F201-F291 HydrophobicContact CD2-CG 3.99Å; F201-F291 HydrophobicContact CD2-CZ 4.22Å; F201-F291 HydrophobicContact CE1-CB 4.07Å; F201-F291 HydrophobicContact CE1-CD2 4.28Å; F201-F291 HydrophobicContact CE1-CG 4.38Å; F201-F291 AromaticContact CE2-CD2 3.75Å; F201-F291 HydrophobicContact CE2-CD2 3.75Å; F201-F291 HydrophobicContact CE2-CE2 4.17Å; F201-F291 HydrophobicContact CG-CB 4.06Å; F201-F291 HydrophobicContact CG-CD1 4.04Å; F201-F291 AromaticContact CG-CD2 3.3Å; F201-F291 HydrophobicContact CG-CD2 3.3Å; F201-F291 HydrophobicContact CG-CE1 4.35Å; F201-F291 AromaticContact CG-CE2 3.67Å; F201-F291 HydrophobicContact CG-CE2 3.67Å; F201-F291 AromaticContact CG-CG 3.52Å; F201-F291 HydrophobicContact CG-CG 3.52Å; F201-F291 HydrophobicContact CG-CZ 4.19Å; F201-F291 HydrophobicContact CZ-CD2 4.24Å
202Y94.1Very high91.9Very high47 Ų4742.2 Ų42.218%0.18421%0.213CC..Iπ-helixtrans-67-40.2-167.5-63.5-76.1000113.7T197 F198 C206 F291 L295T197-Y202 WeakPolarHBondContact O-CD2 3.45Å; T197-Y202 PolarHBondContact O-N 3.15Å; F198-Y202 HydrophobicContact CD2-CD2 4.23Å; F198-Y202 HydrophobicContact CE2-CD2 4.49Å; F198-Y202 HydrophobicContact CG-CD2 4.36Å; F198-Y202 PolarHBondContact O-N 3.26Å; Y202-C206 WeakPolarHBondContact O-CB 3.37Å; Y202-C206 PolarHBondContact O-N 3.28Å; Y202-C206 PolarHBondContact O-SG 3.45Å; Y202-F291 PolarHBondContact OH-O 3.35Å; Y202-L295 HydrophobicContact CE2-CD2 3.89Å
203L94.5Very high92Very high93 Ų9348.2 Ų48.249%0.48724%0.236SC..Hα-helixtrans-64.7-57.6176.9177.769.3000111.8W124 F198 F201 L205 C206 V207W124-L203 HydrophobicContact CH2-CD2 4.28Å; W124-L203 HydrophobicContact CH2-CG 4.49Å; W124-L203 HydrophobicContact CZ2-CD2 4.21Å; F198-L203 WeakPolarHBondContact O-CB 3.49Å; F198-L203 PolarHBondContact O-N 2.91Å; F201-L203 PolarHBondContact O-N 2.9Å; L203-L205 PolarHBondContact O-N 2.92Å; L203-C206 PolarHBondContact O-N 2.98Å; L203-C206 VanDerWaalsContact O-N 3.16Å; L203-V207 WeakPolarHBondContact O-CG2 3.38Å; L203-V207 PolarHBondContact O-N 3.42Å
204P93.4Very high92Very high0 Ų051.4 Ų51.40%025%0.25CC..Hα-helixtrans-58.9-33.7175.916.5-27.7000112.9I123 W124 T127 F201 V207 V208I123-P204 HydrophobicContact CD1-CB 4.03Å; I123-P204 HydrophobicContact CD1-CG 4.02Å; I123-P204 HydrophobicContact CG1-CB 4.17Å; I123-P204 HydrophobicContact CG1-CG 4.49Å; I123-P204 HydrophobicContact CG2-CB 3.85Å; I123-P204 HydrophobicContact CG2-CG 3.58Å; W124-P204 HydrophobicContact CD2-CB 3.88Å; W124-P204 HydrophobicContact CD2-CG 4.28Å; W124-P204 HydrophobicContact CE3-CB 4.16Å; W124-P204 HydrophobicContact CG-CB 4.37Å; W124-P204 HydrophobicContact CH2-CB 4.28Å; W124-P204 HydrophobicContact CZ2-CB 4Å; W124-P204 HydrophobicContact CZ2-CG 3.98Å; W124-P204 HydrophobicContact CZ3-CB 4.35Å; T127-P204 PolarHBondContact OG1-O 2.81Å; F201-P204 WeakPolarHBondContact O-CD 3.33Å; F201-P204 WeakPolarHBondContact O-CG 3.41Å; P204-V207 PolarHBondContact O-N 3.27Å; P204-V208 WeakPolarHBondContact O-CB 3.31Å; P204-V208 PolarHBondContact O-N 3.38Å
205L93.8Very high91.7Very high18 Ų1848.1 Ų48.19%0.09423%0.233CC..Hα-helixtrans-60.9-48.8173178.459.7000112.2I123 F201 L203 V207 V208 L209 V284I123-L205 HydrophobicContact CD1-CB 4.25Å; F201-L205 HydrophobicContact CD1-CD2 4.44Å; F201-L205 HydrophobicContact CE1-CD2 3.71Å; F201-L205 HydrophobicContact CZ-CD2 3.83Å; F201-L205 WeakPolarHBondContact O-CB 3.23Å; F201-L205 PolarHBondContact O-N 2.95Å; L203-L205 PolarHBondContact O-N 2.92Å; L205-V207 VanDerWaalsContact C-N 3.31Å; L205-V207 PolarHBondContact O-N 3.26Å; L205-V208 HydrophobicContact CD1-CG1 4.3Å; L205-V208 WeakPolarHBondContact O-CG1 3.32Å; L205-V208 PolarHBondContact O-N 3.15Å; L205-L209 HydrophobicContact CD1-CD1 3.77Å; L205-L209 HydrophobicContact CD1-CD2 4.48Å; L205-L209 HydrophobicContact CD1-CG 3.89Å; L205-L209 HydrophobicContact CG-CD1 3.89Å; L205-L209 HydrophobicContact CG-CG 4.39Å; L205-L209 WeakPolarHBondContact O-CB 3.39Å; L205-L209 VanDerWaalsContact O-CG 3.24Å; L205-L209 WeakPolarHBondContact O-CG 3.42Å; L205-L209 PolarHBondContact O-N 3.35Å; L205-V284 HydrophobicContact CD1-CG2 3.33Å
206C94.9Very high91.4Very high84 Ų8450 Ų5057%0.56824%0.238SC*.Hα-helixtrans-59.5-43.6176.6-74.60000111.7Y202 L203 F210Y202-C206 WeakPolarHBondContact O-CB 3.37Å; Y202-C206 PolarHBondContact O-N 3.28Å; Y202-C206 PolarHBondContact O-SG 3.45Å; L203-C206 PolarHBondContact O-N 2.98Å; L203-C206 VanDerWaalsContact O-N 3.16Å; C206-F210 VanDerWaalsContact O-CB 3.29Å; C206-F210 WeakPolarHBondContact O-CB 3.36Å; C206-F210 PolarHBondContact O-N 3.35Å
207V94.6Very high91.1Very high48 Ų4855.5 Ų55.529%0.29126%0.261SS..Hα-helixtrans-62.2-49177.9176.40000110.7T127 L203 P204 L205 L209 F210 V211T127-V207 HydrophobicContact CG2-CB 4.13Å; T127-V207 HydrophobicContact CG2-CG1 3.61Å; L203-V207 WeakPolarHBondContact O-CG2 3.38Å; L203-V207 PolarHBondContact O-N 3.42Å; P204-V207 PolarHBondContact O-N 3.27Å; L205-V207 VanDerWaalsContact C-N 3.31Å; L205-V207 PolarHBondContact O-N 3.26Å; V207-L209 PolarHBondContact O-N 3.24Å; V207-F210 PolarHBondContact O-N 3.19Å; V207-V211 HydrophobicContact CG1-CG2 4.33Å; V207-V211 WeakPolarHBondContact O-CB 3.09Å; V207-V211 VanDerWaalsContact O-CG2 3.22Å; V207-V211 WeakPolarHBondContact O-CG2 3.27Å; V207-V211 PolarHBondContact O-N 3.08Å
208V91.9Very high90.6Very high3 Ų356.6 Ų56.62%0.01827%0.271CS..Hα-helixtrans-67.2-39.5-176.280.60000112.1V126 T127 A130 P204 L205 V211 Y212 I280V126-V208 HydrophobicContact CG1-CG2 4.28Å; T127-V208 HydrophobicContact CG2-CB 4.46Å; A130-V208 HydrophobicContact CB-CG2 3.63Å; P204-V208 WeakPolarHBondContact O-CB 3.31Å; P204-V208 PolarHBondContact O-N 3.38Å; L205-V208 HydrophobicContact CD1-CG1 4.3Å; L205-V208 WeakPolarHBondContact O-CG1 3.32Å; L205-V208 PolarHBondContact O-N 3.15Å; V208-V211 PolarHBondContact O-N 2.72Å; V208-Y212 WeakPolarHBondContact O-CB 3.13Å; V208-Y212 PolarHBondContact O-N 3Å; V208-I280 HydrophobicContact CG1-CG1 4.34Å; V208-I280 HydrophobicContact CG1-CG2 4.01Å; V208-I280 HydrophobicContact CG2-CD1 3.56Å; V208-I280 HydrophobicContact CG2-CG1 3.64Å
209L92.4Very high89.7Confident86 Ų8653.8 Ų53.845%0.4527%0.266SS..Hα-helixtrans-64.3-42.6175-69.9175.3000111.5L205 V207 Y212 W213 I280L205-L209 HydrophobicContact CD1-CD1 3.77Å; L205-L209 HydrophobicContact CD1-CD2 4.48Å; L205-L209 HydrophobicContact CD1-CG 3.89Å; L205-L209 HydrophobicContact CG-CD1 3.89Å; L205-L209 HydrophobicContact CG-CG 4.39Å; L205-L209 WeakPolarHBondContact O-CB 3.39Å; L205-L209 VanDerWaalsContact O-CG 3.24Å; L205-L209 WeakPolarHBondContact O-CG 3.42Å; L205-L209 PolarHBondContact O-N 3.35Å; V207-L209 PolarHBondContact O-N 3.24Å; L209-Y212 PolarHBondContact O-N 3.14Å; L209-W213 WeakPolarHBondContact O-CB 3.1Å; L209-W213 PolarHBondContact O-N 3.33Å; L209-I280 HydrophobicContact CD2-CG2 4.04Å
210F93.2Very high88.9Confident113 Ų11359.4 Ų59.450%0.49629%0.287SS..Hα-helixtrans-61.7-46.1175.9174-100.4000112C206 V207 Y212 W213 K214C206-F210 VanDerWaalsContact O-CB 3.29Å; C206-F210 WeakPolarHBondContact O-CB 3.36Å; C206-F210 PolarHBondContact O-N 3.35Å; V207-F210 PolarHBondContact O-N 3.19Å; F210-Y212 VanDerWaalsContact C-N 3.34Å; F210-W213 HydrophobicContact CD2-CE3 4.23Å; F210-W213 HydrophobicContact CE2-CE3 4.28Å; F210-W213 HydrophobicContact CE2-CZ3 4.16Å; F210-W213 PolarHBondContact O-N 3.23Å; F210-K214 HydrophobicContact CD1-CG 4.49Å; F210-K214 HydrophobicContact CE1-CG 4.14Å; F210-K214 HydrophobicContact CE2-CG 4.47Å; F210-K214 HydrophobicContact CZ-CD 4.38Å; F210-K214 HydrophobicContact CZ-CG 4.15Å; F210-K214 WeakPolarHBondContact O-CG 3.26Å; F210-K214 PolarHBondContact O-N 3.35Å
211V91.3Very high88Confident7 Ų766.4 Ų66.44%0.04232%0.317CS..Hα-helixtrans-62.7-43.7177.3173.10000110.5A130 L131 Y134 V207 V208 K214 I215A130-V211 HydrophobicContact CB-CG1 4.13Å; L131-V211 HydrophobicContact CD2-CG1 4.34Å; L131-V211 HydrophobicContact CD2-CG2 3.49Å; L131-V211 VanDerWaalsContact CD2-CG2 3.49Å; L131-V211 HydrophobicContact CG-CG2 4.14Å; Y134-V211 HydrophobicContact CG-CG1 4.11Å; V207-V211 HydrophobicContact CG1-CG2 4.33Å; V207-V211 WeakPolarHBondContact O-CB 3.09Å; V207-V211 VanDerWaalsContact O-CG2 3.22Å; V207-V211 WeakPolarHBondContact O-CG2 3.27Å; V207-V211 PolarHBondContact O-N 3.08Å; V208-V211 PolarHBondContact O-N 2.72Å; V211-K214 WeakPolarHBondContact O-CB 3.45Å; V211-K214 PolarHBondContact O-N 3.36Å; V211-I215 HydrophobicContact CG1-CD1 4.17Å; V211-I215 WeakPolarHBondContact O-CG1 3.29Å; V211-I215 PolarHBondContact O-N 2.87Å
212Y86.8Confident86.7Confident74 Ų7472.1 Ų72.129%0.2934%0.338SS..Hα-helixtrans-63.7-41.9177.4-172.9-104.6000112.3V208 L209 F210 K214 I215 Y216 I280V208-Y212 WeakPolarHBondContact O-CB 3.13Å; V208-Y212 PolarHBondContact O-N 3Å; L209-Y212 PolarHBondContact O-N 3.14Å; F210-Y212 VanDerWaalsContact C-N 3.34Å; Y212-K214 VanDerWaalsContact C-N 3.31Å; Y212-K214 PolarHBondContact O-N 3.46Å; Y212-I215 WeakPolarHBondContact O-CB 3.12Å; Y212-I215 PolarHBondContact O-N 2.87Å; Y212-I215 VanDerWaalsContact O-N 3.15Å; Y212-Y216 PolarHBondContact O-N 2.93Å; Y212-I280 HydrophobicContact CD2-CD1 3.98Å; Y212-I280 HydrophobicContact CG-CD1 4.08Å
213W88.6Confident85.1Confident134 Ų13473.4 Ų73.451%0.50835%0.348SS..Hα-helixtrans-58.8-42.1173174.571.6000112L209 F210 Y216 K217L209-W213 WeakPolarHBondContact O-CB 3.1Å; L209-W213 PolarHBondContact O-N 3.33Å; F210-W213 HydrophobicContact CD2-CE3 4.23Å; F210-W213 HydrophobicContact CE2-CE3 4.28Å; F210-W213 HydrophobicContact CE2-CZ3 4.16Å; F210-W213 PolarHBondContact O-N 3.23Å; W213-Y216 PolarHBondContact O-N 3.31Å; W213-K217 WeakPolarHBondContact O-CB 3.3Å; W213-K217 PolarHBondContact O-N 3.2Å
214K89.3Confident83.3Confident71 Ų7170.8 Ų70.831%0.30934%0.343SS..Hα-helixtrans-63.2-41.2174.3-71.2-79.5-173.4169.70112.2Y134 F210 V211 Y212 K217 A218Y134-K214 HydrophobicContact CD2-CB 4.1Å; Y134-K214 HydrophobicContact CE2-CB 3.59Å; F210-K214 HydrophobicContact CD1-CG 4.49Å; F210-K214 HydrophobicContact CE1-CG 4.14Å; F210-K214 HydrophobicContact CE2-CG 4.47Å; F210-K214 HydrophobicContact CZ-CD 4.38Å; F210-K214 HydrophobicContact CZ-CG 4.15Å; F210-K214 WeakPolarHBondContact O-CG 3.26Å; F210-K214 PolarHBondContact O-N 3.35Å; V211-K214 WeakPolarHBondContact O-CB 3.45Å; V211-K214 PolarHBondContact O-N 3.36Å; Y212-K214 VanDerWaalsContact C-N 3.31Å; Y212-K214 PolarHBondContact O-N 3.46Å; K214-K217 PolarHBondContact O-N 2.99Å; K214-A218 WeakPolarHBondContact O-CB 3.21Å; K214-A218 PolarHBondContact O-N 3.36Å
215I84.9Confident81.4Confident6 Ų673.1 Ų73.13%0.03136%0.359CS..Hα-helixtrans-60.6-49.3174.2-67.3168.6000110.1R133 Y134 I137 V211 Y212 K217 A218 A219 A273R133-I215 HydrophobicContact CB-CD1 4.46Å; Y134-I215 HydrophobicContact CD2-CG1 3.8Å; Y134-I215 HydrophobicContact CG-CG1 4.33Å; I137-I215 HydrophobicContact CD1-CG2 4.13Å; V211-I215 HydrophobicContact CG1-CD1 4.17Å; V211-I215 WeakPolarHBondContact O-CG1 3.29Å; V211-I215 PolarHBondContact O-N 2.87Å; Y212-I215 WeakPolarHBondContact O-CB 3.12Å; Y212-I215 PolarHBondContact O-N 2.87Å; Y212-I215 VanDerWaalsContact O-N 3.15Å; I215-K217 PolarHBondContact O-N 3.35Å; I215-A218 PolarHBondContact O-N 3.41Å; I215-A219 WeakPolarHBondContact O-CB 3.42Å; I215-A219 PolarHBondContact O-N 2.96Å; I215-A273 HydrophobicContact CG2-CB 4.15Å
216Y83.9Confident79.5Confident130 Ų13076.6 Ų76.651%0.5137%0.371SS..Hα-helixtrans-59.5-45.7179.2174.2-104.9000111.9Y212 W213 A218 A219 K220Y212-Y216 PolarHBondContact O-N 2.93Å; W213-Y216 PolarHBondContact O-N 3.31Å; Y216-A218 PolarHBondContact O-N 3.49Å; Y216-A219 PolarHBondContact O-N 3.48Å; Y216-K220 HydrophobicContact CE1-CD 4.39Å; Y216-K220 WeakPolarHBondContact O-CB 3.41Å; Y216-K220 PolarHBondContact O-N 2.92Å
217K84.2Confident77.3Confident125 Ų12580.7 Ų80.754%0.54338%0.379SS..Hα-helixtrans-61.4-45.2176.4-173.6177.9179.8177.40111.7W213 K214 I215 A219 K220 F221W213-K217 WeakPolarHBondContact O-CB 3.3Å; W213-K217 PolarHBondContact O-N 3.2Å; K214-K217 PolarHBondContact O-N 2.99Å; I215-K217 PolarHBondContact O-N 3.35Å; K217-A219 VanDerWaalsContact C-N 3.34Å; K217-A219 PolarHBondContact O-N 2.9Å; K217-K220 PolarHBondContact O-N 3.34Å; K217-F221 WeakPolarHBondContact O-CB 3.38Å; K217-F221 PolarHBondContact O-N 2.66Å
218A80.8Confident75.1Confident28 Ų2884 Ų8423%0.23140%0.399CS..Hα-helixtrans-62.3-4117800000112K214 I215 Y216 R222K214-A218 WeakPolarHBondContact O-CB 3.21Å; K214-A218 PolarHBondContact O-N 3.36Å; I215-A218 PolarHBondContact O-N 3.41Å; Y216-A218 PolarHBondContact O-N 3.49Å; A218-R222 WeakPolarHBondContact O-CG 3Å; A218-R222 PolarHBondContact O-N 3.23Å
219A75.4Confident73Confident43 Ų4390 Ų9036%0.35543%0.431SS..Hα-helixtrans-66.3-43.317600000112.2I215 Y216 K217 R222 I223I215-A219 WeakPolarHBondContact O-CB 3.42Å; I215-A219 PolarHBondContact O-N 2.96Å; Y216-A219 PolarHBondContact O-N 3.48Å; K217-A219 VanDerWaalsContact C-N 3.34Å; K217-A219 PolarHBondContact O-N 2.9Å; A219-R222 PolarHBondContact O-N 3.33Å; A219-I223 WeakPolarHBondContact O-CG1 3.39Å; A219-I223 PolarHBondContact O-N 3.18Å
220K76.1Confident70.5Confident132 Ų13290.6 Ų90.657%0.57444%0.439SS*.Hα-helixtrans-65.9-39.4178.7-170.7173.3-179.5177.60112.2Y216 K217 I223 G224Y216-K220 HydrophobicContact CE1-CD 4.39Å; Y216-K220 WeakPolarHBondContact O-CB 3.41Å; Y216-K220 PolarHBondContact O-N 2.92Å; K217-K220 PolarHBondContact O-N 3.34Å; K220-I223 PolarHBondContact O-N 3.29Å; K220-G224 PolarHBondContact O-N 2.95Å
221F70.4Confident68.3Low151 Ų15192.6 Ų92.666%0.66245%0.453SS*.Hα-helixtrans-63.6-40.8177.2-168.7-96.7000112.1K217 I223 G224 S225K217-F221 WeakPolarHBondContact O-CB 3.38Å; K217-F221 PolarHBondContact O-N 2.66Å; F221-I223 VanDerWaalsContact C-N 3.31Å; F221-I223 PolarHBondContact O-N 3.41Å; F221-G224 PolarHBondContact O-N 3.14Å; F221-S225 PolarHBondContact O-N 3.36Å
222R66Low65.8Low121 Ų12197.7 Ų97.746%0.45748%0.484SS..Hα-helixtrans-61.8-35.9174.7-72.8-174.3-179.7-1634.5113.2I137 A218 A219 R226I137-R222 PolarHBondContact O-NH2 3.02Å; A218-R222 WeakPolarHBondContact O-CG 3Å; A218-R222 PolarHBondContact O-N 3.23Å; A219-R222 PolarHBondContact O-N 3.33Å; R222-R226 PolarHBondContact O-N 2.92Å
223I61.3Low63.5Low75 Ų7599.5 Ų99.539%0.38551%0.505SS..Hα-helixtrans-74-38.9176.2-63.6166.9000110.9A219 K220 F221 R226 K227A219-I223 WeakPolarHBondContact O-CG1 3.39Å; A219-I223 PolarHBondContact O-N 3.18Å; K220-I223 PolarHBondContact O-N 3.29Å; F221-I223 VanDerWaalsContact C-N 3.31Å; F221-I223 PolarHBondContact O-N 3.41Å; I223-R226 PolarHBondContact O-N 2.94Å; I223-K227 PolarHBondContact O-N 2.92Å
224G55.8Low60.9Low37 Ų37101 Ų10138%0.38152%0.52SS..Hα-helixtrans-60.7-51.8176.600000112.7K220 F221 R226 K227 T228K220-G224 PolarHBondContact O-N 2.95Å; F221-G224 PolarHBondContact O-N 3.14Å; G224-R226 VanDerWaalsContact C-N 3.26Å; G224-R226 PolarHBondContact O-N 2.67Å; G224-K227 PolarHBondContact O-N 3.23Å; G224-T228 PolarHBondContact O-N 3.32Å; G224-T228 PolarHBondContact O-OG1 3.49Å
225S54.4Low58.5Low50 Ų50103 Ų10335%0.3554%0.54SS..Hα-helixtrans-63.6-28.5176.7-69.10000113.5F221 T228 N229F221-S225 PolarHBondContact O-N 3.36Å; S225-T228 PolarHBondContact O-N 3.42Å; S225-N229 VanDerWaalsContact O-CG 3.31Å; S225-N229 PolarHBondContact O-N 3.23Å
226R52.6Low56Low91 Ų91111.4 Ų111.434%0.34358%0.58SS.*Hα-helixtrans-69-41.4174.4-99.8-172.5176.4170.12.7112.8R222 I223 G224 T228 N229 T230 Q258 E266R222-R226 PolarHBondContact O-N 2.92Å; I223-R226 PolarHBondContact O-N 2.94Å; G224-R226 VanDerWaalsContact C-N 3.26Å; G224-R226 PolarHBondContact O-N 2.67Å; R226-T228 PolarHBondContact O-N 3.04Å; R226-N229 PolarHBondContact O-N 3Å; R226-N229 VanDerWaalsContact O-N 3.15Å; R226-T230 PolarHBondContact O-N 3.33Å; R226-T230 VanDerWaalsContact O-N 3.09Å; R226-T230 PolarHBondContact O-OG1 3.35Å; R226-T230 VanDerWaalsContact O-OG1 3.11Å; R226-Q258 VanDerWaalsContact CZ-NE2 3.3Å; R226-E266 IonicContact CZ-OE2 3.31Å; R226-E266 VanDerWaalsContact CZ-OE2 3.31Å; R226-E266 IonicContact NH1-OE1 3.57Å; R226-E266 IonicContact NH1-OE2 2.6Å; R226-E266 PolarHBondContact NH1-OE2 3.16Å; R226-E266 IonicContact NH2-OE2 3.33Å; R226-E266 PolarHBondContact NH2-OE2 3.08Å
227K48.9Very low53.9Low170 Ų170110.4 Ų110.474%0.73959%0.586SS**Hα-helixtrans-62-31.9175.9-79.5-169.5174.2-170.50112.3I223 G224I223-K227 PolarHBondContact O-N 2.92Å; G224-K227 PolarHBondContact O-N 3.23Å
228T49.5Very low51.7Low116 Ų116113.9 Ų113.971%0.71260%0.602SS**Hα-helixtrans-76.8-25.3176.9-40.40000112.9G224 S225 R226G224-T228 PolarHBondContact O-N 3.32Å; G224-T228 PolarHBondContact O-OG1 3.49Å; S225-T228 PolarHBondContact O-N 3.42Å; R226-T228 PolarHBondContact O-N 3.04Å
229N47.8Very low49.6Very low129 Ų129121 Ų12169%0.6963%0.63SS**Hα-helixtrans-96.1-3.3-179.9-69-9.9000114S225 R226 I231S225-N229 VanDerWaalsContact O-CG 3.31Å; S225-N229 PolarHBondContact O-N 3.23Å; R226-N229 PolarHBondContact O-N 3Å; R226-N229 VanDerWaalsContact O-N 3.15Å; N229-I231 PolarHBondContact O-N 3.03Å; N229-I231 VanDerWaalsContact O-N 3.08Å
230T39.5Very low47.5Very low99 Ų99128.5 Ų128.561%0.60766%0.658SS**  trans-7595.1166.9-48.50000107.7R226 T232R226-T230 PolarHBondContact O-N 3.33Å; R226-T230 VanDerWaalsContact O-N 3.09Å; R226-T230 PolarHBondContact O-OG1 3.35Å; R226-T230 VanDerWaalsContact O-OG1 3.11Å; T230-T232 PolarHBondContact O-N 2.84Å
231I46.2Very low45.8Very low155 Ų155126.5 Ų126.580%0.79567%0.666SS**  trans-63.3101.4167.7-60.1170.5000106.3N229N229-I231 PolarHBondContact O-N 3.03Å; N229-I231 VanDerWaalsContact O-N 3.08Å
232T39.3Very low43.7Very low114 Ų114128.9 Ų128.970%0.69968%0.679SS**PPolyproline II helixtrans-56.7130.9162-19.70000106.5T230 M234T230-T232 PolarHBondContact O-N 2.84Å; T232-M234 PolarHBondContact O-N 3.22Å; T232-M234 VanDerWaalsContact O-N 3.09Å
233P38.3Very low41.9Very low113 Ų113132.2 Ų132.273%0.73470%0.7SS**PPolyproline II helixtrans-53.2124.6169.7-17.328.4000107.1
234M35.1Very low40.8Very low165 Ų165134 Ų13481%0.81372%0.716SS**PPolyproline II helixtrans-54.5134.2167.1-80.5179.665.100107T232 E236T232-M234 PolarHBondContact O-N 3.22Å; T232-M234 VanDerWaalsContact O-N 3.09Å; M234-E236 PolarHBondContact O-N 3.32Å
235P37.9Very low39.3Very low113 Ų113140.8 Ų140.873%0.73474%0.738SS**PPolyproline II helixtrans-57127.9169.224.3-30.1000107.2V237P235-V237 PolarHBondContact O-N 3.12Å
236E32.2Very low38.3Very low183 Ų183147.7 Ų147.786%0.85577%0.767SS**  trans-54.8100.7177.8-166.3174.4-172.400108.4M234 K238M234-E236 PolarHBondContact O-N 3.32Å; E236-K238 PolarHBondContact O-N 3.17Å; E236-K238 VanDerWaalsContact O-N 3.15Å
237V40.8Very low37.3Very low108 Ų108148.2 Ų148.266%0.65578%0.78SS**  trans-71.8106.2167.2178.90000105.1P235 E239P235-V237 PolarHBondContact O-N 3.12Å; V237-E239 PolarHBondContact O-N 3.05Å; V237-E239 VanDerWaalsContact O-N 3.15Å
238K38.2Very low36.5Very low199 Ų199149.3 Ų149.387%0.86579%0.785SS**  trans-60.6112.8163.9-78.2-176.7174.6-176.80107.2E236E236-K238 PolarHBondContact O-N 3.17Å; E236-K238 VanDerWaalsContact O-N 3.15Å
239E35.4Very low35.7Very low178 Ų178148.9 Ų148.983%0.83278%0.783SS**  trans-118.4117.6173.1-147.8166.4-156.500108.8V237V237-E239 PolarHBondContact O-N 3.05Å; V237-E239 VanDerWaalsContact O-N 3.15Å
240E31.6Very low35.1Very low199 Ų199146.8 Ų146.893%0.9378%0.775SS**  trans-73.8123170.4-82.2178.9151.600110
241A39.7Very low35.1Very low90 Ų90152.9 Ų152.974%0.74479%0.787SS**  trans4.2120.4163.200000121.7
242Q28Very low34.6Very low201 Ų201153.3 Ų153.394%0.93979%0.785SS**  -164.2143.6120.6-121.8157.7-20.400114.7
243Q27.8Very low34.6Very low191 Ų191151.7 Ų151.789%0.89378%0.783SS**  trans-41.3172.9-172.7-95.9179.5-300122.7
244P37.2Very low34.5Very low113 Ų113152 Ų15273%0.73478%0.783SS**  -102.1152.8-121.140.4-36.6000116.6
245Q25.7Very low34.8Very low179 Ų179149.3 Ų149.384%0.83678%0.775SS**  trans-129.4122.7152.9-83.5-167.3-14.900110.1V247Q245-V247 PolarHBondContact O-N 3.29Å; Q245-V247 VanDerWaalsContact O-N 3.08Å
246M32.6Very low35.2Very low195 Ų195149.5 Ų149.596%0.96178%0.775SS**  trans-7594.3171.4-69.7-163.9-69.900109.4
247V31Very low36Very low103 Ų103149.3 Ų149.362%0.62477%0.772SS**  trans-99105.4162.2-176.90000107.4Q245 T249Q245-V247 PolarHBondContact O-N 3.29Å; Q245-V247 VanDerWaalsContact O-N 3.08Å; V247-T249 HydrophobicContact CG1-CG2 4.05Å; V247-T249 PolarHBondContact O-N 2.99Å
248F32.7Very low36.6Very low192 Ų192149.5 Ų149.584%0.84277%0.765SS**  trans-7183172.8-166.1-105.3000109.1V250F248-V250 HydrophobicContact CD1-CG2 3.58Å; F248-V250 HydrophobicContact CE1-CG2 3.02Å; F248-V250 HydrophobicContact CE2-CG2 4.42Å; F248-V250 HydrophobicContact CG-CG2 4.49Å; F248-V250 HydrophobicContact CZ-CG2 3.52Å
249T33.3Very low37.4Very low108 Ų108143.9 Ų143.966%0.66375%0.748SS**  trans-93.299.7164.438.30000108.2V247 R251V247-T249 HydrophobicContact CG1-CG2 4.05Å; V247-T249 PolarHBondContact O-N 2.99Å; T249-R251 PolarHBondContact O-N 3.29Å
250V35.7Very low38.3Very low85 Ų85142.2 Ų142.252%0.51574%0.744SS.*  trans-67.986.2164.3-174.80000107.5F248 H252F248-V250 HydrophobicContact CD1-CG2 3.58Å; F248-V250 HydrophobicContact CE1-CG2 3.02Å; F248-V250 HydrophobicContact CE2-CG2 4.42Å; F248-V250 HydrophobicContact CG-CG2 4.49Å; F248-V250 HydrophobicContact CZ-CG2 3.52Å; V250-H252 VanDerWaalsContact C-N 3.35Å; V250-H252 PolarHBondContact O-N 3.36Å; V250-H252 VanDerWaalsContact O-N 3.13Å
251R38.8Very low39.6Very low227 Ų227134.3 Ų134.386%0.85772%0.716SS**  trans-74.496.1161-88.8-175.4171.9174.7-0.2106.8T249 A253T249-R251 PolarHBondContact O-N 3.29Å; R251-A253 PolarHBondContact O-N 2.87Å
252H35.5Very low40.8Very low163 Ų163132.9 Ų132.976%0.75570%0.696SS**  trans-60.788.7159.6-80-78.6000108V250 T254V250-H252 VanDerWaalsContact C-N 3.35Å; V250-H252 PolarHBondContact O-N 3.36Å; V250-H252 VanDerWaalsContact O-N 3.13Å; H252-T254 VanDerWaalsContact C-N 3.3Å; H252-T254 PolarHBondContact O-N 2.76Å
253A38.3Very low42.6Very low80 Ų80125.5 Ų125.566%0.66167%0.665SS**  trans-6995.316500000106.7R251 V255R251-A253 PolarHBondContact O-N 2.87Å; A253-V255 PolarHBondContact O-N 3.28Å
254T36.8Very low44.3Very low120 Ų120123.5 Ų123.574%0.73665%0.649SS**  trans-68.484.8169.1-47.90000107.8H252 T256H252-T254 VanDerWaalsContact C-N 3.3Å; H252-T254 PolarHBondContact O-N 2.76Å; T254-T256 PolarHBondContact O-N 3.36Å
255V42Very low45.7Very low108 Ų108125.6 Ų125.666%0.65564%0.643SS**  trans-66.299.9171.7179.50000107A253 F257A253-V255 PolarHBondContact O-N 3.28Å; V255-F257 HydrophobicContact CG1-CD2 4Å; V255-F257 HydrophobicContact CG1-CE2 3.95Å; V255-F257 PolarHBondContact O-N 3.01Å
256T47.1Very low47.7Very low117 Ų117119 Ų11972%0.71861%0.611SS**  trans-79.399.8172.5300000108.1T254 Q258T254-T256 PolarHBondContact O-N 3.36Å; T256-Q258 PolarHBondContact O-N 2.91Å
257F47Very low49.5Very low180 Ų180115.1 Ų115.179%0.78959%0.591SS**  trans-62.799.7167.2-88.2-95000108.8V255 T259V255-F257 HydrophobicContact CG1-CD2 4Å; V255-F257 HydrophobicContact CG1-CE2 3.95Å; V255-F257 PolarHBondContact O-N 3.01Å; F257-T259 PolarHBondContact O-N 3.23Å
258Q53.8Low51.4Low112 Ų112115.6 Ų115.652%0.52359%0.585SS.*  trans-74.5105164.6-90.3178.7-0.800107.9R226 T256R226-Q258 VanDerWaalsContact CZ-NE2 3.3Å; T256-Q258 PolarHBondContact O-N 2.91Å
259T55.3Low53.2Low81 Ų81110 Ų11050%0.49756%0.561SS.*  trans-69143.8171.562.40000109.3F257 G261 D262F257-T259 PolarHBondContact O-N 3.23Å; T259-G261 PolarHBondContact O-N 3.45Å; T259-D262 PolarHBondContact O-N 3.21Å; T259-D262 PolarHBondContact OG1-OD2 2.94Å
260D54.7Low55.1Low142 Ų142109.5 Ų109.576%0.75955%0.55SS**Hα-helixtrans-57-16.4177.1-144.912.1000112.6T263 W264D260-T263 PolarHBondContact O-OG1 2.97Å; D260-W264 PolarHBondContact O-N 3.42Å
261G59.8Low57Low33 Ų33111.1 Ų111.134%0.3455%0.55SS..Hα-helixtrans-70.5-29.3171.300000114.8T259 R265T259-G261 PolarHBondContact O-N 3.45Å; G261-R265 VanDerWaalsContact O-CG 3.27Å; G261-R265 WeakPolarHBondContact O-CG 3.49Å; G261-R265 PolarHBondContact O-N 3Å; G261-R265 VanDerWaalsContact O-N 3.09Å
262D64.4Low58.6Low61 Ų61101.7 Ų101.733%0.32652%0.521SS..Hα-helixtrans-77.9-37.9-177.4-66-41.2000111.9T259 R265 E266T259-D262 PolarHBondContact O-N 3.21Å; T259-D262 PolarHBondContact OG1-OD2 2.94Å; D262-R265 PolarHBondContact O-N 3Å; D262-E266 WeakPolarHBondContact O-CB 3.34Å; D262-E266 PolarHBondContact O-N 2.88Å
263T65.9Low60.5Low45 Ų4594.9 Ų94.928%0.27649%0.493SS..Hα-helixtrans-64.1-42.7172.752.30000111D260 E266 Q267D260-T263 PolarHBondContact O-OG1 2.97Å; T263-E266 PolarHBondContact O-N 3.29Å; T263-Q267 WeakPolarHBondContact O-CG 3.27Å; T263-Q267 PolarHBondContact O-N 3.3Å
264W62.6Low62.5Low150 Ų15095.3 Ų95.357%0.56848%0.483SS*.Hα-helixtrans-63.7-43.7176.1-17990.7000113D260 E266 Q267 K268D260-W264 PolarHBondContact O-N 3.42Å; W264-E266 PolarHBondContact O-N 2.93Å; W264-Q267 PolarHBondContact O-N 3.24Å; W264-K268 HydrophobicContact CH2-CD 3.86Å; W264-K268 HydrophobicContact CZ2-CD 4.31Å; W264-K268 HydrophobicContact CZ3-CD 4.09Å; W264-K268 PolarHBondContact O-N 2.96Å; W264-K268 VanDerWaalsContact O-N 3.09Å
265R66.3Low64.6Low157 Ų15790.9 Ų90.959%0.59246%0.455SS*.Hα-helixtrans-60.4-44.7175.8-77.5171.8-177.9176.80.5111.3G261 D262 K268 E269G261-R265 VanDerWaalsContact O-CG 3.27Å; G261-R265 WeakPolarHBondContact O-CG 3.49Å; G261-R265 PolarHBondContact O-N 3Å; G261-R265 VanDerWaalsContact O-N 3.09Å; D262-R265 PolarHBondContact O-N 3Å; R265-K268 WeakPolarHBondContact O-CB 3.4Å; R265-K268 PolarHBondContact O-N 2.78Å; R265-E269 WeakPolarHBondContact O-CG 3.3Å; R265-E269 PolarHBondContact O-N 3.26Å
266E68.9Low66.4Low39 Ų3985.8 Ų85.818%0.18242%0.424CS..Hα-helixtrans-65.4-41.8179.4-171.6-171.5159.900112.7R226 D262 T263 W264 K268 E269 K270R226-E266 IonicContact CZ-OE2 3.31Å; R226-E266 VanDerWaalsContact CZ-OE2 3.31Å; R226-E266 IonicContact NH1-OE1 3.57Å; R226-E266 IonicContact NH1-OE2 2.6Å; R226-E266 PolarHBondContact NH1-OE2 3.16Å; R226-E266 IonicContact NH2-OE2 3.33Å; R226-E266 PolarHBondContact NH2-OE2 3.08Å; D262-E266 WeakPolarHBondContact O-CB 3.34Å; D262-E266 PolarHBondContact O-N 2.88Å; T263-E266 PolarHBondContact O-N 3.29Å; W264-E266 PolarHBondContact O-N 2.93Å; E266-K268 VanDerWaalsContact C-N 3.26Å; E266-K268 PolarHBondContact O-N 3.41Å; E266-E269 PolarHBondContact O-N 2.97Å; E266-K270 WeakPolarHBondContact O-CG 3.29Å; E266-K270 PolarHBondContact O-N 3.42Å; E266-K270 WeakPolarHBondContact OE1-CE 3.35Å; E266-K270 IonicContact OE1-NZ 2.73Å; E266-K270 PolarHBondContact OE1-NZ 3.42Å
267Q70Confident68.2Low115 Ų11581 Ų8154%0.53740%0.397SS..Hα-helixtrans-60.3-38.7174.1-73.9-178.73.700111.6T263 W264 K270 K271T263-Q267 WeakPolarHBondContact O-CG 3.27Å; T263-Q267 PolarHBondContact O-N 3.3Å; W264-Q267 PolarHBondContact O-N 3.24Å; Q267-K270 PolarHBondContact O-N 2.96Å; Q267-K271 WeakPolarHBondContact O-CG 3.5Å; Q267-K271 PolarHBondContact O-N 3.27Å
268K70.6Confident70.2Confident112 Ų11275 Ų7549%0.48737%0.373SS..Hα-helixtrans-66.6-39.9176.1-170.7175.6-179.8176.80111.9W264 R265 E266 K271 A272W264-K268 HydrophobicContact CH2-CD 3.86Å; W264-K268 HydrophobicContact CZ2-CD 4.31Å; W264-K268 HydrophobicContact CZ3-CD 4.09Å; W264-K268 PolarHBondContact O-N 2.96Å; W264-K268 VanDerWaalsContact O-N 3.09Å; R265-K268 WeakPolarHBondContact O-CB 3.4Å; R265-K268 PolarHBondContact O-N 2.78Å; E266-K268 VanDerWaalsContact C-N 3.26Å; E266-K268 PolarHBondContact O-N 3.41Å; K268-K271 PolarHBondContact O-N 3.41Å; K268-A272 WeakPolarHBondContact O-CB 3.31Å; K268-A272 PolarHBondContact O-N 2.75Å
269E71.1Confident71.7Confident74 Ų7469.7 Ų69.735%0.34635%0.348SS..Hα-helixtrans-65.6-42.5174.9-72.6-17617100112.3R265 E266 K271 A272 A273R265-E269 WeakPolarHBondContact O-CG 3.3Å; R265-E269 PolarHBondContact O-N 3.26Å; E266-E269 PolarHBondContact O-N 2.97Å; E269-K271 PolarHBondContact O-N 3.15Å; E269-A272 PolarHBondContact O-N 3.46Å; E269-A273 PolarHBondContact O-N 3.47Å
270K72.5Confident73.3Confident99 Ų9966.3 Ų66.343%0.4333%0.327SS..Hα-helixtrans-59.8-44.3174.6-74.7175.6-176.6165.30112E266 Q267 A272 A273 L274E266-K270 WeakPolarHBondContact O-CG 3.29Å; E266-K270 PolarHBondContact O-N 3.42Å; E266-K270 WeakPolarHBondContact OE1-CE 3.35Å; E266-K270 IonicContact OE1-NZ 2.73Å; E266-K270 PolarHBondContact OE1-NZ 3.42Å; Q267-K270 PolarHBondContact O-N 2.96Å; K270-A272 VanDerWaalsContact C-N 3.34Å; K270-A272 PolarHBondContact O-N 3.48Å; K270-A273 PolarHBondContact O-N 2.99Å; K270-L274 WeakPolarHBondContact O-CB 2.95Å; K270-L274 PolarHBondContact O-N 2.86Å
271K75.9Confident75Confident118 Ų11861 Ų6151%0.51331%0.305SS..Hα-helixtrans-62.4-41.2175.6-74.1178-179.6179.30112.1Q267 K268 E269 L274 M275Q267-K271 WeakPolarHBondContact O-CG 3.5Å; Q267-K271 PolarHBondContact O-N 3.27Å; K268-K271 PolarHBondContact O-N 3.41Å; E269-K271 PolarHBondContact O-N 3.15Å; K271-L274 PolarHBondContact O-N 3.21Å; K271-M275 WeakPolarHBondContact O-CB 3.39Å; K271-M275 PolarHBondContact O-N 3.03Å
272A72.1Confident76.5Confident30 Ų3060.9 Ų60.925%0.24830%0.298CS..Hα-helixtrans-66.5-39.5176.600000112.5K268 E269 K270 M275 V276K268-A272 WeakPolarHBondContact O-CB 3.31Å; K268-A272 PolarHBondContact O-N 2.75Å; E269-A272 PolarHBondContact O-N 3.46Å; K270-A272 VanDerWaalsContact C-N 3.34Å; K270-A272 PolarHBondContact O-N 3.48Å; A272-M275 PolarHBondContact O-N 3.25Å; A272-V276 PolarHBondContact O-N 2.84Å
273A74.8Confident77.7Confident20 Ų2058.1 Ų58.117%0.16528%0.284CS..Hα-helixtrans-67-41175.400000112I215 E269 K270 V276 G277I215-A273 HydrophobicContact CG2-CB 4.15Å; E269-A273 PolarHBondContact O-N 3.47Å; K270-A273 PolarHBondContact O-N 2.99Å; A273-V276 PolarHBondContact O-N 3.39Å; A273-G277 PolarHBondContact O-N 3.02Å
274L81.4Confident78.9Confident88 Ų8857.4 Ų57.446%0.46128%0.279SS..Hα-helixtrans-60-45.217417864.3000111.5K270 K271 V276 G277 I278 F330K270-L274 WeakPolarHBondContact O-CB 2.95Å; K270-L274 PolarHBondContact O-N 2.86Å; K271-L274 PolarHBondContact O-N 3.21Å; L274-V276 VanDerWaalsContact C-N 3.31Å; L274-V276 PolarHBondContact O-N 2.96Å; L274-G277 PolarHBondContact O-N 2.86Å; L274-G277 VanDerWaalsContact O-N 3.12Å; L274-I278 HydrophobicContact CD1-CD1 4.13Å; L274-I278 HydrophobicContact CD1-CG1 4.32Å; L274-I278 HydrophobicContact CG-CD1 3.93Å; L274-I278 WeakPolarHBondContact O-CG1 3.43Å; L274-I278 PolarHBondContact O-N 3.05Å; L274-F330 HydrophobicContact CD2-CE1 3.85Å; L274-F330 HydrophobicContact CD2-CZ 4.48Å; L274-F330 HydrophobicContact CG-CE1 4.34Å
275M81.1Confident80.4Confident28 Ų2856.5 Ų56.514%0.13828%0.284CS..Hα-helixtrans-56-45.5176.1-175.1-170.177.200111.4K271 A272 I278 L279 I326 Y327 F330K271-M275 WeakPolarHBondContact O-CB 3.39Å; K271-M275 PolarHBondContact O-N 3.03Å; A272-M275 PolarHBondContact O-N 3.25Å; M275-I278 PolarHBondContact O-N 3.34Å; M275-L279 HydrophobicContact CE-CD1 4.49Å; M275-L279 HydrophobicContact CG-CD1 4.34Å; M275-L279 VanDerWaalsContact O-CG 3.31Å; M275-L279 WeakPolarHBondContact O-CG 3.09Å; M275-L279 PolarHBondContact O-N 2.89Å; M275-I326 HydrophobicContact CG-CG2 3.8Å; M275-Y327 HydrophobicContact CE-CD1 4.29Å; M275-Y327 HydrophobicContact CE-CE1 4.35Å; M275-Y327 HydrophobicContact SD-CD1 4.01Å; M275-F330 HydrophobicContact CB-CB 4.07Å; M275-F330 HydrophobicContact CB-CG 4.2Å; M275-F330 HydrophobicContact CG-CB 3.97Å; M275-F330 HydrophobicContact CG-CD2 4.34Å; M275-F330 HydrophobicContact CG-CG 4.31Å; M275-F330 HydrophobicContact SD-CB 4.12Å
276V79.9Confident81.8Confident1 Ų149.3 Ų49.31%0.00626%0.258CS..Hα-helixtrans-63.5-41.6175.6172.70000111.9I129 A130 R133 A272 A273 L274 I278 L279 I280I129-V276 HydrophobicContact CG2-CG2 3.9Å; A130-V276 HydrophobicContact CB-CG1 3.88Å; R133-V276 HydrophobicContact CG-CG2 3.75Å; A272-V276 PolarHBondContact O-N 2.84Å; A273-V276 PolarHBondContact O-N 3.39Å; L274-V276 VanDerWaalsContact C-N 3.31Å; L274-V276 PolarHBondContact O-N 2.96Å; V276-I278 VanDerWaalsContact C-N 3.33Å; V276-I278 PolarHBondContact O-N 2.91Å; V276-L279 PolarHBondContact O-N 3.41Å; V276-I280 HydrophobicContact CG1-CD1 3.76Å; V276-I280 HydrophobicContact CG1-CG1 4.41Å; V276-I280 WeakPolarHBondContact O-CD1 3.24Å; V276-I280 VanDerWaalsContact O-CG1 3.24Å; V276-I280 WeakPolarHBondContact O-CG1 3.48Å; V276-I280 PolarHBondContact O-N 2.88Å
277G84.8Confident83Confident15 Ų1547.8 Ų47.816%0.15525%0.251CS..Hα-helixtrans-60-42175.400000113.1A273 L274 I280 G281A273-G277 PolarHBondContact O-N 3.02Å; L274-G277 PolarHBondContact O-N 2.86Å; L274-G277 VanDerWaalsContact O-N 3.12Å; G277-I280 PolarHBondContact O-N 3.16Å; G277-G281 PolarHBondContact O-N 3.43Å
278I87.6Confident84.1Confident55 Ų5545.1 Ų45.128%0.28224%0.24SC..Hα-helixtrans-66.2-43.7176.8-66.9168.6000110.9L274 M275 V276 I280 G281 V282 I326 F330L274-I278 HydrophobicContact CD1-CD1 4.13Å; L274-I278 HydrophobicContact CD1-CG1 4.32Å; L274-I278 HydrophobicContact CG-CD1 3.93Å; L274-I278 WeakPolarHBondContact O-CG1 3.43Å; L274-I278 PolarHBondContact O-N 3.05Å; M275-I278 PolarHBondContact O-N 3.34Å; V276-I278 VanDerWaalsContact C-N 3.33Å; V276-I278 PolarHBondContact O-N 2.91Å; I278-I280 VanDerWaalsContact C-N 3.33Å; I278-I280 PolarHBondContact O-N 2.94Å; I278-G281 PolarHBondContact O-N 2.95Å; I278-V282 HydrophobicContact CG2-CG2 4.3Å; I278-V282 WeakPolarHBondContact O-CG2 3.37Å; I278-V282 PolarHBondContact O-N 3.18Å; I278-I326 HydrophobicContact CB-CG2 4.48Å; I278-I326 HydrophobicContact CG2-CD1 3.92Å; I278-I326 HydrophobicContact CG2-CG1 3.99Å; I278-I326 HydrophobicContact CG2-CG2 4.14Å; I278-F330 HydrophobicContact CD1-CE1 4.16Å; I278-F330 HydrophobicContact CD1-CE2 3.52Å; I278-F330 HydrophobicContact CD1-CZ 3.27Å
279L86.3Confident85.3Confident1 Ų141.4 Ų41.41%0.00523%0.227CC..Hα-helixtrans-57.4-46.2175.9-71.7163.6000111.6M275 V276 F283 I326 Y327M275-L279 HydrophobicContact CE-CD1 4.49Å; M275-L279 HydrophobicContact CG-CD1 4.34Å; M275-L279 VanDerWaalsContact O-CG 3.31Å; M275-L279 WeakPolarHBondContact O-CG 3.09Å; M275-L279 PolarHBondContact O-N 2.89Å; V276-L279 PolarHBondContact O-N 3.41Å; L279-F283 VanDerWaalsContact O-CB 3.3Å; L279-F283 WeakPolarHBondContact O-CB 3.26Å; L279-F283 PolarHBondContact O-N 2.93Å; L279-I326 HydrophobicContact CD2-CB 3.98Å; L279-I326 HydrophobicContact CD2-CD1 3.72Å; L279-I326 HydrophobicContact CD2-CG1 4.48Å; L279-I326 HydrophobicContact CD2-CG2 3.9Å; L279-I326 HydrophobicContact CG-CD1 4.36Å; L279-I326 HydrophobicContact CG-CG2 3.89Å; L279-Y327 HydrophobicContact CD1-CD1 4.42Å; L279-Y327 HydrophobicContact CD1-CE1 3.52Å; L279-Y327 HydrophobicContact CD2-CE1 4.05Å; L279-Y327 HydrophobicContact CG-CE1 4.41Å
280I87.9Confident86.3Confident9 Ų938.7 Ų38.75%0.04621%0.214CC..Hα-helixtrans-62.6-46.9177.2-63.2160.4000110.4V126 V208 L209 Y212 V276 G277 I278 F283 V284V126-I280 HydrophobicContact CG1-CG1 3.91Å; V208-I280 HydrophobicContact CG1-CG1 4.34Å; V208-I280 HydrophobicContact CG1-CG2 4.01Å; V208-I280 HydrophobicContact CG2-CD1 3.56Å; V208-I280 HydrophobicContact CG2-CG1 3.64Å; L209-I280 HydrophobicContact CD2-CG2 4.04Å; Y212-I280 HydrophobicContact CD2-CD1 3.98Å; Y212-I280 HydrophobicContact CG-CD1 4.08Å; V276-I280 HydrophobicContact CG1-CD1 3.76Å; V276-I280 HydrophobicContact CG1-CG1 4.41Å; V276-I280 WeakPolarHBondContact O-CD1 3.24Å; V276-I280 VanDerWaalsContact O-CG1 3.24Å; V276-I280 WeakPolarHBondContact O-CG1 3.48Å; V276-I280 PolarHBondContact O-N 2.88Å; G277-I280 PolarHBondContact O-N 3.16Å; I278-I280 VanDerWaalsContact C-N 3.33Å; I278-I280 PolarHBondContact O-N 2.94Å; I280-F283 PolarHBondContact O-N 3.35Å; I280-V284 HydrophobicContact CG2-CG2 4.32Å; I280-V284 WeakPolarHBondContact O-CB 3.38Å; I280-V284 WeakPolarHBondContact O-CG2 3.41Å; I280-V284 PolarHBondContact O-N 3.24Å
281G90.3Very high87.3Confident30 Ų3034.7 Ų34.731%0.30920%0.197SC..Hα-helixtrans-60.4-46.9-179.200000112.9G277 I278 V284 L285G277-G281 PolarHBondContact O-N 3.43Å; I278-G281 PolarHBondContact O-N 2.95Å; G281-V284 PolarHBondContact O-N 2.98Å; G281-L285 WeakPolarHBondContact O-CB 3.48Å; G281-L285 VanDerWaalsContact O-CG 3.24Å; G281-L285 WeakPolarHBondContact O-CG 3.29Å; G281-L285 PolarHBondContact O-N 2.6Å
282V91.9Very high88.1Confident32 Ų3232.6 Ų32.619%0.19419%0.19CC..Hα-helixtrans-63.8-45.2177.4172.50000110.9I278 V284 L285 C286 F322 I326I278-V282 HydrophobicContact CG2-CG2 4.3Å; I278-V282 WeakPolarHBondContact O-CG2 3.37Å; I278-V282 PolarHBondContact O-N 3.18Å; V282-V284 VanDerWaalsContact C-N 3.31Å; V282-V284 PolarHBondContact O-N 2.93Å; V282-L285 PolarHBondContact O-N 3.38Å; V282-C286 WeakPolarHBondContact O-CB 3.36Å; V282-C286 PolarHBondContact O-N 2.94Å; V282-C286 PolarHBondContact O-SG 3.43Å; V282-C286 VanDerWaalsContact O-SG 3.35Å; V282-F322 HydrophobicContact CG1-CB 3.75Å; V282-F322 HydrophobicContact CG1-CD2 3.75Å; V282-F322 HydrophobicContact CG1-CG 3.98Å; V282-I326 HydrophobicContact CB-CD1 4.37Å; V282-I326 HydrophobicContact CG2-CD1 4.11Å
283F89.9Confident89Confident3 Ų331.9 Ų31.91%0.01318%0.183CC..Hα-helixtrans-55.1-49.1177.1-172-82.7000111.6I123 V126 F201 L279 I280 C286 W287 N319I123-F283 HydrophobicContact CB-CD1 4.49Å; I123-F283 HydrophobicContact CB-CE1 3.7Å; I123-F283 HydrophobicContact CB-CE2 3.85Å; I123-F283 HydrophobicContact CB-CZ 3.38Å; I123-F283 HydrophobicContact CD1-CD1 3.88Å; I123-F283 HydrophobicContact CD1-CE1 3.26Å; I123-F283 HydrophobicContact CD1-CZ 3.9Å; I123-F283 HydrophobicContact CG1-CD1 3.85Å; I123-F283 HydrophobicContact CG1-CE1 3.39Å; I123-F283 HydrophobicContact CG1-CE2 4.24Å; I123-F283 HydrophobicContact CG1-CG 4.49Å; I123-F283 HydrophobicContact CG1-CZ 3.66Å; I123-F283 HydrophobicContact CG2-CZ 4.45Å; V126-F283 HydrophobicContact CG2-CD2 4.31Å; F201-F283 AromaticContact CD2-CE1 3.73Å; F201-F283 HydrophobicContact CD2-CE1 3.73Å; F201-F283 HydrophobicContact CD2-CZ 4.43Å; F201-F283 HydrophobicContact CE2-CD1 4.17Å; F201-F283 AromaticContact CE2-CE1 3.56Å; F201-F283 HydrophobicContact CE2-CE1 3.56Å; L279-F283 VanDerWaalsContact O-CB 3.3Å; L279-F283 WeakPolarHBondContact O-CB 3.26Å; L279-F283 PolarHBondContact O-N 2.93Å; I280-F283 PolarHBondContact O-N 3.35Å; F283-C286 PolarHBondContact O-N 3.46Å; F283-W287 AromaticContact CD2-CD1 3.88Å; F283-W287 HydrophobicContact CE1-CB 4.12Å; F283-W287 AromaticContact CE1-CD1 3.92Å; F283-W287 HydrophobicContact CE1-CG 4.15Å; F283-W287 AromaticContact CE2-CD1 3.53Å; F283-W287 HydrophobicContact CE2-CG 4.36Å; F283-W287 AromaticContact CE2-NE1 3.71Å; F283-W287 HydrophobicContact CZ-CB 4.36Å; F283-W287 AromaticContact CZ-CD1 3.5Å; F283-W287 AromaticContact CZ-CG 3.91Å; F283-W287 HydrophobicContact CZ-CG 3.91Å; F283-W287 AromaticContact CZ-NE1 3.95Å; F283-W287 WeakPolarHBondContact O-CB 3.17Å; F283-W287 PolarHBondContact O-N 3.35Å; F283-N319 VanDerWaalsContact CA-OD1 3.29Å; F283-N319 WeakPolarHBondContact CA-OD1 3.3Å; F283-N319 WeakPolarHBondContact CD2-ND2 3.37Å
284V91.8Very high89.6Confident30 Ų3032.1 Ų32.118%0.18218%0.18CC..Hα-helixtrans-61.2-49.4179.51700000111.6L205 I280 G281 V282 C286 W287 I288L205-V284 HydrophobicContact CD1-CG2 3.33Å; I280-V284 HydrophobicContact CG2-CG2 4.32Å; I280-V284 WeakPolarHBondContact O-CB 3.38Å; I280-V284 WeakPolarHBondContact O-CG2 3.41Å; I280-V284 PolarHBondContact O-N 3.24Å; G281-V284 PolarHBondContact O-N 2.98Å; V282-V284 VanDerWaalsContact C-N 3.31Å; V282-V284 PolarHBondContact O-N 2.93Å; V284-C286 VanDerWaalsContact C-N 3.3Å; V284-C286 PolarHBondContact O-N 2.91Å; V284-W287 PolarHBondContact O-N 2.8Å; V284-I288 HydrophobicContact CG1-CD1 3.3Å; V284-I288 HydrophobicContact CG1-CG1 3.8Å; V284-I288 WeakPolarHBondContact O-CB 3.33Å; V284-I288 VanDerWaalsContact O-CG1 3.25Å; V284-I288 WeakPolarHBondContact O-CG1 3.34Å; V284-I288 PolarHBondContact O-N 2.96Å
285L93.9Very high90.1Very high130 Ų13029.3 Ų29.368%0.68117%0.166SC*.Hα-helixtrans-62.4-38.3-179-71.1170.7000112.3G281 V282G281-L285 WeakPolarHBondContact O-CB 3.48Å; G281-L285 VanDerWaalsContact O-CG 3.24Å; G281-L285 WeakPolarHBondContact O-CG 3.29Å; G281-L285 PolarHBondContact O-N 2.6Å; V282-L285 PolarHBondContact O-N 3.38Å
286C94.7Very high90.4Very high6 Ų632 Ų324%0.04118%0.18CC..Hα-helixtrans-72.8-41.7-179.6-72.70000112.8V282 F283 V284 L315 G316 N319V282-C286 WeakPolarHBondContact O-CB 3.36Å; V282-C286 PolarHBondContact O-N 2.94Å; V282-C286 PolarHBondContact O-SG 3.43Å; V282-C286 VanDerWaalsContact O-SG 3.35Å; F283-C286 PolarHBondContact O-N 3.46Å; V284-C286 VanDerWaalsContact C-N 3.3Å; V284-C286 PolarHBondContact O-N 2.91Å; C286-L315 WeakPolarHBondContact CB-O 3.19Å; C286-G316 PolarHBondContact O-N 3.01Å; C286-N319 HydrophobicContact CB-CB 3.93Å
287W94Very high90.7Very high7 Ų732.6 Ų32.63%0.02718%0.183CC..Hα-helixtrans-99.8-24.5-168.4-78.1102000115.1C119 F201 F283 V284 F290 F291 G316 Y317C119-W287 HydrophobicContact CB-CH2 3.75Å; C119-W287 HydrophobicContact CB-CZ2 4.01Å; C119-W287 HydrophobicContact CB-CZ3 4.27Å; C119-W287 WeakPolarHBondContact SG-CH2 3.25Å; C119-W287 VanDerWaalsContact SG-CZ2 3.57Å; C119-W287 VanDerWaalsContact SG-CZ3 3.52Å; F201-W287 HydrophobicContact CD2-CB 4.23Å; F201-W287 HydrophobicContact CE2-CB 3.63Å; F201-W287 HydrophobicContact CZ-CB 4.39Å; F283-W287 AromaticContact CD2-CD1 3.88Å; F283-W287 HydrophobicContact CE1-CB 4.12Å; F283-W287 AromaticContact CE1-CD1 3.92Å; F283-W287 HydrophobicContact CE1-CG 4.15Å; F283-W287 AromaticContact CE2-CD1 3.53Å; F283-W287 HydrophobicContact CE2-CG 4.36Å; F283-W287 AromaticContact CE2-NE1 3.71Å; F283-W287 HydrophobicContact CZ-CB 4.36Å; F283-W287 AromaticContact CZ-CD1 3.5Å; F283-W287 AromaticContact CZ-CG 3.91Å; F283-W287 HydrophobicContact CZ-CG 3.91Å; F283-W287 AromaticContact CZ-NE1 3.95Å; F283-W287 WeakPolarHBondContact O-CB 3.17Å; F283-W287 PolarHBondContact O-N 3.35Å; V284-W287 PolarHBondContact O-N 2.8Å; W287-F290 HydrophobicContact CE3-CB 4.46Å; W287-F290 AromaticContact CE3-CD1 3.92Å; W287-F290 HydrophobicContact CE3-CD1 3.92Å; W287-F290 HydrophobicContact CE3-CG 4.46Å; W287-F290 AromaticContact CZ3-CD1 3.82Å; W287-F290 HydrophobicContact CZ3-CD1 3.82Å; W287-F290 HydrophobicContact CZ3-CE1 4.16Å; W287-F290 HydrophobicContact CZ3-CG 4.45Å; W287-F290 PolarHBondContact O-N 3.1Å; W287-F291 HydrophobicContact CB-CD2 3.95Å; W287-F291 HydrophobicContact CB-CE2 4.04Å; W287-F291 AromaticContact CD2-CE2 3.96Å; W287-F291 HydrophobicContact CD2-CE2 3.96Å; W287-F291 AromaticContact CE3-CD2 3.98Å; W287-F291 HydrophobicContact CE3-CD2 3.98Å; W287-F291 AromaticContact CE3-CE2 3.39Å; W287-F291 HydrophobicContact CE3-CE2 3.39Å; W287-F291 HydrophobicContact CE3-CZ 4.2Å; W287-F291 HydrophobicContact CG-CE2 4.27Å; W287-F291 HydrophobicContact CZ3-CE2 4.12Å; W287-F291 WeakPolarHBondContact O-CD2 3.35Å; W287-F291 PolarHBondContact O-N 3.39Å; W287-G316 PolarHBondContact NE1-O 3.36Å; W287-Y317 HydrophobicContact CH2-CD1 4.42Å; W287-Y317 HydrophobicContact CH2-CE1 4.42Å
288I94.3Very high90.7Very high60 Ų6032.9 Ų32.931%0.30818%0.183SC..Hα-helixtrans-51.2-49.8179.1-85.9-169.8000112.5F201 V284 F290 F291 I292F201-I288 HydrophobicContact CE1-CG1 4.08Å; F201-I288 HydrophobicContact CZ-CB 4.49Å; F201-I288 HydrophobicContact CZ-CG1 3.65Å; V284-I288 HydrophobicContact CG1-CD1 3.3Å; V284-I288 HydrophobicContact CG1-CG1 3.8Å; V284-I288 WeakPolarHBondContact O-CB 3.33Å; V284-I288 VanDerWaalsContact O-CG1 3.25Å; V284-I288 WeakPolarHBondContact O-CG1 3.34Å; V284-I288 PolarHBondContact O-N 2.96Å; I288-F290 VanDerWaalsContact C-N 3.28Å; I288-F290 PolarHBondContact O-N 3.42Å; I288-F291 PolarHBondContact O-N 2.98Å; I288-I292 HydrophobicContact CG2-CD1 3.5Å; I288-I292 VanDerWaalsContact CG2-CD1 3.5Å; I288-I292 HydrophobicContact CG2-CG1 4.16Å; I288-I292 WeakPolarHBondContact O-CB 3.47Å; I288-I292 VanDerWaalsContact O-CG1 3.3Å; I288-I292 WeakPolarHBondContact O-CG1 3.39Å; I288-I292 PolarHBondContact O-N 3.01Å
289P94.9Very high90.4Very high33 Ų3335.1 Ų35.121%0.21420%0.195CC..Hα-helixtrans-58.9-42.8-175.3-26.136.3000111.9T293 F312 L315P289-T293 WeakPolarHBondContact O-CG2 3.42Å; P289-T293 PolarHBondContact O-N 3.44Å; P289-T293 VanDerWaalsContact O-N 3.13Å; P289-T293 PolarHBondContact O-OG1 3.41Å; P289-F312 HydrophobicContact CB-CB 4.28Å; P289-F312 HydrophobicContact CB-CD1 3.58Å; P289-F312 HydrophobicContact CB-CD2 4.38Å; P289-F312 HydrophobicContact CB-CE1 3.96Å; P289-F312 HydrophobicContact CB-CG 3.83Å; P289-L315 HydrophobicContact CG-CD2 4.12Å
290F93.1Very high90.3Very high18 Ų1837.8 Ų37.88%0.07921%0.213CC..Hα-helixtrans-64.4-52.7178.7-179.9-100.4000112W287 I288 I292 T293 E294 F312 L313W287-F290 HydrophobicContact CE3-CB 4.46Å; W287-F290 AromaticContact CE3-CD1 3.92Å; W287-F290 HydrophobicContact CE3-CD1 3.92Å; W287-F290 HydrophobicContact CE3-CG 4.46Å; W287-F290 AromaticContact CZ3-CD1 3.82Å; W287-F290 HydrophobicContact CZ3-CD1 3.82Å; W287-F290 HydrophobicContact CZ3-CE1 4.16Å; W287-F290 HydrophobicContact CZ3-CG 4.45Å; W287-F290 PolarHBondContact O-N 3.1Å; I288-F290 VanDerWaalsContact C-N 3.28Å; I288-F290 PolarHBondContact O-N 3.42Å; F290-I292 VanDerWaalsContact C-N 3.32Å; F290-I292 PolarHBondContact O-N 2.95Å; F290-T293 PolarHBondContact O-N 3.39Å; F290-T293 VanDerWaalsContact O-N 3.07Å; F290-T293 PolarHBondContact O-OG1 2.02Å; F290-E294 HydrophobicContact CD1-CG 4.15Å; F290-E294 HydrophobicContact CD2-CG 4.42Å; F290-E294 HydrophobicContact CE1-CG 3.69Å; F290-E294 HydrophobicContact CE2-CG 3.96Å; F290-E294 HydrophobicContact CZ-CG 3.58Å; F290-E294 PolarHBondContact O-N 3.29Å; F290-F312 HydrophobicContact CB-CB 4.12Å; F290-F312 HydrophobicContact CD2-CB 4.48Å; F290-L313 HydrophobicContact CD2-CB 4.32Å; F290-L313 HydrophobicContact CD2-CD1 4.16Å; F290-L313 HydrophobicContact CE2-CB 4.32Å; F290-L313 HydrophobicContact CE2-CD1 3.63Å; F290-L313 HydrophobicContact CZ-CD1 3.95Å
291F92.9Very high89.8Confident14 Ų1442.7 Ų42.76%0.06125%0.248CC..Hα-helixtrans-65.8-33.4-177.9-80.6-72.9000113.3T197 A200 F201 Y202 W287 I288 L295T197-F291 HydrophobicContact CG2-CD1 4.35Å; A200-F291 HydrophobicContact CB-CE1 4.33Å; F201-F291 HydrophobicContact CB-CB 4.48Å; F201-F291 HydrophobicContact CB-CD1 3.61Å; F201-F291 HydrophobicContact CB-CD2 3.68Å; F201-F291 HydrophobicContact CB-CE1 3.62Å; F201-F291 HydrophobicContact CB-CE2 3.69Å; F201-F291 HydrophobicContact CB-CG 3.65Å; F201-F291 HydrophobicContact CB-CZ 3.67Å; F201-F291 HydrophobicContact CD1-CB 3.73Å; F201-F291 HydrophobicContact CD1-CD1 4.43Å; F201-F291 AromaticContact CD1-CD2 3.84Å; F201-F291 HydrophobicContact CD1-CD2 3.84Å; F201-F291 AromaticContact CD1-CG 3.74Å; F201-F291 HydrophobicContact CD1-CG 3.74Å; F201-F291 AromaticContact CD2-CD2 3.25Å; F201-F291 HydrophobicContact CD2-CD2 3.25Å; F201-F291 AromaticContact CD2-CE2 3.39Å; F201-F291 HydrophobicContact CD2-CE2 3.39Å; F201-F291 AromaticContact CD2-CG 3.99Å; F201-F291 HydrophobicContact CD2-CG 3.99Å; F201-F291 HydrophobicContact CD2-CZ 4.22Å; F201-F291 HydrophobicContact CE1-CB 4.07Å; F201-F291 HydrophobicContact CE1-CD2 4.28Å; F201-F291 HydrophobicContact CE1-CG 4.38Å; F201-F291 AromaticContact CE2-CD2 3.75Å; F201-F291 HydrophobicContact CE2-CD2 3.75Å; F201-F291 HydrophobicContact CE2-CE2 4.17Å; F201-F291 HydrophobicContact CG-CB 4.06Å; F201-F291 HydrophobicContact CG-CD1 4.04Å; F201-F291 AromaticContact CG-CD2 3.3Å; F201-F291 HydrophobicContact CG-CD2 3.3Å; F201-F291 HydrophobicContact CG-CE1 4.35Å; F201-F291 AromaticContact CG-CE2 3.67Å; F201-F291 HydrophobicContact CG-CE2 3.67Å; F201-F291 AromaticContact CG-CG 3.52Å; F201-F291 HydrophobicContact CG-CG 3.52Å; F201-F291 HydrophobicContact CG-CZ 4.19Å; F201-F291 HydrophobicContact CZ-CD2 4.24Å; Y202-F291 PolarHBondContact OH-O 3.35Å; W287-F291 HydrophobicContact CB-CD2 3.95Å; W287-F291 HydrophobicContact CB-CE2 4.04Å; W287-F291 AromaticContact CD2-CE2 3.96Å; W287-F291 HydrophobicContact CD2-CE2 3.96Å; W287-F291 AromaticContact CE3-CD2 3.98Å; W287-F291 HydrophobicContact CE3-CD2 3.98Å; W287-F291 AromaticContact CE3-CE2 3.39Å; W287-F291 HydrophobicContact CE3-CE2 3.39Å; W287-F291 HydrophobicContact CE3-CZ 4.2Å; W287-F291 HydrophobicContact CG-CE2 4.27Å; W287-F291 HydrophobicContact CZ3-CE2 4.12Å; W287-F291 WeakPolarHBondContact O-CD2 3.35Å; W287-F291 PolarHBondContact O-N 3.39Å; I288-F291 PolarHBondContact O-N 2.98Å; F291-L295 WeakPolarHBondContact O-CB 3.45Å; F291-L295 PolarHBondContact O-N 3.41Å
292I92.8Very high89.4Confident75 Ų7544 Ų4439%0.38525%0.252SS..Hα-helixtrans-61.5-46.8171.2-72.9179.7000110.1I288 F290 L295 I296I288-I292 HydrophobicContact CG2-CD1 3.5Å; I288-I292 VanDerWaalsContact CG2-CD1 3.5Å; I288-I292 HydrophobicContact CG2-CG1 4.16Å; I288-I292 WeakPolarHBondContact O-CB 3.47Å; I288-I292 VanDerWaalsContact O-CG1 3.3Å; I288-I292 WeakPolarHBondContact O-CG1 3.39Å; I288-I292 PolarHBondContact O-N 3.01Å; F290-I292 VanDerWaalsContact C-N 3.32Å; F290-I292 PolarHBondContact O-N 2.95Å; I292-L295 PolarHBondContact O-N 3.07Å; I292-I296 HydrophobicContact CG2-CD1 3.55Å; I292-I296 HydrophobicContact CG2-CG1 4.33Å; I292-I296 WeakPolarHBondContact O-CB 3.49Å; I292-I296 VanDerWaalsContact O-CG1 3.31Å; I292-I296 WeakPolarHBondContact O-CG1 3.36Å; I292-I296 PolarHBondContact O-N 2.93Å
293T90.4Very high88.9Confident14 Ų1450.2 Ų50.29%0.08628%0.284CS..Hα-helixtrans-65.9-41.2179.351.30000113.1P289 F290 L295 I296 V297 I304 F312P289-T293 WeakPolarHBondContact O-CG2 3.42Å; P289-T293 PolarHBondContact O-N 3.44Å; P289-T293 VanDerWaalsContact O-N 3.13Å; P289-T293 PolarHBondContact O-OG1 3.41Å; F290-T293 PolarHBondContact O-N 3.39Å; F290-T293 VanDerWaalsContact O-N 3.07Å; F290-T293 PolarHBondContact O-OG1 2.02Å; T293-L295 VanDerWaalsContact C-N 3.29Å; T293-L295 PolarHBondContact O-N 3.25Å; T293-I296 PolarHBondContact O-N 3.5Å; T293-V297 VanDerWaalsContact O-CB 3.3Å; T293-V297 WeakPolarHBondContact O-CB 3.37Å; T293-V297 WeakPolarHBondContact O-CG2 3.45Å; T293-V297 PolarHBondContact O-N 3.4Å; T293-I304 HydrophobicContact CG2-CD1 3.44Å; T293-I304 VanDerWaalsContact CG2-CD1 3.44Å; T293-F312 HydrophobicContact CG2-CD2 3.66Å; T293-F312 HydrophobicContact CG2-CE2 3.59Å
294E88.8Confident88.7Confident25 Ų2552.2 Ų52.212%0.11729%0.294CS..Hα-helixtrans-65.2-32.7177.5-72.8-59.1138.900112.4T193 T197 F290 P298T193-E294 VanDerWaalsContact CG2-O 3.28Å; T193-E294 WeakPolarHBondContact CG2-O 3.31Å; T197-E294 HydrophobicContact CG2-CB 4.4Å; F290-E294 HydrophobicContact CD1-CG 4.15Å; F290-E294 HydrophobicContact CD2-CG 4.42Å; F290-E294 HydrophobicContact CE1-CG 3.69Å; F290-E294 HydrophobicContact CE2-CG 3.96Å; F290-E294 HydrophobicContact CZ-CG 3.58Å; F290-E294 PolarHBondContact O-N 3.29Å; E294-P298 WeakPolarHBondContact O-CD 3.38Å; E294-P298 WeakPolarHBondContact O-CG 3.37Å
295L90.1Very high88.5Confident30 Ų3054 Ų5416%0.15731%0.307CS..Hα-helixtrans-76.2-43.8175.2-176.863.4000112.2F198 Y202 F291 I292 T293 L299F198-L295 HydrophobicContact CE2-CD1 4.48Å; Y202-L295 HydrophobicContact CE2-CD2 3.89Å; F291-L295 WeakPolarHBondContact O-CB 3.45Å; F291-L295 PolarHBondContact O-N 3.41Å; I292-L295 PolarHBondContact O-N 3.07Å; T293-L295 VanDerWaalsContact C-N 3.29Å; T293-L295 PolarHBondContact O-N 3.25Å; L295-L299 HydrophobicContact CD1-CD1 3.97Å; L295-L299 HydrophobicContact CG-CD1 4.13Å; L295-L299 VanDerWaalsContact O-CD1 3.24Å; L295-L299 WeakPolarHBondContact O-CD1 3.45Å; L295-L299 WeakPolarHBondContact O-CG 2.99Å
296I88.9Confident88.1Confident83 Ų8351.7 Ų51.743%0.42630%0.299SS..Hα-helixtrans-78.9-41.5-171.1-70.2178.7000112.4I292 T293 L299 C300I292-I296 HydrophobicContact CG2-CD1 3.55Å; I292-I296 HydrophobicContact CG2-CG1 4.33Å; I292-I296 WeakPolarHBondContact O-CB 3.49Å; I292-I296 VanDerWaalsContact O-CG1 3.31Å; I292-I296 WeakPolarHBondContact O-CG1 3.36Å; I292-I296 PolarHBondContact O-N 2.93Å; T293-I296 PolarHBondContact O-N 3.5Å; I296-L299 PolarHBondContact O-N 3.31Å; I296-C300 HydrophobicContact CG2-CB 4.32Å; I296-C300 WeakPolarHBondContact CG2-SG 3.24Å; I296-C300 PolarHBondContact O-N 3.17Å; I296-C300 PolarHBondContact O-SG 3.04Å
297V86.2Confident87.8Confident14 Ų1454.8 Ų54.89%0.08532%0.315CS..Hα-helixtrans-54.8-48.6-173.8165.50000112.9T293 L299 S301 I304T293-V297 VanDerWaalsContact O-CB 3.3Å; T293-V297 WeakPolarHBondContact O-CB 3.37Å; T293-V297 WeakPolarHBondContact O-CG2 3.45Å; T293-V297 PolarHBondContact O-N 3.4Å; V297-L299 VanDerWaalsContact C-N 3.33Å; V297-L299 PolarHBondContact O-N 3.36Å; V297-S301 WeakPolarHBondContact O-CA 3.47Å; V297-S301 PolarHBondContact O-N 3.42Å; V297-S301 VanDerWaalsContact O-N 3.12Å; V297-I304 HydrophobicContact CG2-CD1 3.44Å; V297-I304 VanDerWaalsContact CG2-CD1 3.44Å; V297-I304 HydrophobicContact CG2-CG1 3.82Å
298P83.4Confident87.7Confident22 Ų2260.8 Ų60.814%0.14334%0.338CS..Hα-helixtrans-67.3-31.2176.1-13.124.1000113.4Q188 T193 E294Q188-P298 HydrophobicContact CB-CB 4.49Å; Q188-P298 VanDerWaalsContact OE1-CG 3.28Å; T193-P298 HydrophobicContact CG2-CG 3.95Å; E294-P298 WeakPolarHBondContact O-CD 3.38Å; E294-P298 WeakPolarHBondContact O-CG 3.37Å
299L82.1Confident87.4Confident101 Ų10160.4 Ų60.453%0.52933%0.334SS..Hα-helixtrans-81.6-34.5-173.8-66.4178.3000113.4L295 I296 V297L295-L299 HydrophobicContact CD1-CD1 3.97Å; L295-L299 HydrophobicContact CG-CD1 4.13Å; L295-L299 VanDerWaalsContact O-CD1 3.24Å; L295-L299 WeakPolarHBondContact O-CD1 3.45Å; L295-L299 WeakPolarHBondContact O-CG 2.99Å; I296-L299 PolarHBondContact O-N 3.31Å; V297-L299 VanDerWaalsContact C-N 3.33Å; V297-L299 PolarHBondContact O-N 3.36Å
300C83.8Confident87.3Confident57 Ų5759.4 Ų59.439%0.38533%0.327SS..Hα-helixtrans-102.5-3.3-179.971.30000113.8I296 C302I296-C300 HydrophobicContact CG2-CB 4.32Å; I296-C300 WeakPolarHBondContact CG2-SG 3.24Å; I296-C300 PolarHBondContact O-N 3.17Å; I296-C300 PolarHBondContact O-SG 3.04Å; C300-C302 HydrophobicContact CB-CB 4.44Å; C300-C302 WeakPolarHBondContact CB-SG 3.25Å; C300-C302 PolarHBondContact O-N 3.25Å; C300-C302 WeakPolarHBondContact SG-CB 3.37Å; C300-C302 PolarHBondContact SG-N 2.93Å; C300-C302 CovalentContact SG-SG 2.03Å; C300-C302 PolarHBondContact SG-SG 3.11Å
301S77.8Confident87.3Confident112 Ų11262.2 Ų62.278%0.78334%0.342SS*.THydrogen-bonded Turntrans53.134.4-172.1-57.20000112.8V297V297-S301 WeakPolarHBondContact O-CA 3.47Å; V297-S301 PolarHBondContact O-N 3.42Å; V297-S301 VanDerWaalsContact O-N 3.12Å
302C82.3Confident87.4Confident58 Ų5863.5 Ų63.539%0.39235%0.348SS..  trans-88.9133.9-177.5-50.40000111.2C300C300-C302 HydrophobicContact CB-CB 4.44Å; C300-C302 WeakPolarHBondContact CB-SG 3.25Å; C300-C302 PolarHBondContact O-N 3.25Å; C300-C302 WeakPolarHBondContact SG-CB 3.37Å; C300-C302 PolarHBondContact SG-N 2.93Å; C300-C302 CovalentContact SG-SG 2.03Å; C300-C302 PolarHBondContact SG-SG 3.11Å
303D80.9Confident87.4Confident163 Ų16360.9 Ų60.987%0.87234%0.335SS*.  trans-88.7114.3174.6-91.4-34.7000111.8
304I85.2Confident87.7Confident44 Ų4461 Ų6123%0.22633%0.333CS..  trans-96.5128.6172.2-61.6-178.7000108.7T293 V297 W308 K309T293-I304 HydrophobicContact CG2-CD1 3.44Å; T293-I304 VanDerWaalsContact CG2-CD1 3.44Å; V297-I304 HydrophobicContact CG2-CD1 3.44Å; V297-I304 VanDerWaalsContact CG2-CD1 3.44Å; V297-I304 HydrophobicContact CG2-CG1 3.82Å; I304-W308 HydrophobicContact CG2-CB 3.68Å; I304-K309 HydrophobicContact CG2-CG 4.21Å
305P88.2Confident88Confident69 Ų6962.9 Ų62.945%0.44834%0.344SS..  trans-53.2138.1177-27.133.6000112.2I307 W308P305-I307 HydrophobicContact CB-CG2 3.99Å; P305-I307 PolarHBondContact O-N 2.99Å; P305-W308 PolarHBondContact O-N 3.16Å
306P85.9Confident88.2Confident81 Ų8161.5 Ų61.553%0.52634%0.337SS..Hα-helixtrans-56.2-27.1-176-28.234.6000114.8W308 K309 S310P306-W308 VanDerWaalsContact C-N 3.34Å; P306-W308 PolarHBondContact O-N 2.94Å; P306-K309 PolarHBondContact O-N 3.44Å; P306-S310 WeakPolarHBondContact O-CB 3.46Å; P306-S310 PolarHBondContact O-N 3.38Å
307I88.5Confident88.5Confident71 Ų7157.6 Ų57.636%0.36432%0.317SS..Hα-helixtrans-61.2-40.2175.6-17463.9000112.2P305 S310 I311P305-I307 HydrophobicContact CB-CG2 3.99Å; P305-I307 PolarHBondContact O-N 2.99Å; I307-S310 WeakPolarHBondContact O-CB 3.22Å; I307-S310 PolarHBondContact O-N 2.67Å; I307-I311 HydrophobicContact CD1-CD1 4.47Å; I307-I311 HydrophobicContact CG1-CD1 4.04Å; I307-I311 VanDerWaalsContact O-CG1 3.27Å; I307-I311 WeakPolarHBondContact O-CG1 3.34Å; I307-I311 PolarHBondContact O-N 2.91Å
308W91Very high88.9Confident133 Ų13357.6 Ų57.650%0.50432%0.318SS..Hα-helixtrans-72.1-40-179.8-72.8113.7000111.6I304 P305 P306 S310 I311 F312I304-W308 HydrophobicContact CG2-CB 3.68Å; P305-W308 PolarHBondContact O-N 3.16Å; P306-W308 VanDerWaalsContact C-N 3.34Å; P306-W308 PolarHBondContact O-N 2.94Å; W308-S310 VanDerWaalsContact C-N 3.29Å; W308-S310 PolarHBondContact O-N 3.36Å; W308-I311 HydrophobicContact CE3-CD1 4.09Å; W308-I311 HydrophobicContact CZ3-CD1 4.31Å; W308-I311 PolarHBondContact O-N 3.45Å; W308-F312 HydrophobicContact CB-CE2 4.17Å; W308-F312 HydrophobicContact CB-CZ 4.41Å; W308-F312 HydrophobicContact CE3-CE1 4.01Å; W308-F312 AromaticContact CE3-CZ 3.88Å; W308-F312 HydrophobicContact CE3-CZ 3.88Å; W308-F312 VanDerWaalsContact O-CD2 3.28Å; W308-F312 WeakPolarHBondContact O-CD2 3.32Å; W308-F312 VanDerWaalsContact O-CG 3.23Å; W308-F312 WeakPolarHBondContact O-CG 3.29Å; W308-F312 PolarHBondContact O-N 3.41Å
309K89.3Confident89.4Confident52 Ų5256.6 Ų56.623%0.22631%0.311CS..Hα-helixtrans-58-44.5172.9-65-168.1178.6-168.30111.2I304 P306 F312 L313I304-K309 HydrophobicContact CG2-CG 4.21Å; P306-K309 PolarHBondContact O-N 3.44Å; K309-F312 PolarHBondContact O-N 2.87Å; K309-L313 VanDerWaalsContact O-CB 3.31Å; K309-L313 WeakPolarHBondContact O-CB 3.3Å; K309-L313 PolarHBondContact O-N 3.29Å
310S91.3Very high89.9Confident12 Ų1252 Ų528%0.08429%0.287CS..Hα-helixtrans-60.3-49174.8-179.70000112.3E95 P306 I307 W308 F312 L313 W314E95-S310 WeakPolarHBondContact OE1-CB 3.19Å; E95-S310 PolarHBondContact OE1-OG 2.84Å; E95-S310 PolarHBondContact OE2-OG 3.35Å; P306-S310 WeakPolarHBondContact O-CB 3.46Å; P306-S310 PolarHBondContact O-N 3.38Å; I307-S310 WeakPolarHBondContact O-CB 3.22Å; I307-S310 PolarHBondContact O-N 2.67Å; W308-S310 VanDerWaalsContact C-N 3.29Å; W308-S310 PolarHBondContact O-N 3.36Å; S310-F312 VanDerWaalsContact C-N 3.35Å; S310-F312 PolarHBondContact O-N 3.07Å; S310-L313 PolarHBondContact O-N 2.98Å; S310-W314 VanDerWaalsContact O-CD1 3.25Å; S310-W314 PolarHBondContact O-N 3.39Å
311I93.6Very high90.3Very high76 Ų7651.6 Ų51.639%0.3928%0.279SS..Hα-helixtrans-58-46.8178.6-71165.2000111I307 W308 L315I307-I311 HydrophobicContact CD1-CD1 4.47Å; I307-I311 HydrophobicContact CG1-CD1 4.04Å; I307-I311 VanDerWaalsContact O-CG1 3.27Å; I307-I311 WeakPolarHBondContact O-CG1 3.34Å; I307-I311 PolarHBondContact O-N 2.91Å; W308-I311 HydrophobicContact CE3-CD1 4.09Å; W308-I311 HydrophobicContact CZ3-CD1 4.31Å; W308-I311 PolarHBondContact O-N 3.45Å; I311-L315 WeakPolarHBondContact O-CB 3.15Å; I311-L315 PolarHBondContact O-N 3.31Å
312F95.1Very high90.9Very high42 Ų4250 Ų5018%0.18426%0.258CS..Hα-helixtrans-67.5-38.2-179.4-59-27.2000112.4P289 F290 T293 W308 K309 S310 L315 G316P289-F312 HydrophobicContact CB-CB 4.28Å; P289-F312 HydrophobicContact CB-CD1 3.58Å; P289-F312 HydrophobicContact CB-CD2 4.38Å; P289-F312 HydrophobicContact CB-CE1 3.96Å; P289-F312 HydrophobicContact CB-CG 3.83Å; F290-F312 HydrophobicContact CB-CB 4.12Å; F290-F312 HydrophobicContact CD2-CB 4.48Å; T293-F312 HydrophobicContact CG2-CD2 3.66Å; T293-F312 HydrophobicContact CG2-CE2 3.59Å; W308-F312 HydrophobicContact CB-CE2 4.17Å; W308-F312 HydrophobicContact CB-CZ 4.41Å; W308-F312 HydrophobicContact CE3-CE1 4.01Å; W308-F312 AromaticContact CE3-CZ 3.88Å; W308-F312 HydrophobicContact CE3-CZ 3.88Å; W308-F312 VanDerWaalsContact O-CD2 3.28Å; W308-F312 WeakPolarHBondContact O-CD2 3.32Å; W308-F312 VanDerWaalsContact O-CG 3.23Å; W308-F312 WeakPolarHBondContact O-CG 3.29Å; W308-F312 PolarHBondContact O-N 3.41Å; K309-F312 PolarHBondContact O-N 2.87Å; S310-F312 VanDerWaalsContact C-N 3.35Å; S310-F312 PolarHBondContact O-N 3.07Å; F312-L315 PolarHBondContact O-N 3.25Å; F312-G316 PolarHBondContact O-N 2.92Å
313L93.3Very high91.1Very high20 Ų2047.2 Ų47.211%0.10524%0.239CC..Hα-helixtrans-63-50175.7-174.369.1000111.5W111 F290 K309 S310 L315 G316 Y317W111-L313 HydrophobicContact CZ2-CD2 4.47Å; F290-L313 HydrophobicContact CD2-CB 4.32Å; F290-L313 HydrophobicContact CD2-CD1 4.16Å; F290-L313 HydrophobicContact CE2-CB 4.32Å; F290-L313 HydrophobicContact CE2-CD1 3.63Å; F290-L313 HydrophobicContact CZ-CD1 3.95Å; K309-L313 VanDerWaalsContact O-CB 3.31Å; K309-L313 WeakPolarHBondContact O-CB 3.3Å; K309-L313 PolarHBondContact O-N 3.29Å; S310-L313 PolarHBondContact O-N 2.98Å; L313-L315 VanDerWaalsContact C-N 3.31Å; L313-L315 PolarHBondContact O-N 3.41Å; L313-G316 WeakPolarHBondContact O-CA 3.28Å; L313-G316 PolarHBondContact O-N 3.07Å; L313-G316 VanDerWaalsContact O-N 3.1Å; L313-Y317 HydrophobicContact CD1-CE1 4.2Å; L313-Y317 HydrophobicContact CD1-CE2 4.13Å; L313-Y317 HydrophobicContact CD2-CE2 3.92Å; L313-Y317 HydrophobicContact CG-CD2 4.28Å; L313-Y317 HydrophobicContact CG-CE2 3.63Å; L313-Y317 PolarHBondContact O-N 2.54Å
314W95.7Very high91.2Very high15 Ų1539.5 Ų39.56%0.05720%0.198CC..Hα-helixtrans-67.6-31.6179.1-79.6103.6000112.9L41 L44 V45 M88 L92 S310 Y317 S318L41-W314 HydrophobicContact CB-CH2 3.98Å; L41-W314 HydrophobicContact CB-CZ2 4.23Å; L41-W314 HydrophobicContact CB-CZ3 4.13Å; L41-W314 HydrophobicContact CD1-CD2 4.05Å; L41-W314 HydrophobicContact CD1-CG 4.4Å; L41-W314 HydrophobicContact CD1-CH2 4.46Å; L41-W314 HydrophobicContact CD1-CZ2 3.89Å; L41-W314 HydrophobicContact CD2-CB 4.31Å; L41-W314 HydrophobicContact CD2-CD2 3.55Å; L41-W314 HydrophobicContact CD2-CE3 3.58Å; L41-W314 HydrophobicContact CD2-CG 3.89Å; L41-W314 HydrophobicContact CD2-CH2 4.5Å; L41-W314 HydrophobicContact CD2-CZ3 4.06Å; L41-W314 HydrophobicContact CG-CD2 4.28Å; L41-W314 HydrophobicContact CG-CE3 4.42Å; L41-W314 HydrophobicContact CG-CZ2 4.42Å; L44-W314 HydrophobicContact CD2-CE3 4.26Å; V45-W314 HydrophobicContact CG2-CH2 3.89Å; V45-W314 HydrophobicContact CG2-CZ3 3.9Å; M88-W314 HydrophobicContact CB-CH2 4.45Å; M88-W314 HydrophobicContact CB-CZ3 4.47Å; L92-W314 HydrophobicContact CB-CH2 4.22Å; L92-W314 HydrophobicContact CB-CZ2 4.22Å; L92-W314 HydrophobicContact CD1-CH2 4.44Å; L92-W314 HydrophobicContact CD1-CZ2 4.35Å; S310-W314 VanDerWaalsContact O-CD1 3.25Å; S310-W314 PolarHBondContact O-N 3.39Å; W314-Y317 HydrophobicContact CD2-CD2 4.21Å; W314-Y317 HydrophobicContact CE3-CD2 4.01Å; W314-Y317 HydrophobicContact CZ3-CD2 4.4Å; W314-Y317 PolarHBondContact O-N 3.11Å; W314-S318 PolarHBondContact O-N 2.96Å
315L96Very high91.1Very high66 Ų6640.2 Ų40.235%0.34620%0.202SC..Hα-helixtrans-63.4-42.6169.7-178.664.3000111C286 P289 I311 F312 L313 S318C286-L315 WeakPolarHBondContact CB-O 3.19Å; P289-L315 HydrophobicContact CG-CD2 4.12Å; I311-L315 WeakPolarHBondContact O-CB 3.15Å; I311-L315 PolarHBondContact O-N 3.31Å; F312-L315 PolarHBondContact O-N 3.25Å; L313-L315 VanDerWaalsContact C-N 3.31Å; L313-L315 PolarHBondContact O-N 3.41Å; L315-S318 WeakPolarHBondContact O-CB 3.41Å; L315-S318 PolarHBondContact O-N 3.25Å; L315-S318 PolarHBondContact O-OG 3.4Å
316G94.3Very high90.9Very high0 Ų037.6 Ų37.60%018%0.184CC..Hα-helixtrans-57.9-48.3171.500000112.3C286 W287 F312 L313 S318 N319C286-G316 PolarHBondContact O-N 3.01Å; W287-G316 PolarHBondContact NE1-O 3.36Å; F312-G316 PolarHBondContact O-N 2.92Å; L313-G316 WeakPolarHBondContact O-CA 3.28Å; L313-G316 PolarHBondContact O-N 3.07Å; L313-G316 VanDerWaalsContact O-N 3.1Å; G316-S318 VanDerWaalsContact C-N 3.28Å; G316-S318 PolarHBondContact O-N 3.28Å; G316-N319 WeakPolarHBondContact O-CB 3.19Å; G316-N319 PolarHBondContact O-N 2.91Å
317Y95.2Very high90.3Very high1 Ų134.2 Ų34.20%0.00416%0.161CC..Hα-helixtrans-60.3-32.9177-70.4-19.9000114.2V83 V87 M88 D115 W287 L313 W314 N319 S320V83-Y317 HydrophobicContact CG1-CD1 3.91Å; V83-Y317 HydrophobicContact CG1-CE1 4.25Å; V87-Y317 HydrophobicContact CG1-CE1 3.74Å; V87-Y317 HydrophobicContact CG1-CE2 4.39Å; V87-Y317 WeakPolarHBondContact CG1-OH 3.4Å; M88-Y317 HydrophobicContact CE-CG 4.26Å; M88-Y317 VanDerWaalsContact CE-O 3.32Å; M88-Y317 WeakPolarHBondContact CE-O 3.34Å; M88-Y317 HydrophobicContact CG-CD2 4.09Å; M88-Y317 HydrophobicContact CG-CG 4.12Å; D115-Y317 WeakPolarHBondContact OD1-CE1 3.42Å; D115-Y317 PolarHBondContact OD1-OH 2.87Å; W287-Y317 HydrophobicContact CH2-CD1 4.42Å; W287-Y317 HydrophobicContact CH2-CE1 4.42Å; L313-Y317 HydrophobicContact CD1-CE1 4.2Å; L313-Y317 HydrophobicContact CD1-CE2 4.13Å; L313-Y317 HydrophobicContact CD2-CE2 3.92Å; L313-Y317 HydrophobicContact CG-CD2 4.28Å; L313-Y317 HydrophobicContact CG-CE2 3.63Å; L313-Y317 PolarHBondContact O-N 2.54Å; W314-Y317 HydrophobicContact CD2-CD2 4.21Å; W314-Y317 HydrophobicContact CE3-CD2 4.01Å; W314-Y317 HydrophobicContact CZ3-CD2 4.4Å; W314-Y317 PolarHBondContact O-N 3.11Å; Y317-N319 PolarHBondContact O-N 3.18Å; Y317-N319 VanDerWaalsContact O-N 3.12Å; Y317-S320 PolarHBondContact O-N 3.04Å
318S94.1Very high89.7Confident15 Ų1531.3 Ų31.311%0.10515%0.147CC..Hα-helixtrans-60.7-21.6175.577.70000113.4W314 L315 G316 S320 F321 F322W314-S318 PolarHBondContact O-N 2.96Å; L315-S318 WeakPolarHBondContact O-CB 3.41Å; L315-S318 PolarHBondContact O-N 3.25Å; L315-S318 PolarHBondContact O-OG 3.4Å; G316-S318 VanDerWaalsContact C-N 3.28Å; G316-S318 PolarHBondContact O-N 3.28Å; S318-S320 VanDerWaalsContact C-N 3.28Å; S318-S320 PolarHBondContact O-N 3.42Å; S318-F321 VanDerWaalsContact O-CB 3.31Å; S318-F321 WeakPolarHBondContact O-CB 3.4Å; S318-F321 PolarHBondContact O-N 3.45Å; S318-F322 WeakPolarHBondContact O-CD2 3.4Å; S318-F322 PolarHBondContact O-N 3.07Å
319N93.1Very high88.8Confident0 Ų028.4 Ų28.40%015%0.151CC..Hα-helixtrans-55.5-43.3174.3-179.570.1000112.5F283 C286 G316 Y317 F321 F322 N323F283-N319 VanDerWaalsContact CA-OD1 3.29Å; F283-N319 WeakPolarHBondContact CA-OD1 3.3Å; F283-N319 WeakPolarHBondContact CD2-ND2 3.37Å; C286-N319 HydrophobicContact CB-CB 3.93Å; G316-N319 WeakPolarHBondContact O-CB 3.19Å; G316-N319 PolarHBondContact O-N 2.91Å; Y317-N319 PolarHBondContact O-N 3.18Å; Y317-N319 VanDerWaalsContact O-N 3.12Å; N319-F321 PolarHBondContact O-N 2.94Å; N319-F322 PolarHBondContact O-N 3.33Å; N319-F322 VanDerWaalsContact O-N 3.08Å; N319-N323 PolarHBondContact O-N 3.39Å; N319-N323 VanDerWaalsContact O-N 3.11Å
320S93.1Very high87.8Confident4 Ų429.6 Ų29.63%0.02816%0.156CC..Hα-helixtrans-64.1-23.2179.1-65.90000112.7N52 D80 Y317 S318 P324N52-S320 PolarHBondContact ND2-O 3.47Å; D80-S320 VanDerWaalsContact OD1-CB 3.26Å; D80-S320 WeakPolarHBondContact OD1-CB 3.4Å; D80-S320 PolarHBondContact OD1-OG 2.96Å; Y317-S320 PolarHBondContact O-N 3.04Å; S318-S320 VanDerWaalsContact C-N 3.28Å; S318-S320 PolarHBondContact O-N 3.42Å; S320-P324 WeakPolarHBondContact O-CD 3.46Å
321F92.4Very high86.6Confident50 Ų5031 Ų3122%0.21916%0.163CC..Hα-helixtrans-76.2-41.2171.9175-108.4000112L44 A47 S318 N319 L325L44-F321 HydrophobicContact CD1-CB 3.95Å; L44-F321 HydrophobicContact CD1-CD1 4.3Å; L44-F321 HydrophobicContact CD1-CD2 4.41Å; L44-F321 HydrophobicContact CD1-CG 3.97Å; A47-F321 HydrophobicContact CB-CD2 4.28Å; A47-F321 HydrophobicContact CB-CE2 3.93Å; S318-F321 VanDerWaalsContact O-CB 3.31Å; S318-F321 WeakPolarHBondContact O-CB 3.4Å; S318-F321 PolarHBondContact O-N 3.45Å; N319-F321 PolarHBondContact O-N 2.94Å; F321-L325 HydrophobicContact CD1-CD1 4Å; F321-L325 HydrophobicContact CE1-CD1 3.48Å; F321-L325 VanDerWaalsContact CE1-CD1 3.48Å; F321-L325 HydrophobicContact CE2-CD1 4.45Å; F321-L325 HydrophobicContact CZ-CD1 3.73Å
322F90.1Very high85.2Confident78 Ų7835.2 Ų35.234%0.34218%0.178SC..Hα-helixtrans-71.9-31.8-177.4-66.6-59.8000113.8V282 S318 N319 L325 I326V282-F322 HydrophobicContact CG1-CB 3.75Å; V282-F322 HydrophobicContact CG1-CD2 3.75Å; V282-F322 HydrophobicContact CG1-CG 3.98Å; S318-F322 WeakPolarHBondContact O-CD2 3.4Å; S318-F322 PolarHBondContact O-N 3.07Å; N319-F322 PolarHBondContact O-N 3.33Å; N319-F322 VanDerWaalsContact O-N 3.08Å; F322-L325 HydrophobicContact CD1-CD1 4.27Å; F322-L325 WeakPolarHBondContact O-CB 3.22Å; F322-L325 PolarHBondContact O-N 2.73Å; F322-I326 HydrophobicContact CB-CD1 4.34Å; F322-I326 WeakPolarHBondContact O-CG1 3.28Å; F322-I326 PolarHBondContact O-N 2.93Å
323N86.1Confident83.7Confident0 Ų037.5 Ų37.50%019%0.193CC..Hα-helixtrans-47.7-59-177.7-78.6-18.4000112.4M76 D80 N319 L325 I326 Y327M76-N323 HydrophobicContact SD-CB 4.25Å; D80-N323 PolarHBondContact OD1-ND2 3.18Å; D80-N323 PolarHBondContact OD2-ND2 3.21Å; N319-N323 PolarHBondContact O-N 3.39Å; N319-N323 VanDerWaalsContact O-N 3.11Å; N323-L325 PolarHBondContact O-N 3.19Å; N323-I326 PolarHBondContact O-N 2.9Å; N323-Y327 HydrophobicContact CB-CE2 4.31Å; N323-Y327 WeakPolarHBondContact O-CD2 3.3Å; N323-Y327 WeakPolarHBondContact O-CE2 3.11Å; N323-Y327 PolarHBondContact O-N 3.36Å
324P83.6Confident82.3Confident0 Ų036.7 Ų36.70%019%0.188CC..Hα-helixtrans-61.1-33.6173.1-32.538.7000118.4W51 N52 V55 S320 I326 Y327 T328W51-P324 HydrophobicContact CG-CB 4.14Å; N52-P324 HydrophobicContact CB-CG 4.49Å; N52-P324 VanDerWaalsContact CG-CG 3.5Å; N52-P324 WeakPolarHBondContact OD1-CD 3.48Å; N52-P324 WeakPolarHBondContact OD1-CG 3.17Å; V55-P324 HydrophobicContact CG2-CB 3.75Å; V55-P324 HydrophobicContact CG2-CG 4.1Å; S320-P324 WeakPolarHBondContact O-CD 3.46Å; P324-I326 PolarHBondContact O-N 3.07Å; P324-Y327 PolarHBondContact O-N 3.35Å; P324-T328 WeakPolarHBondContact O-CB 3.28Å; P324-T328 WeakPolarHBondContact O-CG2 3.37Å; P324-T328 PolarHBondContact O-N 2.94Å; P324-T328 PolarHBondContact O-OG1 3.42Å
325L82.9Confident81.1Confident59 Ų5938.7 Ų38.731%0.30920%0.2SC..Hα-helixtrans-63-39.6178.1-73.5172.9000109.9W51 F321 F322 N323 T328 A329W51-L325 HydrophobicContact CH2-CD2 4.25Å; W51-L325 HydrophobicContact CZ2-CD2 3.81Å; F321-L325 HydrophobicContact CD1-CD1 4Å; F321-L325 HydrophobicContact CE1-CD1 3.48Å; F321-L325 VanDerWaalsContact CE1-CD1 3.48Å; F321-L325 HydrophobicContact CE2-CD1 4.45Å; F321-L325 HydrophobicContact CZ-CD1 3.73Å; F322-L325 HydrophobicContact CD1-CD1 4.27Å; F322-L325 WeakPolarHBondContact O-CB 3.22Å; F322-L325 PolarHBondContact O-N 2.73Å; N323-L325 PolarHBondContact O-N 3.19Å; L325-T328 WeakPolarHBondContact CA-OG1 3.2Å; L325-T328 PolarHBondContact O-OG1 3.39Å; L325-T328 VanDerWaalsContact O-OG1 3.08Å; L325-A329 WeakPolarHBondContact O-CB 3.23Å; L325-A329 PolarHBondContact O-N 3.01Å
326I83.7Confident79.7Confident14 Ų1439.5 Ų39.57%0.07220%0.204CC..Hα-helixtrans-66.7-43.5175.8-60.8159.3000110M275 I278 L279 V282 F322 N323 P324 T328 F330M275-I326 HydrophobicContact CG-CG2 3.8Å; I278-I326 HydrophobicContact CB-CG2 4.48Å; I278-I326 HydrophobicContact CG2-CD1 3.92Å; I278-I326 HydrophobicContact CG2-CG1 3.99Å; I278-I326 HydrophobicContact CG2-CG2 4.14Å; L279-I326 HydrophobicContact CD2-CB 3.98Å; L279-I326 HydrophobicContact CD2-CD1 3.72Å; L279-I326 HydrophobicContact CD2-CG1 4.48Å; L279-I326 HydrophobicContact CD2-CG2 3.9Å; L279-I326 HydrophobicContact CG-CD1 4.36Å; L279-I326 HydrophobicContact CG-CG2 3.89Å; V282-I326 HydrophobicContact CB-CD1 4.37Å; V282-I326 HydrophobicContact CG2-CD1 4.11Å; F322-I326 HydrophobicContact CB-CD1 4.34Å; F322-I326 WeakPolarHBondContact O-CG1 3.28Å; F322-I326 PolarHBondContact O-N 2.93Å; N323-I326 PolarHBondContact O-N 2.9Å; P324-I326 PolarHBondContact O-N 3.07Å; I326-T328 PolarHBondContact O-N 3.4Å; I326-F330 HydrophobicContact CG2-CD2 4Å; I326-F330 HydrophobicContact CG2-CE2 4.35Å; I326-F330 VanDerWaalsContact O-CD2 3.31Å; I326-F330 WeakPolarHBondContact O-CD2 3.45Å; I326-F330 PolarHBondContact O-N 2.98Å
327Y74.9Confident78.3Confident10 Ų1040 Ų404%0.03921%0.208CC..Hα-helixtrans-62.7-42.7177.7-62-44000113.7V73 M76 M275 L279 N323 P324 N331V73-Y327 HydrophobicContact CG1-CD2 3.8Å; V73-Y327 HydrophobicContact CG1-CE1 4.44Å; V73-Y327 HydrophobicContact CG1-CE2 3.71Å; V73-Y327 HydrophobicContact CG1-CG 4.25Å; V73-Y327 HydrophobicContact CG2-CD1 4.39Å; V73-Y327 HydrophobicContact CG2-CE1 3.9Å; V73-Y327 HydrophobicContact CG2-CE2 4.46Å; M76-Y327 HydrophobicContact SD-CE2 4.15Å; M76-Y327 PolarHBondContact SD-OH 3.13Å; M275-Y327 HydrophobicContact CE-CD1 4.29Å; M275-Y327 HydrophobicContact CE-CE1 4.35Å; M275-Y327 HydrophobicContact SD-CD1 4.01Å; L279-Y327 HydrophobicContact CD1-CD1 4.42Å; L279-Y327 HydrophobicContact CD1-CE1 3.52Å; L279-Y327 HydrophobicContact CD2-CE1 4.05Å; L279-Y327 HydrophobicContact CG-CE1 4.41Å; N323-Y327 HydrophobicContact CB-CE2 4.31Å; N323-Y327 WeakPolarHBondContact O-CD2 3.3Å; N323-Y327 WeakPolarHBondContact O-CE2 3.11Å; N323-Y327 PolarHBondContact O-N 3.36Å; P324-Y327 PolarHBondContact O-N 3.35Å; Y327-N331 WeakPolarHBondContact O-CB 3.4Å; Y327-N331 PolarHBondContact O-N 3.31Å
328T74.6Confident77Confident11 Ų1141.1 Ų41.17%0.06722%0.215CC..Hα-helixtrans-71.6-40.7-179.849.90000111.6W51 P324 L325 I326 F330 Y334 N335 L338W51-T328 HydrophobicContact CZ2-CG2 4.42Å; P324-T328 WeakPolarHBondContact O-CB 3.28Å; P324-T328 WeakPolarHBondContact O-CG2 3.37Å; P324-T328 PolarHBondContact O-N 2.94Å; P324-T328 PolarHBondContact O-OG1 3.42Å; L325-T328 WeakPolarHBondContact CA-OG1 3.2Å; L325-T328 PolarHBondContact O-OG1 3.39Å; L325-T328 VanDerWaalsContact O-OG1 3.08Å; I326-T328 PolarHBondContact O-N 3.4Å; T328-F330 PolarHBondContact O-N 2.93Å; T328-Y334 HydrophobicContact CG2-CD1 3.92Å; T328-Y334 HydrophobicContact CG2-CE1 4.4Å; T328-N335 VanDerWaalsContact O-CG 3.25Å; T328-N335 PolarHBondContact O-ND2 3.13Å; T328-N335 PolarHBondContact O-OD1 2.98Å; T328-L338 HydrophobicContact CG2-CD1 3.72Å
329A72.7Confident75.9Confident72 Ų7249.3 Ų49.360%0.59524%0.243SC*.Hα-helixtrans-63-41.5178.600000113.3L325L325-A329 WeakPolarHBondContact O-CB 3.23Å; L325-A329 PolarHBondContact O-N 3.01Å
330F67.6Low74.8Confident77 Ų7754 Ų5434%0.33827%0.268SS..Hα-helixtrans-94.4-9.7-173.5-70.9-81.8000114.5L274 M275 I278 I326 T328L274-F330 HydrophobicContact CD2-CE1 3.85Å; L274-F330 HydrophobicContact CD2-CZ 4.48Å; L274-F330 HydrophobicContact CG-CE1 4.34Å; M275-F330 HydrophobicContact CB-CB 4.07Å; M275-F330 HydrophobicContact CB-CG 4.2Å; M275-F330 HydrophobicContact CG-CB 3.97Å; M275-F330 HydrophobicContact CG-CD2 4.34Å; M275-F330 HydrophobicContact CG-CG 4.31Å; M275-F330 HydrophobicContact SD-CB 4.12Å; I278-F330 HydrophobicContact CD1-CE1 4.16Å; I278-F330 HydrophobicContact CD1-CE2 3.52Å; I278-F330 HydrophobicContact CD1-CZ 3.27Å; I326-F330 HydrophobicContact CG2-CD2 4Å; I326-F330 HydrophobicContact CG2-CE2 4.35Å; I326-F330 VanDerWaalsContact O-CD2 3.31Å; I326-F330 WeakPolarHBondContact O-CD2 3.45Å; I326-F330 PolarHBondContact O-N 2.98Å; T328-F330 PolarHBondContact O-N 2.93Å
331N67Low73.6Confident41 Ų4156 Ų5622%0.21928%0.278CS..  trans-117.895.1-177.8-166.2-12.1000113Y327 N333 Y334 N335Y327-N331 WeakPolarHBondContact O-CB 3.4Å; Y327-N331 PolarHBondContact O-N 3.31Å; N331-N333 PolarHBondContact O-N 3.34Å; N331-N333 VanDerWaalsContact O-N 3.13Å; N331-N333 WeakPolarHBondContact OD1-CB 3.3Å; N331-N333 PolarHBondContact OD1-N 2.95Å; N331-N333 VanDerWaalsContact OD1-N 3.15Å; N331-Y334 WeakPolarHBondContact O-CA 3.31Å; N331-Y334 VanDerWaalsContact O-CB 3.22Å; N331-Y334 WeakPolarHBondContact O-CB 3.34Å; N331-Y334 PolarHBondContact O-N 2.78Å; N331-N335 PolarHBondContact O-N 3.02Å
332K63.9Low72.6Confident165 Ų16559.6 Ų59.672%0.71729%0.294SS*.Hα-helixtrans-53.5-33.3175.1-74.8-171.4176-173.30113.5Y334 N335 N336K332-Y334 VanDerWaalsContact C-N 3.25Å; K332-Y334 PolarHBondContact O-N 3.28Å; K332-N335 PolarHBondContact O-N 2.84Å; K332-N336 WeakPolarHBondContact O-CB 3.5Å; K332-N336 PolarHBondContact O-N 3.45Å; K332-N336 PolarHBondContact O-ND2 3.45Å; K332-N336 PolarHBondContact O-OD1 3.21Å
333N64.4Low71.4Confident90 Ų9059.4 Ų59.448%0.48130%0.303SS..Hα-helixtrans-66.4-33.7178.1-64.4-14.8000111.3F65 N331 A337F65-N333 HydrophobicContact CE1-CB 3.95Å; F65-N333 HydrophobicContact CZ-CB 4.16Å; N331-N333 PolarHBondContact O-N 3.34Å; N331-N333 VanDerWaalsContact O-N 3.13Å; N331-N333 WeakPolarHBondContact OD1-CB 3.3Å; N331-N333 PolarHBondContact OD1-N 2.95Å; N331-N333 VanDerWaalsContact OD1-N 3.15Å; N333-A337 WeakPolarHBondContact O-CB 3.42Å; N333-A337 PolarHBondContact O-N 3.44Å
334Y64.1Low69.9Low3 Ų370.4 Ų70.41%0.01234%0.344CS..Hα-helixtrans-69.9-44.6178.3-139-81.9000111.4V55 T58 I59 T328 N331 K332 N336 A337 L338V55-Y334 VanDerWaalsContact C-OH 3.27Å; V55-Y334 WeakPolarHBondContact CA-OH 3.34Å; V55-Y334 HydrophobicContact CB-CE1 4.49Å; V55-Y334 WeakPolarHBondContact CB-OH 3.39Å; V55-Y334 WeakPolarHBondContact CG1-OH 3.24Å; V55-Y334 HydrophobicContact CG2-CE1 4.02Å; V55-Y334 PolarHBondContact O-OH 3.23Å; T58-Y334 HydrophobicContact CG2-CE1 4.08Å; I59-Y334 HydrophobicContact CD1-CE2 4.21Å; I59-Y334 WeakPolarHBondContact CD1-OH 3.33Å; I59-Y334 HydrophobicContact CG1-CE2 3.91Å; I59-Y334 VanDerWaalsContact CG1-OH 3.27Å; I59-Y334 WeakPolarHBondContact CG1-OH 3.2Å; T328-Y334 HydrophobicContact CG2-CD1 3.92Å; T328-Y334 HydrophobicContact CG2-CE1 4.4Å; N331-Y334 WeakPolarHBondContact O-CA 3.31Å; N331-Y334 VanDerWaalsContact O-CB 3.22Å; N331-Y334 WeakPolarHBondContact O-CB 3.34Å; N331-Y334 PolarHBondContact O-N 2.78Å; K332-Y334 VanDerWaalsContact C-N 3.25Å; K332-Y334 PolarHBondContact O-N 3.28Å; Y334-N336 VanDerWaalsContact C-N 3.32Å; Y334-N336 PolarHBondContact O-N 2.78Å; Y334-A337 PolarHBondContact O-N 3.42Å; Y334-L338 HydrophobicContact CD1-CD1 4Å; Y334-L338 HydrophobicContact CD1-CG 4.35Å; Y334-L338 HydrophobicContact CE1-CD1 4.42Å; Y334-L338 PolarHBondContact O-N 3.01Å
335N68.6Low68.3Low56 Ų5678.1 Ų78.130%0.29938%0.38SS..Hα-helixtrans-62.4-39.4174.3-68.7-20.4000112.3T328 N331 K332 L338 R339T328-N335 VanDerWaalsContact O-CG 3.25Å; T328-N335 PolarHBondContact O-ND2 3.13Å; T328-N335 PolarHBondContact O-OD1 2.98Å; N331-N335 PolarHBondContact O-N 3.02Å; K332-N335 PolarHBondContact O-N 2.84Å; N335-L338 PolarHBondContact O-N 3.11Å; N335-R339 WeakPolarHBondContact O-CB 3.35Å; N335-R339 VanDerWaalsContact O-CG 3.31Å; N335-R339 WeakPolarHBondContact O-CG 3.41Å; N335-R339 PolarHBondContact O-N 3.46Å
336N68.3Low66.2Low83 Ų8389.8 Ų89.844%0.44442%0.42SS..Hα-helixtrans-67.3-38.5175.8-68.9-10000111.7K332 Y334 N340K332-N336 WeakPolarHBondContact O-CB 3.5Å; K332-N336 PolarHBondContact O-N 3.45Å; K332-N336 PolarHBondContact O-ND2 3.45Å; K332-N336 PolarHBondContact O-OD1 3.21Å; Y334-N336 VanDerWaalsContact C-N 3.32Å; Y334-N336 PolarHBondContact O-N 2.78Å; N336-N340 WeakPolarHBondContact O-CB 3.27Å; N336-N340 PolarHBondContact O-N 3.48Å; N336-N340 PolarHBondContact O-ND2 3.45Å
337A63.7Low65.4Low10 Ų1093.6 Ų93.68%0.08344%0.437CS..Hα-helixtrans-67.3-41.9175.500000112.7T58 V62 F65 N333 Y334 N340 L341T58-A337 HydrophobicContact CG2-CB 3.83Å; V62-A337 HydrophobicContact CG2-CB 4.28Å; F65-A337 HydrophobicContact CE2-CB 3.48Å; F65-A337 VanDerWaalsContact CE2-CB 3.48Å; F65-A337 HydrophobicContact CZ-CB 3.8Å; N333-A337 WeakPolarHBondContact O-CB 3.42Å; N333-A337 PolarHBondContact O-N 3.44Å; Y334-A337 PolarHBondContact O-N 3.42Å; A337-N340 PolarHBondContact O-N 2.95Å; A337-L341 PolarHBondContact O-N 2.89Å
338L68.9Low64.8Low26 Ų2698 Ų9814%0.13646%0.458CS..Hα-helixtrans-60.6-48.6172.9-79.6166.9000110.9T328 Y334 N335 N340 L341 F342T328-L338 HydrophobicContact CG2-CD1 3.72Å; Y334-L338 HydrophobicContact CD1-CD1 4Å; Y334-L338 HydrophobicContact CD1-CG 4.35Å; Y334-L338 HydrophobicContact CE1-CD1 4.42Å; Y334-L338 PolarHBondContact O-N 3.01Å; N335-L338 PolarHBondContact O-N 3.11Å; L338-N340 VanDerWaalsContact C-N 3.27Å; L338-N340 PolarHBondContact O-N 3.12Å; L338-L341 WeakPolarHBondContact O-CB 3.28Å; L338-L341 PolarHBondContact O-N 3.01Å; L338-L341 VanDerWaalsContact O-N 3.11Å; L338-F342 HydrophobicContact CD2-CE2 4.26Å; L338-F342 WeakPolarHBondContact O-CD2 3.44Å; L338-F342 PolarHBondContact O-N 3.17Å
339R71.1Confident64.3Low186 Ų186102.8 Ų102.870%0.70248%0.48SS*.Hα-helixtrans-56.3-42.6174.7-77.3178.3177.9-162.3-1.7112N335 F342 S343N335-R339 WeakPolarHBondContact O-CB 3.35Å; N335-R339 VanDerWaalsContact O-CG 3.31Å; N335-R339 WeakPolarHBondContact O-CG 3.41Å; N335-R339 PolarHBondContact O-N 3.46Å; R339-F342 PolarHBondContact O-N 2.76Å; R339-S343 VanDerWaalsContact O-CB 3.24Å; R339-S343 WeakPolarHBondContact O-CB 3.17Å; R339-S343 PolarHBondContact O-N 3.47Å; R339-S343 PolarHBondContact O-OG 3.24Å; R339-S343 VanDerWaalsContact O-OG 3.09Å
340N69.8Low63.8Low100 Ų100104.6 Ų104.654%0.53547%0.473SS..Hα-helixtrans-68.8-32177.8-72.4-14.1000113.4N336 A337 L338 S343 R344N336-N340 WeakPolarHBondContact O-CB 3.27Å; N336-N340 PolarHBondContact O-N 3.48Å; N336-N340 PolarHBondContact O-ND2 3.45Å; A337-N340 PolarHBondContact O-N 2.95Å; L338-N340 VanDerWaalsContact C-N 3.27Å; L338-N340 PolarHBondContact O-N 3.12Å; N340-S343 WeakPolarHBondContact CA-OG 3.05Å; N340-S343 PolarHBondContact O-OG 2.03Å; N340-R344 WeakPolarHBondContact O-CB 2.99Å; N340-R344 PolarHBondContact O-N 3.4Å; N340-R344 VanDerWaalsContact O-N 3.1Å
341L68.4Low63.6Low44 Ų44106.4 Ų106.423%0.2348%0.482CS..Hα-helixtrans-65.4-43.2173.2-95.1152.5000111.5T58 A337 L338T58-L341 HydrophobicContact CG2-CD1 3.87Å; T58-L341 VanDerWaalsContact OG1-CD1 3.27Å; T58-L341 WeakPolarHBondContact OG1-CD1 3.37Å; A337-L341 PolarHBondContact O-N 2.89Å; L338-L341 WeakPolarHBondContact O-CB 3.28Å; L338-L341 PolarHBondContact O-N 3.01Å; L338-L341 VanDerWaalsContact O-N 3.11Å
342F69.7Low63.4Low127 Ų127110.7 Ų110.756%0.55750%0.499SS*.Hα-helixtrans-79.2-25.4177.7-68.6-68.9000113.5L54 L338 R339L54-F342 HydrophobicContact CD1-CZ 4.5Å; L54-F342 HydrophobicContact CD2-CZ 4.21Å; L338-F342 HydrophobicContact CD2-CE2 4.26Å; L338-F342 WeakPolarHBondContact O-CD2 3.44Å; L338-F342 PolarHBondContact O-N 3.17Å; R339-F342 PolarHBondContact O-N 2.76Å
343S65.8Low63.3Low74 Ų74106.9 Ų106.952%0.51748%0.484SS..Hα-helixtrans-85.3-25.3179.170.50000114.3R339 N340 Q345R339-S343 VanDerWaalsContact O-CB 3.24Å; R339-S343 WeakPolarHBondContact O-CB 3.17Å; R339-S343 PolarHBondContact O-N 3.47Å; R339-S343 PolarHBondContact O-OG 3.24Å; R339-S343 VanDerWaalsContact O-OG 3.09Å; N340-S343 WeakPolarHBondContact CA-OG 3.05Å; N340-S343 PolarHBondContact O-OG 2.03Å; S343-Q345 PolarHBondContact O-N 3.3Å
344R54.9Low63.2Low231 Ų231108.2 Ų108.287%0.87248%0.484SS*.THydrogen-bonded Turntrans-77.52.5173.9-98.4-179.2159.9175-5.7114.5N340N340-R344 WeakPolarHBondContact O-CB 2.99Å; N340-R344 PolarHBondContact O-N 3.4Å; N340-R344 VanDerWaalsContact O-N 3.1Å
345Q50.3Low63.2Low162 Ų162116.9 Ų116.976%0.75752%0.523SS*.THydrogen-bonded Turntrans-97.814.2179-128.6175.7-14.400113.1S343S343-Q345 PolarHBondContact O-N 3.3Å
346R38.6Very low62.7Low304 Ų304122.5 Ų122.5100%1.14754%0.544SS*.  trans-115.30168.8-96.8-171.9-173.6174.12.4111.4

Retrieved 346 of 346 residues in 163.8 ms (Link to these results)