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Natural resistance-associated macrophage protein 1

Macrophage-specific antiporter that fluxes metal ions in either direction against a proton gradient. Localized to late endosomal lysosomal membranes, delivers bivalent cations from the cytosol into these acidic compartments where they may directly affect antimicrobial activity. Involved in iron metabolism and host natural resistance to infection with intracellular parasites. Pathogen resistance involves sequestration of Fe(2+) and Mn(2+), cofactors of both prokaryotic and eukaryotic catalases and superoxide dismutases, not only to protect the macrophage against its own generation of reactive oxygen species, but to deny the cations to the pathogen for synthesis of its protective enzymes.

AlphaFold DB , UniProt , Accession A0A087WNR0, Species MOUSE (Mus musculus, Mouse), Gene Slc11a1, Length 507 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M34.4Very low29.8Very low227 Ų227148.3 Ų148.3100%1.11880%0.799SS**  0108.80-67.7163.317400105.4
2I26.8Very low29.6Very low161 Ų161155.2 Ų155.283%0.82681%0.805SS**  62.5120.867.2-56.2169.9000107.7
3S27.1Very low29.8Very low109 Ų109152.8 Ų152.876%0.76281%0.805SS**  cis-155.717825-109.60000109.1
4D28.6Very low29.3Very low126 Ų126150.1 Ų150.167%0.67481%0.805SS**  cis-174.5177.9-9.1168.639.4000108.1
5K30.6Very low29Very low183 Ų183154.4 Ų154.480%0.79681%0.808SS**  trans109.198.4152.6-58.9-169.9176.1176.10120.4
6S25.9Very low28.8Very low103 Ų103149.6 Ų149.672%0.7281%0.807SS**  trans-79.3-163.9155.260.40000110.8
7P39.5Very low28.8Very low111 Ų111147.1 Ų147.172%0.72180%0.803SS**  cis-135.5-140.6-2.843.5-21.6000110.7
8P38.3Very low28.5Very low96 Ų96147.9 Ų147.962%0.62381%0.805SS**  cis-134160.2-24.333.8-14.1000117.8
9R26.1Very low28.8Very low232 Ų232146.1 Ų146.188%0.87580%0.804SS**  trans62.9127.5142.8-69.2170.3-161.5-148.55.2122.5
10L26Very low28.6Very low174 Ų174144.6 Ų144.691%0.91181%0.805SS**  -142.2172.299.1-132.584.9000111
11S24.2Very low28.6Very low109 Ų109145.4 Ų145.476%0.76281%0.807SS**  trans-113.6152.7-151.3420000117.9
12R28.1Very low28.4Very low231 Ų231140.6 Ų140.687%0.87279%0.792SS**  trans-47.9171.5167.6-71.1-178.7-178.4-174.90.3114.7
13P31.5Very low28.5Very low124 Ų124135.9 Ų135.981%0.80578%0.784SS**  cis-130.7-172.421.932-6.7000114.1
14S23.5Very low28.5Very low115 Ų115136.7 Ų136.780%0.80479%0.786SS**  cis-155.7161.630.2-164.10000114.2
15Y24.9Very low28.5Very low215 Ų215134.5 Ų134.584%0.84379%0.786SS**  trans-92139.3172.1-94.6-103.4000111.1
16G25.4Very low28.3Very low78 Ų78132 Ų13280%0.80479%0.788SS**  trans-130.7109.6161.700000109.1
17S28Very low28.3Very low106 Ų106135.2 Ų135.274%0.74179%0.792SS**  trans-96112.4-176.5-38.70000110.4
18I24.7Very low27.6Very low163 Ų163135.7 Ų135.784%0.83680%0.795SS**  trans-136.8128.2156.3-58-176.4000109.3
19S33.4Very low26.9Very low113 Ų113135.4 Ų135.479%0.7980%0.801SS**  trans-64.9130.817748.10000114
20S25.2Very low26.8Very low116 Ų116130.1 Ų130.181%0.81180%0.796SS**  trans-155.7149.9153.249.60000110.2
21L28.5Very low26.7Very low161 Ų161127.8 Ų127.884%0.84379%0.793SS**PPolyproline II helixtrans-68.3155.4-175.3-79.582.4000112.1G23L21-G23 PolarHBondContact O-N 3.05Å
22P30.9Very low26.8Very low126 Ų126132.6 Ų132.682%0.81880%0.795SS**PPolyproline II helixtrans-61124166.727.3-33.6000109.8
23G27.1Very low26.7Very low63 Ų63129 Ų12965%0.64979%0.788SS**PPolyproline II helixtrans-62.9153.9174.700000111.9L21L21-G23 PolarHBondContact O-N 3.05Å
24P28.7Very low26.4Very low125 Ų125125.6 Ų125.681%0.81277%0.765SS**PPolyproline II helixtrans-64.1148.2-179.628.2-34.8000111.3
25A27.7Very low26.6Very low80 Ų80127.3 Ų127.366%0.66176%0.755SS**PPolyproline II helixtrans-55.5150.2171.400000111.1Q27A25-Q27 PolarHBondContact O-N 2.86Å; A25-Q27 VanDerWaalsContact O-N 3.12Å
26P26.8Very low26.7Very low131 Ų131123.5 Ų123.585%0.85175%0.748SS**PPolyproline II helixtrans-57.9120.7179.123.9-33.6000110.1
27Q25.7Very low26.6Very low170 Ų170123.1 Ų123.179%0.79473%0.733SS**PPolyproline II helixtrans-62.9142.3176.3-67.2-178.3-8.700109.7A25 A29A25-Q27 PolarHBondContact O-N 2.86Å; A25-Q27 VanDerWaalsContact O-N 3.12Å; Q27-A29 PolarHBondContact O-N 3.3Å
28P25.2Very low26.6Very low122 Ų122124.8 Ų124.879%0.79273%0.729SS**PPolyproline II helixtrans-59.5130.316826.8-32.9000108.5
29A24Very low27.1Very low89 Ų89121.4 Ų121.474%0.73671%0.709SS**PPolyproline II helixtrans-57.5135.1179.200000109.8Q27 C31Q27-A29 PolarHBondContact O-N 3.3Å; A29-C31 PolarHBondContact O-N 3.12Å
30P22.9Very low27.3Very low121 Ų121120.2 Ų120.279%0.78669%0.692SS**PPolyproline II helixtrans-59.7134.6177.125-33.1000109.2R32P30-R32 PolarHBondContact O-N 3.27Å
31C24.9Very low27.9Very low126 Ų126118.6 Ų118.685%0.85168%0.679SS**PPolyproline II helixtrans-58.8116169.5-75.70000107.6A29 E33A29-C31 PolarHBondContact O-N 3.12Å; C31-E33 PolarHBondContact O-N 3.13Å
32R25.4Very low28.7Very low209 Ų209113.6 Ų113.679%0.78965%0.653SS**  trans-65.8106.4-179.5-162178.7-163.4170.34.1107.3P30 T34P30-R32 PolarHBondContact O-N 3.27Å; R32-T34 PolarHBondContact O-N 3.22Å
33E27.2Very low29.5Very low157 Ų157108.3 Ų108.373%0.73462%0.619SS**  trans-54.4130.8177.4-67.4-176.7146.400109.1C31 Y35C31-E33 PolarHBondContact O-N 3.13Å; E33-Y35 PolarHBondContact O-N 3.4Å
34T24Very low30.6Very low52 Ų52106 Ų10632%0.31959%0.592SS.*  trans-58.7133.5175.4-46.20000108.2R32 L36 S37R32-T34 PolarHBondContact O-N 3.22Å; T34-L36 HydrophobicContact CG2-CB 4.4Å; T34-L36 HydrophobicContact CG2-CD1 4.38Å; T34-L36 PolarHBondContact O-N 3.39Å; T34-S37 WeakPolarHBondContact O-CB 3.25Å; T34-S37 PolarHBondContact O-N 3.19Å; T34-S37 PolarHBondContact O-OG 3.34Å
35Y27.7Very low31.6Very low150 Ų150100.9 Ų100.959%0.58856%0.56SS**G310 helixtrans-57-10.3-177.2-68.4-83.8000115.3E33 S37E33-Y35 PolarHBondContact O-N 3.4Å; Y35-S37 PolarHBondContact O-N 3.48Å
36L26.8Very low32.8Very low135 Ų13599.6 Ų99.671%0.70754%0.543SS*.G310 helixtrans-69-11.7167.6-82.8155.1000114.2T34T34-L36 HydrophobicContact CG2-CB 4.4Å; T34-L36 HydrophobicContact CG2-CD1 4.38Å; T34-L36 PolarHBondContact O-N 3.39Å
37S24.4Very low34.7Very low70 Ų7095 Ų9549%0.4951%0.51SS..G310 helixtrans-97.3-8.2-179.8-50.50000113.7T34 Y35 K39T34-S37 WeakPolarHBondContact O-CB 3.25Å; T34-S37 PolarHBondContact O-N 3.19Å; T34-S37 PolarHBondContact O-OG 3.34Å; Y35-S37 PolarHBondContact O-N 3.48Å; S37-K39 PolarHBondContact O-N 3.37Å
38E28Very low36.9Very low141 Ų14187.5 Ų87.566%0.65948%0.475SS*.SBendtrans-70.5105.2-179.8-166.7164.1-179.100108.6I40E38-I40 PolarHBondContact O-N 2.79Å
39K34.8Very low39.6Very low93 Ų9381.7 Ų81.740%0.40444%0.437SS..  trans-56.4106.1-174.8-72.3-179.3-178.2174.20109.8S37 P41 D293 N295S37-K39 PolarHBondContact O-N 3.37Å; K39-P41 VanDerWaalsContact O-CD 3.3Å; K39-P41 WeakPolarHBondContact O-CD 3.49Å; K39-D293 IonicContact NZ-OD2 3.16Å; K39-D293 PolarHBondContact NZ-OD2 3.25Å; K39-N295 HydrophobicContact CD-CB 3.72Å; K39-N295 PolarHBondContact NZ-ND2 3.29Å
40I38.3Very low42.6Very low87 Ų8781.1 Ų81.145%0.44642%0.416SS..  trans-59.2118.5-173.6-59.3172.4000109.3E38 I42 P195E38-I40 PolarHBondContact O-N 2.79Å; I40-I42 PolarHBondContact O-N 3.08Å; I40-P195 HydrophobicContact CD1-CB 4.14Å; I40-P195 HydrophobicContact CG1-CB 4.03Å; I40-P195 HydrophobicContact CG2-CB 4.09Å
41P36.8Very low45.6Very low83 Ų8375.8 Ų75.854%0.53938%0.382SS..  trans-64.1125.9169.5-17.531.7000108.4K39 P43K39-P41 VanDerWaalsContact O-CD 3.3Å; K39-P41 WeakPolarHBondContact O-CD 3.49Å; P41-P43 WeakPolarHBondContact O-CD 3.26Å; P41-P43 VanDerWaalsContact O-N 3.16Å
42I45.2Very low48.7Very low55 Ų5570.2 Ų70.228%0.28234%0.343SS..  trans-65.1114.8-176.6-62.2166000109I40 F266 V299I40-I42 PolarHBondContact O-N 3.08Å; I42-F266 HydrophobicContact CD1-CB 3.94Å; I42-V299 HydrophobicContact CD1-CG2 3.6Å; I42-V299 HydrophobicContact CG1-CG2 4.14Å
43P48.9Very low51.8Low16 Ų1662.5 Ų62.510%0.10432%0.317CS..  trans-61.7143.9163.628.6-33.8000107.9P41 A45 Q47 L48 E196P41-P43 WeakPolarHBondContact O-CD 3.26Å; P41-P43 VanDerWaalsContact O-N 3.16Å; P43-A45 PolarHBondContact O-N 3.08Å; P43-Q47 HydrophobicContact CB-CB 4.35Å; P43-L48 HydrophobicContact CG-CD1 4.16Å; P43-E196 HydrophobicContact CB-CG 4.41Å; P43-E196 HydrophobicContact CG-CG 4.22Å
44S50Low54.8Low14 Ų1462.7 Ų62.710%0.09831%0.311CS..  trans-54137.1-179.572.70000109.4D46 Q47S44-D46 WeakPolarHBondContact CB-OD2 3.48Å; S44-D46 PolarHBondContact O-N 3.34Å; S44-D46 PolarHBondContact OG-OD2 2.67Å; S44-Q47 VanDerWaalsContact N-NE2 3.16Å; S44-Q47 WeakPolarHBondContact O-CB 3.44Å; S44-Q47 WeakPolarHBondContact O-CG 3.25Å; S44-Q47 PolarHBondContact O-N 2.83Å; S44-Q47 WeakPolarHBondContact OG-CG 3.35Å; S44-Q47 PolarHBondContact OG-NE2 3.48Å
45A49.5Very low57.9Low17 Ų1760.3 Ų60.314%0.1430%0.297CS..G310 helixtrans-56.8-26.1-17000000112.9P43 Q47 L49P43-A45 PolarHBondContact O-N 3.08Å; A45-Q47 PolarHBondContact O-N 3.45Å; A45-Q47 VanDerWaalsContact O-N 3.17Å; A45-L49 WeakPolarHBondContact O-CG 3.32Å
46D53.3Low61Low54 Ų5453.8 Ų53.829%0.28927%0.273SS..G310 helixtrans-42.5-37.8164.8-28.7-44.2000114.3S44 L48 G183S44-D46 WeakPolarHBondContact CB-OD2 3.48Å; S44-D46 PolarHBondContact O-N 3.34Å; S44-D46 PolarHBondContact OG-OD2 2.67Å; D46-L48 PolarHBondContact O-N 3.07Å; D46-G183 CarbonylContact O-C 3.51Å; D46-G183 WeakPolarHBondContact O-CA 3.29Å
47Q65.7Low64.2Low35 Ų3550.1 Ų50.116%0.16426%0.256CS..G310 helixtrans-79.6-19.7-165.3-63.3177.237.700114.6P43 S44 A45 W50P43-Q47 HydrophobicContact CB-CB 4.35Å; S44-Q47 VanDerWaalsContact N-NE2 3.16Å; S44-Q47 WeakPolarHBondContact O-CB 3.44Å; S44-Q47 WeakPolarHBondContact O-CG 3.25Å; S44-Q47 PolarHBondContact O-N 2.83Å; S44-Q47 WeakPolarHBondContact OG-CG 3.35Å; S44-Q47 PolarHBondContact OG-NE2 3.48Å; A45-Q47 PolarHBondContact O-N 3.45Å; A45-Q47 VanDerWaalsContact O-N 3.17Å; Q47-W50 PolarHBondContact O-NE1 2.96Å
48L72.6Confident67.3Low11 Ų1147.8 Ų47.86%0.05824%0.238CC..THydrogen-bonded Turntrans-113.8-2.3-178.4-66.3173000113.2P43 D46 W50 V51 L52 Q199 A200 I203P43-L48 HydrophobicContact CG-CD1 4.16Å; D46-L48 PolarHBondContact O-N 3.07Å; L48-W50 VanDerWaalsContact C-N 3.33Å; L48-W50 PolarHBondContact O-N 3.43Å; L48-V51 HydrophobicContact CD2-CG2 3.99Å; L48-V51 WeakPolarHBondContact O-CA 3.36Å; L48-V51 VanDerWaalsContact O-CB 3.29Å; L48-V51 WeakPolarHBondContact O-CB 3.23Å; L48-V51 PolarHBondContact O-N 2.76Å; L48-L52 PolarHBondContact O-N 3.43Å; L48-L52 VanDerWaalsContact O-N 3.14Å; L48-Q199 HydrophobicContact CD1-CB 4.33Å; L48-Q199 VanDerWaalsContact CD1-CD 3.5Å; L48-Q199 HydrophobicContact CD1-CG 3.9Å; L48-A200 HydrophobicContact CD2-CB 4.01Å; L48-I203 HydrophobicContact CB-CD1 3.97Å; L48-I203 HydrophobicContact CD1-CD1 4.02Å; L48-I203 HydrophobicContact CG-CD1 4.47Å
49L82Confident70.4Confident0 Ų041.2 Ų41.20%021%0.208CC..Hα-helixtrans-64-33178.3-85163.6000113.4A45 V51 L52 L53 L180 L184 L256 M259A45-L49 WeakPolarHBondContact O-CG 3.32Å; L49-V51 VanDerWaalsContact C-N 3.3Å; L49-V51 PolarHBondContact O-N 3.15Å; L49-L52 HydrophobicContact CD2-CD2 4.25Å; L49-L52 WeakPolarHBondContact O-CB 3.37Å; L49-L52 PolarHBondContact O-N 3.29Å; L49-L53 PolarHBondContact O-N 3.15Å; L49-L53 VanDerWaalsContact O-N 3.12Å; L49-L180 HydrophobicContact CD1-CD2 3.69Å; L49-L184 HydrophobicContact CB-CD1 4.45Å; L49-L256 HydrophobicContact CD2-CD1 3.47Å; L49-L256 VanDerWaalsContact CD2-CD1 3.47Å; L49-M259 HydrophobicContact CD2-CB 4.29Å
50W85.9Confident73.2Confident77 Ų7738.8 Ų38.829%0.29220%0.199SC..Hα-helixtrans-65-34.2170.971.6-87000111.8Q47 L48 L53 W54 G183 P187Q47-W50 PolarHBondContact O-NE1 2.96Å; L48-W50 VanDerWaalsContact C-N 3.33Å; L48-W50 PolarHBondContact O-N 3.43Å; W50-L53 PolarHBondContact O-N 3.06Å; W50-W54 AromaticContact CE3-CD1 3.97Å; W50-W54 VanDerWaalsContact O-CD1 3.24Å; W50-W54 PolarHBondContact O-N 3.04Å; W50-G183 PolarHBondContact N-O 2.75Å; W50-P187 HydrophobicContact CD2-CB 3.82Å; W50-P187 HydrophobicContact CE3-CB 4.11Å; W50-P187 HydrophobicContact CG-CB 4.12Å
51V87.3Confident75.8Confident10 Ų1037.3 Ų37.36%0.06119%0.192CC..Hα-helixtrans-64.5-44.7175-173.50000109.6L48 L49 L53 W54 A55 A200 I203 V204L48-V51 HydrophobicContact CD2-CG2 3.99Å; L48-V51 WeakPolarHBondContact O-CA 3.36Å; L48-V51 VanDerWaalsContact O-CB 3.29Å; L48-V51 WeakPolarHBondContact O-CB 3.23Å; L48-V51 PolarHBondContact O-N 2.76Å; L49-V51 VanDerWaalsContact C-N 3.3Å; L49-V51 PolarHBondContact O-N 3.15Å; V51-L53 VanDerWaalsContact C-N 3.34Å; V51-L53 PolarHBondContact O-N 2.94Å; V51-W54 PolarHBondContact O-N 3.43Å; V51-A55 WeakPolarHBondContact O-CB 3.17Å; V51-A55 PolarHBondContact O-N 2.65Å; V51-A200 HydrophobicContact CG1-CB 4.24Å; V51-A200 HydrophobicContact CG2-CB 4.25Å; V51-I203 HydrophobicContact CG1-CB 4.48Å; V51-I203 HydrophobicContact CG1-CG2 4.16Å; V51-V204 HydrophobicContact CG1-CG2 4.04Å
52L88.5Confident78.5Confident9 Ų933.4 Ų33.45%0.04717%0.167CC..Hα-helixtrans-55.3-47.2175.3-16985.9000111.9L48 L49 T56 I203 I207 F252 N255 L256 M259L48-L52 PolarHBondContact O-N 3.43Å; L48-L52 VanDerWaalsContact O-N 3.14Å; L49-L52 HydrophobicContact CD2-CD2 4.25Å; L49-L52 WeakPolarHBondContact O-CB 3.37Å; L49-L52 PolarHBondContact O-N 3.29Å; L52-T56 WeakPolarHBondContact O-CB 3.07Å; L52-T56 PolarHBondContact O-N 3.24Å; L52-T56 PolarHBondContact O-OG1 3.49Å; L52-I203 HydrophobicContact CD1-CG2 4.31Å; L52-I207 HydrophobicContact CD1-CD1 3.65Å; L52-I207 HydrophobicContact CG-CD1 4.17Å; L52-F252 HydrophobicContact CD2-CD2 4.24Å; L52-F252 HydrophobicContact CD2-CE2 4.13Å; L52-F252 HydrophobicContact CG-CD2 4.5Å; L52-N255 HydrophobicContact CD1-CB 3.86Å; L52-N255 HydrophobicContact CD2-CB 4.05Å; L52-N255 HydrophobicContact CG-CB 4.39Å; L52-L256 HydrophobicContact CD2-CB 4.35Å; L52-M259 HydrophobicContact CD1-CG 4.41Å
53L90.8Very high80.7Confident47 Ų4731.8 Ų31.825%0.24616%0.158CC..Hα-helixtrans-62.9-53.9177.8-18069.2000111.4L49 W50 V51 A55 T56 V57 L184 F252L49-L53 PolarHBondContact O-N 3.15Å; L49-L53 VanDerWaalsContact O-N 3.12Å; W50-L53 PolarHBondContact O-N 3.06Å; V51-L53 VanDerWaalsContact C-N 3.34Å; V51-L53 PolarHBondContact O-N 2.94Å; L53-A55 PolarHBondContact O-N 3.46Å; L53-T56 WeakPolarHBondContact O-CB 3.45Å; L53-T56 PolarHBondContact O-N 3.01Å; L53-V57 WeakPolarHBondContact O-CG2 3.08Å; L53-V57 PolarHBondContact O-N 3.45Å; L53-L184 HydrophobicContact CB-CD1 4.27Å; L53-L184 HydrophobicContact CB-CG 4.36Å; L53-L184 HydrophobicContact CD2-CD2 4.22Å; L53-L184 HydrophobicContact CD2-CG 4.09Å; L53-F252 HydrophobicContact CB-CE2 4.04Å; L53-F252 HydrophobicContact CD1-CD2 4.45Å; L53-F252 HydrophobicContact CD1-CE1 4.41Å; L53-F252 HydrophobicContact CD1-CE2 3.73Å; L53-F252 HydrophobicContact CD1-CZ 3.71Å
54W89.9Confident82.9Confident160 Ų16035.9 Ų35.961%0.60617%0.171SC*.Hα-helixtrans-68.5-33-176.2-78.8105.6000113.1W50 V51 V57 L58W50-W54 AromaticContact CE3-CD1 3.97Å; W50-W54 VanDerWaalsContact O-CD1 3.24Å; W50-W54 PolarHBondContact O-N 3.04Å; V51-W54 PolarHBondContact O-N 3.43Å; W54-V57 HydrophobicContact CE3-CB 4.48Å; W54-V57 HydrophobicContact CE3-CG1 4.36Å; W54-V57 HydrophobicContact CZ3-CG1 4.41Å; W54-V57 PolarHBondContact O-N 3.46Å; W54-L58 VanDerWaalsContact O-CB 3.24Å; W54-L58 WeakPolarHBondContact O-CB 3.39Å; W54-L58 PolarHBondContact O-N 2.84Å
55A90.4Very high84.9Confident3 Ų335.6 Ų35.63%0.02517%0.168CC..Hα-helixtrans-66.5-38171.700000111.7V51 L53 L58 G59 V204 I207 I208V51-A55 WeakPolarHBondContact O-CB 3.17Å; V51-A55 PolarHBondContact O-N 2.65Å; L53-A55 PolarHBondContact O-N 3.46Å; A55-L58 PolarHBondContact O-N 3.08Å; A55-G59 PolarHBondContact O-N 2.96Å; A55-V204 HydrophobicContact CB-CG2 4.08Å; A55-I207 HydrophobicContact CB-CB 4.33Å; A55-I207 HydrophobicContact CB-CD1 3.66Å; A55-I207 HydrophobicContact CB-CG2 4.45Å; A55-I208 WeakPolarHBondContact O-CD1 3.31Å
56T92.5Very high87Confident13 Ų1334.8 Ų34.88%0.0816%0.162CC..Hα-helixtrans-65.7-45.8173.2-56.80000111.2L52 L53 L58 G59 L60 L248 F252L52-T56 WeakPolarHBondContact O-CB 3.07Å; L52-T56 PolarHBondContact O-N 3.24Å; L52-T56 PolarHBondContact O-OG1 3.49Å; L53-T56 WeakPolarHBondContact O-CB 3.45Å; L53-T56 PolarHBondContact O-N 3.01Å; T56-L58 VanDerWaalsContact C-N 3.3Å; T56-L58 PolarHBondContact O-N 2.9Å; T56-G59 PolarHBondContact O-N 3.29Å; T56-L60 PolarHBondContact O-N 3.19Å; T56-L248 HydrophobicContact CG2-CB 4.35Å; T56-F252 HydrophobicContact CG2-CB 3.85Å; T56-F252 HydrophobicContact CG2-CD2 4.45Å; T56-F252 HydrophobicContact CG2-CG 4.45Å
57V92.7Very high88.9Confident58 Ų5832.7 Ų32.735%0.35215%0.152SC..Hα-helixtrans-59.6-42.3175.5170.70000110.8L53 W54 L60 L61L53-V57 WeakPolarHBondContact O-CG2 3.08Å; L53-V57 PolarHBondContact O-N 3.45Å; W54-V57 HydrophobicContact CE3-CB 4.48Å; W54-V57 HydrophobicContact CE3-CG1 4.36Å; W54-V57 HydrophobicContact CZ3-CG1 4.41Å; W54-V57 PolarHBondContact O-N 3.46Å; V57-L60 PolarHBondContact O-N 3.28Å; V57-L61 WeakPolarHBondContact O-CG 3.34Å; V57-L61 PolarHBondContact O-N 3.24Å
58L91.1Very high90.3Very high21 Ų2132.8 Ų32.811%0.1115%0.151CC..Hα-helixtrans-65-42175.6-178.957.2000111.9W54 A55 T56 L60 L61 C62 I208 I428 L431W54-L58 VanDerWaalsContact O-CB 3.24Å; W54-L58 WeakPolarHBondContact O-CB 3.39Å; W54-L58 PolarHBondContact O-N 2.84Å; A55-L58 PolarHBondContact O-N 3.08Å; T56-L58 VanDerWaalsContact C-N 3.3Å; T56-L58 PolarHBondContact O-N 2.9Å; L58-L60 PolarHBondContact O-N 3.35Å; L58-L61 PolarHBondContact O-N 2.97Å; L58-C62 PolarHBondContact O-N 2.78Å; L58-C62 PolarHBondContact O-SG 3.1Å; L58-I208 HydrophobicContact CB-CD1 3.83Å; L58-I208 HydrophobicContact CD2-CD1 3.62Å; L58-I208 HydrophobicContact CG-CD1 3.56Å; L58-I428 HydrophobicContact CD1-CB 4.21Å; L58-I428 HydrophobicContact CD1-CD1 3.44Å; L58-I428 VanDerWaalsContact CD1-CD1 3.44Å; L58-I428 HydrophobicContact CD1-CG1 3.44Å; L58-I428 VanDerWaalsContact CD1-CG1 3.44Å; L58-I428 HydrophobicContact CD1-CG2 3.77Å; L58-L431 HydrophobicContact CD2-CD2 4.4Å
59G92.2Very high91.3Very high3 Ų332.2 Ų32.23%0.03115%0.148CC..Hα-helixtrans-56.2-47.8172.100000112.1A55 T56 L61 C62 Q63A55-G59 PolarHBondContact O-N 2.96Å; T56-G59 PolarHBondContact O-N 3.29Å; G59-L61 VanDerWaalsContact C-N 3.33Å; G59-L61 PolarHBondContact O-N 3.48Å; G59-C62 PolarHBondContact O-N 2.87Å; G59-Q63 WeakPolarHBondContact O-CB 3.22Å; G59-Q63 WeakPolarHBondContact O-CG 3.48Å; G59-Q63 PolarHBondContact O-N 2.97Å
60L94Very high91.8Very high41 Ų4132.2 Ų32.222%0.21515%0.148CC..Hα-helixtrans-60.1-41.217618061000112.1T56 V57 L58 R64 A244 T245 L248T56-L60 PolarHBondContact O-N 3.19Å; V57-L60 PolarHBondContact O-N 3.28Å; L58-L60 PolarHBondContact O-N 3.35Å; L60-R64 WeakPolarHBondContact O-CB 3.49Å; L60-R64 PolarHBondContact O-N 3.01Å; L60-A244 HydrophobicContact CD1-CB 4.12Å; L60-T245 HydrophobicContact CD2-CG2 4.36Å; L60-L248 HydrophobicContact CB-CD1 3.56Å; L60-L248 HydrophobicContact CD1-CD1 3.93Å; L60-L248 HydrophobicContact CG-CD1 4.33Å
61L93Very high92.1Very high56 Ų5628.7 Ų28.729%0.29314%0.135SC..Hα-helixtrans-63.4-45.1175.5-69.6172.9000111.7V57 L58 G59 L65 I424 I428V57-L61 WeakPolarHBondContact O-CG 3.34Å; V57-L61 PolarHBondContact O-N 3.24Å; L58-L61 PolarHBondContact O-N 2.97Å; G59-L61 VanDerWaalsContact C-N 3.33Å; G59-L61 PolarHBondContact O-N 3.48Å; L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.36Å; L61-L65 PolarHBondContact O-N 3.22Å; L61-L65 VanDerWaalsContact O-N 3.13Å; L61-I424 HydrophobicContact CD1-CG2 4.16Å; L61-I428 HydrophobicContact CD1-CD1 4.4Å
62C92.3Very high92.3Very high1 Ų129.3 Ų29.31%0.00714%0.139CC..Hα-helixtrans-66.4-46.1178-70.70000112.4L58 G59 L65 A66 I213L58-C62 PolarHBondContact O-N 2.78Å; L58-C62 PolarHBondContact O-SG 3.1Å; G59-C62 PolarHBondContact O-N 2.87Å; C62-L65 PolarHBondContact O-N 3.35Å; C62-A66 PolarHBondContact O-N 3.07Å; C62-I213 HydrophobicContact CB-CD1 4.16Å
63Q93.2Very high92.4Very high22 Ų2230.6 Ų30.610%0.10315%0.147CC..Hα-helixtrans-62.9-41.5176.4-72.6-176.73.700112.1G59 L65 A66 A67 L248G59-Q63 WeakPolarHBondContact O-CB 3.22Å; G59-Q63 WeakPolarHBondContact O-CG 3.48Å; G59-Q63 PolarHBondContact O-N 2.97Å; Q63-L65 VanDerWaalsContact C-N 3.3Å; Q63-L65 PolarHBondContact O-N 3.15Å; Q63-A66 WeakPolarHBondContact O-CB 3.4Å; Q63-A66 PolarHBondContact O-N 3.16Å; Q63-A67 WeakPolarHBondContact O-CB 3.44Å; Q63-A67 PolarHBondContact O-N 2.86Å; Q63-L248 VanDerWaalsContact OE1-CD1 3.29Å
64R93.4Very high92.3Very high102 Ų10229.2 Ų29.239%0.38515%0.145SC..Hα-helixtrans-58.5-41.5173.8177.5-172.8-179.9-135.7-1.3111.9L60 R68 L241L60-R64 WeakPolarHBondContact O-CB 3.49Å; L60-R64 PolarHBondContact O-N 3.01Å; R64-R68 VanDerWaalsContact O-CB 3.23Å; R64-R68 WeakPolarHBondContact O-CB 3.49Å; R64-R68 PolarHBondContact O-N 3.41Å; R64-L241 HydrophobicContact CB-CD1 4.31Å; R64-L241 HydrophobicContact CG-CD1 3.95Å
65L93.3Very high92.4Very high7 Ų725.3 Ų25.34%0.03713%0.132CC..Hα-helixtrans-66.6-42.3176.5-71.2175.3000111.2L61 C62 Q63 R68 L69 I402 L403 T406 T425L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.36Å; L61-L65 PolarHBondContact O-N 3.22Å; L61-L65 VanDerWaalsContact O-N 3.13Å; C62-L65 PolarHBondContact O-N 3.35Å; Q63-L65 VanDerWaalsContact C-N 3.3Å; Q63-L65 PolarHBondContact O-N 3.15Å; L65-R68 PolarHBondContact O-N 3.47Å; L65-L69 PolarHBondContact O-N 3.21Å; L65-I402 HydrophobicContact CB-CG1 3.91Å; L65-L403 HydrophobicContact CD1-CD2 3.77Å; L65-T406 HydrophobicContact CB-CG2 4.03Å; L65-T406 HydrophobicContact CD2-CG2 4.18Å; L65-T406 WeakPolarHBondContact O-CG2 3.29Å; L65-T425 HydrophobicContact CD1-CG2 3.75Å
66A94.1Very high92.5Very high0 Ų025.4 Ų25.40%013%0.132CC..Hα-helixtrans-59.8-51.2175.200000113.1C62 Q63 R68 L69 G70 I213 S217 I402C62-A66 PolarHBondContact O-N 3.07Å; Q63-A66 WeakPolarHBondContact O-CB 3.4Å; Q63-A66 PolarHBondContact O-N 3.16Å; A66-R68 PolarHBondContact O-N 3.2Å; A66-L69 PolarHBondContact O-N 3.07Å; A66-G70 PolarHBondContact O-N 3.13Å; A66-I213 HydrophobicContact CB-CG2 3.93Å; A66-I213 VanDerWaalsContact CB-O 3.31Å; A66-I213 WeakPolarHBondContact CB-O 3.27Å; A66-S217 WeakPolarHBondContact O-CA 3.45Å; A66-S217 WeakPolarHBondContact O-CB 3.44Å; A66-I402 HydrophobicContact CB-CD1 4.4Å; A66-I402 HydrophobicContact CB-CG1 4.38Å
67A93.1Very high92.5Very high11 Ų1124.8 Ų24.89%0.09113%0.128CC..Hα-helixtrans-57.8-47.4175.900000111.2Q63 L69 G70 V71 V220 F240Q63-A67 WeakPolarHBondContact O-CB 3.44Å; Q63-A67 PolarHBondContact O-N 2.86Å; A67-L69 VanDerWaalsContact C-N 3.35Å; A67-L69 PolarHBondContact O-N 3.25Å; A67-G70 PolarHBondContact O-N 3.1Å; A67-V71 VanDerWaalsContact O-CG2 3.29Å; A67-V71 WeakPolarHBondContact O-CG2 3.47Å; A67-V71 PolarHBondContact O-N 3.25Å; A67-V220 HydrophobicContact CB-CG1 3.81Å; A67-F240 HydrophobicContact CB-CB 4.41Å
68R93.4Very high92.5Very high36 Ų3622 Ų2214%0.13611%0.111CC..Hα-helixtrans-62.4-37.3179.1-177.1-177.3166.4-162.71.4113.2R64 L65 A66 V72 N237 M412 F415 A416 N417R64-R68 VanDerWaalsContact O-CB 3.23Å; R64-R68 WeakPolarHBondContact O-CB 3.49Å; R64-R68 PolarHBondContact O-N 3.41Å; L65-R68 PolarHBondContact O-N 3.47Å; A66-R68 PolarHBondContact O-N 3.2Å; R68-V72 HydrophobicContact CG-CG2 4.27Å; R68-V72 WeakPolarHBondContact O-CB 3.3Å; R68-V72 VanDerWaalsContact O-CG2 3.24Å; R68-V72 WeakPolarHBondContact O-CG2 3.14Å; R68-V72 PolarHBondContact O-N 3.03Å; R68-N237 VanDerWaalsContact CA-OD1 3.29Å; R68-N237 WeakPolarHBondContact CA-OD1 3.46Å; R68-N237 WeakPolarHBondContact CB-OD1 3.47Å; R68-N237 WeakPolarHBondContact CG-OD1 3.43Å; R68-M412 HydrophobicContact CB-CE 4.45Å; R68-M412 HydrophobicContact CG-CE 3.71Å; R68-F415 VanDerWaalsContact CZ-O 3.31Å; R68-F415 PolarHBondContact NE-O 2.96Å; R68-F415 PolarHBondContact NH2-O 2.75Å; R68-A416 PolarHBondContact NH2-O 3.35Å; R68-N417 PolarHBondContact NH1-OD1 3.41Å
69L93.8Very high92.6Very high0 Ų024 Ų240%012%0.12CC..Hα-helixtrans-60.2-49.1173.4-178.771.3000110.6L65 A66 A67 T73 L77 V80 I402 F405 T406 V411 M412L65-L69 PolarHBondContact O-N 3.21Å; A66-L69 PolarHBondContact O-N 3.07Å; A67-L69 VanDerWaalsContact C-N 3.35Å; A67-L69 PolarHBondContact O-N 3.25Å; L69-T73 HydrophobicContact CD1-CG2 3.79Å; L69-T73 HydrophobicContact CG-CG2 4.45Å; L69-T73 WeakPolarHBondContact O-CB 3.4Å; L69-T73 WeakPolarHBondContact O-CG2 3.38Å; L69-T73 PolarHBondContact O-N 2.98Å; L69-T73 PolarHBondContact O-OG1 2.96Å; L69-L77 HydrophobicContact CD2-CB 4.21Å; L69-L77 HydrophobicContact CD2-CD1 3.58Å; L69-L77 HydrophobicContact CD2-CG 4.49Å; L69-V80 HydrophobicContact CD2-CG2 4.38Å; L69-I402 HydrophobicContact CB-CD1 3.71Å; L69-I402 HydrophobicContact CD2-CD1 3.55Å; L69-I402 HydrophobicContact CG-CD1 4.21Å; L69-F405 HydrophobicContact CD1-CB 4.05Å; L69-F405 HydrophobicContact CD2-CB 4.45Å; L69-T406 HydrophobicContact CB-CG2 4.2Å; L69-V411 HydrophobicContact CD1-CG1 3.73Å; L69-M412 HydrophobicContact CD1-SD 3.69Å
70G92.4Very high92.6Very high0 Ų024 Ų240%012%0.12CC..Hα-helixtrans-65.7-39.4-179.800000113.8A66 A67 G74 K75A66-G70 PolarHBondContact O-N 3.13Å; A67-G70 PolarHBondContact O-N 3.1Å; G70-G74 WeakPolarHBondContact O-CA 3.23Å; G70-G74 PolarHBondContact O-N 3.23Å; G70-K75 WeakPolarHBondContact CA-O 3.4Å
71V92.7Very high92.5Very high2 Ų222.1 Ų22.11%0.01211%0.11CC..Hα-helixtrans-63.6-51.5176.1174.10000111A67 V220 R227 V233 A236 F240A67-V71 VanDerWaalsContact O-CG2 3.29Å; A67-V71 WeakPolarHBondContact O-CG2 3.47Å; A67-V71 PolarHBondContact O-N 3.25Å; V71-V220 HydrophobicContact CG2-CB 3.88Å; V71-V220 HydrophobicContact CG2-CG1 4.08Å; V71-V220 HydrophobicContact CG2-CG2 4.19Å; V71-R227 PolarHBondContact O-NE 3.16Å; V71-V233 HydrophobicContact CG1-CG1 4.24Å; V71-A236 HydrophobicContact CG1-CB 4.01Å; V71-F240 HydrophobicContact CG2-CD2 3.47Å; V71-F240 VanDerWaalsContact CG2-CD2 3.47Å; V71-F240 HydrophobicContact CG2-CE2 3.57Å
72V91.7Very high92.3Very high24 Ų2420.8 Ų20.815%0.14510%0.102CC..Hα-helixtrans-70.3-46.3-174.5173.40000111.9R68 V233 M412 F415R68-V72 HydrophobicContact CG-CG2 4.27Å; R68-V72 WeakPolarHBondContact O-CB 3.3Å; R68-V72 VanDerWaalsContact O-CG2 3.24Å; R68-V72 WeakPolarHBondContact O-CG2 3.14Å; R68-V72 PolarHBondContact O-N 3.03Å; V72-V233 HydrophobicContact CG2-CG1 4.06Å; V72-M412 HydrophobicContact CB-SD 4.5Å; V72-F415 HydrophobicContact CG1-CB 4.31Å; V72-F415 HydrophobicContact CG1-CD2 4.22Å; V72-F415 HydrophobicContact CG2-CB 3.84Å; V72-F415 HydrophobicContact CG2-CD2 4.11Å; V72-F415 HydrophobicContact CG2-CG 4.01Å
73T89.8Confident92.1Very high35 Ų3522.6 Ų22.622%0.21511%0.111CC..Hα-helixtrans-85.9-21.1-175.166.90000113.6L69 K75 V411L69-T73 HydrophobicContact CD1-CG2 3.79Å; L69-T73 HydrophobicContact CG-CG2 4.45Å; L69-T73 WeakPolarHBondContact O-CB 3.4Å; L69-T73 WeakPolarHBondContact O-CG2 3.38Å; L69-T73 PolarHBondContact O-N 2.98Å; L69-T73 PolarHBondContact O-OG1 2.96Å; T73-K75 PolarHBondContact O-N 2.9Å; T73-K75 PolarHBondContact OG1-N 3.01Å; T73-K75 PolarHBondContact OG1-O 3.37Å; T73-V411 HydrophobicContact CG2-CG1 3.57Å
74G89.3Confident91.8Very high19 Ų1923 Ų2320%0.19611%0.112CC..SBendtrans692.7-167.600000114.5G70G70-G74 WeakPolarHBondContact O-CA 3.23Å; G70-G74 PolarHBondContact O-N 3.23Å
75K91.1Very high91.6Very high78 Ų7818.4 Ų18.434%0.33910%0.095SC..SBendtrans-116143.6-178-65.4-177.6-179.2179.60110G70 T73 E79 V80 L83G70-K75 WeakPolarHBondContact CA-O 3.4Å; T73-K75 PolarHBondContact O-N 2.9Å; T73-K75 PolarHBondContact OG1-N 3.01Å; T73-K75 PolarHBondContact OG1-O 3.37Å; K75-E79 WeakPolarHBondContact CA-OE2 3.29Å; K75-E79 HydrophobicContact CB-CB 4.06Å; K75-E79 VanDerWaalsContact CB-OE2 3.31Å; K75-E79 WeakPolarHBondContact CB-OE2 3.49Å; K75-V80 HydrophobicContact CB-CG2 3.94Å; K75-L83 HydrophobicContact CD-CD1 3.78Å
76D92.8Very high91.3Very high4 Ų421.3 Ų21.32%0.02111%0.114CC..  trans-76.7166.3174.459.170.3000111.2G78 E79 V80 A218 K221D76-G78 PolarHBondContact O-N 3.19Å; D76-G78 WeakPolarHBondContact OD1-CA 3.39Å; D76-G78 PolarHBondContact OD1-N 3.23Å; D76-E79 PolarHBondContact N-OE2 2.87Å; D76-E79 PolarHBondContact O-N 3.43Å; D76-E79 PolarHBondContact OD1-N 2.97Å; D76-E79 WeakPolarHBondContact OD2-CG 3.44Å; D76-V80 WeakPolarHBondContact O-CG2 3.41Å; D76-V80 PolarHBondContact O-N 3.44Å; D76-A218 HydrophobicContact CB-CB 3.81Å; D76-K221 HydrophobicContact CB-CD 4.16Å; D76-K221 IonicContact OD2-NZ 3.8Å; D76-K221 PolarHBondContact OD2-NZ 2.84Å
77L93.4Very high91Very high0 Ų028.8 Ų28.80%015%0.146CC..Hα-helixtrans-60.6-29.9-178.1-177.961.9000112.2L69 C81 I213 Y214 S217 P401 I402 F405L69-L77 HydrophobicContact CD2-CB 4.21Å; L69-L77 HydrophobicContact CD2-CD1 3.58Å; L69-L77 HydrophobicContact CD2-CG 4.49Å; L77-C81 WeakPolarHBondContact O-CB 3.49Å; L77-C81 PolarHBondContact O-N 3.44Å; L77-C81 PolarHBondContact O-SG 3.27Å; L77-I213 HydrophobicContact CD2-CG2 3.98Å; L77-Y214 HydrophobicContact CB-CD1 3.76Å; L77-Y214 HydrophobicContact CB-CE1 3.88Å; L77-Y214 HydrophobicContact CD2-CD1 3.9Å; L77-Y214 HydrophobicContact CD2-CD2 4.41Å; L77-Y214 HydrophobicContact CD2-CE1 3.59Å; L77-Y214 HydrophobicContact CD2-CE2 4.14Å; L77-Y214 HydrophobicContact CD2-CG 4.29Å; L77-Y214 HydrophobicContact CG-CD1 3.88Å; L77-Y214 HydrophobicContact CG-CE1 3.48Å; L77-Y214 VanDerWaalsContact CG-CE1 3.48Å; L77-S217 WeakPolarHBondContact CB-OG 3.49Å; L77-S217 PolarHBondContact N-OG 3.44Å; L77-P401 HydrophobicContact CD1-CB 4.15Å; L77-I402 HydrophobicContact CD1-CB 4.31Å; L77-I402 HydrophobicContact CD1-CD1 4.13Å; L77-I402 HydrophobicContact CD2-CB 4.07Å; L77-F405 HydrophobicContact CD1-CD2 3.95Å
78G92.4Very high90.9Very high0 Ų033.2 Ų33.20%017%0.172CC..Hα-helixtrans-69.9-46.5176.400000112.2D76 V80 C81 H82 G345D76-G78 PolarHBondContact O-N 3.19Å; D76-G78 WeakPolarHBondContact OD1-CA 3.39Å; D76-G78 PolarHBondContact OD1-N 3.23Å; G78-V80 PolarHBondContact O-N 2.94Å; G78-C81 WeakPolarHBondContact O-CB 3.5Å; G78-C81 PolarHBondContact O-N 3.16Å; G78-H82 WeakPolarHBondContact O-CB 3.14Å; G78-H82 PolarHBondContact O-N 3.27Å; G78-G345 CarbonylContact O-C 3.53Å
79E92.9Very high90.7Very high62 Ų6232.5 Ų32.529%0.2917%0.172SC..Hα-helixtrans-59-42.9172.7-71.5171.9154.500111.9K75 D76 H82 L83 K221K75-E79 WeakPolarHBondContact CA-OE2 3.29Å; K75-E79 HydrophobicContact CB-CB 4.06Å; K75-E79 VanDerWaalsContact CB-OE2 3.31Å; K75-E79 WeakPolarHBondContact CB-OE2 3.49Å; D76-E79 PolarHBondContact N-OE2 2.87Å; D76-E79 PolarHBondContact O-N 3.43Å; D76-E79 PolarHBondContact OD1-N 2.97Å; D76-E79 WeakPolarHBondContact OD2-CG 3.44Å; E79-H82 WeakPolarHBondContact O-CB 3.22Å; E79-H82 PolarHBondContact O-N 3.01Å; E79-L83 VanDerWaalsContact O-CG 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.38Å; E79-L83 PolarHBondContact O-N 3.11Å; E79-K221 IonicContact OE1-NZ 2.75Å; E79-K221 PolarHBondContact OE1-NZ 3.44Å; E79-K221 IonicContact OE2-NZ 3.22Å; E79-K221 PolarHBondContact OE2-NZ 2.96Å
80V92Very high90.6Very high5 Ų534.5 Ų34.53%0.0318%0.18CC..Hα-helixtrans-66.4-43.1176.2178.90000111L69 K75 D76 G78 H82 L83 Y84 F405L69-V80 HydrophobicContact CD2-CG2 4.38Å; K75-V80 HydrophobicContact CB-CG2 3.94Å; D76-V80 WeakPolarHBondContact O-CG2 3.41Å; D76-V80 PolarHBondContact O-N 3.44Å; G78-V80 PolarHBondContact O-N 2.94Å; V80-H82 VanDerWaalsContact C-N 3.27Å; V80-H82 PolarHBondContact O-N 3.12Å; V80-L83 PolarHBondContact O-N 3.15Å; V80-Y84 HydrophobicContact CG1-CD2 4.01Å; V80-Y84 HydrophobicContact CG1-CE2 4.38Å; V80-Y84 PolarHBondContact O-N 3.11Å; V80-Y84 VanDerWaalsContact O-N 3.15Å; V80-F405 HydrophobicContact CG1-CB 4.26Å; V80-F405 HydrophobicContact CG1-CD1 3.78Å; V80-F405 HydrophobicContact CG1-CD2 3.67Å; V80-F405 HydrophobicContact CG1-CE1 4.02Å; V80-F405 HydrophobicContact CG1-CE2 3.91Å; V80-F405 HydrophobicContact CG1-CG 3.62Å; V80-F405 HydrophobicContact CG1-CZ 4.08Å
81C91.5Very high90.6Very high0 Ų038.1 Ų38.10%020%0.198CC..Hα-helixtrans-58.1-39.5172.5-730000111.9L77 G78 L83 Y85 L93 F346L77-C81 WeakPolarHBondContact O-CB 3.49Å; L77-C81 PolarHBondContact O-N 3.44Å; L77-C81 PolarHBondContact O-SG 3.27Å; G78-C81 WeakPolarHBondContact O-CB 3.5Å; G78-C81 PolarHBondContact O-N 3.16Å; C81-L83 VanDerWaalsContact C-N 3.3Å; C81-L83 PolarHBondContact O-N 3.34Å; C81-Y85 HydrophobicContact CB-CD2 3.98Å; C81-Y85 HydrophobicContact CB-CE2 4.44Å; C81-Y85 WeakPolarHBondContact O-CB 3.14Å; C81-Y85 PolarHBondContact O-N 2.64Å; C81-L93 HydrophobicContact CB-CD2 4.4Å; C81-F346 HydrophobicContact CB-CD1 4.25Å; C81-F346 HydrophobicContact CB-CE1 3.48Å; C81-F346 VanDerWaalsContact CB-CE1 3.48Å; C81-F346 HydrophobicContact CB-CZ 3.72Å
82H90.2Very high90.6Very high28 Ų2841.8 Ų41.813%0.1322%0.217CC..Hα-helixtrans-64.1-34.6179.1177.4110000113.7G78 E79 V80 R90 G345 F346 K348G78-H82 WeakPolarHBondContact O-CB 3.14Å; G78-H82 PolarHBondContact O-N 3.27Å; E79-H82 WeakPolarHBondContact O-CB 3.22Å; E79-H82 PolarHBondContact O-N 3.01Å; V80-H82 VanDerWaalsContact C-N 3.27Å; V80-H82 PolarHBondContact O-N 3.12Å; H82-R90 PolarHBondContact CE1-NH1 3.01Å; H82-R90 VanDerWaalsContact CE1-NH1 3.34Å; H82-R90 PolarHBondContact ND1-NH1 2.59Å; H82-R90 PolarHBondContact O-NH1 3.25Å; H82-G345 VanDerWaalsContact CB-O 3.22Å; H82-G345 WeakPolarHBondContact CB-O 2.98Å; H82-F346 PolarHBondContact ND1-O 3.36Å; H82-K348 VanDerWaalsContact NE2-CE 3.26Å; H82-K348 WeakPolarHBondContact NE2-CE 3.25Å; H82-K348 PolarHBondContact NE2-NZ 3.41Å
83L88.3Confident90.7Very high39 Ų3940.7 Ų40.720%0.20421%0.211CC..Hα-helixtrans-79.7-35-177.2-72.1169.9000113.2K75 E79 V80 C81 L495K75-L83 HydrophobicContact CD-CD1 3.78Å; E79-L83 VanDerWaalsContact O-CG 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.38Å; E79-L83 PolarHBondContact O-N 3.11Å; V80-L83 PolarHBondContact O-N 3.15Å; C81-L83 VanDerWaalsContact C-N 3.3Å; C81-L83 PolarHBondContact O-N 3.34Å; L83-L495 HydrophobicContact CB-CD1 4.19Å; L83-L495 HydrophobicContact CD1-CD1 4.49Å; L83-L495 HydrophobicContact CD2-CD1 4.03Å; L83-L495 HydrophobicContact CG-CD1 4.46Å
84Y86.5Confident90.9Very high31 Ų3141.4 Ų41.412%0.12221%0.209CC..Hα-helixtrans-102.2-29.1-173.6-78.5-91.7000114.8V80 F405 M408 V411 F491V80-Y84 HydrophobicContact CG1-CD2 4.01Å; V80-Y84 HydrophobicContact CG1-CE2 4.38Å; V80-Y84 PolarHBondContact O-N 3.11Å; V80-Y84 VanDerWaalsContact O-N 3.15Å; Y84-F405 HydrophobicContact CD1-CE1 4.3Å; Y84-F405 HydrophobicContact CD2-CE1 4.01Å; Y84-F405 AromaticContact CG-CE1 3.7Å; Y84-F405 HydrophobicContact CG-CE1 3.7Å; Y84-F405 HydrophobicContact CG-CZ 4.34Å; Y84-M408 HydrophobicContact CD1-CE 4.16Å; Y84-M408 HydrophobicContact CE1-CE 3.97Å; Y84-V411 HydrophobicContact CE1-CG2 4.29Å; Y84-V411 HydrophobicContact CE2-CG2 3.84Å; Y84-F491 HydrophobicContact CD1-CD2 4.3Å; Y84-F491 HydrophobicContact CD1-CE2 4.42Å
85Y88Confident91.1Very high6 Ų644.6 Ų44.62%0.02422%0.222CC..SBendtrans-92.3139.4-179.7-69.1-58.4000112.9C81 L93 P401 F405 Y469 L470 T473 F491C81-Y85 HydrophobicContact CB-CD2 3.98Å; C81-Y85 HydrophobicContact CB-CE2 4.44Å; C81-Y85 WeakPolarHBondContact O-CB 3.14Å; C81-Y85 PolarHBondContact O-N 2.64Å; Y85-L93 HydrophobicContact CD2-CD2 4.25Å; Y85-L93 HydrophobicContact CE2-CD2 4.23Å; Y85-P401 HydrophobicContact CE2-CB 4.25Å; Y85-P401 HydrophobicContact CE2-CG 4.27Å; Y85-F405 HydrophobicContact CD2-CZ 4.19Å; Y85-F405 AromaticContact CE2-CE2 3.8Å; Y85-F405 HydrophobicContact CE2-CE2 3.8Å; Y85-F405 AromaticContact CE2-CZ 3.66Å; Y85-F405 HydrophobicContact CE2-CZ 3.66Å; Y85-Y469 AromaticContact CD1-CE1 3.84Å; Y85-Y469 HydrophobicContact CD1-CE1 3.84Å; Y85-Y469 AromaticContact CE1-CE1 3.98Å; Y85-Y469 HydrophobicContact CE1-CE1 3.98Å; Y85-L470 HydrophobicContact CE1-CD2 3.79Å; Y85-L470 HydrophobicContact CE2-CD2 4.07Å; Y85-L470 VanDerWaalsContact CZ-CD2 3.5Å; Y85-L470 WeakPolarHBondContact OH-CD2 3.38Å; Y85-T473 HydrophobicContact CE1-CG2 4.27Å; Y85-T473 PolarHBondContact OH-OG1 2.87Å; Y85-F491 HydrophobicContact CD1-CE2 4.32Å; Y85-F491 HydrophobicContact CE1-CE2 4.1Å; Y85-F491 HydrophobicContact CE1-CZ 4.23Å
86P88.1Confident91.1Very high68 Ų6842 Ų4244%0.44221%0.212SC..  trans-67.7161.7175.926.5-30.2000111.8V88 P89 R90 Y469P86-V88 VanDerWaalsContact C-N 3.29Å; P86-V88 PolarHBondContact O-N 3.39Å; P86-V88 VanDerWaalsContact O-N 3.08Å; P86-P89 HydrophobicContact CG-CG 4.05Å; P86-P89 WeakPolarHBondContact O-CD 3.47Å; P86-R90 VanDerWaalsContact O-CB 3.3Å; P86-R90 WeakPolarHBondContact O-CB 3.38Å; P86-R90 PolarHBondContact O-N 2.91Å; P86-Y469 WeakPolarHBondContact CD-OH 3.3Å
87K87.8Confident91.2Very high156 Ų15641.8 Ų41.868%0.67821%0.211SC*.Hα-helixtrans-49.3-42.3-168.8-65.4-176.9-179178.90114.5I91K87-I91 WeakPolarHBondContact O-CD1 3.44Å; K87-I91 VanDerWaalsContact O-CG1 3.25Å; K87-I91 WeakPolarHBondContact O-CG1 3.28Å; K87-I91 PolarHBondContact O-N 3.39Å; K87-I91 VanDerWaalsContact O-N 3.08Å
88V90.2Very high91.1Very high104 Ų10442.8 Ų42.863%0.6322%0.216SC*.Hα-helixtrans-71.6-59.8-174.8174.10000112.3P86 R90 I91 L92P86-V88 VanDerWaalsContact C-N 3.29Å; P86-V88 PolarHBondContact O-N 3.39Å; P86-V88 VanDerWaalsContact O-N 3.08Å; V88-R90 PolarHBondContact O-N 3.42Å; V88-I91 PolarHBondContact O-N 3.43Å; V88-I91 VanDerWaalsContact O-N 3.16Å; V88-L92 HydrophobicContact CG1-CD1 4.15Å; V88-L92 WeakPolarHBondContact O-CG 3.32Å; V88-L92 PolarHBondContact O-N 2.69Å
89P90.1Very high91.1Very high21 Ų2146.9 Ų46.914%0.13624%0.237CC..Hα-helixtrans-53.9-36.8172.9-28.235000113.6P86 L92 L93 L466 Y469P86-P89 HydrophobicContact CG-CG 4.05Å; P86-P89 WeakPolarHBondContact O-CD 3.47Å; P89-L92 PolarHBondContact O-N 2.94Å; P89-L93 WeakPolarHBondContact O-CB 3.29Å; P89-L93 PolarHBondContact O-N 3.43Å; P89-L466 HydrophobicContact CB-CD1 4.2Å; P89-Y469 HydrophobicContact CB-CD1 4.09Å; P89-Y469 HydrophobicContact CB-CE1 3.68Å; P89-Y469 HydrophobicContact CG-CD1 4.14Å; P89-Y469 HydrophobicContact CG-CE1 3.71Å
90R91.4Very high91.1Very high43 Ų4344 Ų4416%0.16222%0.224CC..Hα-helixtrans-61.8-44.8177.4-176.6-177.870.4-172.912.6113.1H82 P86 V88 W94 F346H82-R90 PolarHBondContact CE1-NH1 3.01Å; H82-R90 VanDerWaalsContact CE1-NH1 3.34Å; H82-R90 PolarHBondContact ND1-NH1 2.59Å; H82-R90 PolarHBondContact O-NH1 3.25Å; P86-R90 VanDerWaalsContact O-CB 3.3Å; P86-R90 WeakPolarHBondContact O-CB 3.38Å; P86-R90 PolarHBondContact O-N 2.91Å; V88-R90 PolarHBondContact O-N 3.42Å; R90-W94 PolarHBondContact O-N 3.01Å; R90-F346 HydrophobicContact CG-CD1 3.89Å
91I92.3Very high91.1Very high75 Ų7543.8 Ų43.839%0.38522%0.222SC..Hα-helixtrans-71.7-39.2179.7-69.2165.5000110.7K87 V88 W94 L95K87-I91 WeakPolarHBondContact O-CD1 3.44Å; K87-I91 VanDerWaalsContact O-CG1 3.25Å; K87-I91 WeakPolarHBondContact O-CG1 3.28Å; K87-I91 PolarHBondContact O-N 3.39Å; K87-I91 VanDerWaalsContact O-N 3.08Å; V88-I91 PolarHBondContact O-N 3.43Å; V88-I91 VanDerWaalsContact O-N 3.16Å; I91-W94 PolarHBondContact O-N 3.27Å; I91-L95 HydrophobicContact CG2-CD1 4.37Å; I91-L95 WeakPolarHBondContact O-CG 3.2Å; I91-L95 PolarHBondContact O-N 3.17Å
92L93.2Very high91.1Very high79 Ų7945.1 Ų45.141%0.41423%0.23SC..Hα-helixtrans-63.5-42.1174.7-65.1175.4000111.7V88 P89 L95 T96 L466V88-L92 HydrophobicContact CG1-CD1 4.15Å; V88-L92 WeakPolarHBondContact O-CG 3.32Å; V88-L92 PolarHBondContact O-N 2.69Å; P89-L92 PolarHBondContact O-N 2.94Å; L92-L95 PolarHBondContact O-N 3.23Å; L92-T96 WeakPolarHBondContact O-CG2 3.22Å; L92-T96 PolarHBondContact O-N 3.41Å; L92-T96 PolarHBondContact O-OG1 2.81Å; L92-L466 HydrophobicContact CB-CD1 4.49Å; L92-L466 HydrophobicContact CB-CD2 3.86Å
93L92.7Very high91.1Very high1 Ų143.9 Ų43.91%0.00523%0.225CC..Hα-helixtrans-65.6-37.7175.9177.855000112.2C81 Y85 P89 T96 I97 F346 F397 P401C81-L93 HydrophobicContact CB-CD2 4.4Å; Y85-L93 HydrophobicContact CD2-CD2 4.25Å; Y85-L93 HydrophobicContact CE2-CD2 4.23Å; P89-L93 WeakPolarHBondContact O-CB 3.29Å; P89-L93 PolarHBondContact O-N 3.43Å; L93-T96 PolarHBondContact O-OG1 2.77Å; L93-T96 VanDerWaalsContact O-OG1 3.06Å; L93-I97 HydrophobicContact CD1-CG1 4.21Å; L93-I97 WeakPolarHBondContact O-CG1 3.06Å; L93-I97 PolarHBondContact O-N 3.03Å; L93-F346 HydrophobicContact CB-CE1 4.08Å; L93-F346 HydrophobicContact CD2-CE1 3.7Å; L93-F346 HydrophobicContact CD2-CZ 3.86Å; L93-F346 HydrophobicContact CG-CE1 3.58Å; L93-F346 HydrophobicContact CG-CZ 3.67Å; L93-F397 HydrophobicContact CD1-CB 3.62Å; L93-F397 HydrophobicContact CD1-CG 4.46Å; L93-F397 VanDerWaalsContact CD1-O 3.25Å; L93-F397 WeakPolarHBondContact CD1-O 3.09Å; L93-P401 HydrophobicContact CD2-CG 4Å
94W94.1Very high91.2Very high50 Ų5042.1 Ų42.119%0.18922%0.216CC..Hα-helixtrans-61.3-49.1170.9170.968000111.5R90 I91 T96 I97 E98 F346 L347R90-W94 PolarHBondContact O-N 3.01Å; I91-W94 PolarHBondContact O-N 3.27Å; W94-T96 VanDerWaalsContact C-N 3.33Å; W94-T96 PolarHBondContact O-N 2.96Å; W94-I97 PolarHBondContact O-N 3.41Å; W94-E98 HydrophobicContact CD2-CG 4.15Å; W94-E98 VanDerWaalsContact CE2-CG 3.44Å; W94-E98 HydrophobicContact CG-CG 4.41Å; W94-E98 HydrophobicContact CZ2-CG 3.69Å; W94-E98 VanDerWaalsContact NE1-CG 3.26Å; W94-E98 PolarHBondContact NE1-OE1 3.39Å; W94-E98 WeakPolarHBondContact O-CG 3.25Å; W94-E98 PolarHBondContact O-N 3.23Å; W94-F346 HydrophobicContact CB-CB 3.86Å; W94-F346 HydrophobicContact CB-CD1 4Å; W94-F346 HydrophobicContact CB-CG 3.91Å; W94-F346 HydrophobicContact CG-CB 4.04Å; W94-F346 HydrophobicContact CG-CG 4.44Å; W94-L347 HydrophobicContact CD2-CD1 3.6Å; W94-L347 HydrophobicContact CD2-CD2 4.28Å; W94-L347 HydrophobicContact CD2-CG 3.98Å; W94-L347 VanDerWaalsContact CE2-CD1 3.44Å; W94-L347 HydrophobicContact CE3-CD1 3.89Å; W94-L347 HydrophobicContact CE3-CD2 4.44Å; W94-L347 HydrophobicContact CE3-CG 4.49Å; W94-L347 HydrophobicContact CG-CD1 4.22Å; W94-L347 HydrophobicContact CG-CD2 4.35Å; W94-L347 HydrophobicContact CG-CG 4.09Å; W94-L347 HydrophobicContact CH2-CD1 3.93Å; W94-L347 HydrophobicContact CZ2-CD1 3.63Å; W94-L347 HydrophobicContact CZ3-CD1 4.04Å
95L93.3Very high91.4Very high87 Ų8740.7 Ų40.746%0.45521%0.211SC..Hα-helixtrans-58.7-39.6178.7-75.3170.3000113.1I91 L92 L99I91-L95 HydrophobicContact CG2-CD1 4.37Å; I91-L95 WeakPolarHBondContact O-CG 3.2Å; I91-L95 PolarHBondContact O-N 3.17Å; L92-L95 PolarHBondContact O-N 3.23Å; L95-L99 WeakPolarHBondContact O-CB 3.42Å; L95-L99 PolarHBondContact O-N 3.15Å
96T92.9Very high91.4Very high23 Ų2341.4 Ų41.414%0.14122%0.215CC..Hα-helixtrans-70.6-31.9178.953.10000112.8L92 L93 W94 A100 L394 F397L92-T96 WeakPolarHBondContact O-CG2 3.22Å; L92-T96 PolarHBondContact O-N 3.41Å; L92-T96 PolarHBondContact O-OG1 2.81Å; L93-T96 PolarHBondContact O-OG1 2.77Å; L93-T96 VanDerWaalsContact O-OG1 3.06Å; W94-T96 VanDerWaalsContact C-N 3.33Å; W94-T96 PolarHBondContact O-N 2.96Å; T96-A100 PolarHBondContact O-N 2.92Å; T96-A100 VanDerWaalsContact O-N 3.12Å; T96-L394 HydrophobicContact CG2-CD2 4.19Å; T96-F397 HydrophobicContact CG2-CD2 3.75Å; T96-F397 HydrophobicContact CG2-CE2 3.68Å; T96-F397 HydrophobicContact CG2-CG 4.4Å; T96-F397 HydrophobicContact CG2-CZ 4.32Å
97I93.2Very high91.4Very high0 Ų039.3 Ų39.30%020%0.199CC..Hα-helixtrans-79-36.8176-58.6-58000111.9L93 W94 L99 A100 I101 P210 Y214 V342 F397 A398L93-I97 HydrophobicContact CD1-CG1 4.21Å; L93-I97 WeakPolarHBondContact O-CG1 3.06Å; L93-I97 PolarHBondContact O-N 3.03Å; W94-I97 PolarHBondContact O-N 3.41Å; I97-L99 VanDerWaalsContact C-N 3.3Å; I97-L99 PolarHBondContact O-N 2.98Å; I97-A100 WeakPolarHBondContact O-CB 3.16Å; I97-A100 PolarHBondContact O-N 3.49Å; I97-A100 VanDerWaalsContact O-N 3.15Å; I97-I101 HydrophobicContact CG2-CD1 4.2Å; I97-I101 WeakPolarHBondContact O-CD1 3.28Å; I97-I101 WeakPolarHBondContact O-CG1 3.22Å; I97-I101 PolarHBondContact O-N 3.03Å; I97-P210 HydrophobicContact CD1-CB 4.18Å; I97-Y214 HydrophobicContact CD1-CD2 4.25Å; I97-Y214 HydrophobicContact CD1-CE2 3.53Å; I97-Y214 HydrophobicContact CG1-CD2 4.31Å; I97-Y214 HydrophobicContact CG1-CE2 3.62Å; I97-Y214 HydrophobicContact CG2-CD2 3.95Å; I97-Y214 HydrophobicContact CG2-CE2 4.12Å; I97-V342 HydrophobicContact CB-CG1 4.23Å; I97-V342 HydrophobicContact CG2-CB 4.41Å; I97-V342 HydrophobicContact CG2-CG1 3.9Å; I97-V342 HydrophobicContact CG2-CG2 3.63Å; I97-F397 HydrophobicContact CD1-CB 4.21Å; I97-A398 HydrophobicContact CD1-CB 4.17Å
98E92.3Very high91.5Very high21 Ų2132.3 Ų32.310%0.09817%0.169CC..Hα-helixtrans-60.9-40.1169.5-67-64.7167.900111.6W94 A100 I101 V102 M343W94-E98 HydrophobicContact CD2-CG 4.15Å; W94-E98 VanDerWaalsContact CE2-CG 3.44Å; W94-E98 HydrophobicContact CG-CG 4.41Å; W94-E98 HydrophobicContact CZ2-CG 3.69Å; W94-E98 VanDerWaalsContact NE1-CG 3.26Å; W94-E98 PolarHBondContact NE1-OE1 3.39Å; W94-E98 WeakPolarHBondContact O-CG 3.25Å; W94-E98 PolarHBondContact O-N 3.23Å; E98-A100 VanDerWaalsContact C-N 3.3Å; E98-A100 PolarHBondContact O-N 3.02Å; E98-I101 PolarHBondContact O-N 2.86Å; E98-V102 WeakPolarHBondContact O-CG2 3.4Å; E98-V102 PolarHBondContact O-N 3.25Å; E98-M343 WeakPolarHBondContact OE1-CG 3.5Å
99L92.3Very high91.5Very high86 Ų8627.3 Ų27.345%0.4514%0.139SC..Hα-helixtrans-62.2-37.3173.7-176.862.7000112L95 I97 G103 L390 L394L95-L99 WeakPolarHBondContact O-CB 3.42Å; L95-L99 PolarHBondContact O-N 3.15Å; I97-L99 VanDerWaalsContact C-N 3.3Å; I97-L99 PolarHBondContact O-N 2.98Å; L99-G103 PolarHBondContact O-N 2.95Å; L99-L390 HydrophobicContact CD2-CD1 4.31Å; L99-L390 HydrophobicContact CG-CD2 4.37Å; L99-L394 HydrophobicContact CB-CD1 4.31Å; L99-L394 HydrophobicContact CD2-CD1 4.31Å; L99-L394 HydrophobicContact CD2-CD2 4.4Å; L99-L394 HydrophobicContact CG-CD1 4.11Å
100A92.7Very high91.4Very high0 Ų026.6 Ų26.60%013%0.134CC..Hα-helixtrans-66.2-37.8173.700000112.1T96 I97 E98 S104 P210 Q391 L394T96-A100 PolarHBondContact O-N 2.92Å; T96-A100 VanDerWaalsContact O-N 3.12Å; I97-A100 WeakPolarHBondContact O-CB 3.16Å; I97-A100 PolarHBondContact O-N 3.49Å; I97-A100 VanDerWaalsContact O-N 3.15Å; E98-A100 VanDerWaalsContact C-N 3.3Å; E98-A100 PolarHBondContact O-N 3.02Å; A100-S104 PolarHBondContact O-N 2.88Å; A100-S104 VanDerWaalsContact O-N 3.08Å; A100-P210 HydrophobicContact CB-CB 4.24Å; A100-P210 HydrophobicContact CB-CG 4.24Å; A100-Q391 PolarHBondContact O-NE2 3.28Å; A100-Q391 PolarHBondContact O-OE1 3.06Å; A100-L394 HydrophobicContact CB-CB 4.33Å; A100-L394 HydrophobicContact CB-CD1 3.74Å
101I91.7Very high91.3Very high1 Ų124.8 Ų24.81%0.00513%0.128CC..Hα-helixtrans-66.5-53176.2-66.8156.2000110.2I97 E98 G103 S104 D105 H211 G335 A338 V342I97-I101 HydrophobicContact CG2-CD1 4.2Å; I97-I101 WeakPolarHBondContact O-CD1 3.28Å; I97-I101 WeakPolarHBondContact O-CG1 3.22Å; I97-I101 PolarHBondContact O-N 3.03Å; E98-I101 PolarHBondContact O-N 2.86Å; I101-G103 VanDerWaalsContact C-N 3.27Å; I101-G103 PolarHBondContact O-N 3.04Å; I101-S104 WeakPolarHBondContact O-CB 3.22Å; I101-S104 PolarHBondContact O-N 3.07Å; I101-S104 VanDerWaalsContact O-N 3.09Å; I101-D105 WeakPolarHBondContact O-CB 3.3Å; I101-D105 PolarHBondContact O-N 3.45Å; I101-H211 HydrophobicContact CD1-CB 4.4Å; I101-H211 HydrophobicContact CG1-CB 3.59Å; I101-G335 WeakPolarHBondContact CG2-O 3.41Å; I101-A338 HydrophobicContact CD1-CB 4.44Å; I101-A338 HydrophobicContact CG1-CB 4.39Å; I101-V342 HydrophobicContact CD1-CB 4.27Å; I101-V342 HydrophobicContact CD1-CG1 4.43Å; I101-V342 HydrophobicContact CD1-CG2 4.23Å
102V91.1Very high91.2Very high28 Ų2821.2 Ų21.217%0.1711%0.11CC..Hα-helixtrans-60.2-37.4177.7174.30000111.3E98 S104 D105 M106 C363 A364E98-V102 WeakPolarHBondContact O-CG2 3.4Å; E98-V102 PolarHBondContact O-N 3.25Å; V102-S104 PolarHBondContact O-N 2.71Å; V102-D105 WeakPolarHBondContact O-CB 3.39Å; V102-D105 PolarHBondContact O-N 3.08Å; V102-M106 WeakPolarHBondContact O-CG 3.4Å; V102-M106 PolarHBondContact O-N 2.98Å; V102-C363 HydrophobicContact CG1-CB 4.24Å; V102-C363 HydrophobicContact CG2-CB 4.31Å; V102-A364 HydrophobicContact CG1-CB 4.31Å
103G90.8Very high91.1Very high2 Ų217.6 Ų17.62%0.0219%0.091CC..Hα-helixtrans-62.9-40.9174.800000113L99 I101 M106 Q107L99-G103 PolarHBondContact O-N 2.95Å; I101-G103 VanDerWaalsContact C-N 3.27Å; I101-G103 PolarHBondContact O-N 3.04Å; G103-M106 PolarHBondContact O-N 3.06Å; G103-Q107 WeakPolarHBondContact O-CG 3.38Å; G103-Q107 PolarHBondContact O-N 3.29Å
104S90.3Very high91Very high2 Ų217.7 Ų17.71%0.0149%0.092CC..Hα-helixtrans-70.5-38.1176.9-167.40000112.4A100 I101 V102 M106 Q107 E108 M209 H211 Q391A100-S104 PolarHBondContact O-N 2.88Å; A100-S104 VanDerWaalsContact O-N 3.08Å; I101-S104 WeakPolarHBondContact O-CB 3.22Å; I101-S104 PolarHBondContact O-N 3.07Å; I101-S104 VanDerWaalsContact O-N 3.09Å; V102-S104 PolarHBondContact O-N 2.71Å; S104-M106 VanDerWaalsContact C-N 3.32Å; S104-M106 PolarHBondContact O-N 3.19Å; S104-Q107 PolarHBondContact O-N 3.17Å; S104-E108 WeakPolarHBondContact O-CB 3.28Å; S104-E108 PolarHBondContact O-N 3.01Å; S104-E108 VanDerWaalsContact O-N 3.14Å; S104-M209 WeakPolarHBondContact OG-CE 3.2Å; S104-H211 VanDerWaalsContact CB-CE1 3.49Å; S104-H211 WeakPolarHBondContact CB-CE1 3.48Å; S104-H211 PolarHBondContact OG-CE1 3.07Å; S104-Q391 VanDerWaalsContact N-NE2 3.2Å
105D90.3Very high90.9Very high2 Ų215.3 Ų15.31%0.0118%0.083CC..Hα-helixtrans-57.4-44.3173.9-165.9-44.3000110.5I101 V102 E108 V109 R361 A364I101-D105 WeakPolarHBondContact O-CB 3.3Å; I101-D105 PolarHBondContact O-N 3.45Å; V102-D105 WeakPolarHBondContact O-CB 3.39Å; V102-D105 PolarHBondContact O-N 3.08Å; D105-E108 PolarHBondContact O-N 3.24Å; D105-V109 WeakPolarHBondContact O-CG2 3.03Å; D105-V109 PolarHBondContact O-N 3.22Å; D105-R361 IonicContact OD1-CZ 3.2Å; D105-R361 IonicContact OD1-NE 3.71Å; D105-R361 PolarHBondContact OD1-NE 2.89Å; D105-R361 IonicContact OD1-NH1 3.16Å; D105-R361 IonicContact OD1-NH2 3.67Å; D105-R361 PolarHBondContact OD1-NH2 2.91Å; D105-R361 VanDerWaalsContact OD1-NH2 3.13Å; D105-R361 IonicContact OD2-CZ 3.96Å; D105-R361 IonicContact OD2-NE 2.73Å; D105-R361 PolarHBondContact OD2-NE 3.48Å; D105-R361 IonicContact OD2-NH2 2.7Å; D105-R361 PolarHBondContact OD2-NH2 3.35Å; D105-A364 HydrophobicContact CB-CB 3.68Å; D105-A364 WeakPolarHBondContact OD1-CB 3.43Å
106M89.2Confident90.9Very high21 Ų2113.7 Ų13.710%0.1037%0.072CC..Hα-helixtrans-61.4-45.4174.1-71.3176.765.500113.3V102 G103 S104 E108 V109 I110 A364 P367 L383 L387V102-M106 WeakPolarHBondContact O-CG 3.4Å; V102-M106 PolarHBondContact O-N 2.98Å; G103-M106 PolarHBondContact O-N 3.06Å; S104-M106 VanDerWaalsContact C-N 3.32Å; S104-M106 PolarHBondContact O-N 3.19Å; M106-E108 VanDerWaalsContact C-N 3.26Å; M106-E108 PolarHBondContact O-N 3.45Å; M106-V109 PolarHBondContact O-N 3.19Å; M106-I110 WeakPolarHBondContact O-CD1 3.45Å; M106-I110 WeakPolarHBondContact O-CG1 3.49Å; M106-I110 PolarHBondContact O-N 3.23Å; M106-A364 HydrophobicContact CG-CB 3.72Å; M106-P367 HydrophobicContact CE-CB 4.02Å; M106-P367 HydrophobicContact CE-CG 3.79Å; M106-P367 HydrophobicContact SD-CG 3.84Å; M106-L383 HydrophobicContact CE-CD1 4.21Å; M106-L383 HydrophobicContact CE-CD2 3.88Å; M106-L383 HydrophobicContact CE-CG 4.38Å; M106-L387 HydrophobicContact CB-CD1 3.63Å; M106-L387 HydrophobicContact CE-CD1 4.34Å; M106-L387 HydrophobicContact SD-CD2 4.4Å
107Q88.7Confident90.7Very high24 Ų2413.1 Ų13.111%0.1127%0.068CC..Hα-helixtrans-60.2-39.8179.2-64.1-178.4-67.800111.9G103 S104 I110 G111 N384 L387 N388G103-Q107 WeakPolarHBondContact O-CG 3.38Å; G103-Q107 PolarHBondContact O-N 3.29Å; S104-Q107 PolarHBondContact O-N 3.17Å; Q107-I110 PolarHBondContact O-N 3.3Å; Q107-G111 PolarHBondContact O-N 3.34Å; Q107-N384 WeakPolarHBondContact CG-OD1 3.19Å; Q107-N384 PolarHBondContact NE2-O 3.46Å; Q107-N384 PolarHBondContact NE2-OD1 2.91Å; Q107-N384 VanDerWaalsContact NE2-OD1 3.16Å; Q107-L387 HydrophobicContact CG-CB 3.51Å; Q107-L387 HydrophobicContact CG-CD1 3.64Å; Q107-L387 HydrophobicContact CG-CG 4.2Å; Q107-N388 PolarHBondContact NE2-OD1 3.04Å
108E89.1Confident90.6Very high8 Ų813.1 Ų13.14%0.0377%0.068CC..Hα-helixtrans-70.4-41.7179173.8-124.8119.800112.7S104 D105 M106 I110 G111 T112 G328 T332 R361S104-E108 WeakPolarHBondContact O-CB 3.28Å; S104-E108 PolarHBondContact O-N 3.01Å; S104-E108 VanDerWaalsContact O-N 3.14Å; D105-E108 PolarHBondContact O-N 3.24Å; M106-E108 VanDerWaalsContact C-N 3.26Å; M106-E108 PolarHBondContact O-N 3.45Å; E108-I110 VanDerWaalsContact C-N 3.31Å; E108-I110 PolarHBondContact O-N 2.98Å; E108-G111 PolarHBondContact O-N 3.43Å; E108-T112 VanDerWaalsContact O-CB 3.31Å; E108-T112 WeakPolarHBondContact O-CB 3.33Å; E108-T112 PolarHBondContact O-N 2.93Å; E108-T112 PolarHBondContact O-OG1 3.33Å; E108-G328 WeakPolarHBondContact CG-O 3.36Å; E108-T332 VanDerWaalsContact CD-CB 3.44Å; E108-T332 WeakPolarHBondContact OE1-CB 3.24Å; E108-T332 WeakPolarHBondContact OE2-CA 3.45Å; E108-T332 VanDerWaalsContact OE2-CB 3.26Å; E108-T332 WeakPolarHBondContact OE2-CB 3.46Å; E108-T332 PolarHBondContact OE2-N 2.99Å; E108-R361 VanDerWaalsContact CD-NH1 3.31Å; E108-R361 IonicContact OE1-CZ 2.9Å; E108-R361 IonicContact OE1-NH1 3.32Å; E108-R361 PolarHBondContact OE1-NH1 2.97Å; E108-R361 IonicContact OE1-NH2 2.99Å; E108-R361 IonicContact OE2-CZ 3.98Å; E108-R361 IonicContact OE2-NH1 3.12Å; E108-R361 PolarHBondContact OE2-NH1 2.85Å; E108-R361 VanDerWaalsContact OE2-NH1 3.16Å; E108-R361 IonicContact OE2-NH2 2.83Å; E108-R361 PolarHBondContact OE2-NH2 3.48Å
109V89.4Confident90.6Very high0 Ų014.9 Ų14.90%08%0.078CC..Hα-helixtrans-62.3-40.2172.71700000110.9D105 M106 A113 V130 T133 I365 T368D105-V109 WeakPolarHBondContact O-CG2 3.03Å; D105-V109 PolarHBondContact O-N 3.22Å; M106-V109 PolarHBondContact O-N 3.19Å; V109-A113 VanDerWaalsContact O-CB 3.31Å; V109-A113 WeakPolarHBondContact O-CB 3.43Å; V109-A113 PolarHBondContact O-N 3.4Å; V109-V130 HydrophobicContact CG1-CB 4.29Å; V109-V130 HydrophobicContact CG1-CG1 3.73Å; V109-V130 HydrophobicContact CG1-CG2 4.11Å; V109-T133 HydrophobicContact CG1-CG2 4.2Å; V109-I365 HydrophobicContact CG1-CG1 4.33Å; V109-I365 HydrophobicContact CG2-CG1 4.07Å; V109-T368 HydrophobicContact CG1-CG2 4.05Å
110I88.4Confident90.5Very high6 Ų611.7 Ų11.73%0.0316%0.063CC..Hα-helixtrans-62.1-51.7173.9-67.8163.3000110.7M106 Q107 E108 T112 A113 I114 T368 L380 L383 L387M106-I110 WeakPolarHBondContact O-CD1 3.45Å; M106-I110 WeakPolarHBondContact O-CG1 3.49Å; M106-I110 PolarHBondContact O-N 3.23Å; Q107-I110 PolarHBondContact O-N 3.3Å; E108-I110 VanDerWaalsContact C-N 3.31Å; E108-I110 PolarHBondContact O-N 2.98Å; I110-T112 VanDerWaalsContact C-N 3.34Å; I110-T112 PolarHBondContact O-N 3.35Å; I110-A113 PolarHBondContact O-N 3.48Å; I110-I114 HydrophobicContact CG2-CD1 3.74Å; I110-I114 HydrophobicContact CG2-CG1 4.49Å; I110-I114 WeakPolarHBondContact O-CB 3.29Å; I110-I114 VanDerWaalsContact O-CG1 3.29Å; I110-I114 WeakPolarHBondContact O-CG1 3.34Å; I110-I114 PolarHBondContact O-N 3.27Å; I110-T368 HydrophobicContact CD1-CG2 4.42Å; I110-T368 HydrophobicContact CG1-CG2 3.64Å; I110-L380 HydrophobicContact CG1-CD2 4.41Å; I110-L383 HydrophobicContact CD1-CD2 3.99Å; I110-L383 HydrophobicContact CD1-CG 4.16Å; I110-L387 HydrophobicContact CD1-CD1 4.31Å
111G89.9Confident90.1Very high5 Ų513.7 Ų13.75%0.0528%0.08CC..Hα-helixtrans-59.9-42.217900000112.9Q107 E108 I114 S115 L324Q107-G111 PolarHBondContact O-N 3.34Å; E108-G111 PolarHBondContact O-N 3.43Å; G111-I114 PolarHBondContact O-N 3.26Å; G111-S115 PolarHBondContact O-N 3.09Å; G111-L324 VanDerWaalsContact O-CD2 3.32Å; G111-L324 WeakPolarHBondContact O-CD2 3.45Å; G111-L324 WeakPolarHBondContact O-CG 3.48Å
112T90.8Very high89.6Confident0 Ų015.5 Ų15.50%010%0.098CC..Hα-helixtrans-65.4-44.2177.3-56.70000111.3E108 I110 I114 S115 F116 T133 L325E108-T112 VanDerWaalsContact O-CB 3.31Å; E108-T112 WeakPolarHBondContact O-CB 3.33Å; E108-T112 PolarHBondContact O-N 2.93Å; E108-T112 PolarHBondContact O-OG1 3.33Å; I110-T112 VanDerWaalsContact C-N 3.34Å; I110-T112 PolarHBondContact O-N 3.35Å; T112-I114 PolarHBondContact O-N 3.06Å; T112-S115 PolarHBondContact O-N 3.01Å; T112-S115 PolarHBondContact O-OG 3.01Å; T112-F116 HydrophobicContact CG2-CD2 4.01Å; T112-F116 HydrophobicContact CG2-CE2 3.64Å; T112-F116 WeakPolarHBondContact O-CD2 3.1Å; T112-F116 PolarHBondContact O-N 3.29Å; T112-F116 VanDerWaalsContact O-N 3.08Å; T112-T133 HydrophobicContact CG2-CG2 3.7Å; T112-L325 HydrophobicContact CG2-CD1 3.89Å
113A90.3Very high89.4Confident2 Ų224.2 Ų24.22%0.01713%0.128CC..Hα-helixtrans-62.4-41.3175.400000112.7V109 I110 S115 F116 N117 L126 V130V109-A113 VanDerWaalsContact O-CB 3.31Å; V109-A113 WeakPolarHBondContact O-CB 3.43Å; V109-A113 PolarHBondContact O-N 3.4Å; I110-A113 PolarHBondContact O-N 3.48Å; A113-S115 VanDerWaalsContact C-N 3.33Å; A113-S115 PolarHBondContact O-N 3Å; A113-F116 PolarHBondContact O-N 3.35Å; A113-N117 PolarHBondContact O-N 2.89Å; A113-L126 HydrophobicContact CB-CD2 4.39Å; A113-L126 WeakPolarHBondContact O-CD2 3.48Å; A113-V130 HydrophobicContact CB-CB 4.44Å; A113-V130 HydrophobicContact CB-CG2 3.56Å
114I89.4Confident89.2Confident4 Ų426.4 Ų26.42%0.02114%0.139CC..Hα-helixtrans-59.2-44.6173.1-72.8169.9000110.6I110 G111 T112 F116 N117 L118 L126 I301 Y302 L324I110-I114 HydrophobicContact CG2-CD1 3.74Å; I110-I114 HydrophobicContact CG2-CG1 4.49Å; I110-I114 WeakPolarHBondContact O-CB 3.29Å; I110-I114 VanDerWaalsContact O-CG1 3.29Å; I110-I114 WeakPolarHBondContact O-CG1 3.34Å; I110-I114 PolarHBondContact O-N 3.27Å; G111-I114 PolarHBondContact O-N 3.26Å; T112-I114 PolarHBondContact O-N 3.06Å; I114-F116 PolarHBondContact O-N 3.12Å; I114-N117 PolarHBondContact O-N 3.47Å; I114-L118 HydrophobicContact CG2-CD1 4.11Å; I114-L118 WeakPolarHBondContact O-CG 3.35Å; I114-L118 PolarHBondContact O-N 3.1Å; I114-L126 HydrophobicContact CG1-CD1 4.49Å; I114-L126 HydrophobicContact CG1-CD2 4.02Å; I114-I301 HydrophobicContact CG2-CG2 4.4Å; I114-Y302 HydrophobicContact CG2-CD2 4.04Å; I114-L324 HydrophobicContact CB-CD2 4.03Å; I114-L324 HydrophobicContact CG2-CD2 3.54Å
115S92.8Very high89.1Confident0 Ų029.2 Ų29.20%016%0.157CC..Hα-helixtrans-60.5-43.3178.2800000112.4G111 T112 A113 N117 L118 L119 A321 L325G111-S115 PolarHBondContact O-N 3.09Å; T112-S115 PolarHBondContact O-N 3.01Å; T112-S115 PolarHBondContact O-OG 3.01Å; A113-S115 VanDerWaalsContact C-N 3.33Å; A113-S115 PolarHBondContact O-N 3Å; S115-N117 PolarHBondContact O-N 3.21Å; S115-L118 PolarHBondContact O-N 3.3Å; S115-L119 WeakPolarHBondContact O-CB 3.49Å; S115-L119 VanDerWaalsContact O-CG 3.25Å; S115-L119 WeakPolarHBondContact O-CG 3.42Å; S115-L119 PolarHBondContact O-N 3.36Å; S115-A321 WeakPolarHBondContact CB-O 3.25Å; S115-L325 WeakPolarHBondContact OG-CB 3.42Å
116F92.6Very high88.9Confident52 Ų5229.9 Ų29.923%0.22816%0.16CC..Hα-helixtrans-66.3-36176.6-76.7-58.6000112.9T112 A113 I114 S120 I132 L325T112-F116 HydrophobicContact CG2-CD2 4.01Å; T112-F116 HydrophobicContact CG2-CE2 3.64Å; T112-F116 WeakPolarHBondContact O-CD2 3.1Å; T112-F116 PolarHBondContact O-N 3.29Å; T112-F116 VanDerWaalsContact O-N 3.08Å; A113-F116 PolarHBondContact O-N 3.35Å; I114-F116 PolarHBondContact O-N 3.12Å; F116-S120 WeakPolarHBondContact O-CB 3.41Å; F116-S120 PolarHBondContact O-N 3.48Å; F116-S120 PolarHBondContact O-OG 3.11Å; F116-I132 HydrophobicContact CD2-CB 4.48Å; F116-I132 HydrophobicContact CD2-CG2 4.11Å; F116-I132 HydrophobicContact CE1-CG2 4.42Å; F116-I132 HydrophobicContact CE2-CB 4.29Å; F116-I132 HydrophobicContact CE2-CG2 3.52Å; F116-I132 HydrophobicContact CZ-CG2 3.71Å; F116-L325 HydrophobicContact CE2-CD1 4.3Å; F116-L325 HydrophobicContact CZ-CD1 4.15Å
117N90.5Very high88.7Confident12 Ų1233.7 Ų33.76%0.06417%0.174CC..Hα-helixtrans-64.7-43.7174.4-175.7-95000111.8A113 I114 S115 S120 G122 I124 L126 Y302A113-N117 PolarHBondContact O-N 2.89Å; I114-N117 PolarHBondContact O-N 3.47Å; S115-N117 PolarHBondContact O-N 3.21Å; N117-S120 PolarHBondContact O-OG 2.8Å; N117-G122 WeakPolarHBondContact O-CA 3.38Å; N117-G122 PolarHBondContact O-N 2.67Å; N117-I124 PolarHBondContact ND2-O 2.8Å; N117-L126 HydrophobicContact CB-CD2 3.68Å; N117-Y302 WeakPolarHBondContact OD1-CE2 2.99Å; N117-Y302 PolarHBondContact OD1-OH 2.94Å; N117-Y302 VanDerWaalsContact OD1-OH 3.06Å
118L90.3Very high88.7Confident0 Ų035.5 Ų35.50%018%0.184CC..Hα-helixtrans-66.6-49.9176.9-67.9175.3000111.8I114 S115 S120 A121 Y302 V306 L317 A321I114-L118 HydrophobicContact CG2-CD1 4.11Å; I114-L118 WeakPolarHBondContact O-CG 3.35Å; I114-L118 PolarHBondContact O-N 3.1Å; S115-L118 PolarHBondContact O-N 3.3Å; L118-S120 VanDerWaalsContact C-N 3.31Å; L118-S120 PolarHBondContact O-N 3.35Å; L118-A121 PolarHBondContact O-N 3.44Å; L118-A121 VanDerWaalsContact O-N 3.13Å; L118-Y302 HydrophobicContact CD1-CD2 4.43Å; L118-Y302 HydrophobicContact CD2-CD2 3.81Å; L118-Y302 HydrophobicContact CD2-CE2 3.6Å; L118-Y302 HydrophobicContact CG-CD2 4.05Å; L118-Y302 HydrophobicContact CG-CE2 4.09Å; L118-V306 HydrophobicContact CD2-CG2 3.98Å; L118-L317 HydrophobicContact CB-CD2 4Å; L118-L317 HydrophobicContact CD2-CD1 4.23Å; L118-L317 HydrophobicContact CD2-CD2 4.29Å; L118-L317 HydrophobicContact CD2-CG 4.25Å; L118-A321 HydrophobicContact CB-CB 3.68Å; L118-A321 HydrophobicContact CD1-CB 4.26Å
119L92.5Very high88.7Confident58 Ų5835.1 Ų35.130%0.30418%0.182SC..Hα-helixtrans-60.5-36.3178.7-71.3172.5000113.2S115 A121 Y318 A321 V322 L325S115-L119 WeakPolarHBondContact O-CB 3.49Å; S115-L119 VanDerWaalsContact O-CG 3.25Å; S115-L119 WeakPolarHBondContact O-CG 3.42Å; S115-L119 PolarHBondContact O-N 3.36Å; L119-A121 PolarHBondContact O-N 3.07Å; L119-Y318 HydrophobicContact CD2-CD1 4.28Å; L119-A321 HydrophobicContact CD2-CB 3.86Å; L119-A321 HydrophobicContact CG-CB 3.79Å; L119-V322 HydrophobicContact CD2-CG2 3.99Å; L119-L325 HydrophobicContact CD1-CD2 4.04Å
120S89.8Confident88.6Confident18 Ų1835.1 Ų35.113%0.12618%0.182CC..THydrogen-bonded Turntrans-80.72.9179.866.70000114.3F116 N117 L118 G122 R123 I124F116-S120 WeakPolarHBondContact O-CB 3.41Å; F116-S120 PolarHBondContact O-N 3.48Å; F116-S120 PolarHBondContact O-OG 3.11Å; N117-S120 PolarHBondContact O-OG 2.8Å; L118-S120 VanDerWaalsContact C-N 3.31Å; L118-S120 PolarHBondContact O-N 3.35Å; S120-G122 VanDerWaalsContact C-N 3.29Å; S120-G122 PolarHBondContact O-N 3.13Å; S120-R123 WeakPolarHBondContact O-CB 3.24Å; S120-R123 VanDerWaalsContact O-CG 3.3Å; S120-R123 WeakPolarHBondContact O-CG 3.19Å; S120-R123 PolarHBondContact O-N 2.9Å; S120-R123 PolarHBondContact OG-N 3.16Å; S120-I124 WeakPolarHBondContact OG-CB 3.4Å; S120-I124 PolarHBondContact OG-N 3.47Å
121A84.1Confident88.6Confident43 Ų4337.8 Ų37.836%0.35520%0.196SC..THydrogen-bonded Turntrans5639.9-171.200000113.3L118 L119 R123 Y286L118-A121 PolarHBondContact O-N 3.44Å; L118-A121 VanDerWaalsContact O-N 3.13Å; L119-A121 PolarHBondContact O-N 3.07Å; A121-R123 VanDerWaalsContact C-N 3.31Å; A121-R123 PolarHBondContact O-N 3.4Å; A121-Y286 WeakPolarHBondContact CA-OH 3.36Å
122G81.9Confident88.6Confident38 Ų3840.3 Ų40.339%0.39221%0.208SC..THydrogen-bonded Turntrans77.95.6-178.700000115.4N117 S120N117-G122 WeakPolarHBondContact O-CA 3.38Å; N117-G122 PolarHBondContact O-N 2.67Å; S120-G122 VanDerWaalsContact C-N 3.29Å; S120-G122 PolarHBondContact O-N 3.13Å
123R86.2Confident88.5Confident211 Ų21140.3 Ų40.380%0.79621%0.208SC*.  trans-72.6-32.9178.1-67.6-175.1-174.9106.1-7.1113.5S120 A121 P125S120-R123 WeakPolarHBondContact O-CB 3.24Å; S120-R123 VanDerWaalsContact O-CG 3.3Å; S120-R123 WeakPolarHBondContact O-CG 3.19Å; S120-R123 PolarHBondContact O-N 2.9Å; S120-R123 PolarHBondContact OG-N 3.16Å; A121-R123 VanDerWaalsContact C-N 3.31Å; A121-R123 PolarHBondContact O-N 3.4Å; R123-P125 WeakPolarHBondContact O-CD 3.44Å
124I87.9Confident88.2Confident49 Ų4943.3 Ų43.325%0.25122%0.223SC..SBendtrans-94.2111.2174.7-59.3175000107.2N117 S120 D128 I132N117-I124 PolarHBondContact ND2-O 2.8Å; S120-I124 WeakPolarHBondContact OG-CB 3.4Å; S120-I124 PolarHBondContact OG-N 3.47Å; I124-D128 HydrophobicContact CG2-CB 3.75Å; I124-I132 HydrophobicContact CD1-CD1 4.3Å; I124-I132 HydrophobicContact CG2-CD1 4.09Å
125P87Confident88.1Confident61 Ų6147.8 Ų47.840%0.39625%0.25SS..  trans-65.7158.4174.529.6-35.4000110.8R123 W127 D128 G129R123-P125 WeakPolarHBondContact O-CD 3.44Å; P125-W127 VanDerWaalsContact C-N 3.26Å; P125-W127 PolarHBondContact O-N 3.15Å; P125-D128 VanDerWaalsContact CD-OD2 3.26Å; P125-D128 WeakPolarHBondContact CD-OD2 3.16Å; P125-D128 HydrophobicContact CG-CB 3.96Å; P125-D128 VanDerWaalsContact CG-OD2 3.25Å; P125-D128 WeakPolarHBondContact CG-OD2 3.36Å; P125-D128 PolarHBondContact O-N 3.3Å; P125-D128 VanDerWaalsContact O-N 3.13Å; P125-G129 PolarHBondContact O-N 2.64Å
126L85.3Confident87.6Confident16 Ų1648.6 Ų48.68%0.08426%0.255CS..Hα-helixtrans-57.9-36.7-176-70.8-171000113.2A113 I114 N117 D128 G129 V130 L377 L380A113-L126 HydrophobicContact CB-CD2 4.39Å; A113-L126 WeakPolarHBondContact O-CD2 3.48Å; I114-L126 HydrophobicContact CG1-CD1 4.49Å; I114-L126 HydrophobicContact CG1-CD2 4.02Å; N117-L126 HydrophobicContact CB-CD2 3.68Å; L126-D128 PolarHBondContact O-N 3.27Å; L126-G129 CarbonylContact O-C 3.55Å; L126-G129 WeakPolarHBondContact O-CA 3.3Å; L126-G129 PolarHBondContact O-N 3.37Å; L126-G129 VanDerWaalsContact O-N 3.16Å; L126-V130 WeakPolarHBondContact O-CG2 3.26Å; L126-V130 PolarHBondContact O-N 3.21Å; L126-L377 HydrophobicContact CD1-CD2 3.36Å; L126-L377 HydrophobicContact CG-CD2 3.85Å; L126-L380 HydrophobicContact CB-CD1 4.31Å; L126-L380 HydrophobicContact CD1-CD1 3.48Å; L126-L380 VanDerWaalsContact CD1-CD1 3.48Å
127W86.6Confident87Confident101 Ų10146.3 Ų46.338%0.38325%0.245SC..Hα-helixtrans-61.7-43.9177178.462.6000113.1P125 G129 V130 L131 V369 A372 V373P125-W127 VanDerWaalsContact C-N 3.26Å; P125-W127 PolarHBondContact O-N 3.15Å; W127-G129 VanDerWaalsContact C-N 3.3Å; W127-G129 PolarHBondContact O-N 3.17Å; W127-V130 WeakPolarHBondContact O-CB 3.29Å; W127-V130 PolarHBondContact O-N 3.33Å; W127-L131 HydrophobicContact CD2-CD1 4.13Å; W127-L131 HydrophobicContact CE3-CD1 4.23Å; W127-L131 HydrophobicContact CH2-CD1 3.78Å; W127-L131 HydrophobicContact CZ2-CD1 3.63Å; W127-L131 HydrophobicContact CZ2-CG 4.4Å; W127-L131 HydrophobicContact CZ3-CD1 4.06Å; W127-L131 PolarHBondContact O-N 3.35Å; W127-V369 VanDerWaalsContact NE1-CG1 3.28Å; W127-A372 HydrophobicContact CB-CB 4.17Å; W127-V373 HydrophobicContact CB-CG2 4.23Å; W127-V373 HydrophobicContact CD2-CG2 3.84Å; W127-V373 HydrophobicContact CG-CG2 3.51Å
128D88.2Confident86.6Confident61 Ų6150.9 Ų50.933%0.32626%0.264SS..Hα-helixtrans-64.1-38.7173.9-70.4-12.4000110.6I124 P125 L126 V130 L131 I132I124-D128 HydrophobicContact CG2-CB 3.75Å; P125-D128 VanDerWaalsContact CD-OD2 3.26Å; P125-D128 WeakPolarHBondContact CD-OD2 3.16Å; P125-D128 HydrophobicContact CG-CB 3.96Å; P125-D128 VanDerWaalsContact CG-OD2 3.25Å; P125-D128 WeakPolarHBondContact CG-OD2 3.36Å; P125-D128 PolarHBondContact O-N 3.3Å; P125-D128 VanDerWaalsContact O-N 3.13Å; L126-D128 PolarHBondContact O-N 3.27Å; D128-V130 VanDerWaalsContact C-N 3.32Å; D128-V130 PolarHBondContact O-N 3.4Å; D128-L131 PolarHBondContact O-N 2.95Å; D128-L131 VanDerWaalsContact O-N 3.16Å; D128-I132 VanDerWaalsContact O-CG1 3.27Å; D128-I132 WeakPolarHBondContact O-CG1 3.36Å; D128-I132 PolarHBondContact O-N 3.21Å
129G88.2Confident86.3Confident0 Ų055.4 Ų55.40%028%0.284CS..Hα-helixtrans-57.8-40.9172.100000113.2P125 L126 W127 I132 T133P125-G129 PolarHBondContact O-N 2.64Å; L126-G129 CarbonylContact O-C 3.55Å; L126-G129 WeakPolarHBondContact O-CA 3.3Å; L126-G129 PolarHBondContact O-N 3.37Å; L126-G129 VanDerWaalsContact O-N 3.16Å; W127-G129 VanDerWaalsContact C-N 3.3Å; W127-G129 PolarHBondContact O-N 3.17Å; G129-I132 PolarHBondContact O-N 3.06Å; G129-T133 WeakPolarHBondContact O-CG2 3.37Å
130V88.3Confident85.7Confident1 Ų153 Ų531%0.00627%0.271CS..Hα-helixtrans-67.5-37.6174.4171.10000111.4V109 A113 L126 W127 D128 I132 T133 I365 T368 V369V109-V130 HydrophobicContact CG1-CB 4.29Å; V109-V130 HydrophobicContact CG1-CG1 3.73Å; V109-V130 HydrophobicContact CG1-CG2 4.11Å; A113-V130 HydrophobicContact CB-CB 4.44Å; A113-V130 HydrophobicContact CB-CG2 3.56Å; L126-V130 WeakPolarHBondContact O-CG2 3.26Å; L126-V130 PolarHBondContact O-N 3.21Å; W127-V130 WeakPolarHBondContact O-CB 3.29Å; W127-V130 PolarHBondContact O-N 3.33Å; D128-V130 VanDerWaalsContact C-N 3.32Å; D128-V130 PolarHBondContact O-N 3.4Å; V130-I132 VanDerWaalsContact C-N 3.33Å; V130-T133 PolarHBondContact O-N 3.4Å; V130-T133 PolarHBondContact O-OG1 3.46Å; V130-I365 HydrophobicContact CG1-CG2 4.03Å; V130-T368 HydrophobicContact CG1-CG2 4.29Å; V130-T368 HydrophobicContact CG2-CG2 3.91Å; V130-V369 HydrophobicContact CB-CG2 4.47Å; V130-V369 HydrophobicContact CG1-CG2 3.53Å
131L88.8Confident85.1Confident61 Ų6152.3 Ų52.332%0.31927%0.266SS..Hα-helixtrans-68-32.4174.7-68.6-180000112.6W127 D128 T133 I134 V369W127-L131 HydrophobicContact CD2-CD1 4.13Å; W127-L131 HydrophobicContact CE3-CD1 4.23Å; W127-L131 HydrophobicContact CH2-CD1 3.78Å; W127-L131 HydrophobicContact CZ2-CD1 3.63Å; W127-L131 HydrophobicContact CZ2-CG 4.4Å; W127-L131 HydrophobicContact CZ3-CD1 4.06Å; W127-L131 PolarHBondContact O-N 3.35Å; D128-L131 PolarHBondContact O-N 2.95Å; D128-L131 VanDerWaalsContact O-N 3.16Å; L131-T133 VanDerWaalsContact C-N 3.25Å; L131-T133 PolarHBondContact O-N 3.42Å; L131-I134 HydrophobicContact CD2-CD1 4.03Å; L131-I134 VanDerWaalsContact O-CB 3.29Å; L131-I134 WeakPolarHBondContact O-CB 3.26Å; L131-I134 WeakPolarHBondContact O-CG1 3.27Å; L131-I134 PolarHBondContact O-N 3.16Å; L131-V369 HydrophobicContact CD2-CG2 4.24Å
132I89.3Confident85.1Confident58 Ų5855.5 Ų55.530%0.29727%0.272SS..Hα-helixtrans-65.1-27177.6-69.7162.1000111.8F116 I124 D128 G129 V130 I134 V135 D136F116-I132 HydrophobicContact CD2-CB 4.48Å; F116-I132 HydrophobicContact CD2-CG2 4.11Å; F116-I132 HydrophobicContact CE1-CG2 4.42Å; F116-I132 HydrophobicContact CE2-CB 4.29Å; F116-I132 HydrophobicContact CE2-CG2 3.52Å; F116-I132 HydrophobicContact CZ-CG2 3.71Å; I124-I132 HydrophobicContact CD1-CD1 4.3Å; I124-I132 HydrophobicContact CG2-CD1 4.09Å; D128-I132 VanDerWaalsContact O-CG1 3.27Å; D128-I132 WeakPolarHBondContact O-CG1 3.36Å; D128-I132 PolarHBondContact O-N 3.21Å; G129-I132 PolarHBondContact O-N 3.06Å; V130-I132 VanDerWaalsContact C-N 3.33Å; I132-I134 PolarHBondContact O-N 3.14Å; I132-V135 VanDerWaalsContact O-CB 3.3Å; I132-V135 WeakPolarHBondContact O-CB 2.98Å; I132-V135 PolarHBondContact O-N 3.04Å; I132-D136 PolarHBondContact O-N 2.89Å
133T88Confident84.9Confident1 Ų155.5 Ų55.51%0.00626%0.263CS..Hα-helixtrans-67.5-17176.675.70000113.6V109 T112 G129 V130 L131 V135 D136 T137V109-T133 HydrophobicContact CG1-CG2 4.2Å; T112-T133 HydrophobicContact CG2-CG2 3.7Å; G129-T133 WeakPolarHBondContact O-CG2 3.37Å; V130-T133 PolarHBondContact O-N 3.4Å; V130-T133 PolarHBondContact O-OG1 3.46Å; L131-T133 VanDerWaalsContact C-N 3.25Å; L131-T133 PolarHBondContact O-N 3.42Å; T133-V135 PolarHBondContact O-N 2.79Å; T133-D136 PolarHBondContact O-N 3.2Å; T133-T137 PolarHBondContact O-N 2.76Å; T133-T137 PolarHBondContact O-OG1 3.03Å
134I85.6Confident84.3Confident65 Ų6546.5 Ų46.533%0.33323%0.231SC..Hα-helixtrans-62.7-35.5168.2-56.6171.4000110L131 I132 T137 F138 I365L131-I134 HydrophobicContact CD2-CD1 4.03Å; L131-I134 VanDerWaalsContact O-CB 3.29Å; L131-I134 WeakPolarHBondContact O-CB 3.26Å; L131-I134 WeakPolarHBondContact O-CG1 3.27Å; L131-I134 PolarHBondContact O-N 3.16Å; I132-I134 PolarHBondContact O-N 3.14Å; I134-T137 VanDerWaalsContact O-CB 3.32Å; I134-T137 WeakPolarHBondContact O-CB 3.34Å; I134-T137 PolarHBondContact O-N 3.33Å; I134-F138 HydrophobicContact CG2-CD2 4.43Å; I134-F138 HydrophobicContact CG2-CE2 3.89Å; I134-F138 WeakPolarHBondContact O-CD2 3.29Å; I134-F138 PolarHBondContact O-N 2.9Å; I134-I365 HydrophobicContact CG1-CD1 3.69Å; I134-I365 HydrophobicContact CG1-CG2 4.46Å
135V86Confident84Confident97 Ų9748.6 Ų48.659%0.58824%0.242SC*.Hα-helixtrans-71.7-40.6178.4-173.70000111.3I132 T133 T137 F138 F139I132-V135 VanDerWaalsContact O-CB 3.3Å; I132-V135 WeakPolarHBondContact O-CB 2.98Å; I132-V135 PolarHBondContact O-N 3.04Å; T133-V135 PolarHBondContact O-N 2.79Å; V135-T137 VanDerWaalsContact C-N 3.3Å; V135-T137 PolarHBondContact O-N 3.05Å; V135-F138 PolarHBondContact O-N 3.44Å; V135-F138 VanDerWaalsContact O-N 3.11Å; V135-F139 PolarHBondContact O-N 2.83Å
136D82.8Confident83.6Confident18 Ų1851.3 Ų51.310%0.09625%0.246CC..Hα-helixtrans-55.3-45.8170.816628.3000111.1I132 T133 F138 F139 F140 Q329I132-D136 PolarHBondContact O-N 2.89Å; T133-D136 PolarHBondContact O-N 3.2Å; D136-F138 PolarHBondContact O-N 2.73Å; D136-F138 VanDerWaalsContact O-N 3.11Å; D136-F139 CarbonylContact O-C 3.59Å; D136-F139 WeakPolarHBondContact O-CA 3.46Å; D136-F139 WeakPolarHBondContact O-CB 3.33Å; D136-F139 PolarHBondContact O-N 2.83Å; D136-F140 PolarHBondContact O-N 3.46Å; D136-Q329 VanDerWaalsContact CG-OE1 3.3Å; D136-Q329 PolarHBondContact OD1-OE1 3.34Å; D136-Q329 PolarHBondContact OD2-NE2 2.99Å
137T79.4Confident83.4Confident3 Ų352.1 Ų52.12%0.01826%0.258CS..Hα-helixtrans-51.1-41.6175.4-55.90000112.7T133 I134 V135 L141 V357 R361T133-T137 PolarHBondContact O-N 2.76Å; T133-T137 PolarHBondContact O-OG1 3.03Å; I134-T137 VanDerWaalsContact O-CB 3.32Å; I134-T137 WeakPolarHBondContact O-CB 3.34Å; I134-T137 PolarHBondContact O-N 3.33Å; V135-T137 VanDerWaalsContact C-N 3.3Å; V135-T137 PolarHBondContact O-N 3.05Å; T137-L141 HydrophobicContact CG2-CD1 4.26Å; T137-L141 WeakPolarHBondContact O-CB 3.13Å; T137-L141 WeakPolarHBondContact O-CD1 3.5Å; T137-L141 VanDerWaalsContact O-CG 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.44Å; T137-L141 PolarHBondContact O-N 3.34Å; T137-L141 VanDerWaalsContact O-N 3.12Å; T137-V357 HydrophobicContact CG2-CG1 3.49Å; T137-V357 VanDerWaalsContact CG2-CG1 3.49Å; T137-R361 HydrophobicContact CG2-CB 4.39Å; T137-R361 HydrophobicContact CG2-CG 3.76Å; T137-R361 WeakPolarHBondContact OG1-CD 3.34Å
138F82.9Confident83Confident108 Ų10850.1 Ų50.147%0.47425%0.254SS..Hα-helixtrans-72.4-35.3175.2-69.2-67000113.2I134 V135 D136 L141 F142 L358I134-F138 HydrophobicContact CG2-CD2 4.43Å; I134-F138 HydrophobicContact CG2-CE2 3.89Å; I134-F138 WeakPolarHBondContact O-CD2 3.29Å; I134-F138 PolarHBondContact O-N 2.9Å; V135-F138 PolarHBondContact O-N 3.44Å; V135-F138 VanDerWaalsContact O-N 3.11Å; D136-F138 PolarHBondContact O-N 2.73Å; D136-F138 VanDerWaalsContact O-N 3.11Å; F138-L141 PolarHBondContact O-N 2.7Å; F138-F142 WeakPolarHBondContact O-CB 3.29Å; F138-F142 PolarHBondContact O-N 2.91Å; F138-L358 HydrophobicContact CE1-CD2 4.31Å; F138-L358 HydrophobicContact CZ-CD2 4.19Å
139F83.4Confident82.6Confident96 Ų9657.1 Ų57.142%0.42128%0.276SS..Hα-helixtrans-65-43.1174.4178.2-106.2000112.1V135 D136 F142 L143 F154V135-F139 PolarHBondContact O-N 2.83Å; D136-F139 CarbonylContact O-C 3.59Å; D136-F139 WeakPolarHBondContact O-CA 3.46Å; D136-F139 WeakPolarHBondContact O-CB 3.33Å; D136-F139 PolarHBondContact O-N 2.83Å; F139-F142 WeakPolarHBondContact O-CB 3.37Å; F139-F142 PolarHBondContact O-N 2.96Å; F139-L143 HydrophobicContact CD1-CD1 4.04Å; F139-L143 HydrophobicContact CE1-CD1 3.45Å; F139-L143 VanDerWaalsContact CE1-CD1 3.45Å; F139-L143 HydrophobicContact CE1-CG 4.22Å; F139-L143 HydrophobicContact CZ-CD1 3.75Å; F139-L143 HydrophobicContact CZ-CD2 4.48Å; F139-L143 HydrophobicContact CZ-CG 4.16Å; F139-L143 PolarHBondContact O-N 3.18Å; F139-F154 HydrophobicContact CE1-CZ 4.19Å
140F79.3Confident82.5Confident7 Ų763.5 Ų63.53%0.03130%0.304CS..Hα-helixtrans-59.5-48.9171.4169.4-111.4000112D136 F142 L143 D144 L151 T332 M333 T336 Y337D136-F140 PolarHBondContact O-N 3.46Å; F140-F142 PolarHBondContact O-N 2.7Å; F140-L143 WeakPolarHBondContact O-CA 3.42Å; F140-L143 PolarHBondContact O-N 2.96Å; F140-D144 PolarHBondContact O-N 2.75Å; F140-L151 HydrophobicContact CE2-CD1 4.15Å; F140-T332 HydrophobicContact CB-CG2 4.43Å; F140-T332 HydrophobicContact CG-CG2 4.48Å; F140-M333 HydrophobicContact CD2-CB 4.03Å; F140-M333 HydrophobicContact CD2-CE 3.75Å; F140-M333 HydrophobicContact CD2-CG 3.52Å; F140-M333 HydrophobicContact CD2-SD 4.43Å; F140-M333 HydrophobicContact CE2-CB 3.71Å; F140-M333 HydrophobicContact CE2-CE 3.86Å; F140-M333 HydrophobicContact CE2-CG 3.74Å; F140-M333 HydrophobicContact CG-CG 4.37Å; F140-M333 HydrophobicContact CZ-CB 4.44Å; F140-T336 HydrophobicContact CD1-CG2 4.4Å; F140-T336 HydrophobicContact CE1-CG2 4.07Å; F140-T336 WeakPolarHBondContact CE1-OG1 3.03Å; F140-T336 VanDerWaalsContact CZ-OG1 3.22Å; F140-T336 WeakPolarHBondContact CZ-OG1 3.49Å; F140-Y337 HydrophobicContact CE2-CE2 4.25Å; F140-Y337 HydrophobicContact CZ-CE2 4.12Å
141L78.8Confident82.2Confident4 Ų463.8 Ų63.82%0.02131%0.306CS..Hα-helixtrans-60.9-29177.3-76165.7000112.6T137 F138 N145 F354 V357T137-L141 HydrophobicContact CG2-CD1 4.26Å; T137-L141 WeakPolarHBondContact O-CB 3.13Å; T137-L141 WeakPolarHBondContact O-CD1 3.5Å; T137-L141 VanDerWaalsContact O-CG 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.44Å; T137-L141 PolarHBondContact O-N 3.34Å; T137-L141 VanDerWaalsContact O-N 3.12Å; F138-L141 PolarHBondContact O-N 2.7Å; L141-N145 PolarHBondContact O-ND2 2.96Å; L141-F354 HydrophobicContact CB-CD1 4.45Å; L141-F354 HydrophobicContact CB-CE1 3.91Å; L141-F354 HydrophobicContact CB-CZ 4.35Å; L141-F354 HydrophobicContact CD1-CD1 3.77Å; L141-F354 HydrophobicContact CD1-CE1 4.04Å; L141-F354 HydrophobicContact CD2-CD1 4.2Å; L141-F354 HydrophobicContact CD2-CE1 4.32Å; L141-F354 HydrophobicContact CD2-CG 4.38Å; L141-F354 HydrophobicContact CG-CD1 4.38Å; L141-F354 HydrophobicContact CG-CE1 4.33Å; L141-V357 HydrophobicContact CD1-CB 4.4Å; L141-V357 HydrophobicContact CD1-CG1 4.05Å; L141-V357 HydrophobicContact CD2-CB 4.12Å; L141-V357 HydrophobicContact CD2-CG1 4.27Å; L141-V357 HydrophobicContact CD2-CG2 4.06Å; L141-V357 HydrophobicContact CG-CG1 4.17Å
142F82.3Confident81.9Confident109 Ų10964.1 Ų64.148%0.47831%0.305SS..Hα-helixtrans-70.2-45.8170.4178.1-103.5000111.7F138 F139 F140 N145 Y146F138-F142 WeakPolarHBondContact O-CB 3.29Å; F138-F142 PolarHBondContact O-N 2.91Å; F139-F142 WeakPolarHBondContact O-CB 3.37Å; F139-F142 PolarHBondContact O-N 2.96Å; F140-F142 PolarHBondContact O-N 2.7Å; F142-N145 PolarHBondContact O-N 3.16Å; F142-N145 PolarHBondContact O-ND2 3.37Å; F142-Y146 HydrophobicContact CD1-CE2 4.04Å; F142-Y146 AromaticContact CE1-CE2 3.61Å; F142-Y146 HydrophobicContact CE1-CE2 3.61Å; F142-Y146 HydrophobicContact CE2-CE2 4.21Å; F142-Y146 AromaticContact CZ-CE2 3.71Å; F142-Y146 HydrophobicContact CZ-CE2 3.71Å; F142-Y146 AromaticContact CZ-CZ 3.93Å; F142-Y146 VanDerWaalsContact CZ-OH 3.23Å; F142-Y146 WeakPolarHBondContact CZ-OH 3.31Å; F142-Y146 WeakPolarHBondContact O-CD2 3.24Å
143L77.9Confident81.9Confident39 Ų3964.5 Ų64.520%0.20432%0.317CS..Hα-helixtrans-63.8-37.4177.9-75.1179.2000114.1F139 F140 N145 Y146 F154F139-L143 HydrophobicContact CD1-CD1 4.04Å; F139-L143 HydrophobicContact CE1-CD1 3.45Å; F139-L143 VanDerWaalsContact CE1-CD1 3.45Å; F139-L143 HydrophobicContact CE1-CG 4.22Å; F139-L143 HydrophobicContact CZ-CD1 3.75Å; F139-L143 HydrophobicContact CZ-CD2 4.48Å; F139-L143 HydrophobicContact CZ-CG 4.16Å; F139-L143 PolarHBondContact O-N 3.18Å; F140-L143 WeakPolarHBondContact O-CA 3.42Å; F140-L143 PolarHBondContact O-N 2.96Å; L143-N145 PolarHBondContact O-N 3.13Å; L143-N145 VanDerWaalsContact O-N 3.16Å; L143-Y146 WeakPolarHBondContact O-CB 3.46Å; L143-Y146 PolarHBondContact O-N 2.89Å; L143-F154 HydrophobicContact CD1-CD1 4.2Å; L143-F154 HydrophobicContact CD1-CE1 4.01Å; L143-F154 HydrophobicContact CD1-CE2 4.41Å; L143-F154 HydrophobicContact CD1-CG 4.46Å; L143-F154 HydrophobicContact CD1-CZ 4.13Å
144D75.3Confident81.9Confident22 Ų2266.8 Ų66.812%0.11833%0.327CS..Hα-helixtrans-57.7-29.6178.118055.6000112.6F140 Y146 G147 Y337 R353F140-D144 PolarHBondContact O-N 2.75Å; D144-Y146 PolarHBondContact O-N 2.68Å; D144-G147 PolarHBondContact O-N 3.37Å; D144-Y337 PolarHBondContact OD1-OH 3.05Å; D144-R353 WeakPolarHBondContact OD2-CD 3.47Å; D144-R353 IonicContact OD2-CZ 3.65Å; D144-R353 IonicContact OD2-NE 3.9Å; D144-R353 IonicContact OD2-NH1 2.67Å; D144-R353 PolarHBondContact OD2-NH1 3.31Å
145N80.1Confident81.9Confident92 Ų9265.6 Ų65.649%0.49232%0.319SS..THydrogen-bonded Turntrans-66.3-16.8175.5-60.2-60.5000113.9L141 F142 L143L141-N145 PolarHBondContact O-ND2 2.96Å; F142-N145 PolarHBondContact O-N 3.16Å; F142-N145 PolarHBondContact O-ND2 3.37Å; L143-N145 PolarHBondContact O-N 3.13Å; L143-N145 VanDerWaalsContact O-N 3.16Å
146Y80.1Confident82.1Confident119 Ų11962.5 Ų62.547%0.46731%0.308SS..THydrogen-bonded Turntrans-87-4.9180-71.1-86.8000113.9F142 L143 D144F142-Y146 HydrophobicContact CD1-CE2 4.04Å; F142-Y146 AromaticContact CE1-CE2 3.61Å; F142-Y146 HydrophobicContact CE1-CE2 3.61Å; F142-Y146 HydrophobicContact CE2-CE2 4.21Å; F142-Y146 AromaticContact CZ-CE2 3.71Å; F142-Y146 HydrophobicContact CZ-CE2 3.71Å; F142-Y146 AromaticContact CZ-CZ 3.93Å; F142-Y146 VanDerWaalsContact CZ-OH 3.23Å; F142-Y146 WeakPolarHBondContact CZ-OH 3.31Å; F142-Y146 WeakPolarHBondContact O-CD2 3.24Å; L143-Y146 WeakPolarHBondContact O-CB 3.46Å; L143-Y146 PolarHBondContact O-N 2.89Å; D144-Y146 PolarHBondContact O-N 2.68Å
147G80.5Confident82.6Confident33 Ų3366.2 Ų66.234%0.3433%0.327SS..  trans85155.7170.500000115.4D144 R149 K150 L151D144-G147 PolarHBondContact O-N 3.37Å; G147-R149 PolarHBondContact O-N 3.47Å; G147-R149 VanDerWaalsContact O-N 3.11Å; G147-K150 PolarHBondContact O-N 2.96Å; G147-K150 VanDerWaalsContact O-N 3.13Å; G147-L151 PolarHBondContact O-N 3.39Å
148L77.1Confident83.2Confident58 Ų5866.6 Ų66.630%0.30433%0.329SS..Hα-helixtrans-50.8-43.4-164-161.278.9000114.9K150 L151 E152L148-K150 PolarHBondContact O-N 2.92Å; L148-L151 CarbonylContact O-C 3.57Å; L148-L151 WeakPolarHBondContact O-CA 3.35Å; L148-L151 WeakPolarHBondContact O-CB 3.37Å; L148-L151 PolarHBondContact O-N 3.17Å; L148-L151 VanDerWaalsContact O-N 3.07Å; L148-E152 WeakPolarHBondContact CD2-OE1 3.36Å; L148-E152 HydrophobicContact CG-CG 4.48Å; L148-E152 PolarHBondContact O-N 2.86Å
149R81.4Confident83.7Confident209 Ų20964.4 Ų64.479%0.78932%0.321SS*.Hα-helixtrans-63.5-35.6-176.4-66.4-174.6-174173.72.1114G147 L151 A153G147-R149 PolarHBondContact O-N 3.47Å; G147-R149 VanDerWaalsContact O-N 3.11Å; R149-L151 VanDerWaalsContact C-N 3.28Å; R149-A153 PolarHBondContact O-N 3.31Å
150K85.3Confident84.2Confident134 Ų13463.4 Ų63.458%0.58332%0.323SS*.Hα-helixtrans-73.2-29.4176.5-75.1177.7173.3178.50111.1G147 L148 A153 F154G147-K150 PolarHBondContact O-N 2.96Å; G147-K150 VanDerWaalsContact O-N 3.13Å; L148-K150 PolarHBondContact O-N 2.92Å; K150-A153 PolarHBondContact O-N 3.38Å; K150-F154 PolarHBondContact O-N 3.46Å
151L81Confident85Confident7 Ų765.4 Ų65.44%0.03733%0.334CS..Hα-helixtrans-78.1-40.3179.4-160.5149.3000111.5F140 G147 L148 R149 A153 F154 F155 M333 Y337F140-L151 HydrophobicContact CE2-CD1 4.15Å; G147-L151 PolarHBondContact O-N 3.39Å; L148-L151 CarbonylContact O-C 3.57Å; L148-L151 WeakPolarHBondContact O-CA 3.35Å; L148-L151 WeakPolarHBondContact O-CB 3.37Å; L148-L151 PolarHBondContact O-N 3.17Å; L148-L151 VanDerWaalsContact O-N 3.07Å; R149-L151 VanDerWaalsContact C-N 3.28Å; L151-A153 VanDerWaalsContact C-N 3.27Å; L151-A153 PolarHBondContact O-N 3.2Å; L151-F154 PolarHBondContact O-N 2.88Å; L151-F154 VanDerWaalsContact O-N 3.11Å; L151-F155 HydrophobicContact CD2-CD2 3.71Å; L151-F155 HydrophobicContact CD2-CE2 3.25Å; L151-F155 HydrophobicContact CD2-CZ 3.92Å; L151-F155 WeakPolarHBondContact O-CD2 3.34Å; L151-F155 PolarHBondContact O-N 2.67Å; L151-M333 HydrophobicContact CD1-CE 3.88Å; L151-M333 HydrophobicContact CD2-CE 3.66Å; L151-M333 HydrophobicContact CG-CE 3.49Å; L151-M333 VanDerWaalsContact CG-CE 3.49Å; L151-Y337 HydrophobicContact CD1-CE2 4.03Å; L151-Y337 WeakPolarHBondContact CD1-OH 3.34Å; L151-Y337 HydrophobicContact CD2-CE2 3.75Å
152E84Confident85.7Confident67 Ų6766.3 Ų66.331%0.31334%0.338SS..Hα-helixtrans-52.6-44.5165.3-76173.3-154.500111.1L148 F155 G156 R223L148-E152 WeakPolarHBondContact CD2-OE1 3.36Å; L148-E152 HydrophobicContact CG-CG 4.48Å; L148-E152 PolarHBondContact O-N 2.86Å; E152-F155 PolarHBondContact O-N 2.93Å; E152-G156 PolarHBondContact O-N 3.16Å; E152-R223 IonicContact OE1-CZ 2.75Å; E152-R223 IonicContact OE1-NH1 3.52Å; E152-R223 IonicContact OE1-NH2 3.13Å; E152-R223 IonicContact OE2-CZ 3.66Å; E152-R223 IonicContact OE2-NH1 2.69Å; E152-R223 PolarHBondContact OE2-NH1 3.25Å; E152-R223 IonicContact OE2-NH2 3.34Å; E152-R223 PolarHBondContact OE2-NH2 3.04Å
153A87.7Confident86.3Confident66 Ų6662.7 Ų62.755%0.54533%0.328SS..Hα-helixtrans-67.3-35.6176.700000113.3R149 K150 L151 G156 L157R149-A153 PolarHBondContact O-N 3.31Å; K150-A153 PolarHBondContact O-N 3.38Å; L151-A153 VanDerWaalsContact C-N 3.27Å; L151-A153 PolarHBondContact O-N 3.2Å; A153-G156 PolarHBondContact O-N 3.17Å; A153-L157 PolarHBondContact O-N 2.97Å
154F88.8Confident87.1Confident49 Ų4966.7 Ų66.722%0.21535%0.349CS..Hα-helixtrans-68.7-39.5175.1-175.2-104.6000112.1F139 L143 K150 L151 G156 L157 L158 M333F139-F154 HydrophobicContact CE1-CZ 4.19Å; L143-F154 HydrophobicContact CD1-CD1 4.2Å; L143-F154 HydrophobicContact CD1-CE1 4.01Å; L143-F154 HydrophobicContact CD1-CE2 4.41Å; L143-F154 HydrophobicContact CD1-CG 4.46Å; L143-F154 HydrophobicContact CD1-CZ 4.13Å; K150-F154 PolarHBondContact O-N 3.46Å; L151-F154 PolarHBondContact O-N 2.88Å; L151-F154 VanDerWaalsContact O-N 3.11Å; F154-G156 VanDerWaalsContact C-N 3.34Å; F154-G156 PolarHBondContact O-N 3.39Å; F154-L157 HydrophobicContact CD2-CD2 4.45Å; F154-L157 WeakPolarHBondContact O-CB 3.45Å; F154-L157 PolarHBondContact O-N 2.93Å; F154-L158 HydrophobicContact CD1-CD1 4.02Å; F154-L158 HydrophobicContact CD1-CG 4.39Å; F154-L158 HydrophobicContact CE1-CD1 3.61Å; F154-L158 HydrophobicContact CE1-CD2 4.47Å; F154-L158 HydrophobicContact CE1-CG 4.1Å; F154-L158 HydrophobicContact CZ-CD1 4.19Å; F154-L158 HydrophobicContact CZ-CD2 4.24Å; F154-L158 HydrophobicContact CZ-CG 4.3Å; F154-L158 PolarHBondContact O-N 3.18Å; F154-M333 HydrophobicContact CD1-CE 3.64Å; F154-M333 HydrophobicContact CD1-SD 3.63Å; F154-M333 HydrophobicContact CE1-CE 4.08Å; F154-M333 HydrophobicContact CE1-SD 3.7Å
155F86.3Confident88Confident40 Ų4066.4 Ų66.418%0.17535%0.348CS..Hα-helixtrans-57.9-45.8168.5-78-51.7000111.9L151 E152 L157 L158 I159 S330 M333 T334L151-F155 HydrophobicContact CD2-CD2 3.71Å; L151-F155 HydrophobicContact CD2-CE2 3.25Å; L151-F155 HydrophobicContact CD2-CZ 3.92Å; L151-F155 WeakPolarHBondContact O-CD2 3.34Å; L151-F155 PolarHBondContact O-N 2.67Å; E152-F155 PolarHBondContact O-N 2.93Å; F155-L157 VanDerWaalsContact C-N 3.26Å; F155-L157 PolarHBondContact O-N 3.47Å; F155-L158 PolarHBondContact O-N 3.46Å; F155-I159 WeakPolarHBondContact O-CB 3.38Å; F155-I159 WeakPolarHBondContact O-CG1 3.35Å; F155-I159 PolarHBondContact O-N 2.9Å; F155-S330 WeakPolarHBondContact CE1-O 3.32Å; F155-M333 HydrophobicContact CD1-SD 4.14Å; F155-M333 HydrophobicContact CE1-CB 3.51Å; F155-M333 HydrophobicContact CE1-CG 4.15Å; F155-M333 HydrophobicContact CE1-SD 3.72Å; F155-M333 HydrophobicContact CZ-CB 3.4Å; F155-M333 VanDerWaalsContact CZ-CB 3.4Å; F155-M333 HydrophobicContact CZ-CG 4.38Å; F155-M333 HydrophobicContact CZ-SD 4.19Å; F155-T334 HydrophobicContact CE1-CG2 4.07Å; F155-T334 HydrophobicContact CZ-CG2 3.93Å
156G89.8Confident88.7Confident33 Ų3362.6 Ų62.634%0.3433%0.327SS..Hα-helixtrans-57.1-38.8175.300000112.8E152 A153 F154 T160E152-G156 PolarHBondContact O-N 3.16Å; A153-G156 PolarHBondContact O-N 3.17Å; F154-G156 VanDerWaalsContact C-N 3.34Å; F154-G156 PolarHBondContact O-N 3.39Å; G156-T160 WeakPolarHBondContact O-CB 3.27Å; G156-T160 PolarHBondContact O-N 3.45Å; G156-T160 PolarHBondContact O-OG1 3.29Å
157L93.4Very high89.4Confident95 Ų9557.6 Ų57.650%0.49731%0.312SS..Hα-helixtrans-64.6-49.3174.1178.564.6000112.1A153 F154 F155 I159 T160 I161A153-L157 PolarHBondContact O-N 2.97Å; F154-L157 HydrophobicContact CD2-CD2 4.45Å; F154-L157 WeakPolarHBondContact O-CB 3.45Å; F154-L157 PolarHBondContact O-N 2.93Å; F155-L157 VanDerWaalsContact C-N 3.26Å; F155-L157 PolarHBondContact O-N 3.47Å; L157-I159 PolarHBondContact O-N 3.19Å; L157-T160 WeakPolarHBondContact O-CB 3.4Å; L157-T160 PolarHBondContact O-N 3.42Å; L157-I161 HydrophobicContact CD1-CD1 4.35Å; L157-I161 HydrophobicContact CG-CD1 4.15Å; L157-I161 WeakPolarHBondContact O-CG1 3.4Å; L157-I161 PolarHBondContact O-N 2.93Å
158L92.8Very high90Very high11 Ų1161.2 Ų61.26%0.05832%0.316CS..Hα-helixtrans-61.8-43.1179-66.5179000112.1F154 F155 T160 I161 M162 A326 Q329 M333F154-L158 HydrophobicContact CD1-CD1 4.02Å; F154-L158 HydrophobicContact CD1-CG 4.39Å; F154-L158 HydrophobicContact CE1-CD1 3.61Å; F154-L158 HydrophobicContact CE1-CD2 4.47Å; F154-L158 HydrophobicContact CE1-CG 4.1Å; F154-L158 HydrophobicContact CZ-CD1 4.19Å; F154-L158 HydrophobicContact CZ-CD2 4.24Å; F154-L158 HydrophobicContact CZ-CG 4.3Å; F154-L158 PolarHBondContact O-N 3.18Å; F155-L158 PolarHBondContact O-N 3.46Å; L158-T160 VanDerWaalsContact C-N 3.32Å; L158-T160 PolarHBondContact O-N 2.78Å; L158-I161 PolarHBondContact O-N 3.45Å; L158-M162 WeakPolarHBondContact O-CG 3.34Å; L158-M162 PolarHBondContact O-N 2.9Å; L158-A326 HydrophobicContact CD2-CB 4.14Å; L158-Q329 HydrophobicContact CD1-CB 3.85Å; L158-Q329 HydrophobicContact CD2-CB 4.26Å; L158-M333 HydrophobicContact CD1-SD 4.41Å
159I91.9Very high90.7Very high63 Ų6358.5 Ų58.532%0.32330%0.302SS..Hα-helixtrans-63.4-38.8175.3-65.7166.6000111.1F155 L157 M162 A163 V250 I254F155-I159 WeakPolarHBondContact O-CB 3.38Å; F155-I159 WeakPolarHBondContact O-CG1 3.35Å; F155-I159 PolarHBondContact O-N 2.9Å; L157-I159 PolarHBondContact O-N 3.19Å; I159-M162 HydrophobicContact CB-CE 4.27Å; I159-M162 HydrophobicContact CG1-CE 3.82Å; I159-M162 PolarHBondContact O-N 3.49Å; I159-A163 WeakPolarHBondContact O-CB 3.39Å; I159-A163 PolarHBondContact O-N 3.48Å; I159-V250 HydrophobicContact CG2-CG1 3.72Å; I159-I254 HydrophobicContact CG2-CD1 4.38Å
160T94.4Very high91.3Very high74 Ų7450 Ų5045%0.45427%0.27SS..Hα-helixtrans-64.7-41174.8-58.10000111.5G156 L157 L158 A163 L164G156-T160 WeakPolarHBondContact O-CB 3.27Å; G156-T160 PolarHBondContact O-N 3.45Å; G156-T160 PolarHBondContact O-OG1 3.29Å; L157-T160 WeakPolarHBondContact O-CB 3.4Å; L157-T160 PolarHBondContact O-N 3.42Å; L158-T160 VanDerWaalsContact C-N 3.32Å; L158-T160 PolarHBondContact O-N 2.78Å; T160-A163 PolarHBondContact O-N 2.72Å; T160-L164 HydrophobicContact CG2-CD1 3.98Å; T160-L164 HydrophobicContact CG2-CG 4.41Å; T160-L164 WeakPolarHBondContact O-CB 3.3Å; T160-L164 VanDerWaalsContact O-CG 3.28Å; T160-L164 WeakPolarHBondContact O-CG 3.44Å; T160-L164 PolarHBondContact O-N 3.26Å
161I95.6Very high91.6Very high50 Ų5048 Ų4826%0.25627%0.268SS..Hα-helixtrans-60-51.8174.7-68.1164.3000109.9L157 L158 A163 L164 T165 V322 A326L157-I161 HydrophobicContact CD1-CD1 4.35Å; L157-I161 HydrophobicContact CG-CD1 4.15Å; L157-I161 WeakPolarHBondContact O-CG1 3.4Å; L157-I161 PolarHBondContact O-N 2.93Å; L158-I161 PolarHBondContact O-N 3.45Å; I161-A163 VanDerWaalsContact C-N 3.34Å; I161-A163 PolarHBondContact O-N 3.49Å; I161-L164 PolarHBondContact O-N 3.47Å; I161-L164 VanDerWaalsContact O-N 3.16Å; I161-T165 HydrophobicContact CG2-CG2 4.15Å; I161-T165 WeakPolarHBondContact O-CG2 3.49Å; I161-T165 PolarHBondContact O-N 3Å; I161-T165 PolarHBondContact O-OG1 3.41Å; I161-T165 VanDerWaalsContact O-OG1 3.11Å; I161-V322 HydrophobicContact CG2-CG1 3.88Å; I161-A326 HydrophobicContact CB-CB 4.14Å; I161-A326 HydrophobicContact CG2-CB 3.76Å
162M93.8Very high92.1Very high23 Ų2349.6 Ų49.611%0.11328%0.278CS..Hα-helixtrans-56-45.4177-69.8-171.4-71.600112.7L158 I159 L164 T165 F166 I254 A326 A327L158-M162 WeakPolarHBondContact O-CG 3.34Å; L158-M162 PolarHBondContact O-N 2.9Å; I159-M162 HydrophobicContact CB-CE 4.27Å; I159-M162 HydrophobicContact CG1-CE 3.82Å; I159-M162 PolarHBondContact O-N 3.49Å; M162-L164 VanDerWaalsContact C-N 3.32Å; M162-L164 PolarHBondContact O-N 3.33Å; M162-T165 PolarHBondContact O-N 3.18Å; M162-T165 PolarHBondContact O-OG1 3.06Å; M162-F166 HydrophobicContact CB-CD2 4.03Å; M162-F166 HydrophobicContact CB-CE2 3.96Å; M162-F166 HydrophobicContact CG-CE2 4.08Å; M162-F166 WeakPolarHBondContact O-CB 3.35Å; M162-F166 WeakPolarHBondContact O-CD2 3.34Å; M162-F166 WeakPolarHBondContact O-CG 3.48Å; M162-F166 PolarHBondContact O-N 2.88Å; M162-I254 HydrophobicContact CB-CD1 4.07Å; M162-A326 HydrophobicContact CG-CB 4Å; M162-A327 HydrophobicContact CG-CB 4.41Å; M162-A327 WeakPolarHBondContact SD-CA 3.35Å; M162-A327 HydrophobicContact SD-CB 3.53Å; M162-A327 VanDerWaalsContact SD-CB 3.53Å
163A94.4Very high92.2Very high33 Ų3346.8 Ų46.827%0.27327%0.266SS..Hα-helixtrans-62.6-38.4178.900000112.5I159 T160 I161 G167 I254I159-A163 WeakPolarHBondContact O-CB 3.39Å; I159-A163 PolarHBondContact O-N 3.48Å; T160-A163 PolarHBondContact O-N 2.72Å; I161-A163 VanDerWaalsContact C-N 3.34Å; I161-A163 PolarHBondContact O-N 3.49Å; A163-G167 WeakPolarHBondContact O-CA 3.19Å; A163-G167 PolarHBondContact O-N 3.09Å; A163-I254 HydrophobicContact CB-CD1 4.19Å; A163-I254 HydrophobicContact CB-CG1 4.25Å
164L95.7Very high92.2Very high123 Ų12350.8 Ų50.864%0.64427%0.273SS*.Hα-helixtrans-74.5-42.5177.4-69.7173.4000112.4T160 I161 M162 Y168T160-L164 HydrophobicContact CG2-CD1 3.98Å; T160-L164 HydrophobicContact CG2-CG 4.41Å; T160-L164 WeakPolarHBondContact O-CB 3.3Å; T160-L164 VanDerWaalsContact O-CG 3.28Å; T160-L164 WeakPolarHBondContact O-CG 3.44Å; T160-L164 PolarHBondContact O-N 3.26Å; I161-L164 PolarHBondContact O-N 3.47Å; I161-L164 VanDerWaalsContact O-N 3.16Å; M162-L164 VanDerWaalsContact C-N 3.32Å; M162-L164 PolarHBondContact O-N 3.33Å; L164-Y168 WeakPolarHBondContact O-CB 3.4Å; L164-Y168 PolarHBondContact O-N 2.95Å
165T95Very high91.9Very high15 Ų1548.8 Ų48.89%0.09227%0.265CS..Hα-helixtrans-68.7-52.5-179.454.80000111.3I161 M162 G167 Y168 E169 I319 V322 G323I161-T165 HydrophobicContact CG2-CG2 4.15Å; I161-T165 WeakPolarHBondContact O-CG2 3.49Å; I161-T165 PolarHBondContact O-N 3Å; I161-T165 PolarHBondContact O-OG1 3.41Å; I161-T165 VanDerWaalsContact O-OG1 3.11Å; M162-T165 PolarHBondContact O-N 3.18Å; M162-T165 PolarHBondContact O-OG1 3.06Å; T165-G167 VanDerWaalsContact C-N 3.32Å; T165-G167 PolarHBondContact O-N 3.45Å; T165-Y168 WeakPolarHBondContact O-CB 3.4Å; T165-Y168 PolarHBondContact O-N 2.85Å; T165-E169 PolarHBondContact O-N 3.08Å; T165-E169 VanDerWaalsContact O-N 3.13Å; T165-I319 WeakPolarHBondContact CB-O 3.32Å; T165-I319 HydrophobicContact CG2-CG2 3.98Å; T165-V322 HydrophobicContact CG2-CB 4.4Å; T165-V322 HydrophobicContact CG2-CG1 4.16Å; T165-G323 WeakPolarHBondContact OG1-CA 3.05Å
166F93.4Very high91.9Very high13 Ų1350.2 Ų50.26%0.05728%0.28CS..Hα-helixtrans-72.9-27.5-180-56.8-51.1000112.1M162 Y170 I254 F257 V258 W320M162-F166 HydrophobicContact CB-CD2 4.03Å; M162-F166 HydrophobicContact CB-CE2 3.96Å; M162-F166 HydrophobicContact CG-CE2 4.08Å; M162-F166 WeakPolarHBondContact O-CB 3.35Å; M162-F166 WeakPolarHBondContact O-CD2 3.34Å; M162-F166 WeakPolarHBondContact O-CG 3.48Å; M162-F166 PolarHBondContact O-N 2.88Å; F166-Y170 WeakPolarHBondContact O-CB 3.33Å; F166-Y170 PolarHBondContact O-N 3.45Å; F166-I254 HydrophobicContact CD2-CG2 3.71Å; F166-I254 HydrophobicContact CE2-CG2 4.27Å; F166-F257 HydrophobicContact CB-CB 4.41Å; F166-V258 HydrophobicContact CB-CG2 4.14Å; F166-V258 HydrophobicContact CD1-CG2 3.87Å; F166-V258 HydrophobicContact CD2-CG2 4.1Å; F166-V258 HydrophobicContact CE1-CG2 4.27Å; F166-V258 HydrophobicContact CE2-CG2 4.47Å; F166-V258 HydrophobicContact CG-CG2 3.78Å; F166-W320 AromaticContact CD1-CE3 3.92Å; F166-W320 HydrophobicContact CD1-CE3 3.92Å; F166-W320 AromaticContact CD1-CZ3 3.79Å; F166-W320 HydrophobicContact CD1-CZ3 3.79Å; F166-W320 HydrophobicContact CE1-CD2 4.3Å; F166-W320 AromaticContact CE1-CE3 3.68Å; F166-W320 HydrophobicContact CE1-CE3 3.68Å; F166-W320 HydrophobicContact CE1-CH2 4.17Å; F166-W320 AromaticContact CE1-CZ3 3.61Å; F166-W320 HydrophobicContact CE1-CZ3 3.61Å
167G94.4Very high91.6Very high13 Ų1353.4 Ų53.413%0.13429%0.286CS..Hα-helixtrans-66.1-37169.400000113.2A163 T165 Y170 V171A163-G167 WeakPolarHBondContact O-CA 3.19Å; A163-G167 PolarHBondContact O-N 3.09Å; T165-G167 VanDerWaalsContact C-N 3.32Å; T165-G167 PolarHBondContact O-N 3.45Å; G167-Y170 PolarHBondContact O-N 3.39Å; G167-V171 WeakPolarHBondContact O-CG2 3.16Å; G167-V171 PolarHBondContact O-N 3.21Å; G167-V171 VanDerWaalsContact O-N 3.07Å
168Y94.9Very high91.1Very high110 Ų11051.1 Ų51.143%0.43129%0.286SS..Hα-helixtrans-63.6-50.1172.4177.8-91.5000111.3L164 T165 Y170 V171 V172 I319L164-Y168 WeakPolarHBondContact O-CB 3.4Å; L164-Y168 PolarHBondContact O-N 2.95Å; T165-Y168 WeakPolarHBondContact O-CB 3.4Å; T165-Y168 PolarHBondContact O-N 2.85Å; Y168-Y170 VanDerWaalsContact C-N 3.27Å; Y168-Y170 PolarHBondContact O-N 3.23Å; Y168-V171 PolarHBondContact O-N 3.04Å; Y168-V171 VanDerWaalsContact O-N 3.12Å; Y168-V172 HydrophobicContact CD1-CG2 4.07Å; Y168-V172 HydrophobicContact CD2-CG2 4.4Å; Y168-V172 HydrophobicContact CE1-CG2 3.65Å; Y168-V172 HydrophobicContact CE2-CG2 4Å; Y168-V172 HydrophobicContact CG-CG2 4.44Å; Y168-V172 WeakPolarHBondContact O-CG2 3.48Å; Y168-V172 PolarHBondContact O-N 3.32Å; Y168-I319 HydrophobicContact CD1-CD1 3.48Å; Y168-I319 VanDerWaalsContact CD1-CD1 3.48Å; Y168-I319 HydrophobicContact CD1-CG2 4.04Å; Y168-I319 HydrophobicContact CE1-CD1 3.38Å; Y168-I319 HydrophobicContact CG-CD1 4.14Å
169E91.5Very high90.4Very high1 Ų151.8 Ų51.81%0.00529%0.293CS..Hα-helixtrans-55-43.3175.7-64.9-53.9129.600111.7T165 V171 V172 A173 V261 A316 I319T165-E169 PolarHBondContact O-N 3.08Å; T165-E169 VanDerWaalsContact O-N 3.13Å; E169-V171 PolarHBondContact O-N 3.25Å; E169-V172 PolarHBondContact O-N 3.24Å; E169-A173 VanDerWaalsContact O-CB 3.23Å; E169-A173 WeakPolarHBondContact O-CB 3.43Å; E169-A173 PolarHBondContact O-N 2.84Å; E169-V261 HydrophobicContact CB-CG1 4.24Å; E169-V261 HydrophobicContact CB-CG2 3.99Å; E169-A316 VanDerWaalsContact OE1-CA 3.25Å; E169-A316 WeakPolarHBondContact OE1-CA 3.46Å; E169-A316 WeakPolarHBondContact OE2-CB 3.47Å; E169-I319 HydrophobicContact CG-CG2 4.49Å; E169-I319 WeakPolarHBondContact OE1-CG2 3.36Å
170Y92.4Very high89.9Confident31 Ų3149.5 Ų49.512%0.12228%0.282CS..Hα-helixtrans-62.1-41.6177.4-178.7-96.9000113.3F166 G167 Y168 H174 P175 Q177 L180 F257 A260 V261F166-Y170 WeakPolarHBondContact O-CB 3.33Å; F166-Y170 PolarHBondContact O-N 3.45Å; G167-Y170 PolarHBondContact O-N 3.39Å; Y168-Y170 VanDerWaalsContact C-N 3.27Å; Y168-Y170 PolarHBondContact O-N 3.23Å; Y170-H174 PolarHBondContact O-N 3.15Å; Y170-P175 HydrophobicContact CD2-CG 3.73Å; Y170-P175 HydrophobicContact CE2-CG 3.44Å; Y170-P175 VanDerWaalsContact CE2-CG 3.44Å; Y170-P175 HydrophobicContact CG-CG 4.47Å; Y170-P175 WeakPolarHBondContact O-CD 3.49Å; Y170-Q177 VanDerWaalsContact OH-CD 3.27Å; Y170-Q177 PolarHBondContact OH-NE2 3.07Å; Y170-Q177 PolarHBondContact OH-OE1 3.06Å; Y170-L180 HydrophobicContact CE2-CD1 3.87Å; Y170-L180 WeakPolarHBondContact OH-CD1 3.37Å; Y170-F257 AromaticContact CD1-CD1 3.72Å; Y170-F257 HydrophobicContact CD1-CD1 3.72Å; Y170-F257 AromaticContact CD1-CE1 3.65Å; Y170-F257 HydrophobicContact CD1-CE1 3.65Å; Y170-F257 HydrophobicContact CD1-CZ 4.4Å; Y170-F257 HydrophobicContact CD2-CB 4.2Å; Y170-F257 AromaticContact CD2-CD1 3.5Å; Y170-F257 HydrophobicContact CD2-CD1 3.5Å; Y170-F257 HydrophobicContact CD2-CE1 4.24Å; Y170-F257 HydrophobicContact CD2-CG 4.15Å; Y170-F257 HydrophobicContact CE1-CD1 4.11Å; Y170-F257 AromaticContact CE1-CE1 3.86Å; Y170-F257 HydrophobicContact CE1-CE1 3.86Å; Y170-F257 AromaticContact CE2-CD1 3.88Å; Y170-F257 HydrophobicContact CE2-CD1 3.88Å; Y170-F257 HydrophobicContact CE2-CE1 4.4Å; Y170-F257 HydrophobicContact CG-CB 4.28Å; Y170-F257 AromaticContact CG-CD1 3.39Å; Y170-F257 HydrophobicContact CG-CD1 3.39Å; Y170-F257 AromaticContact CG-CE1 3.84Å; Y170-F257 HydrophobicContact CG-CE1 3.84Å; Y170-F257 AromaticContact CG-CG 3.93Å; Y170-F257 HydrophobicContact CG-CG 3.93Å; Y170-A260 HydrophobicContact CD2-CB 3.88Å; Y170-A260 HydrophobicContact CE2-CB 3.63Å; Y170-V261 VanDerWaalsContact CA-CG2 3.47Å
171V92.9Very high89.4Confident91 Ų9151.6 Ų51.655%0.55229%0.289SS*.Hα-helixtrans-67.4-44.2177171.20000110.7G167 Y168 E169 H174G167-V171 WeakPolarHBondContact O-CG2 3.16Å; G167-V171 PolarHBondContact O-N 3.21Å; G167-V171 VanDerWaalsContact O-N 3.07Å; Y168-V171 PolarHBondContact O-N 3.04Å; Y168-V171 VanDerWaalsContact O-N 3.12Å; E169-V171 PolarHBondContact O-N 3.25Å; V171-H174 PolarHBondContact O-CD2 3.25Å; V171-H174 PolarHBondContact O-CE1 3.48Å; V171-H174 PolarHBondContact O-N 3.12Å; V171-H174 PolarHBondContact O-ND1 2.98Å; V171-H174 PolarHBondContact O-NE2 3.36Å
172V91Very high88.8Confident41 Ų4155.9 Ų55.925%0.24831%0.306CS..Hα-helixtrans-69.6-38.2-178.2173.90000112.4Y168 E169 H174 F312Y168-V172 HydrophobicContact CD1-CG2 4.07Å; Y168-V172 HydrophobicContact CD2-CG2 4.4Å; Y168-V172 HydrophobicContact CE1-CG2 3.65Å; Y168-V172 HydrophobicContact CE2-CG2 4Å; Y168-V172 HydrophobicContact CG-CG2 4.44Å; Y168-V172 WeakPolarHBondContact O-CG2 3.48Å; Y168-V172 PolarHBondContact O-N 3.32Å; E169-V172 PolarHBondContact O-N 3.24Å; V172-H174 PolarHBondContact O-CD2 2.89Å; V172-H174 PolarHBondContact O-N 3.17Å; V172-F312 HydrophobicContact CG1-CB 3.76Å; V172-F312 HydrophobicContact CG1-CD1 3.85Å; V172-F312 HydrophobicContact CG1-CG 3.87Å
173A86.7Confident88Confident7 Ų755 Ų556%0.05830%0.302CS..Hα-helixtrans-69.3-16.7178.100000113.8E169 P175 V261 F312E169-A173 VanDerWaalsContact O-CB 3.23Å; E169-A173 WeakPolarHBondContact O-CB 3.43Å; E169-A173 PolarHBondContact O-N 2.84Å; A173-P175 VanDerWaalsContact C-CD 3.5Å; A173-V261 HydrophobicContact CB-CG2 4.15Å; A173-F312 HydrophobicContact CB-CE2 3.98Å; A173-F312 HydrophobicContact CB-CZ 3.8Å
174H86.4Confident87.5Confident150 Ų15054.9 Ų54.969%0.69430%0.297SS*.  trans42.851.1-178.8-70.8-67.6000114.8Y170 V171 V172Y170-H174 PolarHBondContact O-N 3.15Å; V171-H174 PolarHBondContact O-CD2 3.25Å; V171-H174 PolarHBondContact O-CE1 3.48Å; V171-H174 PolarHBondContact O-N 3.12Å; V171-H174 PolarHBondContact O-ND1 2.98Å; V171-H174 PolarHBondContact O-NE2 3.36Å; V172-H174 PolarHBondContact O-CD2 2.89Å; V172-H174 PolarHBondContact O-N 3.17Å
175P83.9Confident86.7Confident7 Ų754 Ų545%0.04530%0.297CS..  trans-65.6151.7-176.229.5-35.4000111.8Y170 A173 Q177 L180 A260 Q264Y170-P175 HydrophobicContact CD2-CG 3.73Å; Y170-P175 HydrophobicContact CE2-CG 3.44Å; Y170-P175 VanDerWaalsContact CE2-CG 3.44Å; Y170-P175 HydrophobicContact CG-CG 4.47Å; Y170-P175 WeakPolarHBondContact O-CD 3.49Å; A173-P175 VanDerWaalsContact C-CD 3.5Å; P175-Q177 PolarHBondContact O-N 3.5Å; P175-Q177 PolarHBondContact O-NE2 2.98Å; P175-L180 HydrophobicContact CB-CD1 4.12Å; P175-L180 HydrophobicContact CG-CD1 4.06Å; P175-A260 HydrophobicContact CB-CB 4.35Å; P175-A260 HydrophobicContact CG-CB 4.18Å; P175-Q264 HydrophobicContact CB-CB 4.3Å
176S84.8Confident85.8Confident70 Ų7057.6 Ų57.649%0.4932%0.315SS..  trans-70.6100.1-173.866.10000112.9G178 A179 L180S176-G178 PolarHBondContact O-N 3.33Å; S176-G178 VanDerWaalsContact O-N 3.09Å; S176-A179 PolarHBondContact O-N 3.24Å; S176-A179 VanDerWaalsContact OG-CB 3.29Å; S176-A179 WeakPolarHBondContact OG-CB 3.23Å; S176-L180 PolarHBondContact O-N 2.91Å
177Q84.8Confident84.8Confident100 Ų10061.3 Ų61.347%0.46734%0.34SS..Hα-helixtrans-54.3-35.9-174.5-55.6-59-67.700113.5Y170 P175 A179 L180 L181Y170-Q177 VanDerWaalsContact OH-CD 3.27Å; Y170-Q177 PolarHBondContact OH-NE2 3.07Å; Y170-Q177 PolarHBondContact OH-OE1 3.06Å; P175-Q177 PolarHBondContact O-N 3.5Å; P175-Q177 PolarHBondContact O-NE2 2.98Å; Q177-A179 VanDerWaalsContact C-N 3.35Å; Q177-A179 PolarHBondContact O-N 3.26Å; Q177-L180 PolarHBondContact O-N 3.5Å; Q177-L181 WeakPolarHBondContact O-CB 3.34Å; Q177-L181 PolarHBondContact O-N 2.68Å
178G82.2Confident83.4Confident47 Ų4764.5 Ų64.549%0.48536%0.357SS..Hα-helixtrans-71.2-22.9178.400000114.8S176 K182S176-G178 PolarHBondContact O-N 3.33Å; S176-G178 VanDerWaalsContact O-N 3.09Å; G178-K182 WeakPolarHBondContact O-CD 3.34Å; G178-K182 VanDerWaalsContact O-CG 3.28Å; G178-K182 WeakPolarHBondContact O-CG 3.5Å
179A77.8Confident82Confident26 Ų2661.1 Ų61.122%0.21535%0.349CS..Hα-helixtrans-80.8-45.517100000110.4S176 Q177 L181 K182 G183S176-A179 PolarHBondContact O-N 3.24Å; S176-A179 VanDerWaalsContact OG-CB 3.29Å; S176-A179 WeakPolarHBondContact OG-CB 3.23Å; Q177-A179 VanDerWaalsContact C-N 3.35Å; Q177-A179 PolarHBondContact O-N 3.26Å; A179-L181 PolarHBondContact O-N 2.76Å; A179-K182 WeakPolarHBondContact O-CB 3.39Å; A179-K182 PolarHBondContact O-N 3.49Å; A179-K182 VanDerWaalsContact O-N 3.08Å; A179-G183 PolarHBondContact O-N 3.15Å
180L82.2Confident80.1Confident15 Ų1566 Ų668%0.07938%0.381CS..Hα-helixtrans-55.7-47.7177.3-63.5176.2000112.4L49 Y170 P175 S176 Q177 K182 G183 L184 A260L49-L180 HydrophobicContact CD1-CD2 3.69Å; Y170-L180 HydrophobicContact CE2-CD1 3.87Å; Y170-L180 WeakPolarHBondContact OH-CD1 3.37Å; P175-L180 HydrophobicContact CB-CD1 4.12Å; P175-L180 HydrophobicContact CG-CD1 4.06Å; S176-L180 PolarHBondContact O-N 2.91Å; Q177-L180 PolarHBondContact O-N 3.5Å; L180-K182 VanDerWaalsContact C-N 3.3Å; L180-K182 PolarHBondContact O-N 3.05Å; L180-G183 PolarHBondContact O-N 2.95Å; L180-L184 WeakPolarHBondContact O-CB 3.19Å; L180-L184 PolarHBondContact O-N 3.45Å; L180-A260 HydrophobicContact CD1-CB 3.86Å; L180-A260 HydrophobicContact CD2-CB 3.62Å; L180-A260 HydrophobicContact CG-CB 4.41Å
181L84.3Confident78.4Confident117 Ų11767.8 Ų67.861%0.61341%0.408SS*.Hα-helixtrans-63-34.4177.4-79.2165.3000113.1Q177 A179 V185Q177-L181 WeakPolarHBondContact O-CB 3.34Å; Q177-L181 PolarHBondContact O-N 2.68Å; A179-L181 PolarHBondContact O-N 2.76Å; L181-V185 WeakPolarHBondContact O-CG2 3.22Å
182K81.8Confident76.9Confident141 Ų14167.2 Ų67.261%0.61341%0.408SS*.Hα-helixtrans-69.9-48.9174.4-73.8174.1-174.4179.10110.8G178 A179 L180 L184 V185 L186G178-K182 WeakPolarHBondContact O-CD 3.34Å; G178-K182 VanDerWaalsContact O-CG 3.28Å; G178-K182 WeakPolarHBondContact O-CG 3.5Å; A179-K182 WeakPolarHBondContact O-CB 3.39Å; A179-K182 PolarHBondContact O-N 3.49Å; A179-K182 VanDerWaalsContact O-N 3.08Å; L180-K182 VanDerWaalsContact C-N 3.3Å; L180-K182 PolarHBondContact O-N 3.05Å; K182-L184 PolarHBondContact O-N 3.21Å; K182-V185 PolarHBondContact O-N 3.4Å; K182-V185 VanDerWaalsContact O-N 3.16Å; K182-L186 HydrophobicContact CB-CD1 4.27Å; K182-L186 HydrophobicContact CG-CD1 4.43Å; K182-L186 WeakPolarHBondContact O-CB 3.44Å; K182-L186 PolarHBondContact O-N 3.39Å
183G78.7Confident75.7Confident3 Ų366.8 Ų66.83%0.03141%0.411CS..Hα-helixtrans-62.3-27.3179.400000114.3D46 W50 A179 L180D46-G183 CarbonylContact O-C 3.51Å; D46-G183 WeakPolarHBondContact O-CA 3.29Å; W50-G183 PolarHBondContact N-O 2.75Å; A179-G183 PolarHBondContact O-N 3.15Å; L180-G183 PolarHBondContact O-N 2.95Å
184L82.8Confident74.8Confident31 Ų3170.6 Ų70.616%0.16243%0.428CS..Hα-helixtrans-71.9-35.9175-155.984.9000113.4L49 L53 L180 K182 F252 L256L49-L184 HydrophobicContact CB-CD1 4.45Å; L53-L184 HydrophobicContact CB-CD1 4.27Å; L53-L184 HydrophobicContact CB-CG 4.36Å; L53-L184 HydrophobicContact CD2-CD2 4.22Å; L53-L184 HydrophobicContact CD2-CG 4.09Å; L180-L184 WeakPolarHBondContact O-CB 3.19Å; L180-L184 PolarHBondContact O-N 3.45Å; K182-L184 PolarHBondContact O-N 3.21Å; L184-F252 HydrophobicContact CD1-CE2 4.11Å; L184-F252 HydrophobicContact CD1-CZ 3.71Å; L184-F252 HydrophobicContact CD2-CZ 4.23Å; L184-L256 HydrophobicContact CD1-CD1 4.39Å
185V79.1Confident73.9Confident105 Ų10565.6 Ų65.664%0.63641%0.409SS*.Hα-helixtrans-103.2-32.7-168.9178.80000112.8L181 K182 P187L181-V185 WeakPolarHBondContact O-CG2 3.22Å; K182-V185 PolarHBondContact O-N 3.4Å; K182-V185 VanDerWaalsContact O-N 3.16Å; V185-P187 WeakPolarHBondContact O-CD 3.25Å
186L76.8Confident73.4Confident90 Ų9066.7 Ų66.747%0.47141%0.413SS..  trans-99.3112-175.1-68.6165.2000110.7K182 T188K182-L186 HydrophobicContact CB-CD1 4.27Å; K182-L186 HydrophobicContact CG-CD1 4.43Å; K182-L186 WeakPolarHBondContact O-CB 3.44Å; K182-L186 PolarHBondContact O-N 3.39Å; L186-T188 HydrophobicContact CB-CG2 4.29Å; L186-T188 PolarHBondContact O-N 3.42Å
187P71.9Confident72.8Confident91 Ų9166.5 Ų66.559%0.59141%0.406SS*.  trans-76.176.3173.132.3-34.9000110.2W50 V185W50-P187 HydrophobicContact CD2-CB 3.82Å; W50-P187 HydrophobicContact CE3-CB 4.11Å; W50-P187 HydrophobicContact CG-CB 4.12Å; V185-P187 WeakPolarHBondContact O-CD 3.25Å
188T65.5Low72.2Confident81 Ų8164.7 Ų64.750%0.49740%0.4SS..  trans-110.2112.1176.751.50000110.8L186 P190L186-T188 HydrophobicContact CB-CG2 4.29Å; L186-T188 PolarHBondContact O-N 3.42Å; T188-P190 WeakPolarHBondContact O-CD 3.46Å
189C64.4Low71.8Confident38 Ų3866.2 Ų66.226%0.25739%0.394SS..  trans-121.183173.1-169.60000109.9G191 C192C189-G191 PolarHBondContact O-N 3.06Å; C189-C192 HydrophobicContact CB-CB 3.91Å; C189-C192 WeakPolarHBondContact CB-SG 3.28Å; C189-C192 WeakPolarHBondContact SG-CA 3.21Å; C189-C192 WeakPolarHBondContact SG-CB 3.48Å; C189-C192 CovalentContact SG-SG 2.03Å; C189-C192 PolarHBondContact SG-SG 3.2Å
190P52.6Low71.9Confident105 Ų10565.7 Ų65.768%0.68239%0.39SS*.THydrogen-bonded Turntrans-72.29017930.5-33.6000110.2T188T188-P190 WeakPolarHBondContact O-CD 3.46Å
191G55.6Low71.6Confident67 Ų6765.5 Ų65.569%0.69139%0.39SS*.THydrogen-bonded Turntrans110.821178.300000115.9C189 G193C189-G191 PolarHBondContact O-N 3.06Å; G191-G193 PolarHBondContact O-N 3.03Å
192C62.3Low71.4Confident79 Ų7960.4 Ų60.453%0.53437%0.365SS..  trans-47.1105.2176.2-105.60000113C189C189-C192 HydrophobicContact CB-CB 3.91Å; C189-C192 WeakPolarHBondContact CB-SG 3.28Å; C189-C192 WeakPolarHBondContact SG-CA 3.21Å; C189-C192 WeakPolarHBondContact SG-CB 3.48Å; C189-C192 CovalentContact SG-SG 2.03Å; C189-C192 PolarHBondContact SG-SG 3.2Å
193G65.8Low71.4Confident32 Ų3254.9 Ų54.933%0.3334%0.342SS..  trans-100.9-161.4173.100000112.1G191 E196 L197G191-G193 PolarHBondContact O-N 3.03Å; G193-E196 WeakPolarHBondContact CA-OE2 3.37Å; G193-E196 PolarHBondContact N-OE2 3.11Å; G193-L197 WeakPolarHBondContact O-CB 3.42Å
194Q66.8Low71.6Confident88 Ų8855.8 Ų55.841%0.41135%0.347SS..Hα-helixtrans-63.2-45.4173.3-67.5-79.2-15.800113.5L198 Y438 S442Q194-L198 WeakPolarHBondContact O-CG 3.32Å; Q194-L198 PolarHBondContact O-N 2.82Å; Q194-Y438 PolarHBondContact NE2-OH 2.95Å; Q194-Y438 PolarHBondContact OE1-OH 3.34Å; Q194-S442 PolarHBondContact OE1-OG 2.94Å
195P67.9Low71.6Confident44 Ų4454.3 Ų54.329%0.28634%0.339SS..Hα-helixtrans-73.4-37.9-17327.9-32.3000113.2I40 L197 L198 Q199I40-P195 HydrophobicContact CD1-CB 4.14Å; I40-P195 HydrophobicContact CG1-CB 4.03Å; I40-P195 HydrophobicContact CG2-CB 4.09Å; P195-L197 VanDerWaalsContact C-N 3.3Å; P195-L197 PolarHBondContact O-N 3.4Å; P195-L198 PolarHBondContact O-N 2.88Å; P195-Q199 PolarHBondContact O-N 3.38Å
196E72.6Confident71.8Confident30 Ų3051.3 Ų51.314%0.1433%0.325CS..Hα-helixtrans-66.5-35.6177.5-55.778-171.500111P43 G193 Q199 A200P43-E196 HydrophobicContact CB-CG 4.41Å; P43-E196 HydrophobicContact CG-CG 4.22Å; G193-E196 WeakPolarHBondContact CA-OE2 3.37Å; G193-E196 PolarHBondContact N-OE2 3.11Å; E196-Q199 PolarHBondContact O-N 2.96Å; E196-A200 WeakPolarHBondContact O-CB 3.3Å; E196-A200 PolarHBondContact O-N 3.27Å
197L73.3Confident72.3Confident66 Ų6648.2 Ų48.235%0.34631%0.309SS..Hα-helixtrans-69.5-40174.1-177.655.9000111.8G193 P195 Q199 A200 V201 Y438G193-L197 WeakPolarHBondContact O-CB 3.42Å; P195-L197 VanDerWaalsContact C-N 3.3Å; P195-L197 PolarHBondContact O-N 3.4Å; L197-Q199 VanDerWaalsContact C-N 3.32Å; L197-Q199 PolarHBondContact O-N 2.9Å; L197-A200 PolarHBondContact O-N 3.49Å; L197-V201 HydrophobicContact CD1-CG2 4.34Å; L197-V201 WeakPolarHBondContact O-CB 3.24Å; L197-V201 VanDerWaalsContact O-CG2 3.25Å; L197-V201 WeakPolarHBondContact O-CG2 3.13Å; L197-V201 PolarHBondContact O-N 3.39Å; L197-Y438 HydrophobicContact CD2-CD1 4.06Å; L197-Y438 HydrophobicContact CD2-CE1 3.37Å; L197-Y438 HydrophobicContact CD2-CE2 4.38Å; L197-Y438 HydrophobicContact CG-CE1 4.15Å
198L72.1Confident73.1Confident63 Ų6344.2 Ų44.233%0.3328%0.283SS..Hα-helixtrans-60.4-41.4171.9-76.8165.9000111.6Q194 P195 V201 G202 F439Q194-L198 WeakPolarHBondContact O-CG 3.32Å; Q194-L198 PolarHBondContact O-N 2.82Å; P195-L198 PolarHBondContact O-N 2.88Å; L198-V201 PolarHBondContact O-N 2.87Å; L198-G202 PolarHBondContact O-N 3.04Å; L198-F439 HydrophobicContact CD2-CD2 3.71Å; L198-F439 HydrophobicContact CD2-CE2 3.59Å
199Q74.8Confident74.3Confident78 Ų7842.1 Ų42.136%0.36427%0.268SS..Hα-helixtrans-64.2-43.8174.9-167.5179.314.300111.9L48 P195 E196 L197 V201 G202 I203L48-Q199 HydrophobicContact CD1-CB 4.33Å; L48-Q199 VanDerWaalsContact CD1-CD 3.5Å; L48-Q199 HydrophobicContact CD1-CG 3.9Å; P195-Q199 PolarHBondContact O-N 3.38Å; E196-Q199 PolarHBondContact O-N 2.96Å; L197-Q199 VanDerWaalsContact C-N 3.32Å; L197-Q199 PolarHBondContact O-N 2.9Å; Q199-V201 VanDerWaalsContact C-N 3.33Å; Q199-V201 PolarHBondContact O-N 3.49Å; Q199-G202 PolarHBondContact O-N 2.98Å; Q199-I203 HydrophobicContact CG-CD1 4.47Å; Q199-I203 WeakPolarHBondContact O-CG1 3.09Å; Q199-I203 PolarHBondContact O-N 3.31Å
200A78.1Confident75.6Confident15 Ų1540.3 Ų40.312%0.12426%0.255CS..Hα-helixtrans-60.8-40.717500000112.4L48 V51 E196 L197 I203 V204L48-A200 HydrophobicContact CD2-CB 4.01Å; V51-A200 HydrophobicContact CG1-CB 4.24Å; V51-A200 HydrophobicContact CG2-CB 4.25Å; E196-A200 WeakPolarHBondContact O-CB 3.3Å; E196-A200 PolarHBondContact O-N 3.27Å; L197-A200 PolarHBondContact O-N 3.49Å; A200-I203 PolarHBondContact O-N 3.07Å; A200-V204 WeakPolarHBondContact O-CG2 3.37Å; A200-V204 PolarHBondContact O-N 3Å
201V77Confident77.5Confident12 Ų1235.3 Ų35.37%0.07322%0.223CC..Hα-helixtrans-66.2-39174.7170.90000111.2L197 L198 Q199 V204 G205 S392 I435L197-V201 HydrophobicContact CD1-CG2 4.34Å; L197-V201 WeakPolarHBondContact O-CB 3.24Å; L197-V201 VanDerWaalsContact O-CG2 3.25Å; L197-V201 WeakPolarHBondContact O-CG2 3.13Å; L197-V201 PolarHBondContact O-N 3.39Å; L198-V201 PolarHBondContact O-N 2.87Å; Q199-V201 VanDerWaalsContact C-N 3.33Å; Q199-V201 PolarHBondContact O-N 3.49Å; V201-V204 PolarHBondContact O-N 3.16Å; V201-G205 PolarHBondContact O-N 3.48Å; V201-S392 VanDerWaalsContact CG1-OG 3.24Å; V201-S392 WeakPolarHBondContact CG1-OG 3.12Å; V201-S392 WeakPolarHBondContact O-CB 3.36Å; V201-S392 PolarHBondContact O-OG 3.36Å; V201-I435 HydrophobicContact CB-CG2 4.38Å; V201-I435 HydrophobicContact CG1-CG2 3.78Å; V201-I435 HydrophobicContact CG2-CG2 3.64Å
202G78.6Confident79.2Confident10 Ų1033.2 Ų33.210%0.10320%0.196CC..Hα-helixtrans-60.3-44.6171.100000113.1L198 Q199 V204 G205 A206L198-G202 PolarHBondContact O-N 3.04Å; Q199-G202 PolarHBondContact O-N 2.98Å; G202-V204 VanDerWaalsContact C-N 3.34Å; G202-V204 PolarHBondContact O-N 2.84Å; G202-G205 PolarHBondContact O-N 2.81Å; G202-A206 WeakPolarHBondContact O-CB 3.47Å; G202-A206 PolarHBondContact O-N 2.89Å
203I82.6Confident80.6Confident24 Ų2429.6 Ų29.612%0.12317%0.171CC..Hα-helixtrans-60.2-42.3175.1-69.3165.5000111.1L48 V51 L52 Q199 A200 A206 I207L48-I203 HydrophobicContact CB-CD1 3.97Å; L48-I203 HydrophobicContact CD1-CD1 4.02Å; L48-I203 HydrophobicContact CG-CD1 4.47Å; V51-I203 HydrophobicContact CG1-CB 4.48Å; V51-I203 HydrophobicContact CG1-CG2 4.16Å; L52-I203 HydrophobicContact CD1-CG2 4.31Å; Q199-I203 HydrophobicContact CG-CD1 4.47Å; Q199-I203 WeakPolarHBondContact O-CG1 3.09Å; Q199-I203 PolarHBondContact O-N 3.31Å; A200-I203 PolarHBondContact O-N 3.07Å; I203-A206 PolarHBondContact O-N 3.5Å; I203-I207 HydrophobicContact CG2-CD1 3.97Å; I203-I207 WeakPolarHBondContact O-CG1 3.23Å; I203-I207 PolarHBondContact O-N 2.87Å; I203-I207 VanDerWaalsContact O-N 3.08Å
204V83.9Confident82Confident22 Ų2228.2 Ų28.213%0.13316%0.156CC..Hα-helixtrans-63-44.2175.7172.40000111.3V51 A55 A200 V201 G202 I208 L395V51-V204 HydrophobicContact CG1-CG2 4.04Å; A55-V204 HydrophobicContact CB-CG2 4.08Å; A200-V204 WeakPolarHBondContact O-CG2 3.37Å; A200-V204 PolarHBondContact O-N 3Å; V201-V204 PolarHBondContact O-N 3.16Å; G202-V204 VanDerWaalsContact C-N 3.34Å; G202-V204 PolarHBondContact O-N 2.84Å; V204-I208 HydrophobicContact CG1-CD1 4.12Å; V204-I208 WeakPolarHBondContact O-CB 3.47Å; V204-I208 WeakPolarHBondContact O-CG1 3.47Å; V204-I208 PolarHBondContact O-N 3.35Å; V204-L395 HydrophobicContact CG1-CD2 4.19Å
205G81.9Confident83.1Confident0 Ų024.3 Ų24.30%014%0.138CC..Hα-helixtrans-65.5-38.517700000114V201 G202V201-G205 PolarHBondContact O-N 3.48Å; G202-G205 PolarHBondContact O-N 2.81Å
206A83.3Confident84.2Confident42 Ų4224.9 Ų24.935%0.34714%0.137SC..Hα-helixtrans-67.6-39.7178.100000112.5G202 I203 M209G202-A206 WeakPolarHBondContact O-CB 3.47Å; G202-A206 PolarHBondContact O-N 2.89Å; I203-A206 PolarHBondContact O-N 3.5Å; A206-M209 WeakPolarHBondContact O-CG 3.33Å
207I87.6Confident85.3Confident26 Ų2623.5 Ų23.513%0.13313%0.13CC..Hα-helixtrans-76.6-46.6176.7-67.3166.6000111.4L52 A55 I203 M209L52-I207 HydrophobicContact CD1-CD1 3.65Å; L52-I207 HydrophobicContact CG-CD1 4.17Å; A55-I207 HydrophobicContact CB-CB 4.33Å; A55-I207 HydrophobicContact CB-CD1 3.66Å; A55-I207 HydrophobicContact CB-CG2 4.45Å; I203-I207 HydrophobicContact CG2-CD1 3.97Å; I203-I207 WeakPolarHBondContact O-CG1 3.23Å; I203-I207 PolarHBondContact O-N 2.87Å; I203-I207 VanDerWaalsContact O-N 3.08Å; I207-M209 PolarHBondContact O-N 2.83Å
208I88.9Confident86.1Confident6 Ų620.4 Ų20.43%0.03112%0.115CC..SBendtrans-97.973.4-173.1-43.6-178.1000109.1A55 L58 V204 I213 L395A55-I208 WeakPolarHBondContact O-CD1 3.31Å; L58-I208 HydrophobicContact CB-CD1 3.83Å; L58-I208 HydrophobicContact CD2-CD1 3.62Å; L58-I208 HydrophobicContact CG-CD1 3.56Å; V204-I208 HydrophobicContact CG1-CD1 4.12Å; V204-I208 WeakPolarHBondContact O-CB 3.47Å; V204-I208 WeakPolarHBondContact O-CG1 3.47Å; V204-I208 PolarHBondContact O-N 3.35Å; I208-I213 HydrophobicContact CG2-CD1 4.42Å; I208-L395 HydrophobicContact CB-CD1 4.15Å; I208-L395 HydrophobicContact CB-CD2 4.3Å; I208-L395 HydrophobicContact CG2-CD1 3.63Å; I208-L395 HydrophobicContact CG2-CD2 4.41Å; I208-L395 WeakPolarHBondContact O-CD1 3.28Å
209M90.6Very high86.9Confident37 Ų3720 Ų2018%0.18211%0.112CC..  trans-69.7125.2-178.5-55.417610400110.9S104 A206 I207 H211 N212S104-M209 WeakPolarHBondContact OG-CE 3.2Å; A206-M209 WeakPolarHBondContact O-CG 3.33Å; I207-M209 PolarHBondContact O-N 2.83Å; M209-H211 VanDerWaalsContact C-N 3.33Å; M209-H211 PolarHBondContact O-N 3.47Å; M209-N212 HydrophobicContact CB-CB 4.23Å; M209-N212 PolarHBondContact O-N 3.47Å; M209-N212 PolarHBondContact SD-ND2 3.33Å
210P91.5Very high87.6Confident0 Ų016.6 Ų16.60%010%0.097CC..Hα-helixtrans-59.4-41.3-174.7-22.430.9000113.1I97 A100 N212 I213 Y214 Q391 L394 A398I97-P210 HydrophobicContact CD1-CB 4.18Å; A100-P210 HydrophobicContact CB-CB 4.24Å; A100-P210 HydrophobicContact CB-CG 4.24Å; P210-N212 VanDerWaalsContact C-N 3.32Å; P210-N212 PolarHBondContact O-N 3.4Å; P210-I213 WeakPolarHBondContact O-CB 3.42Å; P210-I213 PolarHBondContact O-N 2.84Å; P210-Y214 WeakPolarHBondContact O-CD2 3.41Å; P210-Q391 VanDerWaalsContact CD-OE1 3.32Å; P210-Q391 WeakPolarHBondContact CG-O 3.35Å; P210-L394 HydrophobicContact CG-CB 4.25Å; P210-A398 HydrophobicContact CB-CB 3.74Å; P210-A398 WeakPolarHBondContact O-CB 3.14Å
211H91.6Very high88Confident0 Ų019.1 Ų19.10%011%0.105CC..Hα-helixtrans-68.6-29-17864.3-102.8000112.7I101 S104 M209 I213 Y214 L215 A338I101-H211 HydrophobicContact CD1-CB 4.4Å; I101-H211 HydrophobicContact CG1-CB 3.59Å; S104-H211 VanDerWaalsContact CB-CE1 3.49Å; S104-H211 WeakPolarHBondContact CB-CE1 3.48Å; S104-H211 PolarHBondContact OG-CE1 3.07Å; M209-H211 VanDerWaalsContact C-N 3.33Å; M209-H211 PolarHBondContact O-N 3.47Å; H211-I213 VanDerWaalsContact C-N 3.28Å; H211-I213 PolarHBondContact O-N 2.86Å; H211-Y214 PolarHBondContact O-N 3.14Å; H211-Y214 VanDerWaalsContact O-N 3.17Å; H211-L215 PolarHBondContact O-N 3.15Å; H211-A338 HydrophobicContact CB-CB 3.97Å
212N91.3Very high88.3Confident24 Ų2421.3 Ų21.313%0.12812%0.121CC..Hα-helixtrans-67.6-28.5176.7-78.1-22000112.2M209 P210 Y214 L215 H216M209-N212 HydrophobicContact CB-CB 4.23Å; M209-N212 PolarHBondContact O-N 3.47Å; M209-N212 PolarHBondContact SD-ND2 3.33Å; P210-N212 VanDerWaalsContact C-N 3.32Å; P210-N212 PolarHBondContact O-N 3.4Å; N212-Y214 VanDerWaalsContact C-N 3.34Å; N212-L215 PolarHBondContact O-N 3.16Å; N212-H216 WeakPolarHBondContact O-CB 3.41Å; N212-H216 PolarHBondContact O-CD2 3.49Å; N212-H216 PolarHBondContact O-N 3.05Å
213I93.5Very high88.7Confident3 Ų325.1 Ų25.12%0.01513%0.132CC..Hα-helixtrans-63.2-42.3172.7-59.3-179.6000110.2C62 A66 L77 I208 P210 H211 S217 L395 A398 V399 I402C62-I213 HydrophobicContact CB-CD1 4.16Å; A66-I213 HydrophobicContact CB-CG2 3.93Å; A66-I213 VanDerWaalsContact CB-O 3.31Å; A66-I213 WeakPolarHBondContact CB-O 3.27Å; L77-I213 HydrophobicContact CD2-CG2 3.98Å; I208-I213 HydrophobicContact CG2-CD1 4.42Å; P210-I213 WeakPolarHBondContact O-CB 3.42Å; P210-I213 PolarHBondContact O-N 2.84Å; H211-I213 VanDerWaalsContact C-N 3.28Å; H211-I213 PolarHBondContact O-N 2.86Å; I213-S217 PolarHBondContact O-N 3.26Å; I213-L395 HydrophobicContact CD1-CD1 4.45Å; I213-A398 HydrophobicContact CB-CB 4.24Å; I213-A398 HydrophobicContact CD1-CB 3.94Å; I213-V399 HydrophobicContact CD1-CG2 3.73Å; I213-I402 HydrophobicContact CG2-CB 4.32Å; I213-I402 HydrophobicContact CG2-CG2 4.04Å
214Y93.4Very high88.8Confident3 Ų333.7 Ų33.71%0.01217%0.171CC..Hα-helixtrans-67.1-47.1173.7-71.4-88.8000111.5L77 I97 P210 H211 N212 H216 S217 A218 V342 F346 F397 A398L77-Y214 HydrophobicContact CB-CD1 3.76Å; L77-Y214 HydrophobicContact CB-CE1 3.88Å; L77-Y214 HydrophobicContact CD2-CD1 3.9Å; L77-Y214 HydrophobicContact CD2-CD2 4.41Å; L77-Y214 HydrophobicContact CD2-CE1 3.59Å; L77-Y214 HydrophobicContact CD2-CE2 4.14Å; L77-Y214 HydrophobicContact CD2-CG 4.29Å; L77-Y214 HydrophobicContact CG-CD1 3.88Å; L77-Y214 HydrophobicContact CG-CE1 3.48Å; L77-Y214 VanDerWaalsContact CG-CE1 3.48Å; I97-Y214 HydrophobicContact CD1-CD2 4.25Å; I97-Y214 HydrophobicContact CD1-CE2 3.53Å; I97-Y214 HydrophobicContact CG1-CD2 4.31Å; I97-Y214 HydrophobicContact CG1-CE2 3.62Å; I97-Y214 HydrophobicContact CG2-CD2 3.95Å; I97-Y214 HydrophobicContact CG2-CE2 4.12Å; P210-Y214 WeakPolarHBondContact O-CD2 3.41Å; H211-Y214 PolarHBondContact O-N 3.14Å; H211-Y214 VanDerWaalsContact O-N 3.17Å; N212-Y214 VanDerWaalsContact C-N 3.34Å; Y214-H216 PolarHBondContact O-N 2.91Å; Y214-S217 PolarHBondContact O-N 3.03Å; Y214-S217 VanDerWaalsContact O-N 3.16Å; Y214-S217 PolarHBondContact O-OG 2.94Å; Y214-A218 PolarHBondContact O-N 3.24Å; Y214-V342 HydrophobicContact CD1-CG2 4.28Å; Y214-V342 HydrophobicContact CG-CG2 3.98Å; Y214-F346 AromaticContact CD1-CE2 3.99Å; Y214-F346 HydrophobicContact CD1-CE2 3.99Å; Y214-F346 AromaticContact CE1-CE2 3.41Å; Y214-F346 HydrophobicContact CE1-CE2 3.41Å; Y214-F346 VanDerWaalsContact CE1-CE2 3.41Å; Y214-F346 AromaticContact CE1-CZ 3.64Å; Y214-F346 HydrophobicContact CE1-CZ 3.64Å; Y214-F346 AromaticContact CZ-CZ 3.95Å; Y214-F397 PolarHBondContact OH-O 3.2Å; Y214-A398 HydrophobicContact CD2-CB 4.28Å; Y214-A398 HydrophobicContact CE2-CB 3.69Å
215L91.6Very high88.9Confident5 Ų533.7 Ų33.73%0.02617%0.171CC..Hα-helixtrans-56.9-50.2179.5-178.759.3000112.3H211 N212 S217 A218 L219 T334 A338 F341H211-L215 PolarHBondContact O-N 3.15Å; N212-L215 PolarHBondContact O-N 3.16Å; L215-S217 VanDerWaalsContact C-N 3.29Å; L215-S217 PolarHBondContact O-N 2.83Å; L215-A218 CarbonylContact O-C 3.45Å; L215-A218 WeakPolarHBondContact O-CA 3.34Å; L215-A218 PolarHBondContact O-N 3.11Å; L215-L219 HydrophobicContact CD1-CD1 4.07Å; L215-L219 HydrophobicContact CD1-CD2 4.21Å; L215-L219 HydrophobicContact CD1-CG 3.87Å; L215-L219 HydrophobicContact CD2-CD1 4.36Å; L215-L219 HydrophobicContact CG-CD1 3.79Å; L215-L219 HydrophobicContact CG-CG 4.06Å; L215-L219 WeakPolarHBondContact O-CG 3.31Å; L215-L219 PolarHBondContact O-N 2.83Å; L215-T334 HydrophobicContact CD2-CG2 4.06Å; L215-A338 HydrophobicContact CB-CB 4.16Å; L215-F341 HydrophobicContact CD1-CD2 3.94Å; L215-F341 HydrophobicContact CD1-CE2 4.04Å
216H91.1Very high89.2Confident57 Ų5736.5 Ų36.526%0.26419%0.187SC..Hα-helixtrans-63.7-32.4178.3-77.5-69.3000113N212 Y214 A218N212-H216 WeakPolarHBondContact O-CB 3.41Å; N212-H216 PolarHBondContact O-CD2 3.49Å; N212-H216 PolarHBondContact O-N 3.05Å; Y214-H216 PolarHBondContact O-N 2.91Å; H216-A218 PolarHBondContact O-N 3.37Å
217S93.7Very high89.3Confident0 Ų039.8 Ų39.80%019%0.19CC..Hα-helixtrans-67.4-21.217378.30000113.6A66 L77 I213 Y214 L215 V220A66-S217 WeakPolarHBondContact O-CA 3.45Å; A66-S217 WeakPolarHBondContact O-CB 3.44Å; L77-S217 WeakPolarHBondContact CB-OG 3.49Å; L77-S217 PolarHBondContact N-OG 3.44Å; I213-S217 PolarHBondContact O-N 3.26Å; Y214-S217 PolarHBondContact O-N 3.03Å; Y214-S217 VanDerWaalsContact O-N 3.16Å; Y214-S217 PolarHBondContact O-OG 2.94Å; L215-S217 VanDerWaalsContact C-N 3.29Å; L215-S217 PolarHBondContact O-N 2.83Å; S217-V220 WeakPolarHBondContact O-CG2 3.47Å
218A90.8Very high89.2Confident2 Ų244.2 Ų44.22%0.01722%0.219CC..Hα-helixtrans-96.7-39.1178.300000113.1D76 Y214 L215 H216 V220 K221 F341D76-A218 HydrophobicContact CB-CB 3.81Å; Y214-A218 PolarHBondContact O-N 3.24Å; L215-A218 CarbonylContact O-C 3.45Å; L215-A218 WeakPolarHBondContact O-CA 3.34Å; L215-A218 PolarHBondContact O-N 3.11Å; H216-A218 PolarHBondContact O-N 3.37Å; A218-V220 PolarHBondContact O-N 3.3Å; A218-K221 WeakPolarHBondContact O-CB 3.07Å; A218-K221 PolarHBondContact O-N 2.93Å; A218-F341 HydrophobicContact CB-CB 3.8Å; A218-F341 HydrophobicContact CB-CD1 3.52Å; A218-F341 HydrophobicContact CB-CD2 3.46Å; A218-F341 VanDerWaalsContact CB-CD2 3.46Å; A218-F341 HydrophobicContact CB-CE1 3.88Å; A218-F341 HydrophobicContact CB-CE2 3.83Å; A218-F341 HydrophobicContact CB-CG 3.29Å; A218-F341 HydrophobicContact CB-CZ 4.03Å
219L88.3Confident89.2Confident54 Ų5450.7 Ų50.728%0.28324%0.243SC..Hα-helixtrans-58.6-32.3179.8-74.5175.9000112.6L215 K221 S222L215-L219 HydrophobicContact CD1-CD1 4.07Å; L215-L219 HydrophobicContact CD1-CD2 4.21Å; L215-L219 HydrophobicContact CD1-CG 3.87Å; L215-L219 HydrophobicContact CD2-CD1 4.36Å; L215-L219 HydrophobicContact CG-CD1 3.79Å; L215-L219 HydrophobicContact CG-CG 4.06Å; L215-L219 WeakPolarHBondContact O-CG 3.31Å; L215-L219 PolarHBondContact O-N 2.83Å; L219-K221 PolarHBondContact O-N 3.37Å; L219-K221 VanDerWaalsContact O-N 3.17Å; L219-S222 VanDerWaalsContact O-CB 3.26Å; L219-S222 WeakPolarHBondContact O-CB 3.45Å; L219-S222 PolarHBondContact O-N 3.2Å; L219-S222 PolarHBondContact O-OG 2.81Å
220V89.6Confident89Confident7 Ų756.3 Ų56.34%0.04226%0.262CS..G310 helixtrans-61.7-20.9173.8-62.30000113.8A67 V71 S217 A218 S222 F240A67-V220 HydrophobicContact CB-CG1 3.81Å; V71-V220 HydrophobicContact CG2-CB 3.88Å; V71-V220 HydrophobicContact CG2-CG1 4.08Å; V71-V220 HydrophobicContact CG2-CG2 4.19Å; S217-V220 WeakPolarHBondContact O-CG2 3.47Å; A218-V220 PolarHBondContact O-N 3.3Å; V220-S222 PolarHBondContact O-N 2.95Å; V220-F240 HydrophobicContact CB-CD2 4.32Å; V220-F240 HydrophobicContact CB-CE1 4.16Å; V220-F240 HydrophobicContact CB-CE2 3.81Å; V220-F240 HydrophobicContact CB-CZ 3.7Å; V220-F240 HydrophobicContact CG1-CD1 3.78Å; V220-F240 HydrophobicContact CG1-CD2 3.85Å; V220-F240 HydrophobicContact CG1-CE1 3.74Å; V220-F240 HydrophobicContact CG1-CE2 3.81Å; V220-F240 HydrophobicContact CG1-CG 3.83Å; V220-F240 HydrophobicContact CG1-CZ 3.74Å
221K86.9Confident88.9Confident68 Ų6861.3 Ų61.330%0.29629%0.292SS..G310 helixtrans-71.6-12.7174.5-60.4162.765.91710112.5D76 E79 A218 L219D76-K221 HydrophobicContact CB-CD 4.16Å; D76-K221 IonicContact OD2-NZ 3.8Å; D76-K221 PolarHBondContact OD2-NZ 2.84Å; E79-K221 IonicContact OE1-NZ 2.75Å; E79-K221 PolarHBondContact OE1-NZ 3.44Å; E79-K221 IonicContact OE2-NZ 3.22Å; E79-K221 PolarHBondContact OE2-NZ 2.96Å; A218-K221 WeakPolarHBondContact O-CB 3.07Å; A218-K221 PolarHBondContact O-N 2.93Å; L219-K221 PolarHBondContact O-N 3.37Å; L219-K221 VanDerWaalsContact O-N 3.17Å
222S84.7Confident88.9Confident57 Ų5763 Ų6340%0.39930%0.301SS..G310 helixtrans-76.5-21.3177.869.70000114.4L219 V220L219-S222 VanDerWaalsContact O-CB 3.26Å; L219-S222 WeakPolarHBondContact O-CB 3.45Å; L219-S222 PolarHBondContact O-N 3.2Å; L219-S222 PolarHBondContact O-OG 2.81Å; V220-S222 PolarHBondContact O-N 2.95Å
223R86.4Confident88.8Confident90 Ų9062 Ų6234%0.3430%0.296SS..SBendtrans-94.4129.5172.8-53.2-69.2-173.1-140.4-5.7107.7E152 V225 F240E152-R223 IonicContact OE1-CZ 2.75Å; E152-R223 IonicContact OE1-NH1 3.52Å; E152-R223 IonicContact OE1-NH2 3.13Å; E152-R223 IonicContact OE2-CZ 3.66Å; E152-R223 IonicContact OE2-NH1 2.69Å; E152-R223 PolarHBondContact OE2-NH1 3.25Å; E152-R223 IonicContact OE2-NH2 3.34Å; E152-R223 PolarHBondContact OE2-NH2 3.04Å; R223-V225 PolarHBondContact O-N 2.96Å; R223-F240 HydrophobicContact CB-CZ 3.97Å; R223-F240 HydrophobicContact CG-CE1 3.99Å; R223-F240 HydrophobicContact CG-CZ 3.6Å
224E83.7Confident88.6Confident204 Ų20471 Ų7195%0.95333%0.33SS*.  trans-71.7120.5173.9-68.3-178.217800109.6
225V87.1Confident88.6Confident22 Ų2275.3 Ų75.313%0.13335%0.35CS..  trans-127.2124177.5-178.50000108R223 R227 D232 V233 A236R223-V225 PolarHBondContact O-N 2.96Å; V225-R227 PolarHBondContact O-N 3.21Å; V225-R227 VanDerWaalsContact O-N 3.15Å; V225-D232 HydrophobicContact CG1-CB 4.49Å; V225-V233 HydrophobicContact CG1-CG2 4.33Å; V225-A236 HydrophobicContact CG1-CB 4Å; V225-A236 HydrophobicContact CG2-CB 3.79Å
226D87.1Confident88.6Confident60 Ų6075.7 Ų75.732%0.32135%0.354SS..  trans-73104.6173-177.2-5.2000109.7T228 R229D226-T228 VanDerWaalsContact CG-OG1 3.3Å; D226-T228 PolarHBondContact O-N 2.76Å; D226-T228 VanDerWaalsContact OD1-CB 3.3Å; D226-T228 WeakPolarHBondContact OD1-CB 3.39Å; D226-T228 WeakPolarHBondContact OD1-CG2 3.4Å; D226-T228 PolarHBondContact OD1-N 3.11Å; D226-T228 PolarHBondContact OD1-OG1 3.28Å; D226-T228 PolarHBondContact OD2-OG1 3.07Å; D226-R229 PolarHBondContact O-N 3.13Å; D226-R229 IonicContact OD2-CZ 3.16Å; D226-R229 IonicContact OD2-NE 2.96Å
227R85.5Confident88.6Confident110 Ų11074.5 Ų74.542%0.41535%0.349SS..THydrogen-bonded Turntrans-77.8-8.5-178.2-60.4178.3-170.6850.7113.1V71 V225V71-R227 PolarHBondContact O-NE 3.16Å; V225-R227 PolarHBondContact O-N 3.21Å; V225-R227 VanDerWaalsContact O-N 3.15Å
228T85.8Confident88.6Confident120 Ų12079.8 Ų79.874%0.73638%0.375SS*.THydrogen-bonded Turntrans-75.8-30.8172.574.80000111.1D226D226-T228 VanDerWaalsContact CG-OG1 3.3Å; D226-T228 PolarHBondContact O-N 2.76Å; D226-T228 VanDerWaalsContact OD1-CB 3.3Å; D226-T228 WeakPolarHBondContact OD1-CB 3.39Å; D226-T228 WeakPolarHBondContact OD1-CG2 3.4Å; D226-T228 PolarHBondContact OD1-N 3.11Å; D226-T228 PolarHBondContact OD1-OG1 3.28Å; D226-T228 PolarHBondContact OD2-OG1 3.07Å
229R88.8Confident88.7Confident141 Ų14186.2 Ų86.253%0.53240%0.4SS..  trans-95.1115.6-179.7-62.6-164.3-55.7-143.7-1.9111.6D226 V231 D232 V233D226-R229 PolarHBondContact O-N 3.13Å; D226-R229 IonicContact OD2-CZ 3.16Å; D226-R229 IonicContact OD2-NE 2.96Å; R229-V231 PolarHBondContact O-N 3.5Å; R229-D232 HydrophobicContact CB-CB 4.27Å; R229-D232 WeakPolarHBondContact CB-OD1 3.26Å; R229-D232 IonicContact CZ-OD1 3.68Å; R229-D232 IonicContact CZ-OD2 2.68Å; R229-D232 IonicContact NE-OD1 2.94Å; R229-D232 PolarHBondContact NE-OD1 2.96Å; R229-D232 VanDerWaalsContact NE-OD1 3.16Å; R229-D232 IonicContact NE-OD2 3.78Å; R229-D232 PolarHBondContact NE-OD2 3.48Å; R229-D232 IonicContact NH2-OD1 2.94Å; R229-D232 IonicContact NH2-OD2 2.89Å; R229-D232 PolarHBondContact NH2-OD2 3.34Å; R229-D232 PolarHBondContact O-N 3.02Å; R229-V233 PolarHBondContact O-N 3.36Å
230R87Confident88.9Confident156 Ų15684.7 Ų84.759%0.58939%0.391SS*.Hα-helixtrans-63.9-27.9-177.5-59.3175.7-179.8-148.5-12.6113.7R234 E414R230-R234 PolarHBondContact O-N 3.2Å; R230-E414 IonicContact CZ-OE1 3.53Å; R230-E414 IonicContact CZ-OE2 2.77Å; R230-E414 VanDerWaalsContact CZ-OE2 3.32Å; R230-E414 IonicContact NH1-OE1 2.67Å; R230-E414 PolarHBondContact NH1-OE1 2.84Å; R230-E414 IonicContact NH1-OE2 3.5Å; R230-E414 PolarHBondContact NH1-OE2 3.16Å; R230-E414 IonicContact NH2-OE1 3.83Å; R230-E414 PolarHBondContact NH2-OE1 2.96Å; R230-E414 IonicContact NH2-OE2 3.44Å
231V90.1Very high89Confident105 Ų10587 Ų8764%0.63640%0.403SS*.Hα-helixtrans-68.5-52.8179.7-177.90000109.4R229 V233 R234 E235R229-V231 PolarHBondContact O-N 3.5Å; V231-V233 VanDerWaalsContact C-N 3.32Å; V231-V233 PolarHBondContact O-N 2.86Å; V231-R234 CarbonylContact O-C 3.59Å; V231-R234 WeakPolarHBondContact O-CA 3.29Å; V231-R234 WeakPolarHBondContact O-CB 3.4Å; V231-R234 PolarHBondContact O-N 3.29Å; V231-E235 WeakPolarHBondContact O-CB 3.25Å; V231-E235 PolarHBondContact O-N 3.03Å
232D89.9Confident89.3Confident35 Ų3587.3 Ų87.319%0.18741%0.407CS..Hα-helixtrans-54.9-44.4177.7-51.638.3000111.9V225 R229 R234 E235 A236V225-D232 HydrophobicContact CG1-CB 4.49Å; R229-D232 HydrophobicContact CB-CB 4.27Å; R229-D232 WeakPolarHBondContact CB-OD1 3.26Å; R229-D232 IonicContact CZ-OD1 3.68Å; R229-D232 IonicContact CZ-OD2 2.68Å; R229-D232 IonicContact NE-OD1 2.94Å; R229-D232 PolarHBondContact NE-OD1 2.96Å; R229-D232 VanDerWaalsContact NE-OD1 3.16Å; R229-D232 IonicContact NE-OD2 3.78Å; R229-D232 PolarHBondContact NE-OD2 3.48Å; R229-D232 IonicContact NH2-OD1 2.94Å; R229-D232 IonicContact NH2-OD2 2.89Å; R229-D232 PolarHBondContact NH2-OD2 3.34Å; R229-D232 PolarHBondContact O-N 3.02Å; D232-R234 VanDerWaalsContact C-N 3.33Å; D232-R234 PolarHBondContact O-N 3.44Å; D232-E235 PolarHBondContact O-N 3.3Å; D232-A236 VanDerWaalsContact O-CB 3.27Å; D232-A236 WeakPolarHBondContact O-CB 3.35Å; D232-A236 PolarHBondContact O-N 3.19Å
233V90.3Very high89.6Confident4 Ų489.2 Ų89.22%0.02441%0.41CS..Hα-helixtrans-62.7-38.9175.5173.80000111.7V71 V72 V225 R229 V231 N237 F415V71-V233 HydrophobicContact CG1-CG1 4.24Å; V72-V233 HydrophobicContact CG2-CG1 4.06Å; V225-V233 HydrophobicContact CG1-CG2 4.33Å; R229-V233 PolarHBondContact O-N 3.36Å; V231-V233 VanDerWaalsContact C-N 3.32Å; V231-V233 PolarHBondContact O-N 2.86Å; V233-N237 WeakPolarHBondContact O-CB 3.31Å; V233-N237 PolarHBondContact O-N 3.13Å; V233-N237 VanDerWaalsContact O-N 3.16Å; V233-N237 PolarHBondContact O-ND2 3.22Å; V233-F415 HydrophobicContact CB-CE2 4.24Å; V233-F415 HydrophobicContact CB-CZ 4Å; V233-F415 HydrophobicContact CG1-CD2 4.16Å; V233-F415 HydrophobicContact CG1-CE1 4.11Å; V233-F415 HydrophobicContact CG1-CE2 3.6Å; V233-F415 HydrophobicContact CG1-CZ 3.57Å
234R89.7Confident89.9Confident192 Ų19285.5 Ų85.573%0.72540%0.398SS*.Hα-helixtrans-72-38.7177.9-176.3176.3179.3168.5-0.9112R230 V231 D232 N237 M238 F415R230-R234 PolarHBondContact O-N 3.2Å; V231-R234 CarbonylContact O-C 3.59Å; V231-R234 WeakPolarHBondContact O-CA 3.29Å; V231-R234 WeakPolarHBondContact O-CB 3.4Å; V231-R234 PolarHBondContact O-N 3.29Å; D232-R234 VanDerWaalsContact C-N 3.33Å; D232-R234 PolarHBondContact O-N 3.44Å; R234-N237 PolarHBondContact O-N 3.36Å; R234-M238 PolarHBondContact O-N 3.14Å; R234-M238 VanDerWaalsContact O-N 3.12Å; R234-F415 HydrophobicContact CB-CE1 4.49Å
235E92.8Very high90.4Very high93 Ų9378.1 Ų78.144%0.43537%0.367SS..Hα-helixtrans-66.8-48.5177.2179.3170.1-165.700111.4V231 D232 N237 M238 Y239V231-E235 WeakPolarHBondContact O-CB 3.25Å; V231-E235 PolarHBondContact O-N 3.03Å; D232-E235 PolarHBondContact O-N 3.3Å; E235-N237 VanDerWaalsContact C-N 3.31Å; E235-N237 PolarHBondContact O-N 3.14Å; E235-M238 WeakPolarHBondContact O-CA 3.49Å; E235-M238 WeakPolarHBondContact O-CB 3.23Å; E235-M238 PolarHBondContact O-N 2.85Å; E235-Y239 HydrophobicContact CG-CD2 3.81Å; E235-Y239 HydrophobicContact CG-CE2 3.44Å; E235-Y239 VanDerWaalsContact CG-CE2 3.44Å; E235-Y239 WeakPolarHBondContact O-CD2 3.44Å; E235-Y239 PolarHBondContact O-N 3.2Å
236A92.1Very high90.6Very high12 Ų1282.1 Ų82.110%0.09939%0.387CS..Hα-helixtrans-56.5-44.5172.800000111.9V71 V225 D232 M238 Y239 F240V71-A236 HydrophobicContact CG1-CB 4.01Å; V225-A236 HydrophobicContact CG1-CB 4Å; V225-A236 HydrophobicContact CG2-CB 3.79Å; D232-A236 VanDerWaalsContact O-CB 3.27Å; D232-A236 WeakPolarHBondContact O-CB 3.35Å; D232-A236 PolarHBondContact O-N 3.19Å; A236-M238 VanDerWaalsContact C-N 3.25Å; A236-M238 PolarHBondContact O-N 2.97Å; A236-Y239 PolarHBondContact O-N 3.41Å; A236-F240 HydrophobicContact CB-CD2 4.42Å; A236-F240 HydrophobicContact CB-CE2 4.35Å; A236-F240 WeakPolarHBondContact O-CD2 3.44Å; A236-F240 PolarHBondContact O-N 3.38Å
237N91.3Very high90.8Very high32 Ų3282 Ų8217%0.17139%0.394CS..Hα-helixtrans-61.9-28.9174.9-85.7-61.8000113.7R68 V233 R234 E235 L241R68-N237 VanDerWaalsContact CA-OD1 3.29Å; R68-N237 WeakPolarHBondContact CA-OD1 3.46Å; R68-N237 WeakPolarHBondContact CB-OD1 3.47Å; R68-N237 WeakPolarHBondContact CG-OD1 3.43Å; V233-N237 WeakPolarHBondContact O-CB 3.31Å; V233-N237 PolarHBondContact O-N 3.13Å; V233-N237 VanDerWaalsContact O-N 3.16Å; V233-N237 PolarHBondContact O-ND2 3.22Å; R234-N237 PolarHBondContact O-N 3.36Å; E235-N237 VanDerWaalsContact C-N 3.31Å; E235-N237 PolarHBondContact O-N 3.14Å; N237-L241 WeakPolarHBondContact O-CB 3.34Å; N237-L241 PolarHBondContact O-N 3.3Å
238M92.4Very high91Very high111 Ų11177.5 Ų77.555%0.54738%0.378SS..Hα-helixtrans-74.3-46.5173173.6179.3152.600111R234 E235 A236 L241 I242R234-M238 PolarHBondContact O-N 3.14Å; R234-M238 VanDerWaalsContact O-N 3.12Å; E235-M238 WeakPolarHBondContact O-CA 3.49Å; E235-M238 WeakPolarHBondContact O-CB 3.23Å; E235-M238 PolarHBondContact O-N 2.85Å; A236-M238 VanDerWaalsContact C-N 3.25Å; A236-M238 PolarHBondContact O-N 2.97Å; M238-L241 WeakPolarHBondContact O-CB 3.44Å; M238-L241 PolarHBondContact O-N 3.04Å; M238-I242 HydrophobicContact CE-CD1 3.74Å; M238-I242 HydrophobicContact CG-CD1 3.94Å; M238-I242 WeakPolarHBondContact O-CG1 3.21Å; M238-I242 PolarHBondContact O-N 3.33Å
239Y93.3Very high91.4Very high137 Ų13774.5 Ų74.554%0.53736%0.362SS..Hα-helixtrans-62.8-46.6179.3-74.8-57.9000112.6E235 A236 L241 I242 E243E235-Y239 HydrophobicContact CG-CD2 3.81Å; E235-Y239 HydrophobicContact CG-CE2 3.44Å; E235-Y239 VanDerWaalsContact CG-CE2 3.44Å; E235-Y239 WeakPolarHBondContact O-CD2 3.44Å; E235-Y239 PolarHBondContact O-N 3.2Å; A236-Y239 PolarHBondContact O-N 3.41Å; Y239-L241 VanDerWaalsContact C-N 3.26Å; Y239-L241 PolarHBondContact O-N 3.33Å; Y239-I242 PolarHBondContact O-N 3.28Å; Y239-I242 VanDerWaalsContact O-N 3.11Å; Y239-E243 WeakPolarHBondContact O-CB 3.19Å; Y239-E243 PolarHBondContact O-N 3.19Å
240F91.8Very high91.6Very high23 Ų2370.2 Ų70.210%0.10135%0.351CS..Hα-helixtrans-64-29.8175.8-72.6-58.6000113.2A67 V71 V220 R223 A236 A244A67-F240 HydrophobicContact CB-CB 4.41Å; V71-F240 HydrophobicContact CG2-CD2 3.47Å; V71-F240 VanDerWaalsContact CG2-CD2 3.47Å; V71-F240 HydrophobicContact CG2-CE2 3.57Å; V220-F240 HydrophobicContact CB-CD2 4.32Å; V220-F240 HydrophobicContact CB-CE1 4.16Å; V220-F240 HydrophobicContact CB-CE2 3.81Å; V220-F240 HydrophobicContact CB-CZ 3.7Å; V220-F240 HydrophobicContact CG1-CD1 3.78Å; V220-F240 HydrophobicContact CG1-CD2 3.85Å; V220-F240 HydrophobicContact CG1-CE1 3.74Å; V220-F240 HydrophobicContact CG1-CE2 3.81Å; V220-F240 HydrophobicContact CG1-CG 3.83Å; V220-F240 HydrophobicContact CG1-CZ 3.74Å; R223-F240 HydrophobicContact CB-CZ 3.97Å; R223-F240 HydrophobicContact CG-CE1 3.99Å; R223-F240 HydrophobicContact CG-CZ 3.6Å; A236-F240 HydrophobicContact CB-CD2 4.42Å; A236-F240 HydrophobicContact CB-CE2 4.35Å; A236-F240 WeakPolarHBondContact O-CD2 3.44Å; A236-F240 PolarHBondContact O-N 3.38Å; F240-A244 VanDerWaalsContact O-CB 3.29Å; F240-A244 WeakPolarHBondContact O-CB 3.34Å; F240-A244 PolarHBondContact O-N 2.7Å
241L92.5Very high91.8Very high55 Ų5565 Ų6529%0.28834%0.339SS..Hα-helixtrans-67.9-43171.9176.558.7000111.5R64 N237 M238 Y239 T245R64-L241 HydrophobicContact CB-CD1 4.31Å; R64-L241 HydrophobicContact CG-CD1 3.95Å; N237-L241 WeakPolarHBondContact O-CB 3.34Å; N237-L241 PolarHBondContact O-N 3.3Å; M238-L241 WeakPolarHBondContact O-CB 3.44Å; M238-L241 PolarHBondContact O-N 3.04Å; Y239-L241 VanDerWaalsContact C-N 3.26Å; Y239-L241 PolarHBondContact O-N 3.33Å; L241-T245 VanDerWaalsContact O-CB 3.26Å; L241-T245 WeakPolarHBondContact O-CB 3.3Å; L241-T245 PolarHBondContact O-N 2.75Å; L241-T245 PolarHBondContact O-OG1 3.15Å
242I93.6Very high92Very high74 Ų7461.5 Ų61.538%0.37932%0.315SS..Hα-helixtrans-63.8-47.3177.3-68.3165.2000110.1M238 Y239 T245 I246M238-I242 HydrophobicContact CE-CD1 3.74Å; M238-I242 HydrophobicContact CG-CD1 3.94Å; M238-I242 WeakPolarHBondContact O-CG1 3.21Å; M238-I242 PolarHBondContact O-N 3.33Å; Y239-I242 PolarHBondContact O-N 3.28Å; Y239-I242 VanDerWaalsContact O-N 3.11Å; I242-T245 PolarHBondContact O-N 3.32Å; I242-I246 HydrophobicContact CG2-CD1 3.73Å; I242-I246 HydrophobicContact CG2-CG1 4.45Å; I242-I246 WeakPolarHBondContact O-CG1 3.46Å; I242-I246 PolarHBondContact O-N 3.42Å
243E91.2Very high92.1Very high98 Ų9863.5 Ų63.546%0.45833%0.325SS..Hα-helixtrans-56.5-52.8177.4-173.2177.5169.900111.7Y239 T245 I246 A247Y239-E243 WeakPolarHBondContact O-CB 3.19Å; Y239-E243 PolarHBondContact O-N 3.19Å; E243-T245 VanDerWaalsContact C-N 3.33Å; E243-T245 PolarHBondContact O-N 3.3Å; E243-I246 PolarHBondContact O-N 3.28Å; E243-A247 WeakPolarHBondContact O-CB 3.49Å; E243-A247 PolarHBondContact O-N 3.09Å
244A91.3Very high92.2Very high12 Ų1263.9 Ų63.910%0.09933%0.327CS..Hα-helixtrans-62.9-37.117700000112.8L60 F240 L248L60-A244 HydrophobicContact CD1-CB 4.12Å; F240-A244 VanDerWaalsContact O-CB 3.29Å; F240-A244 WeakPolarHBondContact O-CB 3.34Å; F240-A244 PolarHBondContact O-N 2.7Å; A244-L248 WeakPolarHBondContact O-CB 3.46Å; A244-L248 PolarHBondContact O-N 3.28Å
245T94.1Very high92.3Very high49 Ų4957.1 Ų57.130%0.30131%0.305SS..Hα-helixtrans-66.2-43.6177.9-57.20000111.3L60 L241 I242 E243 S249L60-T245 HydrophobicContact CD2-CG2 4.36Å; L241-T245 VanDerWaalsContact O-CB 3.26Å; L241-T245 WeakPolarHBondContact O-CB 3.3Å; L241-T245 PolarHBondContact O-N 2.75Å; L241-T245 PolarHBondContact O-OG1 3.15Å; I242-T245 PolarHBondContact O-N 3.32Å; E243-T245 VanDerWaalsContact C-N 3.33Å; E243-T245 PolarHBondContact O-N 3.3Å; T245-S249 VanDerWaalsContact O-CB 3.27Å; T245-S249 WeakPolarHBondContact O-CB 3.35Å; T245-S249 PolarHBondContact O-N 3.19Å; T245-S249 PolarHBondContact O-OG 3.41Å
246I93.1Very high92.1Very high105 Ų10554.1 Ų54.154%0.53829%0.292SS..Hα-helixtrans-65.2-49.3177.4-67.5167.8000110.1I242 E243 L248 S249 V250I242-I246 HydrophobicContact CG2-CD1 3.73Å; I242-I246 HydrophobicContact CG2-CG1 4.45Å; I242-I246 WeakPolarHBondContact O-CG1 3.46Å; I242-I246 PolarHBondContact O-N 3.42Å; E243-I246 PolarHBondContact O-N 3.28Å; I246-L248 PolarHBondContact O-N 2.92Å; I246-S249 PolarHBondContact O-N 2.92Å; I246-V250 WeakPolarHBondContact O-CG2 3.33Å; I246-V250 PolarHBondContact O-N 3.03Å
247A90Very high92.1Very high57 Ų5755.5 Ų55.547%0.47130%0.296SS..Hα-helixtrans-59.6-47.5-179.600000112.3E243 S249 V250 S251E243-A247 WeakPolarHBondContact O-CB 3.49Å; E243-A247 PolarHBondContact O-N 3.09Å; A247-S249 VanDerWaalsContact C-N 3.35Å; A247-S249 PolarHBondContact O-N 3.34Å; A247-V250 PolarHBondContact O-N 2.66Å; A247-S251 PolarHBondContact O-N 3.25Å
248L91.2Very high91.9Very high17 Ų1755.4 Ų55.49%0.08930%0.296CS..Hα-helixtrans-69.7-28.7176.7-76.3179.9000113.3T56 L60 Q63 A244 I246 S251 F252T56-L248 HydrophobicContact CG2-CB 4.35Å; L60-L248 HydrophobicContact CB-CD1 3.56Å; L60-L248 HydrophobicContact CD1-CD1 3.93Å; L60-L248 HydrophobicContact CG-CD1 4.33Å; Q63-L248 VanDerWaalsContact OE1-CD1 3.29Å; A244-L248 WeakPolarHBondContact O-CB 3.46Å; A244-L248 PolarHBondContact O-N 3.28Å; I246-L248 PolarHBondContact O-N 2.92Å; L248-S251 PolarHBondContact O-N 3.45Å; L248-F252 VanDerWaalsContact O-CB 3.24Å; L248-F252 WeakPolarHBondContact O-CB 3.32Å; L248-F252 PolarHBondContact O-N 3.47Å
249S93.4Very high91.6Very high56 Ų5652.3 Ų52.339%0.39228%0.281SS..Hα-helixtrans-66.3-41.5173.2-61.10000111.4T245 I246 A247 F252 I253T245-S249 VanDerWaalsContact O-CB 3.27Å; T245-S249 WeakPolarHBondContact O-CB 3.35Å; T245-S249 PolarHBondContact O-N 3.19Å; T245-S249 PolarHBondContact O-OG 3.41Å; I246-S249 PolarHBondContact O-N 2.92Å; A247-S249 VanDerWaalsContact C-N 3.35Å; A247-S249 PolarHBondContact O-N 3.34Å; S249-F252 PolarHBondContact O-N 3.35Å; S249-I253 VanDerWaalsContact O-CG1 3.28Å; S249-I253 WeakPolarHBondContact O-CG1 3.44Å; S249-I253 PolarHBondContact O-N 3.01Å
250V93.2Very high91.3Very high51 Ų5145.9 Ų45.931%0.30926%0.256SS..Hα-helixtrans-65.5-45.3174.3174.60000110.9I159 I246 A247 F252 I253 I254I159-V250 HydrophobicContact CG2-CG1 3.72Å; I246-V250 WeakPolarHBondContact O-CG2 3.33Å; I246-V250 PolarHBondContact O-N 3.03Å; A247-V250 PolarHBondContact O-N 2.66Å; V250-F252 VanDerWaalsContact C-N 3.34Å; V250-F252 PolarHBondContact O-N 3.24Å; V250-I253 PolarHBondContact O-N 2.96Å; V250-I254 HydrophobicContact CG1-CD1 4.02Å; V250-I254 WeakPolarHBondContact O-CG1 3.44Å; V250-I254 PolarHBondContact O-N 2.96Å
251S91.4Very high91.1Very high47 Ų4744.9 Ų44.933%0.32925%0.252SS..Hα-helixtrans-59.4-42.6175.5178.20000112.3A247 L248 I254 N255A247-S251 PolarHBondContact O-N 3.25Å; L248-S251 PolarHBondContact O-N 3.45Å; S251-I254 PolarHBondContact O-N 3.49Å; S251-N255 WeakPolarHBondContact O-CB 3.5Å; S251-N255 VanDerWaalsContact O-CG 3.26Å; S251-N255 PolarHBondContact O-N 3.01Å; S251-N255 PolarHBondContact O-ND2 3.37Å
252F92.6Very high90.7Very high31 Ų3143.5 Ų43.514%0.13624%0.244CC..Hα-helixtrans-62.6-41.8175.1167.3-99.7000112.8L52 L53 T56 L184 L248 S249 V250 N255 L256L52-F252 HydrophobicContact CD2-CD2 4.24Å; L52-F252 HydrophobicContact CD2-CE2 4.13Å; L52-F252 HydrophobicContact CG-CD2 4.5Å; L53-F252 HydrophobicContact CB-CE2 4.04Å; L53-F252 HydrophobicContact CD1-CD2 4.45Å; L53-F252 HydrophobicContact CD1-CE1 4.41Å; L53-F252 HydrophobicContact CD1-CE2 3.73Å; L53-F252 HydrophobicContact CD1-CZ 3.71Å; T56-F252 HydrophobicContact CG2-CB 3.85Å; T56-F252 HydrophobicContact CG2-CD2 4.45Å; T56-F252 HydrophobicContact CG2-CG 4.45Å; L184-F252 HydrophobicContact CD1-CE2 4.11Å; L184-F252 HydrophobicContact CD1-CZ 3.71Å; L184-F252 HydrophobicContact CD2-CZ 4.23Å; L248-F252 VanDerWaalsContact O-CB 3.24Å; L248-F252 WeakPolarHBondContact O-CB 3.32Å; L248-F252 PolarHBondContact O-N 3.47Å; S249-F252 PolarHBondContact O-N 3.35Å; V250-F252 VanDerWaalsContact C-N 3.34Å; V250-F252 PolarHBondContact O-N 3.24Å; F252-N255 PolarHBondContact O-N 3.23Å; F252-L256 HydrophobicContact CE1-CD2 4.34Å; F252-L256 HydrophobicContact CZ-CD2 4.41Å; F252-L256 WeakPolarHBondContact O-CB 3.19Å; F252-L256 PolarHBondContact O-N 3.48Å
253I93.1Very high90Very high77 Ų7740.6 Ų40.640%0.39523%0.232SC..Hα-helixtrans-63-43.2175.6-70164.4000110.7S249 V250 L256 F257S249-I253 VanDerWaalsContact O-CG1 3.28Å; S249-I253 WeakPolarHBondContact O-CG1 3.44Å; S249-I253 PolarHBondContact O-N 3.01Å; V250-I253 PolarHBondContact O-N 2.96Å; I253-L256 PolarHBondContact O-N 3.29Å; I253-F257 HydrophobicContact CG2-CD1 4.46Å; I253-F257 HydrophobicContact CG2-CD2 4.11Å; I253-F257 HydrophobicContact CG2-CE1 3.94Å; I253-F257 HydrophobicContact CG2-CE2 3.54Å; I253-F257 HydrophobicContact CG2-CZ 3.45Å; I253-F257 VanDerWaalsContact CG2-CZ 3.45Å; I253-F257 VanDerWaalsContact O-CG 3.24Å; I253-F257 WeakPolarHBondContact O-CG 3.38Å; I253-F257 PolarHBondContact O-N 2.88Å
254I92.4Very high89.6Confident13 Ų1340.5 Ų40.57%0.06723%0.232CC..Hα-helixtrans-59.5-49.4174.9-72.1165.1000110.9I159 M162 A163 F166 V250 S251 L256 F257 V258I159-I254 HydrophobicContact CG2-CD1 4.38Å; M162-I254 HydrophobicContact CB-CD1 4.07Å; A163-I254 HydrophobicContact CB-CD1 4.19Å; A163-I254 HydrophobicContact CB-CG1 4.25Å; F166-I254 HydrophobicContact CD2-CG2 3.71Å; F166-I254 HydrophobicContact CE2-CG2 4.27Å; V250-I254 HydrophobicContact CG1-CD1 4.02Å; V250-I254 WeakPolarHBondContact O-CG1 3.44Å; V250-I254 PolarHBondContact O-N 2.96Å; S251-I254 PolarHBondContact O-N 3.49Å; I254-L256 VanDerWaalsContact C-N 3.33Å; I254-L256 PolarHBondContact O-N 3.45Å; I254-F257 WeakPolarHBondContact O-CB 3.35Å; I254-F257 PolarHBondContact O-N 3.16Å; I254-V258 PolarHBondContact O-N 2.9Å
255N90.8Very high89.1Confident49 Ų4940.1 Ų40.126%0.26223%0.228SC..Hα-helixtrans-65.3-36.8-179.9-67.8-22000112L52 S251 F252 V258 M259L52-N255 HydrophobicContact CD1-CB 3.86Å; L52-N255 HydrophobicContact CD2-CB 4.05Å; L52-N255 HydrophobicContact CG-CB 4.39Å; S251-N255 WeakPolarHBondContact O-CB 3.5Å; S251-N255 VanDerWaalsContact O-CG 3.26Å; S251-N255 PolarHBondContact O-N 3.01Å; S251-N255 PolarHBondContact O-ND2 3.37Å; F252-N255 PolarHBondContact O-N 3.23Å; N255-V258 PolarHBondContact O-N 3.09Å; N255-M259 WeakPolarHBondContact O-CB 3.47Å; N255-M259 VanDerWaalsContact O-CG 3.25Å; N255-M259 WeakPolarHBondContact O-CG 3.36Å; N255-M259 PolarHBondContact O-N 2.8Å
256L90Very high88.3Confident30 Ų3037.9 Ų37.916%0.15722%0.215CC..Hα-helixtrans-61.8-43.3173.2173.662000111.3L49 L52 L184 F252 I253 I254 A260L49-L256 HydrophobicContact CD2-CD1 3.47Å; L49-L256 VanDerWaalsContact CD2-CD1 3.47Å; L52-L256 HydrophobicContact CD2-CB 4.35Å; L184-L256 HydrophobicContact CD1-CD1 4.39Å; F252-L256 HydrophobicContact CE1-CD2 4.34Å; F252-L256 HydrophobicContact CZ-CD2 4.41Å; F252-L256 WeakPolarHBondContact O-CB 3.19Å; F252-L256 PolarHBondContact O-N 3.48Å; I253-L256 PolarHBondContact O-N 3.29Å; I254-L256 VanDerWaalsContact C-N 3.33Å; I254-L256 PolarHBondContact O-N 3.45Å; L256-A260 WeakPolarHBondContact O-CB 3.49Å; L256-A260 PolarHBondContact O-N 2.9Å
257F90.7Very high87.3Confident41 Ų4138.2 Ų38.218%0.1821%0.21CC..Hα-helixtrans-61.5-50.6175.4-68.5-16.2000111.7F166 Y170 I253 I254 M259 A260 V261F166-F257 HydrophobicContact CB-CB 4.41Å; Y170-F257 AromaticContact CD1-CD1 3.72Å; Y170-F257 HydrophobicContact CD1-CD1 3.72Å; Y170-F257 AromaticContact CD1-CE1 3.65Å; Y170-F257 HydrophobicContact CD1-CE1 3.65Å; Y170-F257 HydrophobicContact CD1-CZ 4.4Å; Y170-F257 HydrophobicContact CD2-CB 4.2Å; Y170-F257 AromaticContact CD2-CD1 3.5Å; Y170-F257 HydrophobicContact CD2-CD1 3.5Å; Y170-F257 HydrophobicContact CD2-CE1 4.24Å; Y170-F257 HydrophobicContact CD2-CG 4.15Å; Y170-F257 HydrophobicContact CE1-CD1 4.11Å; Y170-F257 AromaticContact CE1-CE1 3.86Å; Y170-F257 HydrophobicContact CE1-CE1 3.86Å; Y170-F257 AromaticContact CE2-CD1 3.88Å; Y170-F257 HydrophobicContact CE2-CD1 3.88Å; Y170-F257 HydrophobicContact CE2-CE1 4.4Å; Y170-F257 HydrophobicContact CG-CB 4.28Å; Y170-F257 AromaticContact CG-CD1 3.39Å; Y170-F257 HydrophobicContact CG-CD1 3.39Å; Y170-F257 AromaticContact CG-CE1 3.84Å; Y170-F257 HydrophobicContact CG-CE1 3.84Å; Y170-F257 AromaticContact CG-CG 3.93Å; Y170-F257 HydrophobicContact CG-CG 3.93Å; I253-F257 HydrophobicContact CG2-CD1 4.46Å; I253-F257 HydrophobicContact CG2-CD2 4.11Å; I253-F257 HydrophobicContact CG2-CE1 3.94Å; I253-F257 HydrophobicContact CG2-CE2 3.54Å; I253-F257 HydrophobicContact CG2-CZ 3.45Å; I253-F257 VanDerWaalsContact CG2-CZ 3.45Å; I253-F257 VanDerWaalsContact O-CG 3.24Å; I253-F257 WeakPolarHBondContact O-CG 3.38Å; I253-F257 PolarHBondContact O-N 2.88Å; I254-F257 WeakPolarHBondContact O-CB 3.35Å; I254-F257 PolarHBondContact O-N 3.16Å; F257-M259 PolarHBondContact O-N 2.78Å; F257-A260 PolarHBondContact O-N 3.43Å; F257-V261 WeakPolarHBondContact O-CB 3.25Å; F257-V261 VanDerWaalsContact O-CG2 3.22Å; F257-V261 WeakPolarHBondContact O-CG2 3.19Å; F257-V261 PolarHBondContact O-N 3.47Å
258V88.7Confident86.2Confident30 Ų3042.4 Ų42.418%0.18222%0.22CC..Hα-helixtrans-59.1-48.9178.6172.30000111.4F166 I254 N255 A260 V261 F262 W320F166-V258 HydrophobicContact CB-CG2 4.14Å; F166-V258 HydrophobicContact CD1-CG2 3.87Å; F166-V258 HydrophobicContact CD2-CG2 4.1Å; F166-V258 HydrophobicContact CE1-CG2 4.27Å; F166-V258 HydrophobicContact CE2-CG2 4.47Å; F166-V258 HydrophobicContact CG-CG2 3.78Å; I254-V258 PolarHBondContact O-N 2.9Å; N255-V258 PolarHBondContact O-N 3.09Å; V258-A260 PolarHBondContact O-N 2.99Å; V258-V261 PolarHBondContact O-N 2.76Å; V258-F262 HydrophobicContact CG1-CD2 4.45Å; V258-F262 WeakPolarHBondContact O-CB 3.46Å; V258-F262 PolarHBondContact O-N 2.9Å; V258-W320 HydrophobicContact CG1-CH2 3.96Å; V258-W320 HydrophobicContact CG1-CZ3 4.36Å; V258-W320 HydrophobicContact CG2-CZ3 4.35Å
259M85.6Confident85.5Confident46 Ų4644.1 Ų44.123%0.22723%0.227CC..Hα-helixtrans-62.8-39179-72.5-62.2-6100112.7L49 L52 N255 F257 G263L49-M259 HydrophobicContact CD2-CB 4.29Å; L52-M259 HydrophobicContact CD1-CG 4.41Å; N255-M259 WeakPolarHBondContact O-CB 3.47Å; N255-M259 VanDerWaalsContact O-CG 3.25Å; N255-M259 WeakPolarHBondContact O-CG 3.36Å; N255-M259 PolarHBondContact O-N 2.8Å; F257-M259 PolarHBondContact O-N 2.78Å; M259-G263 PolarHBondContact O-N 2.89Å
260A86.1Confident84.9Confident3 Ų343 Ų433%0.02522%0.218CC..Hα-helixtrans-70-40.8177.800000112.7Y170 P175 L180 L256 F257 V258 G263 Q264Y170-A260 HydrophobicContact CD2-CB 3.88Å; Y170-A260 HydrophobicContact CE2-CB 3.63Å; P175-A260 HydrophobicContact CB-CB 4.35Å; P175-A260 HydrophobicContact CG-CB 4.18Å; L180-A260 HydrophobicContact CD1-CB 3.86Å; L180-A260 HydrophobicContact CD2-CB 3.62Å; L180-A260 HydrophobicContact CG-CB 4.41Å; L256-A260 WeakPolarHBondContact O-CB 3.49Å; L256-A260 PolarHBondContact O-N 2.9Å; F257-A260 PolarHBondContact O-N 3.43Å; V258-A260 PolarHBondContact O-N 2.99Å; A260-G263 PolarHBondContact O-N 3.18Å; A260-Q264 WeakPolarHBondContact O-CB 3.23Å; A260-Q264 PolarHBondContact O-N 2.91Å
261V87.5Confident84.4Confident1 Ų140.7 Ų40.71%0.00620%0.204CC..Hα-helixtrans-64.7-48.2176.9167.40000110.7E169 Y170 A173 F257 V258 G263 Q264 A265 L308E169-V261 HydrophobicContact CB-CG1 4.24Å; E169-V261 HydrophobicContact CB-CG2 3.99Å; Y170-V261 VanDerWaalsContact CA-CG2 3.47Å; A173-V261 HydrophobicContact CB-CG2 4.15Å; F257-V261 WeakPolarHBondContact O-CB 3.25Å; F257-V261 VanDerWaalsContact O-CG2 3.22Å; F257-V261 WeakPolarHBondContact O-CG2 3.19Å; F257-V261 PolarHBondContact O-N 3.47Å; V258-V261 PolarHBondContact O-N 2.76Å; V261-G263 VanDerWaalsContact C-N 3.34Å; V261-G263 PolarHBondContact O-N 3.36Å; V261-Q264 PolarHBondContact O-N 3.47Å; V261-A265 VanDerWaalsContact O-CB 3.3Å; V261-A265 WeakPolarHBondContact O-CB 3.43Å; V261-A265 PolarHBondContact O-N 3.43Å; V261-L308 HydrophobicContact CG1-CD1 3.73Å; V261-L308 HydrophobicContact CG1-CD2 3.43Å; V261-L308 VanDerWaalsContact CG1-CD2 3.43Å; V261-L308 HydrophobicContact CG1-CG 4.22Å
262F84.5Confident84.1Confident26 Ų2642.7 Ų42.711%0.11421%0.208CC..Hα-helixtrans-65.4-37.5175.6-81.46.6000112.3V258 A265 F266 V299 L308 W320V258-F262 HydrophobicContact CG1-CD2 4.45Å; V258-F262 WeakPolarHBondContact O-CB 3.46Å; V258-F262 PolarHBondContact O-N 2.9Å; F262-A265 PolarHBondContact O-N 3.29Å; F262-F266 HydrophobicContact CB-CD2 4.25Å; F262-F266 HydrophobicContact CD1-CE2 4.17Å; F262-F266 HydrophobicContact CE1-CE2 4.44Å; F262-F266 HydrophobicContact CG-CD2 4.4Å; F262-F266 HydrophobicContact CG-CE2 4.25Å; F262-F266 WeakPolarHBondContact O-CB 3.23Å; F262-F266 WeakPolarHBondContact O-CD2 3.33Å; F262-F266 PolarHBondContact O-N 3.3Å; F262-V299 HydrophobicContact CD2-CG1 3.7Å; F262-V299 HydrophobicContact CE2-CG1 4.06Å; F262-V299 HydrophobicContact CG-CG1 4.4Å; F262-L308 HydrophobicContact CE1-CD1 4.15Å; F262-W320 HydrophobicContact CD1-CH2 4.38Å; F262-W320 HydrophobicContact CE1-CE3 4.47Å; F262-W320 AromaticContact CE1-CH2 3.43Å; F262-W320 HydrophobicContact CE1-CH2 3.43Å; F262-W320 VanDerWaalsContact CE1-CH2 3.43Å; F262-W320 AromaticContact CE1-CZ2 3.77Å; F262-W320 HydrophobicContact CE1-CZ2 3.77Å; F262-W320 AromaticContact CE1-CZ3 3.81Å; F262-W320 HydrophobicContact CE1-CZ3 3.81Å; F262-W320 HydrophobicContact CE2-CH2 4.07Å; F262-W320 HydrophobicContact CE2-CZ2 4.27Å; F262-W320 AromaticContact CZ-CH2 3.25Å; F262-W320 HydrophobicContact CZ-CH2 3.25Å; F262-W320 AromaticContact CZ-CZ2 3.31Å; F262-W320 HydrophobicContact CZ-CZ2 3.31Å; F262-W320 HydrophobicContact CZ-CZ3 4.12Å
263G80.4Confident83.6Confident14 Ų1445.4 Ų45.414%0.14422%0.221CC..Hα-helixtrans-53.7-56.8169.600000111.7M259 A260 V261 A265 Y267M259-G263 PolarHBondContact O-N 2.89Å; A260-G263 PolarHBondContact O-N 3.18Å; V261-G263 VanDerWaalsContact C-N 3.34Å; V261-G263 PolarHBondContact O-N 3.36Å; G263-A265 VanDerWaalsContact C-N 3.32Å; G263-A265 PolarHBondContact O-N 3.36Å; G263-Y267 WeakPolarHBondContact O-CB 3.28Å; G263-Y267 PolarHBondContact O-N 3.3Å
264Q82.4Confident83.2Confident96 Ų9641.8 Ų41.845%0.44920%0.203SC..Hα-helixtrans-62-36.6-179.4-170.566.62900113.2P175 A260 V261P175-Q264 HydrophobicContact CB-CB 4.3Å; A260-Q264 WeakPolarHBondContact O-CB 3.23Å; A260-Q264 PolarHBondContact O-N 2.91Å; V261-Q264 PolarHBondContact O-N 3.47Å
265A81.1Confident83Confident3 Ų342.4 Ų42.43%0.02521%0.205CC..Hα-helixtrans-78.6-31.2-176.100000114.3V261 F262 G263 I307 L308 L311V261-A265 VanDerWaalsContact O-CB 3.3Å; V261-A265 WeakPolarHBondContact O-CB 3.43Å; V261-A265 PolarHBondContact O-N 3.43Å; F262-A265 PolarHBondContact O-N 3.29Å; G263-A265 VanDerWaalsContact C-N 3.32Å; G263-A265 PolarHBondContact O-N 3.36Å; A265-I307 HydrophobicContact CB-CG2 4.17Å; A265-L308 HydrophobicContact CB-CD2 3.85Å; A265-L311 HydrophobicContact CB-CD1 4.04Å
266F77.3Confident82.8Confident3 Ų344 Ų441%0.01321%0.214CC..Hα-helixtrans-109.8-6.8-175.4-68.4-76.9000114.6I42 F262 Q268 Q269 V297 V299 I307I42-F266 HydrophobicContact CD1-CB 3.94Å; F262-F266 HydrophobicContact CB-CD2 4.25Å; F262-F266 HydrophobicContact CD1-CE2 4.17Å; F262-F266 HydrophobicContact CE1-CE2 4.44Å; F262-F266 HydrophobicContact CG-CD2 4.4Å; F262-F266 HydrophobicContact CG-CE2 4.25Å; F262-F266 WeakPolarHBondContact O-CB 3.23Å; F262-F266 WeakPolarHBondContact O-CD2 3.33Å; F262-F266 PolarHBondContact O-N 3.3Å; F266-Q268 PolarHBondContact O-N 2.88Å; F266-Q268 VanDerWaalsContact O-N 3.09Å; F266-Q269 PolarHBondContact O-N 3.1Å; F266-V297 HydrophobicContact CD1-CB 4.07Å; F266-V297 HydrophobicContact CD1-CG1 3.86Å; F266-V297 HydrophobicContact CE1-CB 4.33Å; F266-V297 HydrophobicContact CE1-CG1 3.61Å; F266-V299 HydrophobicContact CB-CG2 4.08Å; F266-V299 HydrophobicContact CD1-CG2 4.32Å; F266-V299 HydrophobicContact CD2-CG1 4.07Å; F266-V299 HydrophobicContact CD2-CG2 3.98Å; F266-V299 HydrophobicContact CE2-CG1 3.96Å; F266-V299 HydrophobicContact CE2-CG2 4.46Å; F266-V299 HydrophobicContact CG-CG2 3.9Å; F266-I307 HydrophobicContact CE1-CB 4.43Å; F266-I307 HydrophobicContact CE1-CG2 3.84Å; F266-I307 HydrophobicContact CE2-CG2 3.84Å; F266-I307 HydrophobicContact CZ-CB 4.4Å; F266-I307 HydrophobicContact CZ-CG2 3.46Å; F266-I307 VanDerWaalsContact CZ-CG2 3.46Å
267Y72Confident82.7Confident112 Ų11245.1 Ų45.144%0.43922%0.219SC..THydrogen-bonded Turntrans-60117.6-175.5-171.8-117.4000112.5G263 Q269G263-Y267 WeakPolarHBondContact O-CB 3.28Å; G263-Y267 PolarHBondContact O-N 3.3Å; Y267-Q269 PolarHBondContact O-N 3.25Å; Y267-Q269 VanDerWaalsContact O-N 3.11Å
268Q66.9Low82.5Confident145 Ų14543.1 Ų43.168%0.67821%0.21SC*.THydrogen-bonded Turntrans58.213.6-178.8-60.2-174.5-24.900115.8F266F266-Q268 PolarHBondContact O-N 2.88Å; F266-Q268 VanDerWaalsContact O-N 3.09Å
269Q74.7Confident82.4Confident53 Ų5343.6 Ų43.625%0.24822%0.217CC..  trans-76.9128.4178.4-66.2-67.8-35.400111.9F266 Y267 V297F266-Q269 PolarHBondContact O-N 3.1Å; Y267-Q269 PolarHBondContact O-N 3.25Å; Y267-Q269 VanDerWaalsContact O-N 3.11Å; Q269-V297 PolarHBondContact O-N 3.44Å
270T82.8Confident82.5Confident31 Ų3148.7 Ų48.719%0.1925%0.245CC..BIsolated β-bridgetrans-83159.4167.763.30000111.4E272 E273 A274 N295T270-E272 PolarHBondContact O-N 3.02Å; T270-E273 WeakPolarHBondContact CB-OE2 3.25Å; T270-E273 WeakPolarHBondContact CG2-OE2 3.33Å; T270-E273 PolarHBondContact N-OE2 2.91Å; T270-E273 PolarHBondContact O-N 3.32Å; T270-E273 VanDerWaalsContact OG1-CD 3.22Å; T270-E273 VanDerWaalsContact OG1-CG 3.27Å; T270-E273 WeakPolarHBondContact OG1-CG 3.45Å; T270-E273 PolarHBondContact OG1-N 2.69Å; T270-E273 PolarHBondContact OG1-OE2 3.2Å; T270-A274 PolarHBondContact O-N 2.97Å; T270-A274 VanDerWaalsContact O-N 3.07Å; T270-N295 WeakPolarHBondContact CA-O 3.36Å
271N82.8Confident82.5Confident3 Ų349.7 Ų49.72%0.01625%0.252CS..Hα-helixtrans-66.4-27.2177.6-62.1-94000112.6F275 P291 N295 T296 V297N271-F275 WeakPolarHBondContact O-CB 3.23Å; N271-F275 PolarHBondContact O-N 3.47Å; N271-P291 HydrophobicContact CB-CG 4.36Å; N271-P291 WeakPolarHBondContact CB-O 3.47Å; N271-N295 PolarHBondContact N-O 3.48Å; N271-N295 PolarHBondContact ND2-O 3.34Å; N271-T296 VanDerWaalsContact ND2-C 3.28Å; N271-T296 PolarHBondContact ND2-O 3.18Å; N271-V297 HydrophobicContact CB-CG2 4.27Å
272E83.3Confident82.3Confident90 Ų9054.9 Ų54.942%0.42129%0.289SS..Hα-helixtrans-69.7-42.3173.9-176.1167.7-175.700112.3T270 F275 N276T270-E272 PolarHBondContact O-N 3.02Å; E272-F275 WeakPolarHBondContact O-CB 3.2Å; E272-F275 PolarHBondContact O-N 3.34Å; E272-N276 WeakPolarHBondContact O-CB 3.45Å; E272-N276 VanDerWaalsContact O-CG 3.24Å; E272-N276 PolarHBondContact O-N 2.98Å; E272-N276 PolarHBondContact O-ND2 3.21Å; E272-N276 VanDerWaalsContact O-ND2 3.16Å
273E83.8Confident82.3Confident88 Ų8854.4 Ų54.441%0.41129%0.287SS..Hα-helixtrans-62.5-47.2174.3-71.7160.9140.600111.4T270 F275 N276 I277T270-E273 WeakPolarHBondContact CB-OE2 3.25Å; T270-E273 WeakPolarHBondContact CG2-OE2 3.33Å; T270-E273 PolarHBondContact N-OE2 2.91Å; T270-E273 PolarHBondContact O-N 3.32Å; T270-E273 VanDerWaalsContact OG1-CD 3.22Å; T270-E273 VanDerWaalsContact OG1-CG 3.27Å; T270-E273 WeakPolarHBondContact OG1-CG 3.45Å; T270-E273 PolarHBondContact OG1-N 2.69Å; T270-E273 PolarHBondContact OG1-OE2 3.2Å; E273-F275 VanDerWaalsContact C-N 3.33Å; E273-F275 PolarHBondContact O-N 2.99Å; E273-N276 PolarHBondContact O-N 3.33Å; E273-N276 VanDerWaalsContact O-N 3.13Å; E273-I277 VanDerWaalsContact O-CG1 3.28Å; E273-I277 WeakPolarHBondContact O-CG1 3.26Å; E273-I277 PolarHBondContact O-N 2.91Å
274A83.9Confident82.4Confident1 Ų160 Ų601%0.00831%0.309CS..Hα-helixtrans-58.3-42.6175.100000112.5T270 C278 F290 V297 I307T270-A274 PolarHBondContact O-N 2.97Å; T270-A274 VanDerWaalsContact O-N 3.07Å; A274-C278 WeakPolarHBondContact O-CB 3.34Å; A274-C278 PolarHBondContact O-N 2.97Å; A274-C278 VanDerWaalsContact O-N 3.08Å; A274-F290 HydrophobicContact CB-CB 4.46Å; A274-F290 HydrophobicContact CB-CD1 3.86Å; A274-F290 HydrophobicContact CB-CD2 4.37Å; A274-F290 HydrophobicContact CB-CE1 4.21Å; A274-F290 HydrophobicContact CB-CG 3.95Å; A274-V297 HydrophobicContact CB-CG2 3.93Å; A274-I307 HydrophobicContact CB-CD1 3.9Å
275F87.1Confident82.4Confident26 Ų2661.6 Ų61.611%0.11432%0.321CS..Hα-helixtrans-58.5-48.8173.4-178.2-77.5000111.3N271 E272 E273 C278 A279 A287 F290 R292N271-F275 WeakPolarHBondContact O-CB 3.23Å; N271-F275 PolarHBondContact O-N 3.47Å; E272-F275 WeakPolarHBondContact O-CB 3.2Å; E272-F275 PolarHBondContact O-N 3.34Å; E273-F275 VanDerWaalsContact C-N 3.33Å; E273-F275 PolarHBondContact O-N 2.99Å; F275-C278 PolarHBondContact O-N 3.34Å; F275-A279 HydrophobicContact CD1-CB 4.28Å; F275-A279 HydrophobicContact CE1-CB 3.88Å; F275-A279 VanDerWaalsContact O-CB 3.26Å; F275-A279 WeakPolarHBondContact O-CB 3.38Å; F275-A279 PolarHBondContact O-N 3.11Å; F275-A287 HydrophobicContact CD2-CB 4.13Å; F275-A287 WeakPolarHBondContact CD2-O 3.33Å; F275-A287 HydrophobicContact CE1-CB 4.43Å; F275-A287 HydrophobicContact CE2-CB 3.86Å; F275-A287 WeakPolarHBondContact CE2-O 3.23Å; F275-A287 HydrophobicContact CZ-CB 3.99Å; F275-F290 HydrophobicContact CB-CB 4.24Å; F275-R292 HydrophobicContact CD2-CG 4.15Å; F275-R292 HydrophobicContact CG-CG 4.21Å
276N87.3Confident82.5Confident82 Ų8262.8 Ų62.844%0.43933%0.325SS..Hα-helixtrans-67.2-39.7-175.4-72.6-29.9000112.3E272 E273 A279 N280E272-N276 WeakPolarHBondContact O-CB 3.45Å; E272-N276 VanDerWaalsContact O-CG 3.24Å; E272-N276 PolarHBondContact O-N 2.98Å; E272-N276 PolarHBondContact O-ND2 3.21Å; E272-N276 VanDerWaalsContact O-ND2 3.16Å; E273-N276 PolarHBondContact O-N 3.33Å; E273-N276 VanDerWaalsContact O-N 3.13Å; N276-A279 PolarHBondContact O-N 3.32Å; N276-N280 PolarHBondContact O-N 3Å; N276-N280 VanDerWaalsContact O-N 3.11Å
277I87.2Confident82.7Confident53 Ų5362.8 Ų62.827%0.27233%0.326SS..Hα-helixtrans-59.7-51.6173-68.3163.4000110E273 A279 N280 S281 C310 L311E273-I277 VanDerWaalsContact O-CG1 3.28Å; E273-I277 WeakPolarHBondContact O-CG1 3.26Å; E273-I277 PolarHBondContact O-N 2.91Å; I277-A279 PolarHBondContact O-N 2.95Å; I277-N280 PolarHBondContact O-N 3.24Å; I277-S281 PolarHBondContact O-N 2.98Å; I277-C310 HydrophobicContact CG2-CB 4.14Å; I277-L311 HydrophobicContact CD1-CD2 4.25Å; I277-L311 HydrophobicContact CG2-CD2 3.86Å; I277-L311 HydrophobicContact CG2-CG 4.34Å
278C87.2Confident83.1Confident0 Ų066.2 Ų66.20%034%0.343CS..Hα-helixtrans-64.1-37.7178.5-75.70000113.3A274 F275 N280 S281 Q284 A287 C310A274-C278 WeakPolarHBondContact O-CB 3.34Å; A274-C278 PolarHBondContact O-N 2.97Å; A274-C278 VanDerWaalsContact O-N 3.08Å; F275-C278 PolarHBondContact O-N 3.34Å; C278-N280 VanDerWaalsContact C-N 3.33Å; C278-N280 PolarHBondContact O-N 3.41Å; C278-S281 PolarHBondContact O-N 2.89Å; C278-S281 PolarHBondContact O-OG 3.12Å; C278-Q284 WeakPolarHBondContact O-CA 3.4Å; C278-Q284 PolarHBondContact O-N 3.42Å; C278-A287 HydrophobicContact CB-CB 3.92Å; C278-C310 WeakPolarHBondContact CA-SG 3.39Å; C278-C310 HydrophobicContact CB-CB 3.96Å; C278-C310 WeakPolarHBondContact CB-SG 3.46Å; C278-C310 WeakPolarHBondContact SG-CB 3.32Å; C278-C310 CovalentContact SG-SG 2.04Å; C278-C310 PolarHBondContact SG-SG 3.44Å
279A87.8Confident83.8Confident39 Ų3961 Ų6132%0.32232%0.319SS..Hα-helixtrans-67.1-31.2179.500000113.3F275 N276 I277 S281 A287F275-A279 HydrophobicContact CD1-CB 4.28Å; F275-A279 HydrophobicContact CE1-CB 3.88Å; F275-A279 VanDerWaalsContact O-CB 3.26Å; F275-A279 WeakPolarHBondContact O-CB 3.38Å; F275-A279 PolarHBondContact O-N 3.11Å; N276-A279 PolarHBondContact O-N 3.32Å; I277-A279 PolarHBondContact O-N 2.95Å; A279-S281 VanDerWaalsContact C-N 3.35Å; A279-A287 HydrophobicContact CB-CB 4.1Å
280N87.1Confident84.1Confident153 Ų15358.6 Ų58.682%0.81831%0.308SS*.Hα-helixtrans-86.4-6.4175.6-162.329000113.2N276 I277 C278N276-N280 PolarHBondContact O-N 3Å; N276-N280 VanDerWaalsContact O-N 3.11Å; I277-N280 PolarHBondContact O-N 3.24Å; C278-N280 VanDerWaalsContact C-N 3.33Å; C278-N280 PolarHBondContact O-N 3.41Å
281S86.6Confident83.9Confident24 Ų2458.7 Ų58.717%0.16831%0.31CS..SBendtrans-89.8167.2178.981.90000112.4I277 C278 A279 L283 Q284I277-S281 PolarHBondContact O-N 2.98Å; C278-S281 PolarHBondContact O-N 2.89Å; C278-S281 PolarHBondContact O-OG 3.12Å; A279-S281 VanDerWaalsContact C-N 3.35Å; S281-L283 PolarHBondContact O-N 3.5Å; S281-L283 PolarHBondContact OG-N 3Å; S281-Q284 PolarHBondContact O-N 3.35Å
282S83.1Confident83.7Confident111 Ų11166.9 Ų66.978%0.77634%0.34SS*.THydrogen-bonded Turntrans-59.7-10.4169.7-51.50000114
283L84.3Confident83.5Confident15 Ų1565.5 Ų65.58%0.07934%0.335CS..THydrogen-bonded Turntrans-100.523.1-180-70.481.4000113.1S281 N285 Y286 G309 P314 L317S281-L283 PolarHBondContact O-N 3.5Å; S281-L283 PolarHBondContact OG-N 3Å; L283-N285 PolarHBondContact O-N 3.43Å; L283-Y286 HydrophobicContact CB-CD2 4Å; L283-Y286 HydrophobicContact CD2-CD2 4.26Å; L283-Y286 HydrophobicContact CG-CD2 4.4Å; L283-Y286 WeakPolarHBondContact O-CB 3.36Å; L283-Y286 PolarHBondContact O-N 3.21Å; L283-G309 WeakPolarHBondContact CD1-O 3.47Å; L283-P314 HydrophobicContact CD1-CB 4.21Å; L283-P314 HydrophobicContact CD1-CG 3.71Å; L283-L317 HydrophobicContact CD2-CB 4.44Å; L283-L317 HydrophobicContact CD2-CD1 3.46Å; L283-L317 VanDerWaalsContact CD2-CD1 3.46Å
284Q81.8Confident83.3Confident131 Ų13167.8 Ų67.861%0.61235%0.351SS*.G310 helixtrans-40.7-32.2-179.860.8175.4-2100116.5C278 S281 Y286 A287C278-Q284 WeakPolarHBondContact O-CA 3.4Å; C278-Q284 PolarHBondContact O-N 3.42Å; S281-Q284 PolarHBondContact O-N 3.35Å; Q284-Y286 PolarHBondContact O-N 2.73Å; Q284-A287 WeakPolarHBondContact O-CB 3.33Å; Q284-A287 PolarHBondContact O-N 3.28Å
285N83.2Confident83.1Confident131 Ų13171.4 Ų71.470%0.70137%0.37SS*.G310 helixtrans-59.8-32.3176.6-68.8-24.2000113.2L283L283-N285 PolarHBondContact O-N 3.43Å
286Y82.9Confident82.3Confident28 Ų2872.3 Ų72.311%0.1138%0.377CS..G310 helixtrans-83-14.4-178-69.5-89.6000113.7A121 L283 Q284 K288 I289 V306A121-Y286 WeakPolarHBondContact CA-OH 3.36Å; L283-Y286 HydrophobicContact CB-CD2 4Å; L283-Y286 HydrophobicContact CD2-CD2 4.26Å; L283-Y286 HydrophobicContact CG-CD2 4.4Å; L283-Y286 WeakPolarHBondContact O-CB 3.36Å; L283-Y286 PolarHBondContact O-N 3.21Å; Q284-Y286 PolarHBondContact O-N 2.73Å; Y286-K288 PolarHBondContact O-N 2.98Å; Y286-I289 HydrophobicContact CD1-CD1 3.65Å; Y286-I289 HydrophobicContact CG-CD1 4.4Å; Y286-I289 WeakPolarHBondContact O-CB 3.49Å; Y286-I289 WeakPolarHBondContact O-CG1 3.42Å; Y286-I289 PolarHBondContact O-N 3.34Å; Y286-V306 HydrophobicContact CD1-CG1 4.32Å; Y286-V306 HydrophobicContact CD1-CG2 3.82Å; Y286-V306 HydrophobicContact CE1-CG2 4.4Å; Y286-V306 HydrophobicContact CG-CG1 4.27Å
287A80.6Confident81.6Confident3 Ų368.5 Ų68.53%0.02536%0.357CS..G310 helixtrans-54.6-32.1-17900000112.6F275 C278 A279 Q284 I289 F290F275-A287 HydrophobicContact CD2-CB 4.13Å; F275-A287 WeakPolarHBondContact CD2-O 3.33Å; F275-A287 HydrophobicContact CE1-CB 4.43Å; F275-A287 HydrophobicContact CE2-CB 3.86Å; F275-A287 WeakPolarHBondContact CE2-O 3.23Å; F275-A287 HydrophobicContact CZ-CB 3.99Å; C278-A287 HydrophobicContact CB-CB 3.92Å; A279-A287 HydrophobicContact CB-CB 4.1Å; Q284-A287 WeakPolarHBondContact O-CB 3.33Å; Q284-A287 PolarHBondContact O-N 3.28Å; A287-I289 PolarHBondContact O-N 3.49Å; A287-F290 PolarHBondContact O-N 3.48Å; A287-F290 VanDerWaalsContact O-N 3.14Å
288K81.6Confident80.7Confident183 Ų18369.1 Ų69.180%0.79637%0.366SS*.G310 helixtrans-59.4-15.1177.9-62178.7-177.8175.40115.2Y286 F290Y286-K288 PolarHBondContact O-N 2.98Å; K288-F290 VanDerWaalsContact C-N 3.33Å
289I80.4Confident80Confident35 Ų3572 Ų7218%0.17938%0.384CS..G310 helixtrans-73.6-28.5178.4-66162.7000111.2Y286 A287 Y302 Q303 V306Y286-I289 HydrophobicContact CD1-CD1 3.65Å; Y286-I289 HydrophobicContact CG-CD1 4.4Å; Y286-I289 WeakPolarHBondContact O-CB 3.49Å; Y286-I289 WeakPolarHBondContact O-CG1 3.42Å; Y286-I289 PolarHBondContact O-N 3.34Å; A287-I289 PolarHBondContact O-N 3.49Å; I289-Y302 HydrophobicContact CD1-CE1 3.59Å; I289-Y302 HydrophobicContact CG1-CE1 4.15Å; I289-Y302 HydrophobicContact CG2-CD1 4.4Å; I289-Y302 HydrophobicContact CG2-CE1 4.15Å; I289-Q303 HydrophobicContact CG2-CG 3.99Å; I289-V306 HydrophobicContact CD1-CG1 4.45Å; I289-V306 HydrophobicContact CD1-CG2 4Å
290F81.6Confident79.5Confident3 Ų370.8 Ų70.81%0.01337%0.372CS..SBendtrans-89.5116.3176.5-58.3-76000109.3A274 F275 A287 K288 V297 Q303 V306 I307A274-F290 HydrophobicContact CB-CB 4.46Å; A274-F290 HydrophobicContact CB-CD1 3.86Å; A274-F290 HydrophobicContact CB-CD2 4.37Å; A274-F290 HydrophobicContact CB-CE1 4.21Å; A274-F290 HydrophobicContact CB-CG 3.95Å; F275-F290 HydrophobicContact CB-CB 4.24Å; A287-F290 PolarHBondContact O-N 3.48Å; A287-F290 VanDerWaalsContact O-N 3.14Å; K288-F290 VanDerWaalsContact C-N 3.33Å; F290-V297 HydrophobicContact CD1-CG1 4.07Å; F290-V297 HydrophobicContact CE1-CG1 3.93Å; F290-Q303 HydrophobicContact CE1-CB 4.18Å; F290-Q303 HydrophobicContact CZ-CB 4.47Å; F290-V306 HydrophobicContact CE2-CG1 3.82Å; F290-V306 HydrophobicContact CZ-CG1 4.23Å; F290-I307 HydrophobicContact CZ-CB 4.16Å; F290-I307 HydrophobicContact CZ-CD1 4.25Å
291P79.3Confident79.3Confident34 Ų3465.6 Ų65.622%0.22134%0.344CS..  trans-67.4144.5175.729.4-34.1000109.8N271 D293N271-P291 HydrophobicContact CB-CG 4.36Å; N271-P291 WeakPolarHBondContact CB-O 3.47Å; P291-D293 PolarHBondContact O-N 3.25Å
292R77.8Confident79.3Confident175 Ų17565.5 Ų65.566%0.6634%0.34SS*.SBendtrans-79.567177.7-67.1-174.8-178.8176.6-2.7111.6F275F275-R292 HydrophobicContact CD2-CG 4.15Å; F275-R292 HydrophobicContact CG-CG 4.21Å
293D79.9Confident79.4Confident60 Ų6060.9 Ų60.932%0.32131%0.306SS..  trans-113.2144.4176.5-64.9-7.8000110.5K39 P291 N295K39-D293 IonicContact NZ-OD2 3.16Å; K39-D293 PolarHBondContact NZ-OD2 3.25Å; P291-D293 PolarHBondContact O-N 3.25Å; D293-N295 HydrophobicContact CB-CB 4.19Å; D293-N295 PolarHBondContact O-N 3.07Å; D293-N295 PolarHBondContact OD2-ND2 3.44Å
294N79.8Confident79.4Confident137 Ų13760.1 Ų60.173%0.73330%0.302SS*.SBendtrans-73.712.5170.7-119.21.8000114.2
295N78.7Confident79.7Confident76 Ų7653.9 Ų53.941%0.40627%0.273SS..SBendtrans-81.1160.2175.8-67.3-59.7000110.3K39 T270 N271 D293K39-N295 HydrophobicContact CD-CB 3.72Å; K39-N295 PolarHBondContact NZ-ND2 3.29Å; T270-N295 WeakPolarHBondContact CA-O 3.36Å; N271-N295 PolarHBondContact N-O 3.48Å; N271-N295 PolarHBondContact ND2-O 3.34Å; D293-N295 HydrophobicContact CB-CB 4.19Å; D293-N295 PolarHBondContact O-N 3.07Å; D293-N295 PolarHBondContact OD2-ND2 3.44Å
296T71.4Confident80Confident45 Ų4547.7 Ų47.728%0.27624%0.24SC..BIsolated β-bridgetrans-61.4149.7166.445.90000111.2N271N271-T296 VanDerWaalsContact ND2-C 3.28Å; N271-T296 PolarHBondContact ND2-O 3.18Å
297V71.5Confident80.2Confident2 Ų246.4 Ų46.41%0.01224%0.235CC..PPolyproline II helixtrans-70134.6175.2-176.20000109.9F266 Q269 N271 A274 F290F266-V297 HydrophobicContact CD1-CB 4.07Å; F266-V297 HydrophobicContact CD1-CG1 3.86Å; F266-V297 HydrophobicContact CE1-CB 4.33Å; F266-V297 HydrophobicContact CE1-CG1 3.61Å; Q269-V297 PolarHBondContact O-N 3.44Å; N271-V297 HydrophobicContact CB-CG2 4.27Å; A274-V297 HydrophobicContact CB-CG2 3.93Å; F290-V297 HydrophobicContact CD1-CG1 4.07Å; F290-V297 HydrophobicContact CE1-CG1 3.93Å
298S69Low80.6Confident67 Ų6746.3 Ų46.347%0.46923%0.234SC..PPolyproline II helixtrans-69.7128.8167.245.70000109.7D300 Q303S298-D300 PolarHBondContact O-N 3.08Å; S298-Q303 PolarHBondContact O-OE1 2.96Å; S298-Q303 PolarHBondContact OG-OE1 3.02Å
299V71.3Confident81Confident59 Ų5937.6 Ų37.636%0.35820%0.196SC..PPolyproline II helixtrans-82.4118175.8-1760000108.9I42 F262 F266I42-V299 HydrophobicContact CD1-CG2 3.6Å; I42-V299 HydrophobicContact CG1-CG2 4.14Å; F262-V299 HydrophobicContact CD2-CG1 3.7Å; F262-V299 HydrophobicContact CE2-CG1 4.06Å; F262-V299 HydrophobicContact CG-CG1 4.4Å; F266-V299 HydrophobicContact CB-CG2 4.08Å; F266-V299 HydrophobicContact CD1-CG2 4.32Å; F266-V299 HydrophobicContact CD2-CG1 4.07Å; F266-V299 HydrophobicContact CD2-CG2 3.98Å; F266-V299 HydrophobicContact CE2-CG1 3.96Å; F266-V299 HydrophobicContact CE2-CG2 4.46Å; F266-V299 HydrophobicContact CG-CG2 3.9Å
300D78.4Confident81.5Confident15 Ų1536.5 Ų36.58%0.0819%0.191CC..  trans-137.6156.8172.1173.246.9000110.1S298 Y302 Q303 G304 S381S298-D300 PolarHBondContact O-N 3.08Å; D300-Y302 VanDerWaalsContact C-N 3.27Å; D300-Y302 PolarHBondContact O-N 3.47Å; D300-Y302 VanDerWaalsContact OD2-CB 3.32Å; D300-Y302 WeakPolarHBondContact OD2-CB 3.39Å; D300-Y302 PolarHBondContact OD2-N 3.18Å; D300-Y302 VanDerWaalsContact OD2-N 3.16Å; D300-Q303 HydrophobicContact CB-CB 4.44Å; D300-Q303 HydrophobicContact CB-CG 4.45Å; D300-Q303 PolarHBondContact O-N 3.35Å; D300-G304 WeakPolarHBondContact O-CA 3.48Å; D300-G304 PolarHBondContact O-N 3.35Å; D300-S381 WeakPolarHBondContact OD1-CB 3.46Å; D300-S381 PolarHBondContact OD1-OG 2.87Å; D300-S381 PolarHBondContact OD2-OG 3.34Å
301I82.9Confident81.8Confident44 Ų4439.7 Ų39.723%0.22621%0.208CC..Hα-helixtrans-57.9-37.2178.9-58.6178000111.8I114 G305 W320 L324I114-I301 HydrophobicContact CG2-CG2 4.4Å; I301-G305 PolarHBondContact O-N 2.65Å; I301-W320 HydrophobicContact CG2-CZ2 4.16Å; I301-W320 PolarHBondContact O-NE1 3.19Å; I301-W320 VanDerWaalsContact O-NE1 3.14Å; I301-L324 HydrophobicContact CG2-CD1 3.62Å; I301-L324 HydrophobicContact CG2-CD2 3.47Å; I301-L324 VanDerWaalsContact CG2-CD2 3.47Å; I301-L324 HydrophobicContact CG2-CG 4.19Å
302Y86.1Confident82.2Confident21 Ų2141.3 Ų41.38%0.08221%0.212CC..Hα-helixtrans-73.3-51.2176.7-179.2-117.9000111.9I114 N117 L118 I289 D300 G304 G305 V306 L377I114-Y302 HydrophobicContact CG2-CD2 4.04Å; N117-Y302 WeakPolarHBondContact OD1-CE2 2.99Å; N117-Y302 PolarHBondContact OD1-OH 2.94Å; N117-Y302 VanDerWaalsContact OD1-OH 3.06Å; L118-Y302 HydrophobicContact CD1-CD2 4.43Å; L118-Y302 HydrophobicContact CD2-CD2 3.81Å; L118-Y302 HydrophobicContact CD2-CE2 3.6Å; L118-Y302 HydrophobicContact CG-CD2 4.05Å; L118-Y302 HydrophobicContact CG-CE2 4.09Å; I289-Y302 HydrophobicContact CD1-CE1 3.59Å; I289-Y302 HydrophobicContact CG1-CE1 4.15Å; I289-Y302 HydrophobicContact CG2-CD1 4.4Å; I289-Y302 HydrophobicContact CG2-CE1 4.15Å; D300-Y302 VanDerWaalsContact C-N 3.27Å; D300-Y302 PolarHBondContact O-N 3.47Å; D300-Y302 VanDerWaalsContact OD2-CB 3.32Å; D300-Y302 WeakPolarHBondContact OD2-CB 3.39Å; D300-Y302 PolarHBondContact OD2-N 3.18Å; D300-Y302 VanDerWaalsContact OD2-N 3.16Å; Y302-G304 PolarHBondContact O-N 3Å; Y302-G305 PolarHBondContact O-N 3.36Å; Y302-V306 WeakPolarHBondContact O-CG2 3.5Å; Y302-V306 PolarHBondContact O-N 2.92Å; Y302-L377 HydrophobicContact CE1-CD1 4.11Å
303Q85.3Confident82.8Confident14 Ų1434 Ų347%0.06519%0.191CC..Hα-helixtrans-63-32.3179.2-63.4-173.5-63.200111.6I289 F290 S298 D300 V306 I307I289-Q303 HydrophobicContact CG2-CG 3.99Å; F290-Q303 HydrophobicContact CE1-CB 4.18Å; F290-Q303 HydrophobicContact CZ-CB 4.47Å; S298-Q303 PolarHBondContact O-OE1 2.96Å; S298-Q303 PolarHBondContact OG-OE1 3.02Å; D300-Q303 HydrophobicContact CB-CB 4.44Å; D300-Q303 HydrophobicContact CB-CG 4.45Å; D300-Q303 PolarHBondContact O-N 3.35Å; Q303-V306 PolarHBondContact O-N 3.38Å; Q303-I307 PolarHBondContact O-N 2.91Å
304G85Confident83.2Confident0 Ų034 Ų340%019%0.194CC..Hα-helixtrans-59.5-55172.300000112.9D300 Y302 V306 I307 L308D300-G304 WeakPolarHBondContact O-CA 3.48Å; D300-G304 PolarHBondContact O-N 3.35Å; Y302-G304 PolarHBondContact O-N 3Å; G304-V306 PolarHBondContact O-N 2.93Å; G304-I307 WeakPolarHBondContact O-CG2 3.38Å; G304-I307 PolarHBondContact O-N 2.79Å; G304-L308 WeakPolarHBondContact O-CB 3.47Å; G304-L308 VanDerWaalsContact O-CG 3.24Å; G304-L308 WeakPolarHBondContact O-CG 3.3Å; G304-L308 PolarHBondContact O-N 3.49Å
305G87.1Confident83.8Confident0 Ų029.9 Ų29.90%018%0.179CC..Hα-helixtrans-58.3-35.2176.900000113.3I301 Y302 G309I301-G305 PolarHBondContact O-N 2.65Å; Y302-G305 PolarHBondContact O-N 3.36Å; G305-G309 PolarHBondContact O-N 3.26Å; G305-G309 VanDerWaalsContact O-N 3.16Å
306V89.1Confident84.4Confident0 Ų026.4 Ų26.40%016%0.161CC..Hα-helixtrans-70.6-49.8176.51750000112L118 Y286 I289 F290 Y302 Q303 G304 L308 G309 C310L118-V306 HydrophobicContact CD2-CG2 3.98Å; Y286-V306 HydrophobicContact CD1-CG1 4.32Å; Y286-V306 HydrophobicContact CD1-CG2 3.82Å; Y286-V306 HydrophobicContact CE1-CG2 4.4Å; Y286-V306 HydrophobicContact CG-CG1 4.27Å; I289-V306 HydrophobicContact CD1-CG1 4.45Å; I289-V306 HydrophobicContact CD1-CG2 4Å; F290-V306 HydrophobicContact CE2-CG1 3.82Å; F290-V306 HydrophobicContact CZ-CG1 4.23Å; Y302-V306 WeakPolarHBondContact O-CG2 3.5Å; Y302-V306 PolarHBondContact O-N 2.92Å; Q303-V306 PolarHBondContact O-N 3.38Å; G304-V306 PolarHBondContact O-N 2.93Å; V306-L308 VanDerWaalsContact C-N 3.32Å; V306-L308 PolarHBondContact O-N 3.41Å; V306-G309 CarbonylContact O-C 3.6Å; V306-G309 WeakPolarHBondContact O-CA 3.41Å; V306-G309 PolarHBondContact O-N 2.92Å; V306-G309 VanDerWaalsContact O-N 3.1Å; V306-C310 PolarHBondContact O-N 3.21Å; V306-C310 PolarHBondContact O-SG 3.22Å
307I88.4Confident85.4Confident2 Ų224.3 Ų24.31%0.0115%0.148CC..Hα-helixtrans-65.2-37.1-177.4-162.564.3000111.4A265 F266 A274 F290 Q303 G304 G309 C310 L311A265-I307 HydrophobicContact CB-CG2 4.17Å; F266-I307 HydrophobicContact CE1-CB 4.43Å; F266-I307 HydrophobicContact CE1-CG2 3.84Å; F266-I307 HydrophobicContact CE2-CG2 3.84Å; F266-I307 HydrophobicContact CZ-CB 4.4Å; F266-I307 HydrophobicContact CZ-CG2 3.46Å; F266-I307 VanDerWaalsContact CZ-CG2 3.46Å; A274-I307 HydrophobicContact CB-CD1 3.9Å; F290-I307 HydrophobicContact CZ-CB 4.16Å; F290-I307 HydrophobicContact CZ-CD1 4.25Å; Q303-I307 PolarHBondContact O-N 2.91Å; G304-I307 WeakPolarHBondContact O-CG2 3.38Å; G304-I307 PolarHBondContact O-N 2.79Å; I307-G309 VanDerWaalsContact C-N 3.33Å; I307-G309 PolarHBondContact O-N 2.81Å; I307-C310 PolarHBondContact O-N 3.5Å; I307-C310 VanDerWaalsContact O-N 3.16Å; I307-L311 HydrophobicContact CG1-CD1 3.96Å; I307-L311 HydrophobicContact CG1-CG 4.35Å; I307-L311 WeakPolarHBondContact O-CB 3.38Å; I307-L311 WeakPolarHBondContact O-CG 3.17Å; I307-L311 PolarHBondContact O-N 2.9Å
308L88.8Confident86.5Confident0 Ų029.1 Ų29.10%017%0.166CC..Hα-helixtrans-61.3-43172.3-65.1175.4000111.1V261 F262 A265 G304 V306 C310 L311 F312 A316 W320V261-L308 HydrophobicContact CG1-CD1 3.73Å; V261-L308 HydrophobicContact CG1-CD2 3.43Å; V261-L308 VanDerWaalsContact CG1-CD2 3.43Å; V261-L308 HydrophobicContact CG1-CG 4.22Å; F262-L308 HydrophobicContact CE1-CD1 4.15Å; A265-L308 HydrophobicContact CB-CD2 3.85Å; G304-L308 WeakPolarHBondContact O-CB 3.47Å; G304-L308 VanDerWaalsContact O-CG 3.24Å; G304-L308 WeakPolarHBondContact O-CG 3.3Å; G304-L308 PolarHBondContact O-N 3.49Å; V306-L308 VanDerWaalsContact C-N 3.32Å; V306-L308 PolarHBondContact O-N 3.41Å; L308-C310 VanDerWaalsContact C-N 3.32Å; L308-C310 PolarHBondContact O-N 3.16Å; L308-L311 PolarHBondContact O-N 2.8Å; L308-F312 HydrophobicContact CB-CD2 4.4Å; L308-F312 HydrophobicContact CD2-CD2 3.8Å; L308-F312 HydrophobicContact CD2-CE2 3.62Å; L308-F312 WeakPolarHBondContact O-CB 3.5Å; L308-F312 PolarHBondContact O-N 3.24Å; L308-A316 HydrophobicContact CB-CB 4.42Å; L308-W320 HydrophobicContact CD1-CD2 4.2Å; L308-W320 HydrophobicContact CD1-CE3 3.79Å; L308-W320 HydrophobicContact CD1-CZ3 4.33Å
309G89.4Confident87.8Confident0 Ų028 Ų280%016%0.155CC..Hα-helixtrans-59.2-37.917200000114.4L283 G305 V306 I307 G313L283-G309 WeakPolarHBondContact CD1-O 3.47Å; G305-G309 PolarHBondContact O-N 3.26Å; G305-G309 VanDerWaalsContact O-N 3.16Å; V306-G309 CarbonylContact O-C 3.6Å; V306-G309 WeakPolarHBondContact O-CA 3.41Å; V306-G309 PolarHBondContact O-N 2.92Å; V306-G309 VanDerWaalsContact O-N 3.1Å; I307-G309 VanDerWaalsContact C-N 3.33Å; I307-G309 PolarHBondContact O-N 2.81Å; G309-G313 WeakPolarHBondContact CA-O 3.29Å; G309-G313 CarbonylContact O-C 3.1Å; G309-G313 WeakPolarHBondContact O-CA 3.46Å; G309-G313 PolarHBondContact O-N 3.41Å; G309-G313 VanDerWaalsContact O-N 3.08Å
310C89.8Confident88.8Confident12 Ų1225.6 Ų25.68%0.08114%0.139CC..Hα-helixtrans-75.6-36.9178.6-59.70000113.1I277 C278 V306 I307 L308I277-C310 HydrophobicContact CG2-CB 4.14Å; C278-C310 WeakPolarHBondContact CA-SG 3.39Å; C278-C310 HydrophobicContact CB-CB 3.96Å; C278-C310 WeakPolarHBondContact CB-SG 3.46Å; C278-C310 WeakPolarHBondContact SG-CB 3.32Å; C278-C310 CovalentContact SG-SG 2.04Å; C278-C310 PolarHBondContact SG-SG 3.44Å; V306-C310 PolarHBondContact O-N 3.21Å; V306-C310 PolarHBondContact O-SG 3.22Å; I307-C310 PolarHBondContact O-N 3.5Å; I307-C310 VanDerWaalsContact O-N 3.16Å; L308-C310 VanDerWaalsContact C-N 3.32Å; L308-C310 PolarHBondContact O-N 3.16Å
311L88.7Confident89.6Confident70 Ų7024.9 Ų24.937%0.36614%0.135SC..Hα-helixtrans-80.1-47.3-178.7-73.4169.7000112.9A265 I277 I307 L308A265-L311 HydrophobicContact CB-CD1 4.04Å; I277-L311 HydrophobicContact CD1-CD2 4.25Å; I277-L311 HydrophobicContact CG2-CD2 3.86Å; I277-L311 HydrophobicContact CG2-CG 4.34Å; I307-L311 HydrophobicContact CG1-CD1 3.96Å; I307-L311 HydrophobicContact CG1-CG 4.35Å; I307-L311 WeakPolarHBondContact O-CB 3.38Å; I307-L311 WeakPolarHBondContact O-CG 3.17Å; I307-L311 PolarHBondContact O-N 2.9Å; L308-L311 PolarHBondContact O-N 2.8Å
312F88.2Confident90.2Very high69 Ų6925.8 Ų25.830%0.30314%0.143SC..Hα-helixtrans-109-3.8-170.3-54-59.5000113.2V172 A173 L308 A316V172-F312 HydrophobicContact CG1-CB 3.76Å; V172-F312 HydrophobicContact CG1-CD1 3.85Å; V172-F312 HydrophobicContact CG1-CG 3.87Å; A173-F312 HydrophobicContact CB-CE2 3.98Å; A173-F312 HydrophobicContact CB-CZ 3.8Å; L308-F312 HydrophobicContact CB-CD2 4.4Å; L308-F312 HydrophobicContact CD2-CD2 3.8Å; L308-F312 HydrophobicContact CD2-CE2 3.62Å; L308-F312 WeakPolarHBondContact O-CB 3.5Å; L308-F312 PolarHBondContact O-N 3.24Å; F312-A316 HydrophobicContact CB-CB 3.98Å
313G89.5Confident90.7Very high21 Ų2124.8 Ų24.822%0.21614%0.139CC..  trans100169.8173.100000114.2G309 A315 A316G309-G313 WeakPolarHBondContact CA-O 3.29Å; G309-G313 CarbonylContact O-C 3.1Å; G309-G313 WeakPolarHBondContact O-CA 3.46Å; G309-G313 PolarHBondContact O-N 3.41Å; G309-G313 VanDerWaalsContact O-N 3.08Å; G313-A315 PolarHBondContact O-N 3.36Å; G313-A316 WeakPolarHBondContact O-CB 3.35Å; G313-A316 PolarHBondContact O-N 3.12Å
314P89.6Confident91Very high60 Ų6024.9 Ų24.939%0.3914%0.14SC..Hα-helixtrans-56.3-29.3-170.8-22.929000115.1L283 A316 L317 Y318L283-P314 HydrophobicContact CD1-CB 4.21Å; L283-P314 HydrophobicContact CD1-CG 3.71Å; P314-A316 VanDerWaalsContact C-N 3.32Å; P314-A316 PolarHBondContact O-N 2.95Å; P314-L317 PolarHBondContact O-N 3.27Å; P314-Y318 HydrophobicContact CB-CE2 4.44Å; P314-Y318 WeakPolarHBondContact O-CD2 3.29Å; P314-Y318 PolarHBondContact O-N 3.5Å
315A91.9Very high91.4Very high51 Ų5126.7 Ų26.742%0.42115%0.15SC..Hα-helixtrans-60.4-41178.600000112.1G313 L317 Y318 I319G313-A315 PolarHBondContact O-N 3.36Å; A315-L317 PolarHBondContact O-N 2.95Å; A315-Y318 PolarHBondContact O-N 3Å; A315-I319 WeakPolarHBondContact O-CB 3.47Å; A315-I319 VanDerWaalsContact O-CG1 3.26Å; A315-I319 WeakPolarHBondContact O-CG1 3.44Å; A315-I319 PolarHBondContact O-N 3.29Å
316A91.7Very high91.7Very high2 Ų227 Ų272%0.01715%0.152CC..Hα-helixtrans-62.1-42.3179.900000112.1E169 L308 F312 G313 P314 Y318 I319 W320E169-A316 VanDerWaalsContact OE1-CA 3.25Å; E169-A316 WeakPolarHBondContact OE1-CA 3.46Å; E169-A316 WeakPolarHBondContact OE2-CB 3.47Å; L308-A316 HydrophobicContact CB-CB 4.42Å; F312-A316 HydrophobicContact CB-CB 3.98Å; G313-A316 WeakPolarHBondContact O-CB 3.35Å; G313-A316 PolarHBondContact O-N 3.12Å; P314-A316 VanDerWaalsContact C-N 3.32Å; P314-A316 PolarHBondContact O-N 2.95Å; A316-Y318 PolarHBondContact O-N 3.39Å; A316-I319 PolarHBondContact O-N 3.34Å; A316-W320 VanDerWaalsContact O-CB 3.24Å; A316-W320 WeakPolarHBondContact O-CB 3.4Å; A316-W320 PolarHBondContact O-N 3.33Å
317L92.3Very high91.8Very high2 Ų228.5 Ų28.51%0.0117%0.165CC..Hα-helixtrans-59.2-45.1175.7-177.2155.1000112.1L118 L283 P314 A315 A321L118-L317 HydrophobicContact CB-CD2 4Å; L118-L317 HydrophobicContact CD2-CD1 4.23Å; L118-L317 HydrophobicContact CD2-CD2 4.29Å; L118-L317 HydrophobicContact CD2-CG 4.25Å; L283-L317 HydrophobicContact CD2-CB 4.44Å; L283-L317 HydrophobicContact CD2-CD1 3.46Å; L283-L317 VanDerWaalsContact CD2-CD1 3.46Å; P314-L317 PolarHBondContact O-N 3.27Å; A315-L317 PolarHBondContact O-N 2.95Å; L317-A321 WeakPolarHBondContact O-CB 3.12Å; L317-A321 PolarHBondContact O-N 3.03Å
318Y94.3Very high91.9Very high102 Ų10228.7 Ų28.740%0.417%0.166SC..Hα-helixtrans-71.7-37.4179.7-66.9-61.8000112.3L119 P314 A315 A316 A321 V322L119-Y318 HydrophobicContact CD2-CD1 4.28Å; P314-Y318 HydrophobicContact CB-CE2 4.44Å; P314-Y318 WeakPolarHBondContact O-CD2 3.29Å; P314-Y318 PolarHBondContact O-N 3.5Å; A315-Y318 PolarHBondContact O-N 3Å; A316-Y318 PolarHBondContact O-N 3.39Å; Y318-A321 PolarHBondContact O-N 3.48Å; Y318-V322 WeakPolarHBondContact O-CG2 3.43Å; Y318-V322 PolarHBondContact O-N 3.48Å
319I95.1Very high92Very high44 Ų4430.1 Ų30.123%0.22617%0.173CC..Hα-helixtrans-65.6-45176.5-71.9168.7000110.5T165 Y168 E169 A315 A316 A321 V322 G323T165-I319 WeakPolarHBondContact CB-O 3.32Å; T165-I319 HydrophobicContact CG2-CG2 3.98Å; Y168-I319 HydrophobicContact CD1-CD1 3.48Å; Y168-I319 VanDerWaalsContact CD1-CD1 3.48Å; Y168-I319 HydrophobicContact CD1-CG2 4.04Å; Y168-I319 HydrophobicContact CE1-CD1 3.38Å; Y168-I319 HydrophobicContact CG-CD1 4.14Å; E169-I319 HydrophobicContact CG-CG2 4.49Å; E169-I319 WeakPolarHBondContact OE1-CG2 3.36Å; A315-I319 WeakPolarHBondContact O-CB 3.47Å; A315-I319 VanDerWaalsContact O-CG1 3.26Å; A315-I319 WeakPolarHBondContact O-CG1 3.44Å; A315-I319 PolarHBondContact O-N 3.29Å; A316-I319 PolarHBondContact O-N 3.34Å; I319-A321 VanDerWaalsContact C-N 3.34Å; I319-A321 PolarHBondContact O-N 3.13Å; I319-V322 PolarHBondContact O-N 3.35Å; I319-G323 PolarHBondContact O-N 3.22Å
320W94.3Very high91.9Very high8 Ų830.9 Ų30.93%0.0318%0.179CC..Hα-helixtrans-54.1-48.9170.1178.4-97.3000111.9F166 V258 F262 I301 L308 A316 V322 G323 L324F166-W320 AromaticContact CD1-CE3 3.92Å; F166-W320 HydrophobicContact CD1-CE3 3.92Å; F166-W320 AromaticContact CD1-CZ3 3.79Å; F166-W320 HydrophobicContact CD1-CZ3 3.79Å; F166-W320 HydrophobicContact CE1-CD2 4.3Å; F166-W320 AromaticContact CE1-CE3 3.68Å; F166-W320 HydrophobicContact CE1-CE3 3.68Å; F166-W320 HydrophobicContact CE1-CH2 4.17Å; F166-W320 AromaticContact CE1-CZ3 3.61Å; F166-W320 HydrophobicContact CE1-CZ3 3.61Å; V258-W320 HydrophobicContact CG1-CH2 3.96Å; V258-W320 HydrophobicContact CG1-CZ3 4.36Å; V258-W320 HydrophobicContact CG2-CZ3 4.35Å; F262-W320 HydrophobicContact CD1-CH2 4.38Å; F262-W320 HydrophobicContact CE1-CE3 4.47Å; F262-W320 AromaticContact CE1-CH2 3.43Å; F262-W320 HydrophobicContact CE1-CH2 3.43Å; F262-W320 VanDerWaalsContact CE1-CH2 3.43Å; F262-W320 AromaticContact CE1-CZ2 3.77Å; F262-W320 HydrophobicContact CE1-CZ2 3.77Å; F262-W320 AromaticContact CE1-CZ3 3.81Å; F262-W320 HydrophobicContact CE1-CZ3 3.81Å; F262-W320 HydrophobicContact CE2-CH2 4.07Å; F262-W320 HydrophobicContact CE2-CZ2 4.27Å; F262-W320 AromaticContact CZ-CH2 3.25Å; F262-W320 HydrophobicContact CZ-CH2 3.25Å; F262-W320 AromaticContact CZ-CZ2 3.31Å; F262-W320 HydrophobicContact CZ-CZ2 3.31Å; F262-W320 HydrophobicContact CZ-CZ3 4.12Å; I301-W320 HydrophobicContact CG2-CZ2 4.16Å; I301-W320 PolarHBondContact O-NE1 3.19Å; I301-W320 VanDerWaalsContact O-NE1 3.14Å; L308-W320 HydrophobicContact CD1-CD2 4.2Å; L308-W320 HydrophobicContact CD1-CE3 3.79Å; L308-W320 HydrophobicContact CD1-CZ3 4.33Å; A316-W320 VanDerWaalsContact O-CB 3.24Å; A316-W320 WeakPolarHBondContact O-CB 3.4Å; A316-W320 PolarHBondContact O-N 3.33Å; W320-V322 PolarHBondContact O-N 3.01Å; W320-G323 PolarHBondContact O-N 3.13Å; W320-L324 WeakPolarHBondContact O-CB 3.45Å; W320-L324 PolarHBondContact O-N 3.26Å
321A94.6Very high91.7Very high0 Ų031.5 Ų31.50%018%0.183CC..Hα-helixtrans-66.6-36.5-178.700000113S115 L118 L119 L317 Y318 I319 L324 L325S115-A321 WeakPolarHBondContact CB-O 3.25Å; L118-A321 HydrophobicContact CB-CB 3.68Å; L118-A321 HydrophobicContact CD1-CB 4.26Å; L119-A321 HydrophobicContact CD2-CB 3.86Å; L119-A321 HydrophobicContact CG-CB 3.79Å; L317-A321 WeakPolarHBondContact O-CB 3.12Å; L317-A321 PolarHBondContact O-N 3.03Å; Y318-A321 PolarHBondContact O-N 3.48Å; I319-A321 VanDerWaalsContact C-N 3.34Å; I319-A321 PolarHBondContact O-N 3.13Å; A321-L324 PolarHBondContact O-N 3.17Å; A321-L325 WeakPolarHBondContact O-CB 3.31Å; A321-L325 PolarHBondContact O-N 3.46Å
322V95.9Very high91.5Very high63 Ų6328.2 Ų28.238%0.38217%0.166SC..Hα-helixtrans-64.7-42.2171.8171.20000111.4L119 I161 T165 Y318 I319 W320 L325 A326L119-V322 HydrophobicContact CD2-CG2 3.99Å; I161-V322 HydrophobicContact CG2-CG1 3.88Å; T165-V322 HydrophobicContact CG2-CB 4.4Å; T165-V322 HydrophobicContact CG2-CG1 4.16Å; Y318-V322 WeakPolarHBondContact O-CG2 3.43Å; Y318-V322 PolarHBondContact O-N 3.48Å; I319-V322 PolarHBondContact O-N 3.35Å; W320-V322 PolarHBondContact O-N 3.01Å; V322-L325 PolarHBondContact O-N 3.35Å; V322-A326 PolarHBondContact O-N 3.23Å
323G94.8Very high91.2Very high0 Ų025.1 Ų25.10%015%0.153CC..Hα-helixtrans-62-43.7175.800000112.5T165 I319 W320 A326 A327T165-G323 WeakPolarHBondContact OG1-CA 3.05Å; I319-G323 PolarHBondContact O-N 3.22Å; W320-G323 PolarHBondContact O-N 3.13Å; G323-A326 PolarHBondContact O-N 2.97Å; G323-A327 PolarHBondContact O-N 3.22Å
324L92.5Very high91.1Very high16 Ų1625.5 Ų25.58%0.08415%0.151CC..Hα-helixtrans-65.4-40.2176.7-176.364000112.5G111 I114 I301 W320 A321 A327 G328G111-L324 VanDerWaalsContact O-CD2 3.32Å; G111-L324 WeakPolarHBondContact O-CD2 3.45Å; G111-L324 WeakPolarHBondContact O-CG 3.48Å; I114-L324 HydrophobicContact CB-CD2 4.03Å; I114-L324 HydrophobicContact CG2-CD2 3.54Å; I301-L324 HydrophobicContact CG2-CD1 3.62Å; I301-L324 HydrophobicContact CG2-CD2 3.47Å; I301-L324 VanDerWaalsContact CG2-CD2 3.47Å; I301-L324 HydrophobicContact CG2-CG 4.19Å; W320-L324 WeakPolarHBondContact O-CB 3.45Å; W320-L324 PolarHBondContact O-N 3.26Å; A321-L324 PolarHBondContact O-N 3.17Å; L324-A327 PolarHBondContact O-N 3.42Å; L324-G328 PolarHBondContact O-N 3.1Å
325L93.6Very high90.9Very high39 Ų3922.8 Ų22.820%0.20413%0.134CC..Hα-helixtrans-60.5-48.3173179.758.2000110.5T112 S115 F116 L119 A321 V322 A327 G328 Q329T112-L325 HydrophobicContact CG2-CD1 3.89Å; S115-L325 WeakPolarHBondContact OG-CB 3.42Å; F116-L325 HydrophobicContact CE2-CD1 4.3Å; F116-L325 HydrophobicContact CZ-CD1 4.15Å; L119-L325 HydrophobicContact CD1-CD2 4.04Å; A321-L325 WeakPolarHBondContact O-CB 3.31Å; A321-L325 PolarHBondContact O-N 3.46Å; V322-L325 PolarHBondContact O-N 3.35Å; L325-A327 VanDerWaalsContact C-N 3.3Å; L325-A327 PolarHBondContact O-N 2.86Å; L325-G328 PolarHBondContact O-N 3.26Å; L325-Q329 HydrophobicContact CD1-CG 4.24Å; L325-Q329 HydrophobicContact CG-CG 4.49Å; L325-Q329 WeakPolarHBondContact O-CG 3.36Å; L325-Q329 PolarHBondContact O-N 3.13Å
326A93.5Very high90.5Very high6 Ų620.7 Ų20.75%0.0512%0.116CC..Hα-helixtrans-61.4-36.5178.200000113L158 I161 M162 V322 G323 S330L158-A326 HydrophobicContact CD2-CB 4.14Å; I161-A326 HydrophobicContact CB-CB 4.14Å; I161-A326 HydrophobicContact CG2-CB 3.76Å; M162-A326 HydrophobicContact CG-CB 4Å; V322-A326 PolarHBondContact O-N 3.23Å; G323-A326 PolarHBondContact O-N 2.97Å; A326-S330 WeakPolarHBondContact O-CB 3.39Å; A326-S330 PolarHBondContact O-N 2.87Å
327A91.6Very high90.2Very high32 Ų3221.5 Ų21.526%0.26412%0.118SC..Hα-helixtrans-63.5-45.8173.500000112.2M162 G323 L324 L325 S330 S331M162-A327 HydrophobicContact CG-CB 4.41Å; M162-A327 WeakPolarHBondContact SD-CA 3.35Å; M162-A327 HydrophobicContact SD-CB 3.53Å; M162-A327 VanDerWaalsContact SD-CB 3.53Å; G323-A327 PolarHBondContact O-N 3.22Å; L324-A327 PolarHBondContact O-N 3.42Å; L325-A327 VanDerWaalsContact C-N 3.3Å; L325-A327 PolarHBondContact O-N 2.86Å; A327-S330 PolarHBondContact O-N 3.33Å; A327-S331 PolarHBondContact O-N 2.9Å
328G90.3Very high90.1Very high5 Ų521.4 Ų21.45%0.05212%0.118CC..Hα-helixtrans-58.1-55.2174.600000111.9E108 L324 L325 S330 S331 T332E108-G328 WeakPolarHBondContact CG-O 3.36Å; L324-G328 PolarHBondContact O-N 3.1Å; L325-G328 PolarHBondContact O-N 3.26Å; G328-S330 PolarHBondContact O-N 3.23Å; G328-S330 VanDerWaalsContact O-N 3.11Å; G328-S331 PolarHBondContact O-N 3.49Å; G328-T332 PolarHBondContact O-N 2.94Å; G328-T332 PolarHBondContact O-OG1 3.06Å
329Q89.6Confident89.7Confident30 Ų3016.6 Ų16.614%0.1410%0.099CC..Hα-helixtrans-56.5-31.8178-59.6-57.5-98.200113.1D136 L158 L325 T332 M333D136-Q329 VanDerWaalsContact CG-OE1 3.3Å; D136-Q329 PolarHBondContact OD1-OE1 3.34Å; D136-Q329 PolarHBondContact OD2-NE2 2.99Å; L158-Q329 HydrophobicContact CD1-CB 3.85Å; L158-Q329 HydrophobicContact CD2-CB 4.26Å; L325-Q329 HydrophobicContact CD1-CG 4.24Å; L325-Q329 HydrophobicContact CG-CG 4.49Å; L325-Q329 WeakPolarHBondContact O-CG 3.36Å; L325-Q329 PolarHBondContact O-N 3.13Å; Q329-T332 PolarHBondContact O-OG1 3.27Å; Q329-T332 VanDerWaalsContact O-OG1 3.14Å; Q329-M333 VanDerWaalsContact O-CG 3.29Å; Q329-M333 WeakPolarHBondContact O-CG 3.35Å
330S88.9Confident89.3Confident17 Ų1716.4 Ų16.412%0.11910%0.098CC..Hα-helixtrans-74.7-27.4177.8-169.20000113.1F155 A326 A327 G328F155-S330 WeakPolarHBondContact CE1-O 3.32Å; A326-S330 WeakPolarHBondContact O-CB 3.39Å; A326-S330 PolarHBondContact O-N 2.87Å; A327-S330 PolarHBondContact O-N 3.33Å; G328-S330 PolarHBondContact O-N 3.23Å; G328-S330 VanDerWaalsContact O-N 3.11Å
331S85.9Confident89Confident25 Ų2518.2 Ų18.218%0.17511%0.106CC..Hα-helixtrans-87-26-176.41730000113A327 G328 M333 T334 G335A327-S331 PolarHBondContact O-N 2.9Å; G328-S331 PolarHBondContact O-N 3.49Å; S331-M333 VanDerWaalsContact C-N 3.33Å; S331-M333 PolarHBondContact O-N 2.83Å; S331-T334 WeakPolarHBondContact CA-OG1 3.42Å; S331-T334 PolarHBondContact O-N 3.21Å; S331-T334 PolarHBondContact O-OG1 3.49Å; S331-G335 PolarHBondContact O-N 2.92Å
332T83.9Confident88.8Confident1 Ų118.2 Ų18.21%0.00611%0.106CC..Hα-helixtrans-62.3-43.4174.228.90000111.6E108 F140 G328 Q329 T336E108-T332 VanDerWaalsContact CD-CB 3.44Å; E108-T332 WeakPolarHBondContact OE1-CB 3.24Å; E108-T332 WeakPolarHBondContact OE2-CA 3.45Å; E108-T332 VanDerWaalsContact OE2-CB 3.26Å; E108-T332 WeakPolarHBondContact OE2-CB 3.46Å; E108-T332 PolarHBondContact OE2-N 2.99Å; F140-T332 HydrophobicContact CB-CG2 4.43Å; F140-T332 HydrophobicContact CG-CG2 4.48Å; G328-T332 PolarHBondContact O-N 2.94Å; G328-T332 PolarHBondContact O-OG1 3.06Å; Q329-T332 PolarHBondContact O-OG1 3.27Å; Q329-T332 VanDerWaalsContact O-OG1 3.14Å; T332-T336 WeakPolarHBondContact O-CB 3.45Å; T332-T336 VanDerWaalsContact O-CG2 3.28Å; T332-T336 WeakPolarHBondContact O-CG2 3.24Å; T332-T336 PolarHBondContact O-N 3.22Å; T332-T336 PolarHBondContact O-OG1 3.1Å
333M82.1Confident88.5Confident4 Ų415.8 Ų15.82%0.029%0.09CC..Hα-helixtrans-68.3-39.9-178.9-50.1176.880.800111.7F140 L151 F154 F155 L158 Q329 S331 T336 Y337F140-M333 HydrophobicContact CD2-CB 4.03Å; F140-M333 HydrophobicContact CD2-CE 3.75Å; F140-M333 HydrophobicContact CD2-CG 3.52Å; F140-M333 HydrophobicContact CD2-SD 4.43Å; F140-M333 HydrophobicContact CE2-CB 3.71Å; F140-M333 HydrophobicContact CE2-CE 3.86Å; F140-M333 HydrophobicContact CE2-CG 3.74Å; F140-M333 HydrophobicContact CG-CG 4.37Å; F140-M333 HydrophobicContact CZ-CB 4.44Å; L151-M333 HydrophobicContact CD1-CE 3.88Å; L151-M333 HydrophobicContact CD2-CE 3.66Å; L151-M333 HydrophobicContact CG-CE 3.49Å; L151-M333 VanDerWaalsContact CG-CE 3.49Å; F154-M333 HydrophobicContact CD1-CE 3.64Å; F154-M333 HydrophobicContact CD1-SD 3.63Å; F154-M333 HydrophobicContact CE1-CE 4.08Å; F154-M333 HydrophobicContact CE1-SD 3.7Å; F155-M333 HydrophobicContact CD1-SD 4.14Å; F155-M333 HydrophobicContact CE1-CB 3.51Å; F155-M333 HydrophobicContact CE1-CG 4.15Å; F155-M333 HydrophobicContact CE1-SD 3.72Å; F155-M333 HydrophobicContact CZ-CB 3.4Å; F155-M333 VanDerWaalsContact CZ-CB 3.4Å; F155-M333 HydrophobicContact CZ-CG 4.38Å; F155-M333 HydrophobicContact CZ-SD 4.19Å; L158-M333 HydrophobicContact CD1-SD 4.41Å; Q329-M333 VanDerWaalsContact O-CG 3.29Å; Q329-M333 WeakPolarHBondContact O-CG 3.35Å; S331-M333 VanDerWaalsContact C-N 3.33Å; S331-M333 PolarHBondContact O-N 2.83Å; M333-T336 PolarHBondContact O-OG1 2.93Å; M333-T336 VanDerWaalsContact O-OG1 3.05Å; M333-Y337 WeakPolarHBondContact O-CD2 3.43Å; M333-Y337 PolarHBondContact O-N 3.33Å
334T86.4Confident88.2Confident29 Ų2918.4 Ų18.418%0.17810%0.103CC..Hα-helixtrans-71-42.7176.653.50000111.8F155 L215 S331 T336 Y337 A338F155-T334 HydrophobicContact CE1-CG2 4.07Å; F155-T334 HydrophobicContact CZ-CG2 3.93Å; L215-T334 HydrophobicContact CD2-CG2 4.06Å; S331-T334 WeakPolarHBondContact CA-OG1 3.42Å; S331-T334 PolarHBondContact O-N 3.21Å; S331-T334 PolarHBondContact O-OG1 3.49Å; T334-T336 PolarHBondContact O-N 3.48Å; T334-Y337 PolarHBondContact O-N 3.44Å; T334-A338 VanDerWaalsContact O-CB 3.29Å; T334-A338 WeakPolarHBondContact O-CB 3.41Å; T334-A338 PolarHBondContact O-N 3.36Å
335G86.1Confident88Confident3 Ų317.7 Ų17.73%0.03110%0.099CC..Hα-helixtrans-60.6-43.5177.600000113I101 S331 A338 G339I101-G335 WeakPolarHBondContact CG2-O 3.41Å; S331-G335 PolarHBondContact O-N 2.92Å; G335-A338 PolarHBondContact O-N 2.91Å; G335-G339 PolarHBondContact O-N 3.41Å
336T83.9Confident87.7Confident7 Ų715.8 Ų15.84%0.0439%0.089CC..Hα-helixtrans-67.6-41178.449.40000113.1F140 T332 M333 T334 Q340 V357F140-T336 HydrophobicContact CD1-CG2 4.4Å; F140-T336 HydrophobicContact CE1-CG2 4.07Å; F140-T336 WeakPolarHBondContact CE1-OG1 3.03Å; F140-T336 VanDerWaalsContact CZ-OG1 3.22Å; F140-T336 WeakPolarHBondContact CZ-OG1 3.49Å; T332-T336 WeakPolarHBondContact O-CB 3.45Å; T332-T336 VanDerWaalsContact O-CG2 3.28Å; T332-T336 WeakPolarHBondContact O-CG2 3.24Å; T332-T336 PolarHBondContact O-N 3.22Å; T332-T336 PolarHBondContact O-OG1 3.1Å; M333-T336 PolarHBondContact O-OG1 2.93Å; M333-T336 VanDerWaalsContact O-OG1 3.05Å; T334-T336 PolarHBondContact O-N 3.48Å; T336-Q340 PolarHBondContact O-N 3.07Å; T336-V357 HydrophobicContact CG2-CB 4.35Å; T336-V357 HydrophobicContact CG2-CG1 3.87Å; T336-V357 HydrophobicContact CG2-CG2 3.8Å
337Y84.9Confident87.3Confident19 Ų1917.6 Ų17.68%0.07510%0.097CC..Hα-helixtrans-66.8-40.1171.6-78-54.9000112.6F140 D144 L151 M333 T334 G339 Q340 F341F140-Y337 HydrophobicContact CE2-CE2 4.25Å; F140-Y337 HydrophobicContact CZ-CE2 4.12Å; D144-Y337 PolarHBondContact OD1-OH 3.05Å; L151-Y337 HydrophobicContact CD1-CE2 4.03Å; L151-Y337 WeakPolarHBondContact CD1-OH 3.34Å; L151-Y337 HydrophobicContact CD2-CE2 3.75Å; M333-Y337 WeakPolarHBondContact O-CD2 3.43Å; M333-Y337 PolarHBondContact O-N 3.33Å; T334-Y337 PolarHBondContact O-N 3.44Å; Y337-G339 PolarHBondContact O-N 3.43Å; Y337-Q340 WeakPolarHBondContact O-CB 3.38Å; Y337-Q340 PolarHBondContact O-N 3.46Å; Y337-Q340 VanDerWaalsContact O-N 3.15Å; Y337-F341 WeakPolarHBondContact O-CD2 3.28Å; Y337-F341 PolarHBondContact O-N 2.92Å
338A89.1Confident87Confident0 Ų022 Ų220%011%0.111CC..Hα-helixtrans-60.5-46.6176.900000110.8I101 H211 L215 T334 G335 Q340 F341 V342I101-A338 HydrophobicContact CD1-CB 4.44Å; I101-A338 HydrophobicContact CG1-CB 4.39Å; H211-A338 HydrophobicContact CB-CB 3.97Å; L215-A338 HydrophobicContact CB-CB 4.16Å; T334-A338 VanDerWaalsContact O-CB 3.29Å; T334-A338 WeakPolarHBondContact O-CB 3.41Å; T334-A338 PolarHBondContact O-N 3.36Å; G335-A338 PolarHBondContact O-N 2.91Å; A338-Q340 VanDerWaalsContact C-N 3.31Å; A338-Q340 PolarHBondContact O-N 3.44Å; A338-F341 PolarHBondContact O-N 2.93Å; A338-V342 VanDerWaalsContact O-CB 3.3Å; A338-V342 WeakPolarHBondContact O-CB 3.43Å; A338-V342 WeakPolarHBondContact O-CG2 3.32Å; A338-V342 PolarHBondContact O-N 2.95Å
339G87.7Confident86.5Confident1 Ų125.6 Ų25.61%0.0113%0.128CC..Hα-helixtrans-60.3-36173.100000113.6G335 Y337 M343G335-G339 PolarHBondContact O-N 3.41Å; Y337-G339 PolarHBondContact O-N 3.43Å; G339-M343 WeakPolarHBondContact O-CB 3.26Å; G339-M343 VanDerWaalsContact O-CG 3.28Å; G339-M343 WeakPolarHBondContact O-CG 3.32Å; G339-M343 PolarHBondContact O-N 2.93Å
340Q86.4Confident85.7Confident40 Ų4035.2 Ų35.219%0.18716%0.163CC..Hα-helixtrans-58.2-57.1171.7163.5154.19.700112.1T336 Y337 A338 V342 M343 E344 R356T336-Q340 PolarHBondContact O-N 3.07Å; Y337-Q340 WeakPolarHBondContact O-CB 3.38Å; Y337-Q340 PolarHBondContact O-N 3.46Å; Y337-Q340 VanDerWaalsContact O-N 3.15Å; A338-Q340 VanDerWaalsContact C-N 3.31Å; A338-Q340 PolarHBondContact O-N 3.44Å; Q340-V342 VanDerWaalsContact C-N 3.32Å; Q340-V342 PolarHBondContact O-N 3.21Å; Q340-M343 PolarHBondContact O-N 3.41Å; Q340-E344 PolarHBondContact NE2-OE1 2.72Å; Q340-E344 PolarHBondContact NE2-OE2 3.05Å; Q340-E344 VanDerWaalsContact NE2-OE2 3.15Å; Q340-E344 WeakPolarHBondContact O-CB 3.27Å; Q340-E344 PolarHBondContact O-N 2.89Å; Q340-R356 VanDerWaalsContact CG-NH1 3.3Å
341F88Confident85.1Confident45 Ų4540.1 Ų40.120%0.19718%0.179CC..Hα-helixtrans-68.1-33.1-175.7-64.9-62.3000112.4L215 A218 Y337 A338 G345L215-F341 HydrophobicContact CD1-CD2 3.94Å; L215-F341 HydrophobicContact CD1-CE2 4.04Å; A218-F341 HydrophobicContact CB-CB 3.8Å; A218-F341 HydrophobicContact CB-CD1 3.52Å; A218-F341 HydrophobicContact CB-CD2 3.46Å; A218-F341 VanDerWaalsContact CB-CD2 3.46Å; A218-F341 HydrophobicContact CB-CE1 3.88Å; A218-F341 HydrophobicContact CB-CE2 3.83Å; A218-F341 HydrophobicContact CB-CG 3.29Å; A218-F341 HydrophobicContact CB-CZ 4.03Å; Y337-F341 WeakPolarHBondContact O-CD2 3.28Å; Y337-F341 PolarHBondContact O-N 2.92Å; A338-F341 PolarHBondContact O-N 2.93Å; F341-G345 WeakPolarHBondContact O-CA 3.22Å; F341-G345 PolarHBondContact O-N 2.89Å
342V90.6Very high84.7Confident0 Ų042.4 Ų42.40%020%0.195CC..Hα-helixtrans-66.4-50.1175.4168.50000111.1I97 I101 Y214 A338 Q340 E344 F346I97-V342 HydrophobicContact CB-CG1 4.23Å; I97-V342 HydrophobicContact CG2-CB 4.41Å; I97-V342 HydrophobicContact CG2-CG1 3.9Å; I97-V342 HydrophobicContact CG2-CG2 3.63Å; I101-V342 HydrophobicContact CD1-CB 4.27Å; I101-V342 HydrophobicContact CD1-CG1 4.43Å; I101-V342 HydrophobicContact CD1-CG2 4.23Å; Y214-V342 HydrophobicContact CD1-CG2 4.28Å; Y214-V342 HydrophobicContact CG-CG2 3.98Å; A338-V342 VanDerWaalsContact O-CB 3.3Å; A338-V342 WeakPolarHBondContact O-CB 3.43Å; A338-V342 WeakPolarHBondContact O-CG2 3.32Å; A338-V342 PolarHBondContact O-N 2.95Å; Q340-V342 VanDerWaalsContact C-N 3.32Å; Q340-V342 PolarHBondContact O-N 3.21Å; V342-E344 PolarHBondContact O-N 3.48Å; V342-F346 HydrophobicContact CG1-CD2 3.96Å; V342-F346 HydrophobicContact CG1-CE2 4.34Å; V342-F346 WeakPolarHBondContact O-CB 3.47Å; V342-F346 WeakPolarHBondContact O-CD2 3.49Å; V342-F346 PolarHBondContact O-N 3.23Å
343M88.3Confident84.3Confident13 Ų1347.7 Ų47.76%0.06422%0.215CC..Hα-helixtrans-62.4-44.4176.8-70-172.48800112.8E98 G339 Q340 L347 K348 W351 R356E98-M343 WeakPolarHBondContact OE1-CG 3.5Å; G339-M343 WeakPolarHBondContact O-CB 3.26Å; G339-M343 VanDerWaalsContact O-CG 3.28Å; G339-M343 WeakPolarHBondContact O-CG 3.32Å; G339-M343 PolarHBondContact O-N 2.93Å; Q340-M343 PolarHBondContact O-N 3.41Å; M343-L347 WeakPolarHBondContact O-CB 3.45Å; M343-L347 PolarHBondContact O-N 3.27Å; M343-L347 VanDerWaalsContact O-N 3.1Å; M343-K348 PolarHBondContact O-N 2.88Å; M343-W351 HydrophobicContact CE-CE3 4.3Å; M343-R356 HydrophobicContact SD-CG 3.73Å; M343-R356 PolarHBondContact SD-NE 3.16Å
344E89.1Confident84.1Confident55 Ų5552 Ų5226%0.25723%0.234SC..Hα-helixtrans-70.1-41.7-178.5-81.8159.1-144.500112Q340 V342 K348 R356Q340-E344 PolarHBondContact NE2-OE1 2.72Å; Q340-E344 PolarHBondContact NE2-OE2 3.05Å; Q340-E344 VanDerWaalsContact NE2-OE2 3.15Å; Q340-E344 WeakPolarHBondContact O-CB 3.27Å; Q340-E344 PolarHBondContact O-N 2.89Å; V342-E344 PolarHBondContact O-N 3.48Å; E344-K348 WeakPolarHBondContact O-CA 3.5Å; E344-K348 PolarHBondContact O-N 3Å; E344-K348 VanDerWaalsContact O-N 3.08Å; E344-R356 IonicContact OE1-CZ 3.64Å; E344-R356 IonicContact OE1-NH1 2.76Å; E344-R356 PolarHBondContact OE1-NH1 3.36Å; E344-R356 IonicContact OE1-NH2 2.7Å; E344-R356 PolarHBondContact OE1-NH2 3.15Å
345G87.3Confident83.9Confident0 Ų052.6 Ų52.60%024%0.242CC..Hα-helixtrans-68.9-52.5177.700000113G78 H82 F341G78-G345 CarbonylContact O-C 3.53Å; H82-G345 VanDerWaalsContact CB-O 3.22Å; H82-G345 WeakPolarHBondContact CB-O 2.98Å; F341-G345 WeakPolarHBondContact O-CA 3.22Å; F341-G345 PolarHBondContact O-N 2.89Å
346F88.5Confident83.6Confident0 Ų052.7 Ų52.70%024%0.241CC..Hα-helixtrans-74.3-43.2-174.8-82-87.1000114C81 H82 R90 L93 W94 Y214 V342C81-F346 HydrophobicContact CB-CD1 4.25Å; C81-F346 HydrophobicContact CB-CE1 3.48Å; C81-F346 VanDerWaalsContact CB-CE1 3.48Å; C81-F346 HydrophobicContact CB-CZ 3.72Å; H82-F346 PolarHBondContact ND1-O 3.36Å; R90-F346 HydrophobicContact CG-CD1 3.89Å; L93-F346 HydrophobicContact CB-CE1 4.08Å; L93-F346 HydrophobicContact CD2-CE1 3.7Å; L93-F346 HydrophobicContact CD2-CZ 3.86Å; L93-F346 HydrophobicContact CG-CE1 3.58Å; L93-F346 HydrophobicContact CG-CZ 3.67Å; W94-F346 HydrophobicContact CB-CB 3.86Å; W94-F346 HydrophobicContact CB-CD1 4Å; W94-F346 HydrophobicContact CB-CG 3.91Å; W94-F346 HydrophobicContact CG-CB 4.04Å; W94-F346 HydrophobicContact CG-CG 4.44Å; Y214-F346 AromaticContact CD1-CE2 3.99Å; Y214-F346 HydrophobicContact CD1-CE2 3.99Å; Y214-F346 AromaticContact CE1-CE2 3.41Å; Y214-F346 HydrophobicContact CE1-CE2 3.41Å; Y214-F346 VanDerWaalsContact CE1-CE2 3.41Å; Y214-F346 AromaticContact CE1-CZ 3.64Å; Y214-F346 HydrophobicContact CE1-CZ 3.64Å; Y214-F346 AromaticContact CZ-CZ 3.95Å; V342-F346 HydrophobicContact CG1-CD2 3.96Å; V342-F346 HydrophobicContact CG1-CE2 4.34Å; V342-F346 WeakPolarHBondContact O-CB 3.47Å; V342-F346 WeakPolarHBondContact O-CD2 3.49Å; V342-F346 PolarHBondContact O-N 3.23Å
347L85.2Confident83.4Confident43 Ų4352.8 Ų52.823%0.22524%0.242CC..Hα-helixtrans-107.9-11.4-171.6-59.5-175000113.7W94 M343 L349W94-L347 HydrophobicContact CD2-CD1 3.6Å; W94-L347 HydrophobicContact CD2-CD2 4.28Å; W94-L347 HydrophobicContact CD2-CG 3.98Å; W94-L347 VanDerWaalsContact CE2-CD1 3.44Å; W94-L347 HydrophobicContact CE3-CD1 3.89Å; W94-L347 HydrophobicContact CE3-CD2 4.44Å; W94-L347 HydrophobicContact CE3-CG 4.49Å; W94-L347 HydrophobicContact CG-CD1 4.22Å; W94-L347 HydrophobicContact CG-CD2 4.35Å; W94-L347 HydrophobicContact CG-CG 4.09Å; W94-L347 HydrophobicContact CH2-CD1 3.93Å; W94-L347 HydrophobicContact CZ2-CD1 3.63Å; W94-L347 HydrophobicContact CZ3-CD1 4.04Å; M343-L347 WeakPolarHBondContact O-CB 3.45Å; M343-L347 PolarHBondContact O-N 3.27Å; M343-L347 VanDerWaalsContact O-N 3.1Å; L347-L349 HydrophobicContact CB-CB 4.26Å; L347-L349 HydrophobicContact CB-CD1 3.86Å; L347-L349 HydrophobicContact CB-CG 3.81Å; L347-L349 HydrophobicContact CD1-CD1 3.72Å; L347-L349 HydrophobicContact CG-CD1 4.47Å; L347-L349 PolarHBondContact O-N 3.26Å
348K84.3Confident83.3Confident125 Ų12555 Ų5554%0.54326%0.255SS..  trans55.923.2-170.7-64.6-179.9173.5170.10113.2H82 M343 E344 R350H82-K348 VanDerWaalsContact NE2-CE 3.26Å; H82-K348 WeakPolarHBondContact NE2-CE 3.25Å; H82-K348 PolarHBondContact NE2-NZ 3.41Å; M343-K348 PolarHBondContact O-N 2.88Å; E344-K348 WeakPolarHBondContact O-CA 3.5Å; E344-K348 PolarHBondContact O-N 3Å; E344-K348 VanDerWaalsContact O-N 3.08Å; K348-R350 PolarHBondContact O-N 3.47Å
349L79.6Confident83.1Confident80 Ų8059 Ų5942%0.41928%0.275SS..  trans-84.6105.6178.9-73175.8000110.7L347 W351 R356L347-L349 HydrophobicContact CB-CB 4.26Å; L347-L349 HydrophobicContact CB-CD1 3.86Å; L347-L349 HydrophobicContact CB-CG 3.81Å; L347-L349 HydrophobicContact CD1-CD1 3.72Å; L347-L349 HydrophobicContact CG-CD1 4.47Å; L347-L349 PolarHBondContact O-N 3.26Å; L349-W351 PolarHBondContact O-N 3.45Å; L349-R356 PolarHBondContact O-NH2 3.05Å
350R73.9Confident82.7Confident233 Ų23359.4 Ų59.488%0.87928%0.278SS*.  trans-83.689172.1-66.2-176.3177.9-178.6-0.7110K348K348-R350 PolarHBondContact O-N 3.47Å
351W75.1Confident82.6Confident119 Ų11957.8 Ų57.845%0.45127%0.27SS..  trans-87.5160.1170.7-99.220.5000111.7M343 L349 A355 R356 L359M343-W351 HydrophobicContact CE-CE3 4.3Å; L349-W351 PolarHBondContact O-N 3.45Å; W351-A355 HydrophobicContact CE3-CB 4.32Å; W351-R356 HydrophobicContact CE3-CB 4.28Å; W351-L359 HydrophobicContact CH2-CD2 3.82Å; W351-L359 HydrophobicContact CZ3-CB 4.14Å; W351-L359 HydrophobicContact CZ3-CD2 3.62Å; W351-L359 HydrophobicContact CZ3-CG 4.46Å
352S78.8Confident82.6Confident73 Ų7359 Ų5951%0.5128%0.284SS..  trans-67.7140.2168.674.10000109.6F354 A355 R356S352-F354 VanDerWaalsContact C-N 3.26Å; S352-F354 PolarHBondContact O-N 3.34Å; S352-A355 PolarHBondContact O-N 2.97Å; S352-A355 VanDerWaalsContact O-N 3.12Å; S352-A355 VanDerWaalsContact OG-CB 3.25Å; S352-A355 WeakPolarHBondContact OG-CB 3.37Å; S352-A355 PolarHBondContact OG-N 3.42Å; S352-R356 PolarHBondContact O-N 2.92Å; S352-R356 VanDerWaalsContact O-N 3.13Å
353R75.1Confident82.4Confident112 Ų11262 Ų6242%0.42331%0.305SS..Hα-helixtrans-51.9-46.1-179.7-73.6179.8-86.7159.9-3.2111.7D144 R356 V357D144-R353 WeakPolarHBondContact OD2-CD 3.47Å; D144-R353 IonicContact OD2-CZ 3.65Å; D144-R353 IonicContact OD2-NE 3.9Å; D144-R353 IonicContact OD2-NH1 2.67Å; D144-R353 PolarHBondContact OD2-NH1 3.31Å; R353-R356 PolarHBondContact O-N 3.33Å; R353-V357 WeakPolarHBondContact O-CG2 3.42Å; R353-V357 PolarHBondContact O-N 3.48Å; R353-V357 VanDerWaalsContact O-N 3.07Å
354F78.5Confident82.2Confident95 Ų9561.4 Ų61.442%0.41730%0.302SS..Hα-helixtrans-57.7-49.2176-72.2-93.4000113.5L141 S352 R356 V357 L358L141-F354 HydrophobicContact CB-CD1 4.45Å; L141-F354 HydrophobicContact CB-CE1 3.91Å; L141-F354 HydrophobicContact CB-CZ 4.35Å; L141-F354 HydrophobicContact CD1-CD1 3.77Å; L141-F354 HydrophobicContact CD1-CE1 4.04Å; L141-F354 HydrophobicContact CD2-CD1 4.2Å; L141-F354 HydrophobicContact CD2-CE1 4.32Å; L141-F354 HydrophobicContact CD2-CG 4.38Å; L141-F354 HydrophobicContact CG-CD1 4.38Å; L141-F354 HydrophobicContact CG-CE1 4.33Å; S352-F354 VanDerWaalsContact C-N 3.26Å; S352-F354 PolarHBondContact O-N 3.34Å; F354-R356 VanDerWaalsContact C-N 3.35Å; F354-R356 PolarHBondContact O-N 2.97Å; F354-V357 PolarHBondContact O-N 3.23Å; F354-L358 WeakPolarHBondContact O-CB 3.37Å; F354-L358 VanDerWaalsContact O-CG 3.29Å; F354-L358 WeakPolarHBondContact O-CG 3.35Å; F354-L358 PolarHBondContact O-N 3.4Å
355A81.9Confident82.1Confident42 Ų4259.5 Ų59.535%0.34729%0.293SS..Hα-helixtrans-66.3-37.1-177.600000112.4W351 S352 L359W351-A355 HydrophobicContact CE3-CB 4.32Å; S352-A355 PolarHBondContact O-N 2.97Å; S352-A355 VanDerWaalsContact O-N 3.12Å; S352-A355 VanDerWaalsContact OG-CB 3.25Å; S352-A355 WeakPolarHBondContact OG-CB 3.37Å; S352-A355 PolarHBondContact OG-N 3.42Å; A355-L359 WeakPolarHBondContact O-CB 3.19Å; A355-L359 PolarHBondContact O-N 3.4Å
356R80.2Confident82.1Confident4 Ų464.7 Ų64.72%0.01532%0.32CS..Hα-helixtrans-62.7-55.1175.1178.5-179.1-65.8137-5111.4Q340 M343 E344 L349 W351 S352 R353 F354 L358 L359 T360Q340-R356 VanDerWaalsContact CG-NH1 3.3Å; M343-R356 HydrophobicContact SD-CG 3.73Å; M343-R356 PolarHBondContact SD-NE 3.16Å; E344-R356 IonicContact OE1-CZ 3.64Å; E344-R356 IonicContact OE1-NH1 2.76Å; E344-R356 PolarHBondContact OE1-NH1 3.36Å; E344-R356 IonicContact OE1-NH2 2.7Å; E344-R356 PolarHBondContact OE1-NH2 3.15Å; L349-R356 PolarHBondContact O-NH2 3.05Å; W351-R356 HydrophobicContact CE3-CB 4.28Å; S352-R356 PolarHBondContact O-N 2.92Å; S352-R356 VanDerWaalsContact O-N 3.13Å; R353-R356 PolarHBondContact O-N 3.33Å; F354-R356 VanDerWaalsContact C-N 3.35Å; F354-R356 PolarHBondContact O-N 2.97Å; R356-L358 PolarHBondContact O-N 3.23Å; R356-L359 PolarHBondContact O-N 3.46Å; R356-L359 VanDerWaalsContact O-N 3.15Å; R356-T360 PolarHBondContact O-N 3.23Å; R356-T360 PolarHBondContact O-OG1 2.86Å
357V79.1Confident81.8Confident9 Ų966.8 Ų66.86%0.05533%0.334CS..Hα-helixtrans-62.5-43-176.8171.80000111.1T137 L141 T336 R353 F354 L359 T360 R361T137-V357 HydrophobicContact CG2-CG1 3.49Å; T137-V357 VanDerWaalsContact CG2-CG1 3.49Å; L141-V357 HydrophobicContact CD1-CB 4.4Å; L141-V357 HydrophobicContact CD1-CG1 4.05Å; L141-V357 HydrophobicContact CD2-CB 4.12Å; L141-V357 HydrophobicContact CD2-CG1 4.27Å; L141-V357 HydrophobicContact CD2-CG2 4.06Å; L141-V357 HydrophobicContact CG-CG1 4.17Å; T336-V357 HydrophobicContact CG2-CB 4.35Å; T336-V357 HydrophobicContact CG2-CG1 3.87Å; T336-V357 HydrophobicContact CG2-CG2 3.8Å; R353-V357 WeakPolarHBondContact O-CG2 3.42Å; R353-V357 PolarHBondContact O-N 3.48Å; R353-V357 VanDerWaalsContact O-N 3.07Å; F354-V357 PolarHBondContact O-N 3.23Å; V357-L359 VanDerWaalsContact C-N 3.33Å; V357-L359 PolarHBondContact O-N 2.92Å; V357-T360 PolarHBondContact O-OG1 3.11Å; V357-R361 HydrophobicContact CG1-CG 4.26Å; V357-R361 VanDerWaalsContact O-CB 3.22Å; V357-R361 WeakPolarHBondContact O-CB 3.48Å; V357-R361 WeakPolarHBondContact O-CG 3.43Å; V357-R361 PolarHBondContact O-N 2.84Å
358L82.3Confident81.7Confident66 Ų6664.7 Ų64.735%0.34632%0.323SS..Hα-helixtrans-63.1-36.6175.3-73169.9000112.5F138 F354 R356 S362F138-L358 HydrophobicContact CE1-CD2 4.31Å; F138-L358 HydrophobicContact CZ-CD2 4.19Å; F354-L358 WeakPolarHBondContact O-CB 3.37Å; F354-L358 VanDerWaalsContact O-CG 3.29Å; F354-L358 WeakPolarHBondContact O-CG 3.35Å; F354-L358 PolarHBondContact O-N 3.4Å; R356-L358 PolarHBondContact O-N 3.23Å; L358-S362 VanDerWaalsContact O-CB 3.23Å; L358-S362 WeakPolarHBondContact O-CB 3.48Å; L358-S362 PolarHBondContact O-N 2.99Å; L358-S362 PolarHBondContact O-OG 3.47Å
359L85.1Confident81.7Confident83 Ų8360 Ų6044%0.43530%0.304SS..Hα-helixtrans-66-53.8176.4-17872.5000111.5W351 A355 R356 V357 R361 S362 C363W351-L359 HydrophobicContact CH2-CD2 3.82Å; W351-L359 HydrophobicContact CZ3-CB 4.14Å; W351-L359 HydrophobicContact CZ3-CD2 3.62Å; W351-L359 HydrophobicContact CZ3-CG 4.46Å; A355-L359 WeakPolarHBondContact O-CB 3.19Å; A355-L359 PolarHBondContact O-N 3.4Å; R356-L359 PolarHBondContact O-N 3.46Å; R356-L359 VanDerWaalsContact O-N 3.15Å; V357-L359 VanDerWaalsContact C-N 3.33Å; V357-L359 PolarHBondContact O-N 2.92Å; L359-R361 VanDerWaalsContact C-N 3.32Å; L359-R361 PolarHBondContact O-N 3.13Å; L359-S362 PolarHBondContact O-N 3.19Å; L359-S362 VanDerWaalsContact O-N 3.17Å; L359-C363 PolarHBondContact O-N 2.91Å; L359-C363 PolarHBondContact O-SG 3.03Å; L359-C363 VanDerWaalsContact O-SG 3.35Å
360T80.1Confident81.9Confident11 Ų1160.1 Ų60.17%0.06731%0.305CS..Hα-helixtrans-62-42.6-176.556.20000111.1R356 V357 C363 A364R356-T360 PolarHBondContact O-N 3.23Å; R356-T360 PolarHBondContact O-OG1 2.86Å; V357-T360 PolarHBondContact O-OG1 3.11Å; T360-C363 WeakPolarHBondContact O-CB 3.24Å; T360-C363 PolarHBondContact O-N 2.95Å; T360-A364 PolarHBondContact O-N 2.65Å; T360-A364 VanDerWaalsContact O-N 3.08Å
361R84.8Confident82.2Confident5 Ų550.8 Ų50.82%0.01927%0.274CS..Hα-helixtrans-62-43173.8-70.9-76.4129.1160.3-4.3112.4D105 E108 T137 V357 L359 C363 A364 I365D105-R361 IonicContact OD1-CZ 3.2Å; D105-R361 IonicContact OD1-NE 3.71Å; D105-R361 PolarHBondContact OD1-NE 2.89Å; D105-R361 IonicContact OD1-NH1 3.16Å; D105-R361 IonicContact OD1-NH2 3.67Å; D105-R361 PolarHBondContact OD1-NH2 2.91Å; D105-R361 VanDerWaalsContact OD1-NH2 3.13Å; D105-R361 IonicContact OD2-CZ 3.96Å; D105-R361 IonicContact OD2-NE 2.73Å; D105-R361 PolarHBondContact OD2-NE 3.48Å; D105-R361 IonicContact OD2-NH2 2.7Å; D105-R361 PolarHBondContact OD2-NH2 3.35Å; E108-R361 VanDerWaalsContact CD-NH1 3.31Å; E108-R361 IonicContact OE1-CZ 2.9Å; E108-R361 IonicContact OE1-NH1 3.32Å; E108-R361 PolarHBondContact OE1-NH1 2.97Å; E108-R361 IonicContact OE1-NH2 2.99Å; E108-R361 IonicContact OE2-CZ 3.98Å; E108-R361 IonicContact OE2-NH1 3.12Å; E108-R361 PolarHBondContact OE2-NH1 2.85Å; E108-R361 VanDerWaalsContact OE2-NH1 3.16Å; E108-R361 IonicContact OE2-NH2 2.83Å; E108-R361 PolarHBondContact OE2-NH2 3.48Å; T137-R361 HydrophobicContact CG2-CB 4.39Å; T137-R361 HydrophobicContact CG2-CG 3.76Å; T137-R361 WeakPolarHBondContact OG1-CD 3.34Å; V357-R361 HydrophobicContact CG1-CG 4.26Å; V357-R361 VanDerWaalsContact O-CB 3.22Å; V357-R361 WeakPolarHBondContact O-CB 3.48Å; V357-R361 WeakPolarHBondContact O-CG 3.43Å; V357-R361 PolarHBondContact O-N 2.84Å; L359-R361 VanDerWaalsContact C-N 3.32Å; L359-R361 PolarHBondContact O-N 3.13Å; R361-C363 VanDerWaalsContact C-N 3.3Å; R361-C363 PolarHBondContact O-N 3.02Å; R361-A364 PolarHBondContact O-N 3.48Å; R361-I365 HydrophobicContact CB-CD1 4.24Å; R361-I365 VanDerWaalsContact O-CB 3.25Å; R361-I365 WeakPolarHBondContact O-CB 3.32Å; R361-I365 WeakPolarHBondContact O-CG1 3.37Å; R361-I365 PolarHBondContact O-N 3.01Å
362S86.1Confident82.4Confident71 Ų7146 Ų4650%0.49726%0.26SS..Hα-helixtrans-61.6-40.5175.8-61.70000111.8L358 L359 A364 L366L358-S362 VanDerWaalsContact O-CB 3.23Å; L358-S362 WeakPolarHBondContact O-CB 3.48Å; L358-S362 PolarHBondContact O-N 2.99Å; L358-S362 PolarHBondContact O-OG 3.47Å; L359-S362 PolarHBondContact O-N 3.19Å; L359-S362 VanDerWaalsContact O-N 3.17Å; S362-A364 VanDerWaalsContact C-N 3.32Å; S362-A364 PolarHBondContact O-N 2.94Å; S362-L366 WeakPolarHBondContact O-CB 3.37Å; S362-L366 PolarHBondContact O-N 3.06Å; S362-L366 VanDerWaalsContact O-N 3.07Å
363C86.5Confident82.4Confident64 Ų6446 Ų4643%0.43226%0.257SS..Hα-helixtrans-66.6-28.8177.4-69.50000113.6V102 L359 T360 R361 P367V102-C363 HydrophobicContact CG1-CB 4.24Å; V102-C363 HydrophobicContact CG2-CB 4.31Å; L359-C363 PolarHBondContact O-N 2.91Å; L359-C363 PolarHBondContact O-SG 3.03Å; L359-C363 VanDerWaalsContact O-SG 3.35Å; T360-C363 WeakPolarHBondContact O-CB 3.24Å; T360-C363 PolarHBondContact O-N 2.95Å; R361-C363 VanDerWaalsContact C-N 3.3Å; R361-C363 PolarHBondContact O-N 3.02Å; C363-P367 WeakPolarHBondContact O-CD 3.34Å; C363-P367 VanDerWaalsContact O-CG 3.28Å; C363-P367 WeakPolarHBondContact O-CG 3.27Å
364A84.6Confident82.5Confident0 Ų048.1 Ų48.10%027%0.269CS..Hα-helixtrans-88.9-41.317700000113.3V102 D105 M106 T360 R361 S362 P367 T368V102-A364 HydrophobicContact CG1-CB 4.31Å; D105-A364 HydrophobicContact CB-CB 3.68Å; D105-A364 WeakPolarHBondContact OD1-CB 3.43Å; M106-A364 HydrophobicContact CG-CB 3.72Å; T360-A364 PolarHBondContact O-N 2.65Å; T360-A364 VanDerWaalsContact O-N 3.08Å; R361-A364 PolarHBondContact O-N 3.48Å; S362-A364 VanDerWaalsContact C-N 3.32Å; S362-A364 PolarHBondContact O-N 2.94Å; A364-P367 WeakPolarHBondContact O-CD 3.21Å; A364-P367 WeakPolarHBondContact O-CG 3.26Å; A364-T368 WeakPolarHBondContact O-CB 3.36Å; A364-T368 PolarHBondContact O-N 2.92Å; A364-T368 PolarHBondContact O-OG1 3.32Å
365I86.9Confident82.1Confident14 Ų1451.2 Ų51.27%0.07228%0.278CS..Hα-helixtrans-70.3-40.5-178.3-67.3172.1000110.7V109 V130 I134 R361 T368 V369V109-I365 HydrophobicContact CG1-CG1 4.33Å; V109-I365 HydrophobicContact CG2-CG1 4.07Å; V130-I365 HydrophobicContact CG1-CG2 4.03Å; I134-I365 HydrophobicContact CG1-CD1 3.69Å; I134-I365 HydrophobicContact CG1-CG2 4.46Å; R361-I365 HydrophobicContact CB-CD1 4.24Å; R361-I365 VanDerWaalsContact O-CB 3.25Å; R361-I365 WeakPolarHBondContact O-CB 3.32Å; R361-I365 WeakPolarHBondContact O-CG1 3.37Å; R361-I365 PolarHBondContact O-N 3.01Å; I365-T368 PolarHBondContact O-N 2.64Å; I365-V369 HydrophobicContact CG2-CG2 3.85Å; I365-V369 WeakPolarHBondContact O-CB 3.37Å; I365-V369 WeakPolarHBondContact O-CG2 3.38Å; I365-V369 PolarHBondContact O-N 2.74Å
366L86.8Confident81.3Confident109 Ų10955.5 Ų55.557%0.57130%0.295SS*.Hα-helixtrans-56.5-54.5-178.9-178.565.3000114.1S362 T368 V369 L370S362-L366 WeakPolarHBondContact O-CB 3.37Å; S362-L366 PolarHBondContact O-N 3.06Å; S362-L366 VanDerWaalsContact O-N 3.07Å; L366-T368 VanDerWaalsContact C-N 3.32Å; L366-T368 PolarHBondContact O-N 3.14Å; L366-V369 PolarHBondContact O-N 3.42Å; L366-L370 HydrophobicContact CD1-CD1 4.41Å; L366-L370 HydrophobicContact CG-CD1 4.33Å; L366-L370 VanDerWaalsContact O-CG 3.29Å; L366-L370 WeakPolarHBondContact O-CG 3.34Å; L366-L370 PolarHBondContact O-N 3.29Å
367P83.5Confident80.3Confident44 Ų4459 Ų5929%0.28631%0.314SS..Hα-helixtrans-64.5-37176.825.4-34.1000112.1M106 C363 A364 L370 V371M106-P367 HydrophobicContact CE-CB 4.02Å; M106-P367 HydrophobicContact CE-CG 3.79Å; M106-P367 HydrophobicContact SD-CG 3.84Å; C363-P367 WeakPolarHBondContact O-CD 3.34Å; C363-P367 VanDerWaalsContact O-CG 3.28Å; C363-P367 WeakPolarHBondContact O-CG 3.27Å; A364-P367 WeakPolarHBondContact O-CD 3.21Å; A364-P367 WeakPolarHBondContact O-CG 3.26Å; P367-L370 PolarHBondContact O-N 2.87Å; P367-V371 WeakPolarHBondContact O-CG2 3.48Å; P367-V371 PolarHBondContact O-N 3.37Å
368T82.6Confident79.4Confident0 Ų065 Ų650%034%0.34CS..Hα-helixtrans-65.9-40.9179.5-50.60000111.7V109 I110 V130 A364 I365 L366 V371 A372 L380V109-T368 HydrophobicContact CG1-CG2 4.05Å; I110-T368 HydrophobicContact CD1-CG2 4.42Å; I110-T368 HydrophobicContact CG1-CG2 3.64Å; V130-T368 HydrophobicContact CG1-CG2 4.29Å; V130-T368 HydrophobicContact CG2-CG2 3.91Å; A364-T368 WeakPolarHBondContact O-CB 3.36Å; A364-T368 PolarHBondContact O-N 2.92Å; A364-T368 PolarHBondContact O-OG1 3.32Å; I365-T368 PolarHBondContact O-N 2.64Å; L366-T368 VanDerWaalsContact C-N 3.32Å; L366-T368 PolarHBondContact O-N 3.14Å; T368-V371 PolarHBondContact O-N 3.37Å; T368-A372 VanDerWaalsContact O-CB 3.27Å; T368-A372 WeakPolarHBondContact O-CB 3.48Å; T368-A372 PolarHBondContact O-N 3.16Å; T368-L380 HydrophobicContact CG2-CD2 4.28Å
369V85.3Confident78.6Confident25 Ų2564.8 Ų64.815%0.15234%0.339CS..Hα-helixtrans-59.2-48.4170.31550000111.1W127 V130 L131 I365 L366 V371 A372 V373W127-V369 VanDerWaalsContact NE1-CG1 3.28Å; V130-V369 HydrophobicContact CB-CG2 4.47Å; V130-V369 HydrophobicContact CG1-CG2 3.53Å; L131-V369 HydrophobicContact CD2-CG2 4.24Å; I365-V369 HydrophobicContact CG2-CG2 3.85Å; I365-V369 WeakPolarHBondContact O-CB 3.37Å; I365-V369 WeakPolarHBondContact O-CG2 3.38Å; I365-V369 PolarHBondContact O-N 2.74Å; L366-V369 PolarHBondContact O-N 3.42Å; V369-V371 VanDerWaalsContact C-N 3.33Å; V369-V371 PolarHBondContact O-N 3.08Å; V369-A372 PolarHBondContact O-N 3.05Å; V369-V373 HydrophobicContact CG1-CG2 4.4Å; V369-V373 WeakPolarHBondContact O-CG2 3.38Å; V369-V373 PolarHBondContact O-N 3.19Å
370L83.6Confident77.7Confident83 Ų8361.2 Ų61.244%0.43532%0.32SS..Hα-helixtrans-61.4-42.2-178.4-71.4170.1000111.4L366 P367 F374L366-L370 HydrophobicContact CD1-CD1 4.41Å; L366-L370 HydrophobicContact CG-CD1 4.33Å; L366-L370 VanDerWaalsContact O-CG 3.29Å; L366-L370 WeakPolarHBondContact O-CG 3.34Å; L366-L370 PolarHBondContact O-N 3.29Å; P367-L370 PolarHBondContact O-N 2.87Å; L370-F374 HydrophobicContact CD2-CD2 4.13Å; L370-F374 HydrophobicContact CD2-CE2 3.79Å; L370-F374 WeakPolarHBondContact O-CB 3.1Å; L370-F374 VanDerWaalsContact O-CD2 3.3Å; L370-F374 WeakPolarHBondContact O-CD2 3.25Å; L370-F374 PolarHBondContact O-N 2.81Å; L370-F374 VanDerWaalsContact O-N 3.07Å
371V80.3Confident76.9Confident37 Ų3761.6 Ų61.622%0.22432%0.323CS..Hα-helixtrans-65.4-46.6173.6179.20000110.5P367 T368 V369 V373 F374 R375 D379 L380 L383P367-V371 WeakPolarHBondContact O-CG2 3.48Å; P367-V371 PolarHBondContact O-N 3.37Å; T368-V371 PolarHBondContact O-N 3.37Å; V369-V371 VanDerWaalsContact C-N 3.33Å; V369-V371 PolarHBondContact O-N 3.08Å; V371-V373 VanDerWaalsContact C-N 3.29Å; V371-V373 PolarHBondContact O-N 3.2Å; V371-F374 PolarHBondContact O-N 3.42Å; V371-R375 HydrophobicContact CG1-CB 4.15Å; V371-R375 HydrophobicContact CG1-CG 4.48Å; V371-R375 WeakPolarHBondContact O-CA 3.45Å; V371-R375 VanDerWaalsContact O-CB 3.32Å; V371-R375 WeakPolarHBondContact O-CB 3.39Å; V371-R375 PolarHBondContact O-N 3.42Å; V371-D379 HydrophobicContact CG1-CB 4.2Å; V371-L380 HydrophobicContact CB-CD2 4.05Å; V371-L380 HydrophobicContact CG1-CD2 3.71Å; V371-L380 HydrophobicContact CG1-CG 3.91Å; V371-L383 HydrophobicContact CG2-CD2 4.27Å
372A78.1Confident76.2Confident19 Ų1963.4 Ų63.416%0.15734%0.343CS..Hα-helixtrans-65.8-22.3-178.400000115.5W127 T368 V369 L380W127-A372 HydrophobicContact CB-CB 4.17Å; T368-A372 VanDerWaalsContact O-CB 3.27Å; T368-A372 WeakPolarHBondContact O-CB 3.48Å; T368-A372 PolarHBondContact O-N 3.16Å; V369-A372 PolarHBondContact O-N 3.05Å; A372-L380 HydrophobicContact CB-CD1 4.01Å; A372-L380 HydrophobicContact CB-CD2 4.36Å
373V80.2Confident75.7Confident74 Ų7461.3 Ų61.345%0.44833%0.326SS..Hα-helixtrans-91.3-41.8176.2173.60000112.1W127 V369 V371W127-V373 HydrophobicContact CB-CG2 4.23Å; W127-V373 HydrophobicContact CD2-CG2 3.84Å; W127-V373 HydrophobicContact CG-CG2 3.51Å; V369-V373 HydrophobicContact CG1-CG2 4.4Å; V369-V373 WeakPolarHBondContact O-CG2 3.38Å; V369-V373 PolarHBondContact O-N 3.19Å; V371-V373 VanDerWaalsContact C-N 3.29Å; V371-V373 PolarHBondContact O-N 3.2Å
374F75.9Confident75.3Confident155 Ų15559.1 Ų59.168%0.6831%0.31SS*.Hα-helixtrans-99.7-7.4-170.2-66.1-68.4000114.4L370 V371L370-F374 HydrophobicContact CD2-CD2 4.13Å; L370-F374 HydrophobicContact CD2-CE2 3.79Å; L370-F374 WeakPolarHBondContact O-CB 3.1Å; L370-F374 VanDerWaalsContact O-CD2 3.3Å; L370-F374 WeakPolarHBondContact O-CD2 3.25Å; L370-F374 PolarHBondContact O-N 2.81Å; L370-F374 VanDerWaalsContact O-N 3.07Å; V371-F374 PolarHBondContact O-N 3.42Å
375R69.9Low74.9Confident160 Ų16063.4 Ų63.460%0.60433%0.333SS*.SBendtrans-132.9158.8-177.7-62.7-58.3-169113-10.5113.1V371 D379V371-R375 HydrophobicContact CG1-CB 4.15Å; V371-R375 HydrophobicContact CG1-CG 4.48Å; V371-R375 WeakPolarHBondContact O-CA 3.45Å; V371-R375 VanDerWaalsContact O-CB 3.32Å; V371-R375 WeakPolarHBondContact O-CB 3.39Å; V371-R375 PolarHBondContact O-N 3.42Å; R375-D379 HydrophobicContact CB-CB 3.73Å; R375-D379 WeakPolarHBondContact CB-OD2 3.42Å; R375-D379 VanDerWaalsContact CD-OD2 3.23Å; R375-D379 WeakPolarHBondContact CD-OD2 3.37Å; R375-D379 HydrophobicContact CG-CB 4.29Å; R375-D379 WeakPolarHBondContact CG-OD2 3.36Å; R375-D379 IonicContact CZ-OD2 2.78Å; R375-D379 IonicContact NE-OD2 2.76Å; R375-D379 IonicContact NH1-OD2 3.81Å; R375-D379 PolarHBondContact NH1-OD2 3.36Å
376D65.8Low74.6Confident133 Ų13367.5 Ų67.571%0.71135%0.354SS*.  trans-71.1161.5177.4-75.3-46.9000112.5K378 D379D376-K378 PolarHBondContact O-N 2.93Å; D376-D379 PolarHBondContact O-N 3.32Å
377L58.9Low74.5Confident78 Ų7862.7 Ų62.741%0.40833%0.329SS..Hα-helixtrans-46.5-36.5178.5-61.5173.2000113.9L126 Y302 D379 L380 S381L126-L377 HydrophobicContact CD1-CD2 3.36Å; L126-L377 HydrophobicContact CG-CD2 3.85Å; Y302-L377 HydrophobicContact CE1-CD1 4.11Å; L377-D379 VanDerWaalsContact C-N 3.29Å; L377-D379 PolarHBondContact O-N 3.05Å; L377-L380 PolarHBondContact O-N 2.89Å; L377-S381 PolarHBondContact O-N 2.87Å; L377-S381 PolarHBondContact O-OG 3.45Å
378K60.9Low74.6Confident135 Ų13562 Ų6259%0.58732%0.323SS*.Hα-helixtrans-63.8-30.6-178.7-64179.5179.6176.60113.3D376 L380 S381 G382D376-K378 PolarHBondContact O-N 2.93Å; K378-L380 VanDerWaalsContact C-N 3.34Å; K378-S381 PolarHBondContact O-N 3.05Å; K378-G382 PolarHBondContact O-N 3.44Å; K378-G382 VanDerWaalsContact O-N 3.12Å
379D64.7Low74.5Confident61 Ų6163.5 Ų63.533%0.32633%0.332SS..Hα-helixtrans-76-23.9-178.5-72.19.6000111.4V371 R375 D376 L377 L383V371-D379 HydrophobicContact CG1-CB 4.2Å; R375-D379 HydrophobicContact CB-CB 3.73Å; R375-D379 WeakPolarHBondContact CB-OD2 3.42Å; R375-D379 VanDerWaalsContact CD-OD2 3.23Å; R375-D379 WeakPolarHBondContact CD-OD2 3.37Å; R375-D379 HydrophobicContact CG-CB 4.29Å; R375-D379 WeakPolarHBondContact CG-OD2 3.36Å; R375-D379 IonicContact CZ-OD2 2.78Å; R375-D379 IonicContact NE-OD2 2.76Å; R375-D379 IonicContact NH1-OD2 3.81Å; R375-D379 PolarHBondContact NH1-OD2 3.36Å; D376-D379 PolarHBondContact O-N 3.32Å; L377-D379 VanDerWaalsContact C-N 3.29Å; L377-D379 PolarHBondContact O-N 3.05Å; D379-L383 WeakPolarHBondContact O-CB 3.46Å; D379-L383 PolarHBondContact O-N 3.06Å; D379-L383 VanDerWaalsContact O-N 3.13Å
380L66.6Low74.6Confident7 Ų764.2 Ų64.24%0.03734%0.335CS..Hα-helixtrans-74.8-39.7172.7-74164.1000112.1I110 L126 T368 V371 A372 L377 K378 L383 N384I110-L380 HydrophobicContact CG1-CD2 4.41Å; L126-L380 HydrophobicContact CB-CD1 4.31Å; L126-L380 HydrophobicContact CD1-CD1 3.48Å; L126-L380 VanDerWaalsContact CD1-CD1 3.48Å; T368-L380 HydrophobicContact CG2-CD2 4.28Å; V371-L380 HydrophobicContact CB-CD2 4.05Å; V371-L380 HydrophobicContact CG1-CD2 3.71Å; V371-L380 HydrophobicContact CG1-CG 3.91Å; A372-L380 HydrophobicContact CB-CD1 4.01Å; A372-L380 HydrophobicContact CB-CD2 4.36Å; L377-L380 PolarHBondContact O-N 2.89Å; K378-L380 VanDerWaalsContact C-N 3.34Å; L380-L383 WeakPolarHBondContact O-CB 3.09Å; L380-L383 PolarHBondContact O-N 3.29Å; L380-N384 PolarHBondContact O-N 3.09Å
381S64.1Low74.9Confident20 Ų2060.3 Ų60.314%0.1431%0.314CS..Hα-helixtrans-63.1-49.1174.7-480000111D300 L377 K378 L383 N384 D385D300-S381 WeakPolarHBondContact OD1-CB 3.46Å; D300-S381 PolarHBondContact OD1-OG 2.87Å; D300-S381 PolarHBondContact OD2-OG 3.34Å; L377-S381 PolarHBondContact O-N 2.87Å; L377-S381 PolarHBondContact O-OG 3.45Å; K378-S381 PolarHBondContact O-N 3.05Å; S381-L383 VanDerWaalsContact C-N 3.25Å; S381-L383 PolarHBondContact O-N 3.2Å; S381-N384 WeakPolarHBondContact O-CB 3.28Å; S381-N384 PolarHBondContact O-N 3.31Å; S381-D385 PolarHBondContact O-N 2.97Å
382G68.9Low75.2Confident42 Ų4258.7 Ų58.743%0.43331%0.305SS..Hα-helixtrans-63.5-28.4175.900000113.9K378 L386K378-G382 PolarHBondContact O-N 3.44Å; K378-G382 VanDerWaalsContact O-N 3.12Å; G382-L386 PolarHBondContact O-N 3.48Å; G382-L386 VanDerWaalsContact O-N 3.1Å
383L75.6Confident75.7Confident28 Ų2859.6 Ų59.615%0.14731%0.307CS..Hα-helixtrans-66.1-39171.2177.461.4000111.8M106 I110 V371 D379 L380 S381 D385 L386 L387M106-L383 HydrophobicContact CE-CD1 4.21Å; M106-L383 HydrophobicContact CE-CD2 3.88Å; M106-L383 HydrophobicContact CE-CG 4.38Å; I110-L383 HydrophobicContact CD1-CD2 3.99Å; I110-L383 HydrophobicContact CD1-CG 4.16Å; V371-L383 HydrophobicContact CG2-CD2 4.27Å; D379-L383 WeakPolarHBondContact O-CB 3.46Å; D379-L383 PolarHBondContact O-N 3.06Å; D379-L383 VanDerWaalsContact O-N 3.13Å; L380-L383 WeakPolarHBondContact O-CB 3.09Å; L380-L383 PolarHBondContact O-N 3.29Å; S381-L383 VanDerWaalsContact C-N 3.25Å; S381-L383 PolarHBondContact O-N 3.2Å; L383-D385 PolarHBondContact O-N 3.3Å; L383-L386 HydrophobicContact CD1-CD2 4.44Å; L383-L386 PolarHBondContact O-N 2.87Å; L383-L387 HydrophobicContact CD1-CD1 4.28Å; L383-L387 HydrophobicContact CD1-CG 4.3Å; L383-L387 HydrophobicContact CG-CD1 4.04Å; L383-L387 WeakPolarHBondContact O-CB 3.26Å; L383-L387 WeakPolarHBondContact O-CG 3.49Å; L383-L387 PolarHBondContact O-N 3.23Å
384N78.4Confident76.3Confident17 Ų1756.4 Ų56.49%0.09129%0.287CS..Hα-helixtrans-62.3-41.2176.3-178.649000112.4Q107 L380 S381 L387 N388Q107-N384 WeakPolarHBondContact CG-OD1 3.19Å; Q107-N384 PolarHBondContact NE2-O 3.46Å; Q107-N384 PolarHBondContact NE2-OD1 2.91Å; Q107-N384 VanDerWaalsContact NE2-OD1 3.16Å; L380-N384 PolarHBondContact O-N 3.09Å; S381-N384 WeakPolarHBondContact O-CB 3.28Å; S381-N384 PolarHBondContact O-N 3.31Å; N384-L387 PolarHBondContact O-N 2.99Å; N384-N388 PolarHBondContact O-N 3.44Å; N384-N388 PolarHBondContact O-ND2 3.35Å
385D76.1Confident77Confident91 Ų9149.2 Ų49.249%0.48726%0.256SS..Hα-helixtrans-66.3-41.7176.1-70.1-25.7000112.1S381 L383 L387 N388 V389S381-D385 PolarHBondContact O-N 2.97Å; L383-D385 PolarHBondContact O-N 3.3Å; D385-L387 PolarHBondContact O-N 3.2Å; D385-N388 PolarHBondContact O-N 3.01Å; D385-V389 WeakPolarHBondContact O-CG2 3.2Å; D385-V389 PolarHBondContact O-N 3.41Å
386L79.9Confident78.1Confident99 Ų9941.6 Ų41.652%0.51823%0.227SC..Hα-helixtrans-58.9-38.1172.8-173.972.5000111.7G382 L383 V389 L390G382-L386 PolarHBondContact O-N 3.48Å; G382-L386 VanDerWaalsContact O-N 3.1Å; L383-L386 HydrophobicContact CD1-CD2 4.44Å; L383-L386 PolarHBondContact O-N 2.87Å; L386-V389 PolarHBondContact O-N 2.9Å; L386-L390 WeakPolarHBondContact O-CB 3.44Å; L386-L390 PolarHBondContact O-N 2.84Å
387L85.6Confident79.4Confident9 Ų935.3 Ų35.35%0.04719%0.194CC..Hα-helixtrans-69.7-37.8177.3-69.5167.2000112.2M106 Q107 I110 L383 N384 D385 V389 L390 Q391M106-L387 HydrophobicContact CB-CD1 3.63Å; M106-L387 HydrophobicContact CE-CD1 4.34Å; M106-L387 HydrophobicContact SD-CD2 4.4Å; Q107-L387 HydrophobicContact CG-CB 3.51Å; Q107-L387 HydrophobicContact CG-CD1 3.64Å; Q107-L387 HydrophobicContact CG-CG 4.2Å; I110-L387 HydrophobicContact CD1-CD1 4.31Å; L383-L387 HydrophobicContact CD1-CD1 4.28Å; L383-L387 HydrophobicContact CD1-CG 4.3Å; L383-L387 HydrophobicContact CG-CD1 4.04Å; L383-L387 WeakPolarHBondContact O-CB 3.26Å; L383-L387 WeakPolarHBondContact O-CG 3.49Å; L383-L387 PolarHBondContact O-N 3.23Å; N384-L387 PolarHBondContact O-N 2.99Å; D385-L387 PolarHBondContact O-N 3.2Å; L387-V389 VanDerWaalsContact C-N 3.34Å; L387-V389 PolarHBondContact O-N 2.83Å; L387-L390 HydrophobicContact CD2-CD2 4.11Å; L387-L390 WeakPolarHBondContact O-CB 3.42Å; L387-L390 PolarHBondContact O-N 3.4Å; L387-Q391 WeakPolarHBondContact O-CG 3.48Å; L387-Q391 PolarHBondContact O-N 3.25Å
388N84.8Confident81.1Confident30 Ų3031.6 Ų31.616%0.1617%0.174CC..Hα-helixtrans-60.4-43.7171.8-76.1-42.2000111.8Q107 N384 D385 L390 Q391 S392Q107-N388 PolarHBondContact NE2-OD1 3.04Å; N384-N388 PolarHBondContact O-N 3.44Å; N384-N388 PolarHBondContact O-ND2 3.35Å; D385-N388 PolarHBondContact O-N 3.01Å; N388-L390 VanDerWaalsContact C-N 3.33Å; N388-Q391 PolarHBondContact O-N 3.31Å; N388-S392 PolarHBondContact O-N 3.02Å; N388-S392 VanDerWaalsContact O-N 3.13Å
389V81.6Confident82.6Confident30 Ų3025.2 Ų25.218%0.18215%0.146CC..Hα-helixtrans-63.3-39.8174.6171.50000111.2D385 L386 L387 S392 L393 F439D385-V389 WeakPolarHBondContact O-CG2 3.2Å; D385-V389 PolarHBondContact O-N 3.41Å; L386-V389 PolarHBondContact O-N 2.9Å; L387-V389 VanDerWaalsContact C-N 3.34Å; L387-V389 PolarHBondContact O-N 2.83Å; V389-S392 PolarHBondContact O-N 3.04Å; V389-L393 PolarHBondContact O-N 3.4Å; V389-F439 HydrophobicContact CG1-CD2 4.28Å; V389-F439 HydrophobicContact CG1-CE1 4.17Å; V389-F439 HydrophobicContact CG1-CE2 3.29Å; V389-F439 HydrophobicContact CG1-CZ 3.23Å
390L86.8Confident84Confident41 Ų4122.3 Ų22.322%0.21513%0.131CC..Hα-helixtrans-61.4-42.8173.7-179.965.6000112.1L99 L386 L387 N388 S392 L393 L394L99-L390 HydrophobicContact CD2-CD1 4.31Å; L99-L390 HydrophobicContact CG-CD2 4.37Å; L386-L390 WeakPolarHBondContact O-CB 3.44Å; L386-L390 PolarHBondContact O-N 2.84Å; L387-L390 HydrophobicContact CD2-CD2 4.11Å; L387-L390 WeakPolarHBondContact O-CB 3.42Å; L387-L390 PolarHBondContact O-N 3.4Å; N388-L390 VanDerWaalsContact C-N 3.33Å; L390-S392 VanDerWaalsContact C-N 3.31Å; L390-S392 PolarHBondContact O-N 3.31Å; L390-L393 WeakPolarHBondContact O-CB 3.43Å; L390-L393 PolarHBondContact O-N 3.26Å; L390-L394 HydrophobicContact CD1-CD1 3.82Å; L390-L394 HydrophobicContact CD1-CG 4.11Å; L390-L394 HydrophobicContact CD2-CD1 4.48Å; L390-L394 HydrophobicContact CG-CD1 3.77Å; L390-L394 HydrophobicContact CG-CG 4.41Å; L390-L394 VanDerWaalsContact O-CG 3.23Å; L390-L394 WeakPolarHBondContact O-CG 3.44Å; L390-L394 PolarHBondContact O-N 2.91Å
391Q89.5Confident85.3Confident0 Ų022 Ų220%013%0.129CC..Hα-helixtrans-59.2-44174.6-62.4-55.2-24.300111.4A100 S104 P210 L387 N388 L393 L394 L395A100-Q391 PolarHBondContact O-NE2 3.28Å; A100-Q391 PolarHBondContact O-OE1 3.06Å; S104-Q391 VanDerWaalsContact N-NE2 3.2Å; P210-Q391 VanDerWaalsContact CD-OE1 3.32Å; P210-Q391 WeakPolarHBondContact CG-O 3.35Å; L387-Q391 WeakPolarHBondContact O-CG 3.48Å; L387-Q391 PolarHBondContact O-N 3.25Å; N388-Q391 PolarHBondContact O-N 3.31Å; Q391-L393 VanDerWaalsContact C-N 3.33Å; Q391-L393 PolarHBondContact O-N 2.86Å; Q391-L394 PolarHBondContact O-N 3.03Å; Q391-L395 PolarHBondContact O-N 3.35Å
392S87.3Confident86.6Confident3 Ų321 Ų212%0.02112%0.122CC..Hα-helixtrans-64.7-36176.6-165.70000112.8V201 N388 V389 L390 L394 L395 N436V201-S392 VanDerWaalsContact CG1-OG 3.24Å; V201-S392 WeakPolarHBondContact CG1-OG 3.12Å; V201-S392 WeakPolarHBondContact O-CB 3.36Å; V201-S392 PolarHBondContact O-OG 3.36Å; N388-S392 PolarHBondContact O-N 3.02Å; N388-S392 VanDerWaalsContact O-N 3.13Å; V389-S392 PolarHBondContact O-N 3.04Å; L390-S392 VanDerWaalsContact C-N 3.31Å; L390-S392 PolarHBondContact O-N 3.31Å; S392-L394 VanDerWaalsContact C-N 3.33Å; S392-L395 WeakPolarHBondContact O-CB 3.24Å; S392-L395 PolarHBondContact O-N 3.33Å; S392-N436 PolarHBondContact O-OD1 3.12Å
393L88.5Confident87.8Confident38 Ų3819 Ų1920%0.19910%0.102CC..Hα-helixtrans-65.1-37.4175.7-173.567.5000111.9V389 L390 Q391 P396 N436 F439 V440 Y463V389-L393 PolarHBondContact O-N 3.4Å; L390-L393 WeakPolarHBondContact O-CB 3.43Å; L390-L393 PolarHBondContact O-N 3.26Å; Q391-L393 VanDerWaalsContact C-N 3.33Å; Q391-L393 PolarHBondContact O-N 2.86Å; L393-P396 VanDerWaalsContact O-CD 3.25Å; L393-P396 WeakPolarHBondContact O-CD 3.48Å; L393-N436 VanDerWaalsContact CA-OD1 3.26Å; L393-N436 WeakPolarHBondContact CA-OD1 3.5Å; L393-N436 PolarHBondContact O-OD1 3.45Å; L393-F439 HydrophobicContact CD1-CD1 3.92Å; L393-F439 HydrophobicContact CD1-CE1 4.35Å; L393-V440 HydrophobicContact CD1-CG2 4.4Å; L393-Y463 HydrophobicContact CD1-CD2 4.43Å; L393-Y463 HydrophobicContact CD1-CE1 4.08Å; L393-Y463 HydrophobicContact CD1-CE2 3.72Å; L393-Y463 HydrophobicContact CG-CD2 4.41Å; L393-Y463 HydrophobicContact CG-CE2 3.73Å; L393-Y463 VanDerWaalsContact O-CE2 3.23Å; L393-Y463 WeakPolarHBondContact O-CE2 3.24Å; L393-Y463 PolarHBondContact O-OH 3.39Å
394L92.1Very high88.5Confident7 Ų717.7 Ų17.74%0.03710%0.095CC..Hα-helixtrans-84.8-13.5-177.9-61.8170.7000113.1T96 L99 A100 P210 L390 Q391 S392 F397T96-L394 HydrophobicContact CG2-CD2 4.19Å; L99-L394 HydrophobicContact CB-CD1 4.31Å; L99-L394 HydrophobicContact CD2-CD1 4.31Å; L99-L394 HydrophobicContact CD2-CD2 4.4Å; L99-L394 HydrophobicContact CG-CD1 4.11Å; A100-L394 HydrophobicContact CB-CB 4.33Å; A100-L394 HydrophobicContact CB-CD1 3.74Å; P210-L394 HydrophobicContact CG-CB 4.25Å; L390-L394 HydrophobicContact CD1-CD1 3.82Å; L390-L394 HydrophobicContact CD1-CG 4.11Å; L390-L394 HydrophobicContact CD2-CD1 4.48Å; L390-L394 HydrophobicContact CG-CD1 3.77Å; L390-L394 HydrophobicContact CG-CG 4.41Å; L390-L394 VanDerWaalsContact O-CG 3.23Å; L390-L394 WeakPolarHBondContact O-CG 3.44Å; L390-L394 PolarHBondContact O-N 2.91Å; Q391-L394 PolarHBondContact O-N 3.03Å; S392-L394 VanDerWaalsContact C-N 3.33Å; L394-F397 HydrophobicContact CB-CD2 4.43Å; L394-F397 HydrophobicContact CD2-CD2 3.99Å; L394-F397 HydrophobicContact CD2-CE2 4.05Å; L394-F397 WeakPolarHBondContact O-CB 3.39Å; L394-F397 WeakPolarHBondContact O-CD2 3.34Å; L394-F397 PolarHBondContact O-N 3.45Å
395L91.1Very high89.1Confident4 Ų416.9 Ų16.92%0.0219%0.091CC..Hα-helixtrans-51.4-41.5179.7-175.858.7000116V204 I208 I213 Q391 S392 F397 A398 V399 V432V204-L395 HydrophobicContact CG1-CD2 4.19Å; I208-L395 HydrophobicContact CB-CD1 4.15Å; I208-L395 HydrophobicContact CB-CD2 4.3Å; I208-L395 HydrophobicContact CG2-CD1 3.63Å; I208-L395 HydrophobicContact CG2-CD2 4.41Å; I208-L395 WeakPolarHBondContact O-CD1 3.28Å; I213-L395 HydrophobicContact CD1-CD1 4.45Å; Q391-L395 PolarHBondContact O-N 3.35Å; S392-L395 WeakPolarHBondContact O-CB 3.24Å; S392-L395 PolarHBondContact O-N 3.33Å; L395-F397 PolarHBondContact O-N 3.46Å; L395-F397 VanDerWaalsContact O-N 3.16Å; L395-A398 PolarHBondContact O-N 3.13Å; L395-V399 HydrophobicContact CD1-CG2 3.44Å; L395-V399 VanDerWaalsContact CD1-CG2 3.44Å; L395-V399 HydrophobicContact CG-CG2 3.84Å; L395-V399 WeakPolarHBondContact O-CB 3.21Å; L395-V399 WeakPolarHBondContact O-CG2 3.43Å; L395-V399 PolarHBondContact O-N 3.46Å; L395-V432 HydrophobicContact CD2-CG2 4.45Å
396P92.9Very high89.8Confident0 Ų012.6 Ų12.60%07%0.067CC..Hα-helixtrans-57.9-31.2177.7-21.432000112.9L393 A398 V399 L400 V432 N436 T467L393-P396 VanDerWaalsContact O-CD 3.25Å; L393-P396 WeakPolarHBondContact O-CD 3.48Å; P396-A398 VanDerWaalsContact C-N 3.35Å; P396-A398 PolarHBondContact O-N 3.22Å; P396-V399 PolarHBondContact O-N 3.46Å; P396-L400 HydrophobicContact CB-CD1 3.91Å; P396-L400 HydrophobicContact CB-CG 4.32Å; P396-L400 VanDerWaalsContact O-CB 3.23Å; P396-L400 WeakPolarHBondContact O-CB 3.42Å; P396-L400 WeakPolarHBondContact O-CG 3.48Å; P396-L400 PolarHBondContact O-N 2.94Å; P396-V432 HydrophobicContact CB-CG1 3.92Å; P396-V432 HydrophobicContact CG-CG1 3.65Å; P396-N436 HydrophobicContact CG-CB 4.16Å; P396-N436 VanDerWaalsContact CG-ND2 3.33Å; P396-N436 WeakPolarHBondContact CG-ND2 3.24Å; P396-T467 HydrophobicContact CB-CG2 4.14Å
397F93.9Very high90.2Very high2 Ų27.9 Ų7.91%0.0094%0.043CC..Hα-helixtrans-70.1-30.6-177.8-58.8-48.8000112.6L93 T96 I97 Y214 L394 L395 P401 Y463 L466 T467 L470L93-F397 HydrophobicContact CD1-CB 3.62Å; L93-F397 HydrophobicContact CD1-CG 4.46Å; L93-F397 VanDerWaalsContact CD1-O 3.25Å; L93-F397 WeakPolarHBondContact CD1-O 3.09Å; T96-F397 HydrophobicContact CG2-CD2 3.75Å; T96-F397 HydrophobicContact CG2-CE2 3.68Å; T96-F397 HydrophobicContact CG2-CG 4.4Å; T96-F397 HydrophobicContact CG2-CZ 4.32Å; I97-F397 HydrophobicContact CD1-CB 4.21Å; Y214-F397 PolarHBondContact OH-O 3.2Å; L394-F397 HydrophobicContact CB-CD2 4.43Å; L394-F397 HydrophobicContact CD2-CD2 3.99Å; L394-F397 HydrophobicContact CD2-CE2 4.05Å; L394-F397 WeakPolarHBondContact O-CB 3.39Å; L394-F397 WeakPolarHBondContact O-CD2 3.34Å; L394-F397 PolarHBondContact O-N 3.45Å; L395-F397 PolarHBondContact O-N 3.46Å; L395-F397 VanDerWaalsContact O-N 3.16Å; F397-P401 WeakPolarHBondContact O-CD 3.47Å; F397-P401 WeakPolarHBondContact O-CG 3.43Å; F397-Y463 AromaticContact CE2-CD2 3.69Å; F397-Y463 HydrophobicContact CE2-CD2 3.69Å; F397-Y463 AromaticContact CE2-CE2 3.43Å; F397-Y463 HydrophobicContact CE2-CE2 3.43Å; F397-Y463 VanDerWaalsContact CE2-CE2 3.43Å; F397-Y463 AromaticContact CZ-CD2 3.46Å; F397-Y463 HydrophobicContact CZ-CD2 3.46Å; F397-Y463 VanDerWaalsContact CZ-CD2 3.46Å; F397-Y463 AromaticContact CZ-CE2 3.43Å; F397-Y463 HydrophobicContact CZ-CE2 3.43Å; F397-Y463 VanDerWaalsContact CZ-CE2 3.43Å; F397-Y463 HydrophobicContact CZ-CG 4.34Å; F397-L466 HydrophobicContact CD1-CD2 3.94Å; F397-L466 HydrophobicContact CD1-CG 4.18Å; F397-L466 HydrophobicContact CE1-CB 4.07Å; F397-L466 HydrophobicContact CE1-CD2 3.55Å; F397-L466 HydrophobicContact CE1-CG 3.69Å; F397-L466 HydrophobicContact CZ-CD2 4.11Å; F397-T467 WeakPolarHBondContact CE1-OG1 3.25Å; F397-L470 HydrophobicContact CD1-CD1 3.75Å; F397-L470 HydrophobicContact CE1-CD1 4.43Å
398A92.9Very high90.2Very high0 Ų07.9 Ų7.90%04%0.043CC..Hα-helixtrans-85.3-41171.100000112.6I97 P210 I213 Y214 L395 P396 I402I97-A398 HydrophobicContact CD1-CB 4.17Å; P210-A398 HydrophobicContact CB-CB 3.74Å; P210-A398 WeakPolarHBondContact O-CB 3.14Å; I213-A398 HydrophobicContact CB-CB 4.24Å; I213-A398 HydrophobicContact CD1-CB 3.94Å; Y214-A398 HydrophobicContact CD2-CB 4.28Å; Y214-A398 HydrophobicContact CE2-CB 3.69Å; L395-A398 PolarHBondContact O-N 3.13Å; P396-A398 VanDerWaalsContact C-N 3.35Å; P396-A398 PolarHBondContact O-N 3.22Å; A398-I402 WeakPolarHBondContact O-CG2 3.49Å
399V93.4Very high90.1Very high1 Ų110.4 Ų10.41%0.0066%0.061CC..Hα-helixtrans-73.2-46-173.61730000112.2I213 L395 P396 I402 L403 I428 V432I213-V399 HydrophobicContact CD1-CG2 3.73Å; L395-V399 HydrophobicContact CD1-CG2 3.44Å; L395-V399 VanDerWaalsContact CD1-CG2 3.44Å; L395-V399 HydrophobicContact CG-CG2 3.84Å; L395-V399 WeakPolarHBondContact O-CB 3.21Å; L395-V399 WeakPolarHBondContact O-CG2 3.43Å; L395-V399 PolarHBondContact O-N 3.46Å; P396-V399 PolarHBondContact O-N 3.46Å; V399-I402 WeakPolarHBondContact O-CG2 3.37Å; V399-I402 PolarHBondContact O-N 3.31Å; V399-L403 HydrophobicContact CG1-CD1 3.52Å; V399-L403 HydrophobicContact CG1-CG 3.9Å; V399-L403 VanDerWaalsContact O-CG 3.25Å; V399-L403 WeakPolarHBondContact O-CG 3.24Å; V399-L403 PolarHBondContact O-N 3.36Å; V399-I428 HydrophobicContact CG1-CG2 3.96Å; V399-V432 HydrophobicContact CG1-CG2 4.44Å
400L93.4Very high90.1Very high0 Ų010.4 Ų10.40%06%0.064CC..Hα-helixtrans-62.9-43.3-175.2-62.7172.1000113P396 I402 L403 T404 M429 T467 L470 A471P396-L400 HydrophobicContact CB-CD1 3.91Å; P396-L400 HydrophobicContact CB-CG 4.32Å; P396-L400 VanDerWaalsContact O-CB 3.23Å; P396-L400 WeakPolarHBondContact O-CB 3.42Å; P396-L400 WeakPolarHBondContact O-CG 3.48Å; P396-L400 PolarHBondContact O-N 2.94Å; L400-I402 PolarHBondContact O-N 2.93Å; L400-L403 PolarHBondContact O-N 3.43Å; L400-T404 WeakPolarHBondContact O-CB 3.36Å; L400-T404 PolarHBondContact O-N 3.02Å; L400-T404 PolarHBondContact O-OG1 2.97Å; L400-M429 HydrophobicContact CD2-CB 4.29Å; L400-M429 HydrophobicContact CD2-CG 3.66Å; L400-M429 HydrophobicContact CD2-SD 4.47Å; L400-T467 HydrophobicContact CD1-CG2 4.14Å; L400-L470 HydrophobicContact CB-CB 3.87Å; L400-L470 HydrophobicContact CD1-CB 3.78Å; L400-L470 HydrophobicContact CG-CB 4.49Å; L400-A471 HydrophobicContact CD1-CB 4.31Å
401P93.6Very high90Very high0 Ų09.2 Ų9.20%06%0.058CC..Hα-helixtrans-60.1-43.7173-2838.7000113.5L77 Y85 L93 F397 T404 F405 L470L77-P401 HydrophobicContact CD1-CB 4.15Å; Y85-P401 HydrophobicContact CE2-CB 4.25Å; Y85-P401 HydrophobicContact CE2-CG 4.27Å; L93-P401 HydrophobicContact CD2-CG 4Å; F397-P401 WeakPolarHBondContact O-CD 3.47Å; F397-P401 WeakPolarHBondContact O-CG 3.43Å; P401-T404 WeakPolarHBondContact O-CB 3.46Å; P401-T404 PolarHBondContact O-N 2.84Å; P401-F405 HydrophobicContact CB-CD2 4.27Å; P401-F405 HydrophobicContact CB-CE2 4.03Å; P401-F405 WeakPolarHBondContact O-CD2 3.45Å; P401-F405 PolarHBondContact O-N 2.98Å; P401-L470 HydrophobicContact CG-CD2 4.41Å
402I93.4Very high89.8Confident0 Ų09.2 Ų9.20%06%0.058CC..Hα-helixtrans-68.6-38.4-178.3-169.761.5000112.2L65 A66 L69 L77 I213 A398 V399 L400 T404 T406L65-I402 HydrophobicContact CB-CG1 3.91Å; A66-I402 HydrophobicContact CB-CD1 4.4Å; A66-I402 HydrophobicContact CB-CG1 4.38Å; L69-I402 HydrophobicContact CB-CD1 3.71Å; L69-I402 HydrophobicContact CD2-CD1 3.55Å; L69-I402 HydrophobicContact CG-CD1 4.21Å; L77-I402 HydrophobicContact CD1-CB 4.31Å; L77-I402 HydrophobicContact CD1-CD1 4.13Å; L77-I402 HydrophobicContact CD2-CB 4.07Å; I213-I402 HydrophobicContact CG2-CB 4.32Å; I213-I402 HydrophobicContact CG2-CG2 4.04Å; A398-I402 WeakPolarHBondContact O-CG2 3.49Å; V399-I402 WeakPolarHBondContact O-CG2 3.37Å; V399-I402 PolarHBondContact O-N 3.31Å; L400-I402 PolarHBondContact O-N 2.93Å; I402-T404 VanDerWaalsContact C-N 3.32Å; I402-T404 PolarHBondContact O-N 3.44Å; I402-T406 HydrophobicContact CD1-CG2 3.68Å; I402-T406 HydrophobicContact CG1-CG2 4.13Å; I402-T406 WeakPolarHBondContact O-CB 3.45Å; I402-T406 VanDerWaalsContact O-CG2 3.3Å; I402-T406 WeakPolarHBondContact O-CG2 3.43Å; I402-T406 PolarHBondContact O-N 2.82Å; I402-T406 PolarHBondContact O-OG1 3.41Å
403L92.1Very high89.6Confident0 Ų015.1 Ų15.10%09%0.085CC..Hα-helixtrans-65.2-37.4173.9-59.8177000111.8L65 V399 L400 S407 T425 I428 M429L65-L403 HydrophobicContact CD1-CD2 3.77Å; V399-L403 HydrophobicContact CG1-CD1 3.52Å; V399-L403 HydrophobicContact CG1-CG 3.9Å; V399-L403 VanDerWaalsContact O-CG 3.25Å; V399-L403 WeakPolarHBondContact O-CG 3.24Å; V399-L403 PolarHBondContact O-N 3.36Å; L400-L403 PolarHBondContact O-N 3.43Å; L403-S407 VanDerWaalsContact O-CB 3.28Å; L403-S407 WeakPolarHBondContact O-CB 3.42Å; L403-S407 PolarHBondContact O-N 3.32Å; L403-S407 PolarHBondContact O-OG 3.29Å; L403-T425 HydrophobicContact CD2-CG2 3.47Å; L403-T425 VanDerWaalsContact CD2-CG2 3.47Å; L403-I428 HydrophobicContact CD1-CB 4.3Å; L403-I428 HydrophobicContact CD1-CG2 4.03Å; L403-M429 HydrophobicContact CD1-CB 3.99Å
404T90.8Very high89.3Confident0 Ų019.7 Ų19.70%011%0.106CC..Hα-helixtrans-62.2-63.6175.6-580000110.4L400 P401 I402 T406 S407 M408 C474 A477 F491L400-T404 WeakPolarHBondContact O-CB 3.36Å; L400-T404 PolarHBondContact O-N 3.02Å; L400-T404 PolarHBondContact O-OG1 2.97Å; P401-T404 WeakPolarHBondContact O-CB 3.46Å; P401-T404 PolarHBondContact O-N 2.84Å; I402-T404 VanDerWaalsContact C-N 3.32Å; I402-T404 PolarHBondContact O-N 3.44Å; T404-T406 PolarHBondContact O-N 2.83Å; T404-S407 PolarHBondContact O-N 3.23Å; T404-M408 HydrophobicContact CG2-SD 3.88Å; T404-M408 WeakPolarHBondContact O-CG 3.37Å; T404-M408 PolarHBondContact O-N 3.03Å; T404-C474 VanDerWaalsContact OG1-CA 3.22Å; T404-C474 WeakPolarHBondContact OG1-CA 3.5Å; T404-C474 WeakPolarHBondContact OG1-CB 3.29Å; T404-C474 PolarHBondContact OG1-N 3.38Å; T404-A477 HydrophobicContact CG2-CB 3.85Å; T404-F491 HydrophobicContact CG2-CE1 3.81Å; T404-F491 HydrophobicContact CG2-CZ 3.93Å
405F91Very high88.9Confident0 Ų021.9 Ų21.90%012%0.115CC..Hα-helixtrans-66.5-36.2-172.4-63.7-53.8000113.1L69 L77 V80 Y84 Y85 P401 S407 M408 V411 M412 F491L69-F405 HydrophobicContact CD1-CB 4.05Å; L69-F405 HydrophobicContact CD2-CB 4.45Å; L77-F405 HydrophobicContact CD1-CD2 3.95Å; V80-F405 HydrophobicContact CG1-CB 4.26Å; V80-F405 HydrophobicContact CG1-CD1 3.78Å; V80-F405 HydrophobicContact CG1-CD2 3.67Å; V80-F405 HydrophobicContact CG1-CE1 4.02Å; V80-F405 HydrophobicContact CG1-CE2 3.91Å; V80-F405 HydrophobicContact CG1-CG 3.62Å; V80-F405 HydrophobicContact CG1-CZ 4.08Å; Y84-F405 HydrophobicContact CD1-CE1 4.3Å; Y84-F405 HydrophobicContact CD2-CE1 4.01Å; Y84-F405 AromaticContact CG-CE1 3.7Å; Y84-F405 HydrophobicContact CG-CE1 3.7Å; Y84-F405 HydrophobicContact CG-CZ 4.34Å; Y85-F405 HydrophobicContact CD2-CZ 4.19Å; Y85-F405 AromaticContact CE2-CE2 3.8Å; Y85-F405 HydrophobicContact CE2-CE2 3.8Å; Y85-F405 AromaticContact CE2-CZ 3.66Å; Y85-F405 HydrophobicContact CE2-CZ 3.66Å; P401-F405 HydrophobicContact CB-CD2 4.27Å; P401-F405 HydrophobicContact CB-CE2 4.03Å; P401-F405 WeakPolarHBondContact O-CD2 3.45Å; P401-F405 PolarHBondContact O-N 2.98Å; F405-S407 PolarHBondContact O-N 3.47Å; F405-M408 HydrophobicContact CD1-SD 3.67Å; F405-M408 HydrophobicContact CE1-SD 4.16Å; F405-M408 PolarHBondContact O-N 3.29Å; F405-V411 HydrophobicContact CB-CG1 4.42Å; F405-V411 HydrophobicContact CD1-CG2 4.21Å; F405-M412 WeakPolarHBondContact O-CG 3.48Å; F405-F491 HydrophobicContact CE1-CE2 4.43Å; F405-F491 HydrophobicContact CE1-CZ 4.03Å
406T90.6Very high88.6Confident0 Ų023 Ų230%013%0.125CC..Hα-helixtrans-68.6-15.9175.859.10000114.1L65 L69 I402 T404 M412 N417L65-T406 HydrophobicContact CB-CG2 4.03Å; L65-T406 HydrophobicContact CD2-CG2 4.18Å; L65-T406 WeakPolarHBondContact O-CG2 3.29Å; L69-T406 HydrophobicContact CB-CG2 4.2Å; I402-T406 HydrophobicContact CD1-CG2 3.68Å; I402-T406 HydrophobicContact CG1-CG2 4.13Å; I402-T406 WeakPolarHBondContact O-CB 3.45Å; I402-T406 VanDerWaalsContact O-CG2 3.3Å; I402-T406 WeakPolarHBondContact O-CG2 3.43Å; I402-T406 PolarHBondContact O-N 2.82Å; I402-T406 PolarHBondContact O-OG1 3.41Å; T404-T406 PolarHBondContact O-N 2.83Å; T406-M412 HydrophobicContact CG2-CE 3.74Å; T406-M412 HydrophobicContact CG2-SD 4.33Å; T406-N417 VanDerWaalsContact O-CG 3.23Å; T406-N417 PolarHBondContact O-N 3.12Å; T406-N417 VanDerWaalsContact O-N 3.15Å; T406-N417 PolarHBondContact O-ND2 3.21Å; T406-N417 PolarHBondContact OG1-ND2 3.23Å; T406-N417 VanDerWaalsContact OG1-ND2 3.09Å
407S88.2Confident88.2Confident0 Ų023.3 Ų23.30%013%0.127CC..Hα-helixtrans-96.4-8.6177.7-60.50000114L403 T404 F405 P409 N417 K422 H478L403-S407 VanDerWaalsContact O-CB 3.28Å; L403-S407 WeakPolarHBondContact O-CB 3.42Å; L403-S407 PolarHBondContact O-N 3.32Å; L403-S407 PolarHBondContact O-OG 3.29Å; T404-S407 PolarHBondContact O-N 3.23Å; F405-S407 PolarHBondContact O-N 3.47Å; S407-P409 WeakPolarHBondContact O-CD 3.39Å; S407-N417 PolarHBondContact OG-ND2 3.39Å; S407-K422 WeakPolarHBondContact O-CE 3.25Å; S407-K422 PolarHBondContact O-NZ 2.91Å; S407-H478 PolarHBondContact OG-CD2 3.04Å; S407-H478 PolarHBondContact OG-NE2 3.28Å
408M85.4Confident87.7Confident9 Ų925.5 Ų25.54%0.04415%0.149CC..  trans-88.4118.4-179.3-71.3169.967.300112Y84 T404 F405 A410 V411 M412 A477 F491Y84-M408 HydrophobicContact CD1-CE 4.16Å; Y84-M408 HydrophobicContact CE1-CE 3.97Å; T404-M408 HydrophobicContact CG2-SD 3.88Å; T404-M408 WeakPolarHBondContact O-CG 3.37Å; T404-M408 PolarHBondContact O-N 3.03Å; F405-M408 HydrophobicContact CD1-SD 3.67Å; F405-M408 HydrophobicContact CE1-SD 4.16Å; F405-M408 PolarHBondContact O-N 3.29Å; M408-A410 VanDerWaalsContact C-N 3.26Å; M408-A410 PolarHBondContact O-N 3.47Å; M408-V411 HydrophobicContact CB-CB 4.33Å; M408-V411 HydrophobicContact CB-CG2 4.16Å; M408-V411 HydrophobicContact CE-CG2 4.17Å; M408-V411 PolarHBondContact O-N 3.43Å; M408-V411 HydrophobicContact SD-CG2 4.49Å; M408-M412 PolarHBondContact O-N 2.93Å; M408-A477 HydrophobicContact CG-CB 3.6Å; M408-A477 HydrophobicContact SD-CB 4.31Å; M408-F491 HydrophobicContact CE-CD1 3.82Å; M408-F491 HydrophobicContact CE-CE1 3.81Å; M408-F491 HydrophobicContact CE-CG 4.49Å; M408-F491 HydrophobicContact CE-CZ 4.47Å; M408-F491 WeakPolarHBondContact CE-O 3.37Å; M408-F491 HydrophobicContact SD-CD1 4.19Å; M408-F491 HydrophobicContact SD-CE1 3.6Å; M408-F491 HydrophobicContact SD-CZ 4.21Å
409P82.9Confident87.4Confident83 Ų8336.6 Ų36.654%0.53919%0.191SC..Hα-helixtrans-61.6-31.3175.1-23.635.2000113.6S407 V411 Q413S407-P409 WeakPolarHBondContact O-CD 3.39Å; P409-V411 PolarHBondContact O-N 2.83Å; P409-Q413 WeakPolarHBondContact O-CA 3.11Å; P409-Q413 PolarHBondContact O-N 3.2Å
410A82.6Confident87.1Confident31 Ų3143.8 Ų43.826%0.25623%0.226SC..Hα-helixtrans-62.6-29.4177.400000113.4M408 Q413M408-A410 VanDerWaalsContact C-N 3.26Å; M408-A410 PolarHBondContact O-N 3.47Å; A410-Q413 PolarHBondContact O-NE2 3Å; A410-Q413 VanDerWaalsContact O-NE2 3.17Å
411V85.1Confident86.7Confident15 Ų1545 Ų459%0.09124%0.235CC..Hα-helixtrans-93.3-48.5-179.9179.50000111L69 T73 Y84 F405 M408 P409L69-V411 HydrophobicContact CD1-CG1 3.73Å; T73-V411 HydrophobicContact CG2-CG1 3.57Å; Y84-V411 HydrophobicContact CE1-CG2 4.29Å; Y84-V411 HydrophobicContact CE2-CG2 3.84Å; F405-V411 HydrophobicContact CB-CG1 4.42Å; F405-V411 HydrophobicContact CD1-CG2 4.21Å; M408-V411 HydrophobicContact CB-CB 4.33Å; M408-V411 HydrophobicContact CB-CG2 4.16Å; M408-V411 HydrophobicContact CE-CG2 4.17Å; M408-V411 PolarHBondContact O-N 3.43Å; M408-V411 HydrophobicContact SD-CG2 4.49Å; P409-V411 PolarHBondContact O-N 2.83Å
412M85.3Confident86.3Confident0 Ų047.2 Ų47.20%025%0.245CC..Hα-helixtrans-93.5-6.1-171.7-60.5-70.2-87.500114.2R68 L69 V72 F405 T406 M408 E414 F415 A416R68-M412 HydrophobicContact CB-CE 4.45Å; R68-M412 HydrophobicContact CG-CE 3.71Å; L69-M412 HydrophobicContact CD1-SD 3.69Å; V72-M412 HydrophobicContact CB-SD 4.5Å; F405-M412 WeakPolarHBondContact O-CG 3.48Å; T406-M412 HydrophobicContact CG2-CE 3.74Å; T406-M412 HydrophobicContact CG2-SD 4.33Å; M408-M412 PolarHBondContact O-N 2.93Å; M412-E414 PolarHBondContact O-N 3.37Å; M412-F415 CarbonylContact O-C 3.56Å; M412-F415 WeakPolarHBondContact O-CA 3.47Å; M412-F415 WeakPolarHBondContact O-CB 3.46Å; M412-F415 PolarHBondContact O-N 2.91Å; M412-A416 HydrophobicContact CB-CB 4.19Å
413Q83.3Confident86Confident127 Ų12750.3 Ų50.359%0.59327%0.27SS*.G310 helixtrans52.7-135.4-177.2-58.1-63.2-33.600111.1P409 A410 F415 A416P409-Q413 WeakPolarHBondContact O-CA 3.11Å; P409-Q413 PolarHBondContact O-N 3.2Å; A410-Q413 PolarHBondContact O-NE2 3Å; A410-Q413 VanDerWaalsContact O-NE2 3.17Å; Q413-F415 PolarHBondContact O-N 3.05Å; Q413-A416 PolarHBondContact O-N 3.04Å
414E81.3Confident85.9Confident134 Ų13453.8 Ų53.863%0.62629%0.288SS*.G310 helixtrans-62-19.8175.3-62.2-178.5-17100113.4R230 M412 A416R230-E414 IonicContact CZ-OE1 3.53Å; R230-E414 IonicContact CZ-OE2 2.77Å; R230-E414 VanDerWaalsContact CZ-OE2 3.32Å; R230-E414 IonicContact NH1-OE1 2.67Å; R230-E414 PolarHBondContact NH1-OE1 2.84Å; R230-E414 IonicContact NH1-OE2 3.5Å; R230-E414 PolarHBondContact NH1-OE2 3.16Å; R230-E414 IonicContact NH2-OE1 3.83Å; R230-E414 PolarHBondContact NH2-OE1 2.96Å; R230-E414 IonicContact NH2-OE2 3.44Å; M412-E414 PolarHBondContact O-N 3.37Å; E414-A416 VanDerWaalsContact C-N 3.26Å; E414-A416 PolarHBondContact O-N 3.02Å
415F84.4Confident85.7Confident54 Ų5453.9 Ų53.924%0.23729%0.288CS..G310 helixtrans-87.326.4175.9-59.1-82.4000113R68 V72 V233 R234 M412 Q413R68-F415 VanDerWaalsContact CZ-O 3.31Å; R68-F415 PolarHBondContact NE-O 2.96Å; R68-F415 PolarHBondContact NH2-O 2.75Å; V72-F415 HydrophobicContact CG1-CB 4.31Å; V72-F415 HydrophobicContact CG1-CD2 4.22Å; V72-F415 HydrophobicContact CG2-CB 3.84Å; V72-F415 HydrophobicContact CG2-CD2 4.11Å; V72-F415 HydrophobicContact CG2-CG 4.01Å; V233-F415 HydrophobicContact CB-CE2 4.24Å; V233-F415 HydrophobicContact CB-CZ 4Å; V233-F415 HydrophobicContact CG1-CD2 4.16Å; V233-F415 HydrophobicContact CG1-CE1 4.11Å; V233-F415 HydrophobicContact CG1-CE2 3.6Å; V233-F415 HydrophobicContact CG1-CZ 3.57Å; R234-F415 HydrophobicContact CB-CE1 4.49Å; M412-F415 CarbonylContact O-C 3.56Å; M412-F415 WeakPolarHBondContact O-CA 3.47Å; M412-F415 WeakPolarHBondContact O-CB 3.46Å; M412-F415 PolarHBondContact O-N 2.91Å; Q413-F415 PolarHBondContact O-N 3.05Å
416A83.8Confident85.5Confident26 Ų2656.1 Ų56.122%0.21530%0.304CS..SBendtrans-68.2160.7172.500000113.4R68 M412 Q413 E414 G418R68-A416 PolarHBondContact NH2-O 3.35Å; M412-A416 HydrophobicContact CB-CB 4.19Å; Q413-A416 PolarHBondContact O-N 3.04Å; E414-A416 VanDerWaalsContact C-N 3.26Å; E414-A416 PolarHBondContact O-N 3.02Å; A416-G418 PolarHBondContact O-N 2.76Å
417N84Confident85.5Confident8 Ų860.3 Ų60.34%0.04333%0.332CS..PPolyproline II helixtrans-65.6122175.1-75.1-21.9000112.5R68 T406 S407 S421 K422R68-N417 PolarHBondContact NH1-OD1 3.41Å; T406-N417 VanDerWaalsContact O-CG 3.23Å; T406-N417 PolarHBondContact O-N 3.12Å; T406-N417 VanDerWaalsContact O-N 3.15Å; T406-N417 PolarHBondContact O-ND2 3.21Å; T406-N417 PolarHBondContact OG1-ND2 3.23Å; T406-N417 VanDerWaalsContact OG1-ND2 3.09Å; S407-N417 PolarHBondContact OG-ND2 3.39Å; N417-S421 PolarHBondContact OD1-OG 2.96Å; N417-K422 HydrophobicContact CB-CG 3.95Å; N417-K422 VanDerWaalsContact O-CE 3.23Å; N417-K422 WeakPolarHBondContact O-CE 3.45Å
418G84.8Confident85.6Confident47 Ų4760.8 Ų60.849%0.48534%0.335SS..PPolyproline II helixtrans-70.5168171.300000113.1A416 M420 S421 K422A416-G418 PolarHBondContact O-N 2.76Å; G418-M420 PolarHBondContact O-N 3.37Å; G418-S421 CarbonylContact O-C 3.59Å; G418-S421 WeakPolarHBondContact O-CA 3.43Å; G418-S421 WeakPolarHBondContact O-CB 3.45Å; G418-S421 PolarHBondContact O-N 3.46Å; G418-K422 PolarHBondContact O-N 2.81Å
419R85.2Confident85.8Confident234 Ų23461.2 Ų61.288%0.88334%0.337SS*.Hα-helixtrans-51.4-47-170.6-65.5-177.4-178.1172.80.6114.4S421 K422 A423R419-S421 PolarHBondContact O-N 2.85Å; R419-K422 PolarHBondContact O-N 3.07Å; R419-A423 PolarHBondContact O-N 2.95Å
420M87.1Confident86.1Confident151 Ų15160.1 Ų60.174%0.74434%0.335SS*.Hα-helixtrans-63.1-41.4177.1-174.1178.477.500112G418 K422 A423 I424G418-M420 PolarHBondContact O-N 3.37Å; M420-K422 VanDerWaalsContact C-N 3.34Å; M420-K422 PolarHBondContact O-N 2.76Å; M420-A423 PolarHBondContact O-N 3.46Å; M420-I424 HydrophobicContact CG-CD1 4.3Å; M420-I424 WeakPolarHBondContact O-CG1 3.46Å; M420-I424 PolarHBondContact O-N 2.91Å
421S85.2Confident86.4Confident25 Ų2562.7 Ų62.718%0.17534%0.344CS..Hα-helixtrans-64.4-39.2175.3-165.70000111.3N417 G418 R419 I424 T425N417-S421 PolarHBondContact OD1-OG 2.96Å; G418-S421 CarbonylContact O-C 3.59Å; G418-S421 WeakPolarHBondContact O-CA 3.43Å; G418-S421 WeakPolarHBondContact O-CB 3.45Å; G418-S421 PolarHBondContact O-N 3.46Å; R419-S421 PolarHBondContact O-N 2.85Å; S421-I424 PolarHBondContact O-N 3.14Å; S421-T425 WeakPolarHBondContact O-CG2 3.42Å; S421-T425 PolarHBondContact O-N 3.05Å; S421-T425 PolarHBondContact O-OG1 3.01Å
422K84.9Confident86.5Confident48 Ų4862.2 Ų62.221%0.20934%0.341CS..Hα-helixtrans-65-36.2175-68.6-163.1175.1-156.40112.9S407 N417 G418 R419 M420 T425 S426 A477S407-K422 WeakPolarHBondContact O-CE 3.25Å; S407-K422 PolarHBondContact O-NZ 2.91Å; N417-K422 HydrophobicContact CB-CG 3.95Å; N417-K422 VanDerWaalsContact O-CE 3.23Å; N417-K422 WeakPolarHBondContact O-CE 3.45Å; G418-K422 PolarHBondContact O-N 2.81Å; R419-K422 PolarHBondContact O-N 3.07Å; M420-K422 VanDerWaalsContact C-N 3.34Å; M420-K422 PolarHBondContact O-N 2.76Å; K422-T425 WeakPolarHBondContact CA-OG1 3.41Å; K422-T425 PolarHBondContact O-OG1 3.04Å; K422-T425 VanDerWaalsContact O-OG1 3.13Å; K422-S426 VanDerWaalsContact O-CB 3.24Å; K422-S426 WeakPolarHBondContact O-CB 3.48Å; K422-S426 PolarHBondContact O-N 3.31Å; K422-A477 PolarHBondContact NZ-O 3.42Å; K422-A477 VanDerWaalsContact NZ-O 3.09Å
423A88.5Confident86.6Confident65 Ų6563.8 Ų63.854%0.53735%0.352SS..Hα-helixtrans-64.3-44.8173.600000111.4R419 M420 S426 C427R419-A423 PolarHBondContact O-N 2.95Å; M420-A423 PolarHBondContact O-N 3.46Å; A423-S426 PolarHBondContact O-N 3.07Å; A423-C427 PolarHBondContact O-N 3.04Å
424I88.8Confident86.9Confident72 Ų7260.5 Ų60.537%0.36935%0.346SS..Hα-helixtrans-62.4-50.4175.6-65.3165.2000110.7L61 M420 S421 S426 C427 I428L61-I424 HydrophobicContact CD1-CG2 4.16Å; M420-I424 HydrophobicContact CG-CD1 4.3Å; M420-I424 WeakPolarHBondContact O-CG1 3.46Å; M420-I424 PolarHBondContact O-N 2.91Å; S421-I424 PolarHBondContact O-N 3.14Å; I424-S426 VanDerWaalsContact C-N 3.27Å; I424-S426 PolarHBondContact O-N 3.07Å; I424-C427 WeakPolarHBondContact O-CB 3.23Å; I424-C427 PolarHBondContact O-N 2.92Å; I424-C427 VanDerWaalsContact O-N 3.09Å; I424-I428 HydrophobicContact CG2-CD1 3.98Å; I424-I428 WeakPolarHBondContact O-CG1 3.43Å; I424-I428 PolarHBondContact O-N 3.43Å
425T86.7Confident87Confident2 Ų255.7 Ų55.71%0.01232%0.324CS..Hα-helixtrans-62.2-34.2178.456.90000112.3L65 L403 S421 K422 I428 M429 H478L65-T425 HydrophobicContact CD1-CG2 3.75Å; L403-T425 HydrophobicContact CD2-CG2 3.47Å; L403-T425 VanDerWaalsContact CD2-CG2 3.47Å; S421-T425 WeakPolarHBondContact O-CG2 3.42Å; S421-T425 PolarHBondContact O-N 3.05Å; S421-T425 PolarHBondContact O-OG1 3.01Å; K422-T425 WeakPolarHBondContact CA-OG1 3.41Å; K422-T425 PolarHBondContact O-OG1 3.04Å; K422-T425 VanDerWaalsContact O-OG1 3.13Å; T425-I428 PolarHBondContact O-N 3.25Å; T425-M429 WeakPolarHBondContact O-CB 3.02Å; T425-M429 PolarHBondContact O-N 3.16Å; T425-H478 PolarHBondContact OG1-CE1 2.94Å; T425-H478 VanDerWaalsContact OG1-CE1 3.26Å; T425-H478 PolarHBondContact OG1-NE2 3.12Å; T425-H478 VanDerWaalsContact OG1-NE2 3.1Å
426S88.1Confident87.1Confident48 Ų4853.3 Ų53.334%0.33631%0.314SS..Hα-helixtrans-68.8-34.3174.7-159.80000112.9K422 A423 I424 A430 H478K422-S426 VanDerWaalsContact O-CB 3.24Å; K422-S426 WeakPolarHBondContact O-CB 3.48Å; K422-S426 PolarHBondContact O-N 3.31Å; A423-S426 PolarHBondContact O-N 3.07Å; I424-S426 VanDerWaalsContact C-N 3.27Å; I424-S426 PolarHBondContact O-N 3.07Å; S426-A430 WeakPolarHBondContact O-CB 3.05Å; S426-A430 PolarHBondContact O-N 3.47Å; S426-H478 PolarHBondContact N-CE1 3.2Å
427C90.7Very high87.1Confident87 Ų8756.1 Ų56.159%0.58833%0.325SS*.Hα-helixtrans-66.2-44.9172.4-173.40000111.1A423 I424 M429 A430 L431A423-C427 PolarHBondContact O-N 3.04Å; I424-C427 WeakPolarHBondContact O-CB 3.23Å; I424-C427 PolarHBondContact O-N 2.92Å; I424-C427 VanDerWaalsContact O-N 3.09Å; C427-M429 PolarHBondContact O-N 2.85Å; C427-A430 PolarHBondContact O-N 2.98Å; C427-L431 WeakPolarHBondContact O-CB 3.36Å; C427-L431 PolarHBondContact O-N 3.08Å
428I89.2Confident87.2Confident11 Ų1160 Ų606%0.05634%0.34CS..Hα-helixtrans-59.1-47.9175.7-63.1171000111L58 L61 V399 L403 I424 T425 A430 L431 V432L58-I428 HydrophobicContact CD1-CB 4.21Å; L58-I428 HydrophobicContact CD1-CD1 3.44Å; L58-I428 VanDerWaalsContact CD1-CD1 3.44Å; L58-I428 HydrophobicContact CD1-CG1 3.44Å; L58-I428 VanDerWaalsContact CD1-CG1 3.44Å; L58-I428 HydrophobicContact CD1-CG2 3.77Å; L61-I428 HydrophobicContact CD1-CD1 4.4Å; V399-I428 HydrophobicContact CG1-CG2 3.96Å; L403-I428 HydrophobicContact CD1-CB 4.3Å; L403-I428 HydrophobicContact CD1-CG2 4.03Å; I424-I428 HydrophobicContact CG2-CD1 3.98Å; I424-I428 WeakPolarHBondContact O-CG1 3.43Å; I424-I428 PolarHBondContact O-N 3.43Å; T425-I428 PolarHBondContact O-N 3.25Å; I428-A430 VanDerWaalsContact C-N 3.34Å; I428-A430 PolarHBondContact O-N 3.49Å; I428-L431 PolarHBondContact O-N 3.1Å; I428-V432 HydrophobicContact CG2-CG2 4.25Å; I428-V432 WeakPolarHBondContact O-CB 3.3Å; I428-V432 WeakPolarHBondContact O-CG2 3.22Å; I428-V432 PolarHBondContact O-N 3.4Å
429M89.8Confident86.9Confident18 Ų1859.1 Ų59.19%0.08932%0.322CS..Hα-helixtrans-55.8-48175.4174.3-178.974.200111.6L400 L403 T425 C427 C433 C474L400-M429 HydrophobicContact CD2-CB 4.29Å; L400-M429 HydrophobicContact CD2-CG 3.66Å; L400-M429 HydrophobicContact CD2-SD 4.47Å; L403-M429 HydrophobicContact CD1-CB 3.99Å; T425-M429 WeakPolarHBondContact O-CB 3.02Å; T425-M429 PolarHBondContact O-N 3.16Å; C427-M429 PolarHBondContact O-N 2.85Å; M429-C433 WeakPolarHBondContact O-CB 3.37Å; M429-C433 PolarHBondContact O-N 3.41Å; M429-C433 PolarHBondContact O-SG 3.48Å; M429-C474 HydrophobicContact SD-CB 3.63Å; M429-C474 VanDerWaalsContact SD-SG 3.62Å
430A90.1Very high86.7Confident59 Ų5948.6 Ų48.649%0.48828%0.284SS..Hα-helixtrans-63.1-44.4179.500000112.1S426 C427 I428 A434S426-A430 WeakPolarHBondContact O-CB 3.05Å; S426-A430 PolarHBondContact O-N 3.47Å; C427-A430 PolarHBondContact O-N 2.98Å; I428-A430 VanDerWaalsContact C-N 3.34Å; I428-A430 PolarHBondContact O-N 3.49Å; A430-A434 WeakPolarHBondContact O-CB 3.5Å; A430-A434 PolarHBondContact O-N 3Å
431L88.4Confident86.4Confident86 Ų8646.4 Ų46.445%0.4527%0.274SS..Hα-helixtrans-61.1-50.9177.8179.264.6000111.8L58 C427 I428 C433 A434 I435L58-L431 HydrophobicContact CD2-CD2 4.4Å; C427-L431 WeakPolarHBondContact O-CB 3.36Å; C427-L431 PolarHBondContact O-N 3.08Å; I428-L431 PolarHBondContact O-N 3.1Å; L431-C433 PolarHBondContact O-N 2.87Å; L431-A434 PolarHBondContact O-N 3.26Å; L431-I435 HydrophobicContact CD1-CD1 3.87Å; L431-I435 HydrophobicContact CD1-CG1 4.32Å; L431-I435 HydrophobicContact CG-CD1 3.92Å; L431-I435 WeakPolarHBondContact O-CG1 3.41Å; L431-I435 PolarHBondContact O-N 2.04Å
432V87.6Confident86.1Confident5 Ų547 Ų473%0.0328%0.279CS..Hα-helixtrans-62.9-43.3-179.2168.80000111L395 P396 V399 I428 N436L395-V432 HydrophobicContact CD2-CG2 4.45Å; P396-V432 HydrophobicContact CB-CG1 3.92Å; P396-V432 HydrophobicContact CG-CG1 3.65Å; V399-V432 HydrophobicContact CG1-CG2 4.44Å; I428-V432 HydrophobicContact CG2-CG2 4.25Å; I428-V432 WeakPolarHBondContact O-CB 3.3Å; I428-V432 WeakPolarHBondContact O-CG2 3.22Å; I428-V432 PolarHBondContact O-N 3.4Å; V432-N436 WeakPolarHBondContact O-CB 3.4Å; V432-N436 PolarHBondContact O-N 3.21Å; V432-N436 PolarHBondContact O-ND2 2.89Å
433C87.6Confident85.6Confident33 Ų3348.8 Ų48.822%0.22329%0.285CS..Hα-helixtrans-65.5-39.5174.8-71.50000112.7M429 L431 L437M429-C433 WeakPolarHBondContact O-CB 3.37Å; M429-C433 PolarHBondContact O-N 3.41Å; M429-C433 PolarHBondContact O-SG 3.48Å; L431-C433 PolarHBondContact O-N 2.87Å; C433-L437 VanDerWaalsContact O-CB 3.26Å; C433-L437 WeakPolarHBondContact O-CB 3.18Å; C433-L437 PolarHBondContact O-N 2.9Å
434A88.3Confident84.8Confident57 Ų5747.4 Ų47.447%0.47127%0.268SS..Hα-helixtrans-66.7-46.1179.700000112.3A430 L431 N436 L437 Y438A430-A434 WeakPolarHBondContact O-CB 3.5Å; A430-A434 PolarHBondContact O-N 3Å; L431-A434 PolarHBondContact O-N 3.26Å; A434-N436 VanDerWaalsContact C-N 3.33Å; A434-N436 PolarHBondContact O-N 3.46Å; A434-L437 PolarHBondContact O-N 3.41Å; A434-Y438 VanDerWaalsContact O-CB 3.32Å; A434-Y438 WeakPolarHBondContact O-CB 3.45Å; A434-Y438 PolarHBondContact O-N 3.47Å
435I84.2Confident84Confident33 Ų3349 Ų4917%0.16928%0.284CS..Hα-helixtrans-56.8-48.1175.7-73.2168.6000110.6V201 L431 Y438 F439V201-I435 HydrophobicContact CB-CG2 4.38Å; V201-I435 HydrophobicContact CG1-CG2 3.78Å; V201-I435 HydrophobicContact CG2-CG2 3.64Å; L431-I435 HydrophobicContact CD1-CD1 3.87Å; L431-I435 HydrophobicContact CD1-CG1 4.32Å; L431-I435 HydrophobicContact CG-CD1 3.92Å; L431-I435 WeakPolarHBondContact O-CG1 3.41Å; L431-I435 PolarHBondContact O-N 2.04Å; I435-Y438 PolarHBondContact O-N 3.22Å; I435-F439 WeakPolarHBondContact O-CB 3.34Å; I435-F439 PolarHBondContact O-N 2.71Å
436N85.4Confident83.1Confident4 Ų450.7 Ų50.72%0.02130%0.295CS..Hα-helixtrans-71.8-36.8-176.4-80.1-80000113S392 L393 P396 V432 A434 F439 V440 Y463S392-N436 PolarHBondContact O-OD1 3.12Å; L393-N436 VanDerWaalsContact CA-OD1 3.26Å; L393-N436 WeakPolarHBondContact CA-OD1 3.5Å; L393-N436 PolarHBondContact O-OD1 3.45Å; P396-N436 HydrophobicContact CG-CB 4.16Å; P396-N436 VanDerWaalsContact CG-ND2 3.33Å; P396-N436 WeakPolarHBondContact CG-ND2 3.24Å; V432-N436 WeakPolarHBondContact O-CB 3.4Å; V432-N436 PolarHBondContact O-N 3.21Å; V432-N436 PolarHBondContact O-ND2 2.89Å; A434-N436 VanDerWaalsContact C-N 3.33Å; A434-N436 PolarHBondContact O-N 3.46Å; N436-F439 PolarHBondContact O-N 3.16Å; N436-V440 WeakPolarHBondContact O-CG2 3.07Å; N436-V440 PolarHBondContact O-N 2.93Å; N436-V440 VanDerWaalsContact O-N 3.07Å; N436-Y463 HydrophobicContact CB-CE1 4.49Å; N436-Y463 WeakPolarHBondContact CB-OH 3.27Å; N436-Y463 VanDerWaalsContact CG-OH 3.24Å; N436-Y463 PolarHBondContact OD1-OH 3.23Å
437L85.4Confident82.2Confident86 Ų8650 Ų5045%0.4529%0.288SS..Hα-helixtrans-64-44.4172.8-178.962.2000111.3C433 A434 V440 I441 L464C433-L437 VanDerWaalsContact O-CB 3.26Å; C433-L437 WeakPolarHBondContact O-CB 3.18Å; C433-L437 PolarHBondContact O-N 2.9Å; A434-L437 PolarHBondContact O-N 3.41Å; L437-V440 PolarHBondContact O-N 2.91Å; L437-I441 HydrophobicContact CD1-CD1 3.93Å; L437-I441 HydrophobicContact CD1-CG1 4.42Å; L437-I441 HydrophobicContact CG-CD1 3.87Å; L437-I441 WeakPolarHBondContact O-CB 3.39Å; L437-I441 VanDerWaalsContact O-CG1 3.27Å; L437-I441 WeakPolarHBondContact O-CG1 3.46Å; L437-I441 PolarHBondContact O-N 3.5Å; L437-L464 HydrophobicContact CD1-CD2 4.03Å
438Y84.5Confident81Confident90 Ų9050.4 Ų50.435%0.35329%0.289SS..Hα-helixtrans-59.8-46.6175.4177-92.9000111.7Q194 L197 A434 I435 V440 I441 S442Q194-Y438 PolarHBondContact NE2-OH 2.95Å; Q194-Y438 PolarHBondContact OE1-OH 3.34Å; L197-Y438 HydrophobicContact CD2-CD1 4.06Å; L197-Y438 HydrophobicContact CD2-CE1 3.37Å; L197-Y438 HydrophobicContact CD2-CE2 4.38Å; L197-Y438 HydrophobicContact CG-CE1 4.15Å; A434-Y438 VanDerWaalsContact O-CB 3.32Å; A434-Y438 WeakPolarHBondContact O-CB 3.45Å; A434-Y438 PolarHBondContact O-N 3.47Å; I435-Y438 PolarHBondContact O-N 3.22Å; Y438-V440 PolarHBondContact O-N 3.31Å; Y438-I441 PolarHBondContact O-N 3.37Å; Y438-S442 WeakPolarHBondContact O-CB 3.47Å; Y438-S442 PolarHBondContact O-N 3.43Å
439F78.9Confident80.2Confident27 Ų2755.6 Ų55.612%0.11831%0.313CS..Hα-helixtrans-58-49.1178.2-177-90.4000111.9L198 V389 L393 I435 N436 I441 S442 Y443L198-F439 HydrophobicContact CD2-CD2 3.71Å; L198-F439 HydrophobicContact CD2-CE2 3.59Å; V389-F439 HydrophobicContact CG1-CD2 4.28Å; V389-F439 HydrophobicContact CG1-CE1 4.17Å; V389-F439 HydrophobicContact CG1-CE2 3.29Å; V389-F439 HydrophobicContact CG1-CZ 3.23Å; L393-F439 HydrophobicContact CD1-CD1 3.92Å; L393-F439 HydrophobicContact CD1-CE1 4.35Å; I435-F439 WeakPolarHBondContact O-CB 3.34Å; I435-F439 PolarHBondContact O-N 2.71Å; N436-F439 PolarHBondContact O-N 3.16Å; F439-I441 VanDerWaalsContact C-N 3.34Å; F439-I441 PolarHBondContact O-N 2.91Å; F439-S442 PolarHBondContact O-N 3.31Å; F439-Y443 HydrophobicContact CE1-CG 4.38Å; F439-Y443 HydrophobicContact CZ-CD2 4.18Å; F439-Y443 HydrophobicContact CZ-CG 4.46Å; F439-Y443 VanDerWaalsContact O-CB 3.28Å; F439-Y443 WeakPolarHBondContact O-CB 3.17Å; F439-Y443 PolarHBondContact O-N 3.48Å
440V80.4Confident79.3Confident14 Ų1460.1 Ų60.19%0.08534%0.343CS..Hα-helixtrans-60.1-42.9177.9171.20000111.6L393 N436 L437 Y438 L444 A460 Y463 L464L393-V440 HydrophobicContact CD1-CG2 4.4Å; N436-V440 WeakPolarHBondContact O-CG2 3.07Å; N436-V440 PolarHBondContact O-N 2.93Å; N436-V440 VanDerWaalsContact O-N 3.07Å; L437-V440 PolarHBondContact O-N 2.91Å; Y438-V440 PolarHBondContact O-N 3.31Å; V440-L444 HydrophobicContact CG1-CD1 3.84Å; V440-L444 WeakPolarHBondContact O-CB 3.5Å; V440-L444 PolarHBondContact O-N 2.9Å; V440-L444 VanDerWaalsContact O-N 3.15Å; V440-A460 HydrophobicContact CG1-CB 3.98Å; V440-Y463 HydrophobicContact CG2-CD1 4.04Å; V440-Y463 HydrophobicContact CG2-CE1 4.01Å; V440-L464 HydrophobicContact CG1-CD1 4.14Å; V440-L464 HydrophobicContact CG1-CG 4.48Å
441I82.4Confident78.3Confident104 Ų10461.4 Ų61.453%0.53335%0.354SS..Hα-helixtrans-67.2-36.9178.7-68.9168.8000112.1L437 Y438 F439 P445L437-I441 HydrophobicContact CD1-CD1 3.93Å; L437-I441 HydrophobicContact CD1-CG1 4.42Å; L437-I441 HydrophobicContact CG-CD1 3.87Å; L437-I441 WeakPolarHBondContact O-CB 3.39Å; L437-I441 VanDerWaalsContact O-CG1 3.27Å; L437-I441 WeakPolarHBondContact O-CG1 3.46Å; L437-I441 PolarHBondContact O-N 3.5Å; Y438-I441 PolarHBondContact O-N 3.37Å; F439-I441 VanDerWaalsContact C-N 3.34Å; F439-I441 PolarHBondContact O-N 2.91Å; I441-P445 WeakPolarHBondContact O-CD 3.3Å; I441-P445 WeakPolarHBondContact O-CG 3.01Å
442S77.7Confident77.6Confident38 Ų3864.3 Ų64.327%0.26636%0.36SS..Hα-helixtrans-76.4-33.8178.1-165.10000112.6Q194 Y438 F439 P445Q194-S442 PolarHBondContact OE1-OG 2.94Å; Y438-S442 WeakPolarHBondContact O-CB 3.47Å; Y438-S442 PolarHBondContact O-N 3.43Å; F439-S442 PolarHBondContact O-N 3.31Å; S442-P445 WeakPolarHBondContact O-CD 2.98Å
443Y74.4Confident77.1Confident85 Ų8568.9 Ų68.933%0.33338%0.38SS..Hα-helixtrans-76.2-40.5-177.2-169.1-99.1000113F439 S446 L447F439-Y443 HydrophobicContact CE1-CG 4.38Å; F439-Y443 HydrophobicContact CZ-CD2 4.18Å; F439-Y443 HydrophobicContact CZ-CG 4.46Å; F439-Y443 VanDerWaalsContact O-CB 3.28Å; F439-Y443 WeakPolarHBondContact O-CB 3.17Å; F439-Y443 PolarHBondContact O-N 3.48Å; Y443-S446 PolarHBondContact O-N 3.14Å; Y443-S446 PolarHBondContact O-OG 2.98Å; Y443-L447 HydrophobicContact CE1-CD2 3.94Å
444L72.4Confident76.7Confident37 Ų3769.6 Ų69.619%0.19439%0.393CS..G310 helixtrans-53.5-45-178-91.2160.5000114.6V440 S446 F453 V456 A457 A460V440-L444 HydrophobicContact CG1-CD1 3.84Å; V440-L444 WeakPolarHBondContact O-CB 3.5Å; V440-L444 PolarHBondContact O-N 2.9Å; V440-L444 VanDerWaalsContact O-N 3.15Å; L444-S446 VanDerWaalsContact C-N 3.3Å; L444-S446 PolarHBondContact O-N 3.38Å; L444-F453 HydrophobicContact CD2-CE2 4.12Å; L444-F453 HydrophobicContact CD2-CZ 4.46Å; L444-V456 HydrophobicContact CD2-CG1 4.37Å; L444-A457 HydrophobicContact CD2-CB 4.31Å; L444-A460 HydrophobicContact CD1-CB 4.23Å
445P71.9Confident76.4Confident106 Ų10671.7 Ų71.769%0.68840%0.396SS*.G310 helixtrans-72.3-15.5177.1-20.333.9000115.3I441 S442 L447I441-P445 WeakPolarHBondContact O-CD 3.3Å; I441-P445 WeakPolarHBondContact O-CG 3.01Å; S442-P445 WeakPolarHBondContact O-CD 2.98Å; P445-L447 VanDerWaalsContact C-N 3.34Å
446S67.9Low76.3Confident37 Ų3771.8 Ų71.826%0.25940%0.398SS..G310 helixtrans-86-4.5-174.672.90000114.2Y443 L444Y443-S446 PolarHBondContact O-N 3.14Å; Y443-S446 PolarHBondContact O-OG 2.98Å; L444-S446 VanDerWaalsContact C-N 3.3Å; L444-S446 PolarHBondContact O-N 3.38Å
447L68.5Low76.1Confident33 Ų3372.6 Ų72.617%0.17341%0.405CS..  trans-70.4126.5-177.5-67.4171.7000112.1Y443 P445 H449 F453 V456Y443-L447 HydrophobicContact CE1-CD2 3.94Å; P445-L447 VanDerWaalsContact C-N 3.34Å; L447-H449 VanDerWaalsContact C-N 3.32Å; L447-H449 PolarHBondContact O-N 3.48Å; L447-F453 HydrophobicContact CD1-CD2 4.48Å; L447-V456 HydrophobicContact CD1-CB 3.69Å; L447-V456 HydrophobicContact CD1-CG1 3.85Å; L447-V456 HydrophobicContact CD1-CG2 3.86Å; L447-V456 HydrophobicContact CD2-CG2 4.39Å
448P65.2Low76.1Confident95 Ų9574.4 Ų74.462%0.61741%0.414SS*.SBendtrans-74.8-11.9-17028-35.9000115.4
449H72.4Confident76.2Confident121 Ų12177 Ų7756%0.5643%0.427SS*.  trans-139.8131.9-175.8-100-48.1000113L447 A451 Y452 F453L447-H449 VanDerWaalsContact C-N 3.32Å; L447-H449 PolarHBondContact O-N 3.48Å; H449-A451 PolarHBondContact O-N 3.33Å; H449-A451 VanDerWaalsContact O-N 3.16Å; H449-Y452 HydrophobicContact CB-CD2 3.72Å; H449-Y452 HydrophobicContact CB-CE2 4.2Å; H449-Y452 PolarHBondContact O-N 3.3Å; H449-Y452 VanDerWaalsContact O-N 3.15Å; H449-F453 PolarHBondContact O-N 3.4Å
450P70.8Confident76.5Confident112 Ų11276.2 Ų76.273%0.72743%0.426SS*.Hα-helixtrans-67.2-18.1-176.126.9-35.2000114.2F453P450-F453 WeakPolarHBondContact O-CB 3.19Å; P450-F453 PolarHBondContact O-N 3.49Å
451A70.1Confident76.8Confident86 Ų8681.3 Ų81.371%0.71145%0.452SS*.Hα-helixtrans-67.4-38.4173.700000112.4H449 F453H449-A451 PolarHBondContact O-N 3.33Å; H449-A451 VanDerWaalsContact O-N 3.16Å; A451-F453 VanDerWaalsContact C-N 3.33Å
452Y72.8Confident77.2Confident147 Ų14778.5 Ų78.558%0.57645%0.449SS*.Hα-helixtrans-74.9-26175.7-64.5-77.5000112.1H449 G454 L455 V456H449-Y452 HydrophobicContact CB-CD2 3.72Å; H449-Y452 HydrophobicContact CB-CE2 4.2Å; H449-Y452 PolarHBondContact O-N 3.3Å; H449-Y452 VanDerWaalsContact O-N 3.15Å; Y452-G454 VanDerWaalsContact C-N 3.32Å; Y452-G454 PolarHBondContact O-N 3.02Å; Y452-L455 PolarHBondContact O-N 3.17Å; Y452-V456 WeakPolarHBondContact O-CG2 3.38Å; Y452-V456 PolarHBondContact O-N 2.83Å
453F78.1Confident77.8Confident102 Ų10278 Ų7845%0.44744%0.441SS..Hα-helixtrans-55.6-44.2179-171.5-90.7000112.3L444 L447 H449 P450 A451 L455 A457L444-F453 HydrophobicContact CD2-CE2 4.12Å; L444-F453 HydrophobicContact CD2-CZ 4.46Å; L447-F453 HydrophobicContact CD1-CD2 4.48Å; H449-F453 PolarHBondContact O-N 3.4Å; P450-F453 WeakPolarHBondContact O-CB 3.19Å; P450-F453 PolarHBondContact O-N 3.49Å; A451-F453 VanDerWaalsContact C-N 3.33Å; F453-L455 PolarHBondContact O-N 2.96Å; F453-A457 WeakPolarHBondContact O-CB 3.02Å; F453-A457 PolarHBondContact O-N 3.33Å
454G79.2Confident78.6Confident48 Ų4877 Ų7750%0.49544%0.441SS..Hα-helixtrans-63.3-40.7178.900000113.6Y452 L458Y452-G454 VanDerWaalsContact C-N 3.32Å; Y452-G454 PolarHBondContact O-N 3.02Å; G454-L458 PolarHBondContact O-N 2.84Å; G454-L458 VanDerWaalsContact O-N 3.1Å
455L81Confident79.5Confident101 Ų10177.2 Ų77.253%0.52945%0.453SS..Hα-helixtrans-72.5-45.3179.1-178.5132.1000111.7Y452 F453 L458 F459Y452-L455 PolarHBondContact O-N 3.17Å; F453-L455 PolarHBondContact O-N 2.96Å; L455-L458 WeakPolarHBondContact O-CB 3.4Å; L455-L458 PolarHBondContact O-N 3.48Å; L455-F459 HydrophobicContact CD2-CD2 3.92Å; L455-F459 HydrophobicContact CD2-CE2 3.76Å; L455-F459 HydrophobicContact CG-CD2 4.12Å; L455-F459 HydrophobicContact CG-CE2 3.91Å; L455-F459 VanDerWaalsContact O-CD2 3.24Å; L455-F459 WeakPolarHBondContact O-CD2 3.45Å; L455-F459 PolarHBondContact O-N 3.03Å; L455-F459 VanDerWaalsContact O-N 3.09Å
456V81.9Confident80.5Confident35 Ų3573 Ų7321%0.21242%0.424CS..Hα-helixtrans-66.9-36.8176.6178.90000111.3L444 L447 Y452 L458 F459 A460L444-V456 HydrophobicContact CD2-CG1 4.37Å; L447-V456 HydrophobicContact CD1-CB 3.69Å; L447-V456 HydrophobicContact CD1-CG1 3.85Å; L447-V456 HydrophobicContact CD1-CG2 3.86Å; L447-V456 HydrophobicContact CD2-CG2 4.39Å; Y452-V456 WeakPolarHBondContact O-CG2 3.38Å; Y452-V456 PolarHBondContact O-N 2.83Å; V456-L458 PolarHBondContact O-N 2.77Å; V456-F459 PolarHBondContact O-N 2.03Å; V456-A460 VanDerWaalsContact O-CB 3.32Å; V456-A460 WeakPolarHBondContact O-CB 3.16Å; V456-A460 PolarHBondContact O-N 2.86Å
457A81.3Confident81.5Confident21 Ų2171.7 Ų71.717%0.17442%0.415CS..Hα-helixtrans-62.8-39.4173.200000112.2L444 F453 A460 I461L444-A457 HydrophobicContact CD2-CB 4.31Å; F453-A457 WeakPolarHBondContact O-CB 3.02Å; F453-A457 PolarHBondContact O-N 3.33Å; A457-A460 PolarHBondContact O-N 3.24Å; A457-I461 WeakPolarHBondContact O-CB 3.48Å; A457-I461 WeakPolarHBondContact O-CD1 3.17Å; A457-I461 VanDerWaalsContact O-CG1 3.23Å; A457-I461 WeakPolarHBondContact O-CG1 3.26Å; A457-I461 PolarHBondContact O-N 3.29Å
458L85.8Confident82.6Confident124 Ų12473 Ų7365%0.64943%0.431SS*.Hα-helixtrans-60.9-47173.8-17376.9000111.5G454 L455 V456 I461 G462G454-L458 PolarHBondContact O-N 2.84Å; G454-L458 VanDerWaalsContact O-N 3.1Å; L455-L458 WeakPolarHBondContact O-CB 3.4Å; L455-L458 PolarHBondContact O-N 3.48Å; V456-L458 PolarHBondContact O-N 2.77Å; L458-I461 PolarHBondContact O-N 2.79Å; L458-G462 PolarHBondContact O-N 2.92Å
459F86.4Confident83.8Confident143 Ų14371.1 Ų71.163%0.62741%0.412SS*.Hα-helixtrans-62.9-41.7175.4-80.1-67.9000112.3L455 V456 I461 G462 Y463L455-F459 HydrophobicContact CD2-CD2 3.92Å; L455-F459 HydrophobicContact CD2-CE2 3.76Å; L455-F459 HydrophobicContact CG-CD2 4.12Å; L455-F459 HydrophobicContact CG-CE2 3.91Å; L455-F459 VanDerWaalsContact O-CD2 3.24Å; L455-F459 WeakPolarHBondContact O-CD2 3.45Å; L455-F459 PolarHBondContact O-N 3.03Å; L455-F459 VanDerWaalsContact O-N 3.09Å; V456-F459 PolarHBondContact O-N 2.03Å; F459-I461 PolarHBondContact O-N 3.38Å; F459-G462 PolarHBondContact O-N 3.38Å; F459-Y463 VanDerWaalsContact O-CB 3.25Å; F459-Y463 WeakPolarHBondContact O-CB 3.45Å; F459-Y463 PolarHBondContact O-N 3.36Å
460A85.9Confident84.7Confident12 Ų1265.4 Ų65.410%0.09939%0.385CS..Hα-helixtrans-63.3-39.7176.200000112.2V440 L444 V456 A457 Y463 L464V440-A460 HydrophobicContact CG1-CB 3.98Å; L444-A460 HydrophobicContact CD1-CB 4.23Å; V456-A460 VanDerWaalsContact O-CB 3.32Å; V456-A460 WeakPolarHBondContact O-CB 3.16Å; V456-A460 PolarHBondContact O-N 2.86Å; A457-A460 PolarHBondContact O-N 3.24Å; A460-Y463 PolarHBondContact O-N 2.82Å; A460-L464 VanDerWaalsContact O-CB 3.3Å; A460-L464 WeakPolarHBondContact O-CB 3.49Å; A460-L464 VanDerWaalsContact O-CG 3.24Å; A460-L464 WeakPolarHBondContact O-CG 3.28Å; A460-L464 PolarHBondContact O-N 3.43Å
461I87.5Confident85.6Confident120 Ų12060.9 Ų60.962%0.61536%0.358SS*.Hα-helixtrans-64.4-44.9174.1-70.3163000110.7A457 L458 F459 G465A457-I461 WeakPolarHBondContact O-CB 3.48Å; A457-I461 WeakPolarHBondContact O-CD1 3.17Å; A457-I461 VanDerWaalsContact O-CG1 3.23Å; A457-I461 WeakPolarHBondContact O-CG1 3.26Å; A457-I461 PolarHBondContact O-N 3.29Å; L458-I461 PolarHBondContact O-N 2.79Å; F459-I461 PolarHBondContact O-N 3.38Å; I461-G465 PolarHBondContact O-N 3.46Å
462G89.8Confident86.4Confident46 Ų4662.2 Ų62.247%0.47434%0.344SS..Hα-helixtrans-62-44.3176.200000112.6L458 F459 G465 L466L458-G462 PolarHBondContact O-N 2.92Å; F459-G462 PolarHBondContact O-N 3.38Å; G462-G465 PolarHBondContact O-N 3.41Å; G462-L466 PolarHBondContact O-N 3.2Å
463Y90.8Very high87Confident27 Ų2755.5 Ų55.511%0.10632%0.319CS..Hα-helixtrans-59.1-55.1174.8174.5-88.3000111.8L393 F397 N436 V440 F459 A460 G465 L466 T467L393-Y463 HydrophobicContact CD1-CD2 4.43Å; L393-Y463 HydrophobicContact CD1-CE1 4.08Å; L393-Y463 HydrophobicContact CD1-CE2 3.72Å; L393-Y463 HydrophobicContact CG-CD2 4.41Å; L393-Y463 HydrophobicContact CG-CE2 3.73Å; L393-Y463 VanDerWaalsContact O-CE2 3.23Å; L393-Y463 WeakPolarHBondContact O-CE2 3.24Å; L393-Y463 PolarHBondContact O-OH 3.39Å; F397-Y463 AromaticContact CE2-CD2 3.69Å; F397-Y463 HydrophobicContact CE2-CD2 3.69Å; F397-Y463 AromaticContact CE2-CE2 3.43Å; F397-Y463 HydrophobicContact CE2-CE2 3.43Å; F397-Y463 VanDerWaalsContact CE2-CE2 3.43Å; F397-Y463 AromaticContact CZ-CD2 3.46Å; F397-Y463 HydrophobicContact CZ-CD2 3.46Å; F397-Y463 VanDerWaalsContact CZ-CD2 3.46Å; F397-Y463 AromaticContact CZ-CE2 3.43Å; F397-Y463 HydrophobicContact CZ-CE2 3.43Å; F397-Y463 VanDerWaalsContact CZ-CE2 3.43Å; F397-Y463 HydrophobicContact CZ-CG 4.34Å; N436-Y463 HydrophobicContact CB-CE1 4.49Å; N436-Y463 WeakPolarHBondContact CB-OH 3.27Å; N436-Y463 VanDerWaalsContact CG-OH 3.24Å; N436-Y463 PolarHBondContact OD1-OH 3.23Å; V440-Y463 HydrophobicContact CG2-CD1 4.04Å; V440-Y463 HydrophobicContact CG2-CE1 4.01Å; F459-Y463 VanDerWaalsContact O-CB 3.25Å; F459-Y463 WeakPolarHBondContact O-CB 3.45Å; F459-Y463 PolarHBondContact O-N 3.36Å; A460-Y463 PolarHBondContact O-N 2.82Å; Y463-G465 VanDerWaalsContact C-N 3.31Å; Y463-G465 PolarHBondContact O-N 2.91Å; Y463-L466 PolarHBondContact O-N 3.41Å; Y463-T467 WeakPolarHBondContact O-CB 3.49Å; Y463-T467 PolarHBondContact O-N 3.11Å; Y463-T467 PolarHBondContact O-OG1 3.37Å; Y463-T467 VanDerWaalsContact O-OG1 3.11Å
464L90.6Very high87.3Confident63 Ų6350.7 Ų50.733%0.3330%0.297SS..Hα-helixtrans-63.5-37.2-179.8-71.2174.4000111.5L437 V440 A460 A468L437-L464 HydrophobicContact CD1-CD2 4.03Å; V440-L464 HydrophobicContact CG1-CD1 4.14Å; V440-L464 HydrophobicContact CG1-CG 4.48Å; A460-L464 VanDerWaalsContact O-CB 3.3Å; A460-L464 WeakPolarHBondContact O-CB 3.49Å; A460-L464 VanDerWaalsContact O-CG 3.24Å; A460-L464 WeakPolarHBondContact O-CG 3.28Å; A460-L464 PolarHBondContact O-N 3.43Å; L464-A468 WeakPolarHBondContact O-CB 3.41Å; L464-A468 PolarHBondContact O-N 3.43Å
465G91.5Very high87.6Confident43 Ų4350.3 Ų50.344%0.44329%0.287SS..Hα-helixtrans-62.9-44.5175.100000112.9I461 G462 Y463 Y469I461-G465 PolarHBondContact O-N 3.46Å; G462-G465 PolarHBondContact O-N 3.41Å; Y463-G465 VanDerWaalsContact C-N 3.31Å; Y463-G465 PolarHBondContact O-N 2.91Å; G465-Y469 WeakPolarHBondContact O-CB 3.16Å; G465-Y469 PolarHBondContact O-N 3.13Å
466L92.3Very high87.6Confident16 Ų1646.1 Ų46.18%0.08427%0.265CS..Hα-helixtrans-67.6-45.1176.2-17661.6000111.6P89 L92 F397 G462 Y463 A468 Y469 L470P89-L466 HydrophobicContact CB-CD1 4.2Å; L92-L466 HydrophobicContact CB-CD1 4.49Å; L92-L466 HydrophobicContact CB-CD2 3.86Å; F397-L466 HydrophobicContact CD1-CD2 3.94Å; F397-L466 HydrophobicContact CD1-CG 4.18Å; F397-L466 HydrophobicContact CE1-CB 4.07Å; F397-L466 HydrophobicContact CE1-CD2 3.55Å; F397-L466 HydrophobicContact CE1-CG 3.69Å; F397-L466 HydrophobicContact CZ-CD2 4.11Å; G462-L466 PolarHBondContact O-N 3.2Å; Y463-L466 PolarHBondContact O-N 3.41Å; L466-A468 PolarHBondContact O-N 2.91Å; L466-Y469 PolarHBondContact O-N 2.84Å; L466-L470 HydrophobicContact CG-CD1 4.43Å; L466-L470 WeakPolarHBondContact O-CG 3.37Å; L466-L470 PolarHBondContact O-N 3.36Å
467T90.9Very high87.4Confident11 Ų1145 Ų457%0.06726%0.259CS..Hα-helixtrans-62.5-42.3177.3-62.60000111.5P396 F397 L400 Y463 L470 A471P396-T467 HydrophobicContact CB-CG2 4.14Å; F397-T467 WeakPolarHBondContact CE1-OG1 3.25Å; L400-T467 HydrophobicContact CD1-CG2 4.14Å; Y463-T467 WeakPolarHBondContact O-CB 3.49Å; Y463-T467 PolarHBondContact O-N 3.11Å; Y463-T467 PolarHBondContact O-OG1 3.37Å; Y463-T467 VanDerWaalsContact O-OG1 3.11Å; T467-L470 PolarHBondContact O-N 3.08Å; T467-A471 VanDerWaalsContact O-CB 3.28Å; T467-A471 WeakPolarHBondContact O-CB 3.49Å; T467-A471 PolarHBondContact O-N 2.94Å
468A90.8Very high87.3Confident61 Ų6145.8 Ų45.850%0.50426%0.259SS..Hα-helixtrans-64.6-40.717500000112.2L464 L466 A471 W472L464-A468 WeakPolarHBondContact O-CB 3.41Å; L464-A468 PolarHBondContact O-N 3.43Å; L466-A468 PolarHBondContact O-N 2.91Å; A468-A471 PolarHBondContact O-N 3.36Å; A468-W472 WeakPolarHBondContact O-CB 3.34Å; A468-W472 PolarHBondContact O-N 3.02Å
469Y90.8Very high86.5Confident54 Ų5442.1 Ų42.121%0.21225%0.252CS..Hα-helixtrans-60.5-46.6173.9172.2-100.1000111.9Y85 P86 P89 G465 L466 W472 T473Y85-Y469 AromaticContact CD1-CE1 3.84Å; Y85-Y469 HydrophobicContact CD1-CE1 3.84Å; Y85-Y469 AromaticContact CE1-CE1 3.98Å; Y85-Y469 HydrophobicContact CE1-CE1 3.98Å; P86-Y469 WeakPolarHBondContact CD-OH 3.3Å; P89-Y469 HydrophobicContact CB-CD1 4.09Å; P89-Y469 HydrophobicContact CB-CE1 3.68Å; P89-Y469 HydrophobicContact CG-CD1 4.14Å; P89-Y469 HydrophobicContact CG-CE1 3.71Å; G465-Y469 WeakPolarHBondContact O-CB 3.16Å; G465-Y469 PolarHBondContact O-N 3.13Å; L466-Y469 PolarHBondContact O-N 2.84Å; Y469-W472 WeakPolarHBondContact O-CB 2.98Å; Y469-W472 PolarHBondContact O-N 3.16Å; Y469-T473 HydrophobicContact CE1-CG2 4.46Å; Y469-T473 HydrophobicContact CE2-CG2 4.38Å; Y469-T473 PolarHBondContact O-N 2.96Å
470L90.4Very high85.8Confident1 Ų137.1 Ų37.11%0.00524%0.237CC..Hα-helixtrans-66.1-44.8178.2-66.5176.4000111.7Y85 F397 L400 P401 L466 T467 W472 T473 C474Y85-L470 HydrophobicContact CE1-CD2 3.79Å; Y85-L470 HydrophobicContact CE2-CD2 4.07Å; Y85-L470 VanDerWaalsContact CZ-CD2 3.5Å; Y85-L470 WeakPolarHBondContact OH-CD2 3.38Å; F397-L470 HydrophobicContact CD1-CD1 3.75Å; F397-L470 HydrophobicContact CE1-CD1 4.43Å; L400-L470 HydrophobicContact CB-CB 3.87Å; L400-L470 HydrophobicContact CD1-CB 3.78Å; L400-L470 HydrophobicContact CG-CB 4.49Å; P401-L470 HydrophobicContact CG-CD2 4.41Å; L466-L470 HydrophobicContact CG-CD1 4.43Å; L466-L470 WeakPolarHBondContact O-CG 3.37Å; L466-L470 PolarHBondContact O-N 3.36Å; T467-L470 PolarHBondContact O-N 3.08Å; L470-W472 VanDerWaalsContact C-N 3.3Å; L470-W472 PolarHBondContact O-N 3.4Å; L470-T473 PolarHBondContact O-N 3.35Å; L470-T473 VanDerWaalsContact O-N 3.15Å; L470-T473 PolarHBondContact O-OG1 3.38Å; L470-C474 PolarHBondContact O-N 2.96Å
471A89.3Confident84.5Confident18 Ų1841 Ų4115%0.14926%0.259CS..Hα-helixtrans-60.2-40.117600000111.8L400 T467 A468 C474 C475L400-A471 HydrophobicContact CD1-CB 4.31Å; T467-A471 VanDerWaalsContact O-CB 3.28Å; T467-A471 WeakPolarHBondContact O-CB 3.49Å; T467-A471 PolarHBondContact O-N 2.94Å; A468-A471 PolarHBondContact O-N 3.36Å; A471-C474 WeakPolarHBondContact O-CB 3.29Å; A471-C474 PolarHBondContact O-N 3.16Å; A471-C475 PolarHBondContact O-N 3.07Å; A471-C475 PolarHBondContact O-SG 3.07Å; A471-C475 VanDerWaalsContact O-SG 3.36Å
472W88.3Confident83.2Confident114 Ų11444.7 Ų44.743%0.43227%0.271SS..Hα-helixtrans-60-45.7173-179.8-95.2000112.3A468 Y469 L470 C474 C475 I476 L483A468-W472 WeakPolarHBondContact O-CB 3.34Å; A468-W472 PolarHBondContact O-N 3.02Å; Y469-W472 WeakPolarHBondContact O-CB 2.98Å; Y469-W472 PolarHBondContact O-N 3.16Å; L470-W472 VanDerWaalsContact C-N 3.3Å; L470-W472 PolarHBondContact O-N 3.4Å; W472-C474 VanDerWaalsContact C-N 3.3Å; W472-C474 PolarHBondContact O-N 3.27Å; W472-C475 PolarHBondContact O-N 2.95Å; W472-I476 WeakPolarHBondContact O-CG1 3.5Å; W472-I476 PolarHBondContact O-N 3.28Å; W472-I476 VanDerWaalsContact O-N 3.07Å; W472-L483 HydrophobicContact CE3-CD1 4.05Å; W472-L483 HydrophobicContact CH2-CB 3.69Å; W472-L483 HydrophobicContact CH2-CD1 4.28Å; W472-L483 HydrophobicContact CH2-CD2 3.65Å; W472-L483 HydrophobicContact CH2-CG 4.04Å; W472-L483 HydrophobicContact CZ2-CB 3.66Å; W472-L483 HydrophobicContact CZ2-CD2 4.49Å; W472-L483 HydrophobicContact CZ2-CG 4.49Å; W472-L483 WeakPolarHBondContact CZ2-O 3.28Å; W472-L483 HydrophobicContact CZ3-CB 4.16Å; W472-L483 HydrophobicContact CZ3-CD1 3.88Å; W472-L483 HydrophobicContact CZ3-CD2 3.77Å; W472-L483 HydrophobicContact CZ3-CG 4.13Å
473T84.9Confident81.8Confident6 Ų644.8 Ų44.84%0.03726%0.26CS..Hα-helixtrans-63.1-35.4174.760.30000112.7Y85 Y469 L470 I476 A477 F491Y85-T473 HydrophobicContact CE1-CG2 4.27Å; Y85-T473 PolarHBondContact OH-OG1 2.87Å; Y469-T473 HydrophobicContact CE1-CG2 4.46Å; Y469-T473 HydrophobicContact CE2-CG2 4.38Å; Y469-T473 PolarHBondContact O-N 2.96Å; L470-T473 PolarHBondContact O-N 3.35Å; L470-T473 VanDerWaalsContact O-N 3.15Å; L470-T473 PolarHBondContact O-OG1 3.38Å; T473-I476 PolarHBondContact O-N 3.31Å; T473-A477 PolarHBondContact O-N 2.86Å; T473-F491 HydrophobicContact CG2-CZ 4.29Å
474C84.9Confident80.1Confident0 Ų046.7 Ų46.70%028%0.275CS..Hα-helixtrans-67.4-42.7175.4-163.80000112.2T404 M429 L470 A471 W472 I476 A477 H478T404-C474 VanDerWaalsContact OG1-CA 3.22Å; T404-C474 WeakPolarHBondContact OG1-CA 3.5Å; T404-C474 WeakPolarHBondContact OG1-CB 3.29Å; T404-C474 PolarHBondContact OG1-N 3.38Å; M429-C474 HydrophobicContact SD-CB 3.63Å; M429-C474 VanDerWaalsContact SD-SG 3.62Å; L470-C474 PolarHBondContact O-N 2.96Å; A471-C474 WeakPolarHBondContact O-CB 3.29Å; A471-C474 PolarHBondContact O-N 3.16Å; W472-C474 VanDerWaalsContact C-N 3.3Å; W472-C474 PolarHBondContact O-N 3.27Å; C474-I476 VanDerWaalsContact C-N 3.33Å; C474-I476 PolarHBondContact O-N 3.32Å; C474-A477 PolarHBondContact O-N 3.33Å; C474-H478 PolarHBondContact O-N 3.34Å
475C84.8Confident78.3Confident40 Ų4050.7 Ų50.727%0.2729%0.292SS..Hα-helixtrans-59-42.1174.1-73.40000112.2A471 W472 H478 G479 A480 L483A471-C475 PolarHBondContact O-N 3.07Å; A471-C475 PolarHBondContact O-SG 3.07Å; A471-C475 VanDerWaalsContact O-SG 3.36Å; W472-C475 PolarHBondContact O-N 2.95Å; C475-H478 PolarHBondContact O-N 3.11Å; C475-G479 PolarHBondContact O-N 3.09Å; C475-A480 HydrophobicContact CB-CB 4.46Å; C475-A480 WeakPolarHBondContact O-CB 3.47Å; C475-A480 PolarHBondContact O-N 2.64Å; C475-A480 VanDerWaalsContact O-N 3.1Å; C475-L483 HydrophobicContact CB-CD1 4.12Å
476I81.8Confident76.3Confident13 Ų1352.9 Ų52.97%0.06730%0.3CS..Hα-helixtrans-61.3-47.4174.4-70.4170.7000110.6W472 T473 C474 H478 G479 L483 T484 L492W472-I476 WeakPolarHBondContact O-CG1 3.5Å; W472-I476 PolarHBondContact O-N 3.28Å; W472-I476 VanDerWaalsContact O-N 3.07Å; T473-I476 PolarHBondContact O-N 3.31Å; C474-I476 VanDerWaalsContact C-N 3.33Å; C474-I476 PolarHBondContact O-N 3.32Å; I476-H478 VanDerWaalsContact C-N 3.28Å; I476-H478 PolarHBondContact O-N 2.64Å; I476-G479 PolarHBondContact O-N 2.86Å; I476-L483 HydrophobicContact CG1-CB 4.09Å; I476-T484 HydrophobicContact CG1-CG2 4.45Å; I476-T484 HydrophobicContact CG2-CG2 3.98Å; I476-L492 HydrophobicContact CG2-CD1 3.43Å; I476-L492 VanDerWaalsContact CG2-CD1 3.43Å
477A78Confident74.3Confident11 Ų1156.7 Ų56.79%0.09133%0.328CS..Hα-helixtrans-64-28.3177.100000114.1T404 M408 K422 T473 C474 G479T404-A477 HydrophobicContact CG2-CB 3.85Å; M408-A477 HydrophobicContact CG-CB 3.6Å; M408-A477 HydrophobicContact SD-CB 4.31Å; K422-A477 PolarHBondContact NZ-O 3.42Å; K422-A477 VanDerWaalsContact NZ-O 3.09Å; T473-A477 PolarHBondContact O-N 2.86Å; C474-A477 PolarHBondContact O-N 3.33Å; A477-G479 VanDerWaalsContact C-N 3.28Å
478H78.3Confident72.4Confident38 Ų3860 Ų6018%0.17634%0.343CS..Hα-helixtrans-73.9-17.5173.4-75.9-170.9000113.2S407 T425 S426 C474 C475 I476S407-H478 PolarHBondContact OG-CD2 3.04Å; S407-H478 PolarHBondContact OG-NE2 3.28Å; T425-H478 PolarHBondContact OG1-CE1 2.94Å; T425-H478 VanDerWaalsContact OG1-CE1 3.26Å; T425-H478 PolarHBondContact OG1-NE2 3.12Å; T425-H478 VanDerWaalsContact OG1-NE2 3.1Å; S426-H478 PolarHBondContact N-CE1 3.2Å; C474-H478 PolarHBondContact O-N 3.34Å; C475-H478 PolarHBondContact O-N 3.11Å; I476-H478 VanDerWaalsContact C-N 3.28Å; I476-H478 PolarHBondContact O-N 2.64Å
479G69.3Low70.4Confident48 Ų4864 Ų6450%0.49535%0.349SS..THydrogen-bonded Turntrans119.511.4173.300000115.2C475 I476 A477 T481C475-G479 PolarHBondContact O-N 3.09Å; I476-G479 PolarHBondContact O-N 2.86Å; A477-G479 VanDerWaalsContact C-N 3.28Å; G479-T481 PolarHBondContact O-N 2.95Å
480A70.5Confident68.5Low38 Ų3865.6 Ų65.631%0.31436%0.358SS..  trans-74.764.717500000111.6C475 F482 L483C475-A480 HydrophobicContact CB-CB 4.46Å; C475-A480 WeakPolarHBondContact O-CB 3.47Å; C475-A480 PolarHBondContact O-N 2.64Å; C475-A480 VanDerWaalsContact O-N 3.1Å; A480-F482 PolarHBondContact O-N 3.02Å; A480-F482 VanDerWaalsContact O-N 3.16Å; A480-L483 HydrophobicContact CB-CD1 3.8Å; A480-L483 HydrophobicContact CB-CG 4.08Å; A480-L483 WeakPolarHBondContact O-CB 3.38Å; A480-L483 PolarHBondContact O-N 2.78Å
481T60.1Low66.6Low93 Ų9366.5 Ų66.557%0.57136%0.362SS*.G310 helixtrans-62.9-20.7-175.251.20000113.9G479 L483 T484G479-T481 PolarHBondContact O-N 2.95Å; T481-L483 PolarHBondContact O-N 2.87Å; T481-L483 VanDerWaalsContact O-N 3.14Å; T481-T484 PolarHBondContact O-N 2.87Å; T481-T484 VanDerWaalsContact O-N 3.12Å; T481-T484 PolarHBondContact O-OG1 2.94Å
482F59.5Low64.7Low197 Ų19769.3 Ų69.386%0.86437%0.374SS*.G310 helixtrans-57.3-24.4170.2-177.5-104.9000113.2A480 T484A480-F482 PolarHBondContact O-N 3.02Å; A480-F482 VanDerWaalsContact O-N 3.16Å; F482-T484 VanDerWaalsContact C-N 3.34Å
483L60.3Low62.9Low48 Ų4873.2 Ų73.225%0.25139%0.39SS..G310 helixtrans-86.81.7-179.4-52.7-177.7000113.4W472 C475 I476 A480 T481 H485W472-L483 HydrophobicContact CE3-CD1 4.05Å; W472-L483 HydrophobicContact CH2-CB 3.69Å; W472-L483 HydrophobicContact CH2-CD1 4.28Å; W472-L483 HydrophobicContact CH2-CD2 3.65Å; W472-L483 HydrophobicContact CH2-CG 4.04Å; W472-L483 HydrophobicContact CZ2-CB 3.66Å; W472-L483 HydrophobicContact CZ2-CD2 4.49Å; W472-L483 HydrophobicContact CZ2-CG 4.49Å; W472-L483 WeakPolarHBondContact CZ2-O 3.28Å; W472-L483 HydrophobicContact CZ3-CB 4.16Å; W472-L483 HydrophobicContact CZ3-CD1 3.88Å; W472-L483 HydrophobicContact CZ3-CD2 3.77Å; W472-L483 HydrophobicContact CZ3-CG 4.13Å; C475-L483 HydrophobicContact CB-CD1 4.12Å; I476-L483 HydrophobicContact CG1-CB 4.09Å; A480-L483 HydrophobicContact CB-CD1 3.8Å; A480-L483 HydrophobicContact CB-CG 4.08Å; A480-L483 WeakPolarHBondContact O-CB 3.38Å; A480-L483 PolarHBondContact O-N 2.78Å; T481-L483 PolarHBondContact O-N 2.87Å; T481-L483 VanDerWaalsContact O-N 3.14Å; L483-H485 PolarHBondContact O-N 3.39Å
484T55Low61.1Low67 Ų6773.6 Ų73.641%0.41140%0.395SS..  trans-83.3109.9-176.462.20000112.5I476 T481 F482 L492I476-T484 HydrophobicContact CG1-CG2 4.45Å; I476-T484 HydrophobicContact CG2-CG2 3.98Å; T481-T484 PolarHBondContact O-N 2.87Å; T481-T484 VanDerWaalsContact O-N 3.12Å; T481-T484 PolarHBondContact O-OG1 2.94Å; F482-T484 VanDerWaalsContact C-N 3.34Å; T484-L492 HydrophobicContact CG2-CD1 4.5Å
485H53.6Low59.1Low148 Ų14877.1 Ų77.169%0.68541%0.414SS*.  trans-84.2150.6167.9-160.9-107000111.6L483 S487 H488L483-H485 PolarHBondContact O-N 3.39Å; H485-S487 PolarHBondContact O-N 3.21Å; H485-H488 PolarHBondContact O-N 2.81Å
486S49.3Very low56.9Low88 Ų8879.5 Ų79.562%0.61543%0.428SS*.G310 helixtrans-54.6-29.8-167.2-161.50000115H488S486-H488 PolarHBondContact O-N 2.98Å
487S50.6Low54.8Low97 Ų9785.1 Ų85.168%0.67846%0.459SS*.G310 helixtrans-69.7-10.2179.9-162.80000115H485H485-S487 PolarHBondContact O-N 3.21Å
488H50.8Low52.9Low79 Ų7993.2 Ų93.237%0.36649%0.494SS..G310 helixtrans-112.717.3-173.1-71-24.3000115.5H485 S486 H490 F491H485-H488 PolarHBondContact O-N 2.81Å; S486-H488 PolarHBondContact O-N 2.98Å; H488-H490 PolarHBondContact O-N 3.49Å; H488-F491 WeakPolarHBondContact O-CB 3.45Å; H488-F491 PolarHBondContact O-N 3.02Å
489K49.1Very low50.9Low145 Ų14599.4 Ų99.463%0.6352%0.524SS*.Hα-helixtrans-56.7-31.6170.3-69.5-177.7178.2179.90113.1F491 L492 Y493K489-F491 PolarHBondContact O-N 3.18Å; K489-L492 PolarHBondContact O-N 3.09Å; K489-L492 VanDerWaalsContact O-N 3.13Å; K489-Y493 PolarHBondContact O-N 3.46Å; K489-Y493 VanDerWaalsContact O-N 3.1Å
490H49.5Very low49.1Very low89 Ų89104.2 Ų104.241%0.41253%0.533SS..Hα-helixtrans-58.3-27.8172.9-172-73.4000113.5H488 P496H488-H490 PolarHBondContact O-N 3.49Å; H490-P496 WeakPolarHBondContact NE2-CD 3.36Å
491F51.5Low47.1Very low19 Ų19106.4 Ų106.48%0.08356%0.56CS.*Hα-helixtrans-78.4-31.2177.9-153.8-94.8000111.7Y84 Y85 T404 F405 M408 T473 H488 K489Y84-F491 HydrophobicContact CD1-CD2 4.3Å; Y84-F491 HydrophobicContact CD1-CE2 4.42Å; Y85-F491 HydrophobicContact CD1-CE2 4.32Å; Y85-F491 HydrophobicContact CE1-CE2 4.1Å; Y85-F491 HydrophobicContact CE1-CZ 4.23Å; T404-F491 HydrophobicContact CG2-CE1 3.81Å; T404-F491 HydrophobicContact CG2-CZ 3.93Å; F405-F491 HydrophobicContact CE1-CE2 4.43Å; F405-F491 HydrophobicContact CE1-CZ 4.03Å; M408-F491 HydrophobicContact CE-CD1 3.82Å; M408-F491 HydrophobicContact CE-CE1 3.81Å; M408-F491 HydrophobicContact CE-CG 4.49Å; M408-F491 HydrophobicContact CE-CZ 4.47Å; M408-F491 WeakPolarHBondContact CE-O 3.37Å; M408-F491 HydrophobicContact SD-CD1 4.19Å; M408-F491 HydrophobicContact SD-CE1 3.6Å; M408-F491 HydrophobicContact SD-CZ 4.21Å; T473-F491 HydrophobicContact CG2-CZ 4.29Å; H488-F491 WeakPolarHBondContact O-CB 3.45Å; H488-F491 PolarHBondContact O-N 3.02Å; K489-F491 PolarHBondContact O-N 3.18Å
492L49.5Very low45.6Very low77 Ų77105.4 Ų105.440%0.40357%0.567SS.*Hα-helixtrans-86-35.9-177.7-119.180000114I476 T484 K489I476-L492 HydrophobicContact CG2-CD1 3.43Å; I476-L492 VanDerWaalsContact CG2-CD1 3.43Å; T484-L492 HydrophobicContact CG2-CD1 4.5Å; K489-L492 PolarHBondContact O-N 3.09Å; K489-L492 VanDerWaalsContact O-N 3.13Å
493Y48.8Very low44.3Very low197 Ų197102.7 Ų102.777%0.77357%0.567SS**Hα-helixtrans-99.3-0.3-170.8-77.3-86.9000114.7K489K489-Y493 PolarHBondContact O-N 3.46Å; K489-Y493 VanDerWaalsContact O-N 3.1Å
494G48.1Very low42.9Very low14 Ų14110 Ų11014%0.14460%0.599CS.*  trans85.3176.4-177.300000113.6
495L42.3Very low41.7Very low74 Ų74110.7 Ų110.739%0.38762%0.62SS.*  trans-66139.1175-72.9157.1000110.6L83L83-L495 HydrophobicContact CB-CD1 4.19Å; L83-L495 HydrophobicContact CD1-CD1 4.49Å; L83-L495 HydrophobicContact CD2-CD1 4.03Å; L83-L495 HydrophobicContact CG-CD1 4.46Å
496P38.4Very low40.7Very low89 Ų89109.4 Ų109.458%0.57863%0.628SS**  trans-58.5146.5165-2031.9000111.4H490 E498H490-P496 WeakPolarHBondContact NE2-CD 3.36Å; P496-E498 VanDerWaalsContact C-N 3.33Å; P496-E498 PolarHBondContact O-N 2.94Å
497N37.7Very low40Very low131 Ų131112.7 Ų112.770%0.70168%0.676SS**SBendtrans-69.979.2179.3-74.9-14.1000112.5
498E37.8Very low39.4Very low181 Ų181113.5 Ų113.585%0.84668%0.676SS**  trans-104.6-12.1169.3-70.2-163.1148.200114.2P496P496-E498 VanDerWaalsContact C-N 3.33Å; P496-E498 PolarHBondContact O-N 2.94Å
499E38.3Very low38.9Very low169 Ų169115.3 Ų115.379%0.7969%0.692SS**SBendtrans-96.45.1176.4-73.9-172.7156.700114.7
500Q31.2Very low38.3Very low149 Ų149113.7 Ų113.770%0.69670%0.696SS**SBendtrans-91.7-5.4175-78.5-173.3-22.100114.7G502Q500-G502 PolarHBondContact O-N 3.08Å
501G27.8Very low37.6Very low84 Ų84115.1 Ų115.187%0.86671%0.712SS**THydrogen-bonded Turntrans-74.713.6-175.800000116.8
502G28.6Very low36.8Very low71 Ų71121.1 Ų121.173%0.73275%0.752SS**THydrogen-bonded Turntrans-100.7-12-171.500000116.8Q500Q500-G502 PolarHBondContact O-N 3.08Å
503V31.9Very low35.9Very low141 Ų141124.1 Ų124.186%0.85578%0.775SS**SBendtrans-135.958.3-171.9-1640000111.9
504Q31.7Very low35Very low200 Ų200118.9 Ų118.994%0.93578%0.775SS**  trans-159.291.9163.4-113.1172.26.700108.9
505G30.4Very low34Very low82 Ų82126.9 Ų126.985%0.84582%0.823SS**  trans173.232.8-173.100000118.9
506S30.5Very low33.3Very low121 Ų121131.3 Ų131.385%0.84686%0.86SS**  trans-157.2106.9162.455.60000109.9
507G35.2Very low32.8Very low158 Ų158135.2 Ų135.2100%1.62989%0.885SS**  trans-91.80161.700000111.3

Retrieved 507 of 507 residues in 155.3 ms (Link to these results)