A0A087YHD8_POEFO Loading...

Solute carrier family 14 member 2

AlphaFold DB , UniProt , Accession A0A087YHD8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 487 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
1M33.1Very low29.5Very low237 Ų237148.5 Ų148.5100%1.16778%0.775SS**  0125.50-90.1171.7164.700107.5
2T32.4Very low29.4Very low119 Ų119149.1 Ų149.173%0.7377%0.767SS**  trans59.2106.6160.947.40000117.5
3E27.9Very low29.2Very low181 Ų181148.1 Ų148.185%0.84676%0.764SS**  70.4140.578.6-79.5-171.9168.600110.9
4S28.2Very low29.1Very low85 Ų85148.9 Ų148.959%0.59477%0.768SS**  cis179.815624.9116.80000110.3
5H32.5Very low28.9Very low166 Ų166145.2 Ų145.277%0.76976%0.76SS**  trans61.4122.5142.2-66.9-54.1000122.5
6C28.5Very low28.7Very low98 Ų98143.1 Ų143.166%0.66276%0.762SS**  75.6122.175.8-152.90000110.7
7T29.6Very low28.5Very low104 Ų104141.2 Ų141.264%0.63876%0.762SS**  176.6148.386.522.60000112.9
8K28Very low28.3Very low179 Ų179139.7 Ų139.778%0.77876%0.764SS**  trans75110.3131.7-68.4169.1-176.8178.90122.5
9D30.2Very low28.3Very low149 Ų149138.5 Ų138.580%0.79777%0.767SS**  29.6137113.5-62.8-44.3000121.8
10I28.2Very low28.4Very low160 Ų160136.3 Ų136.382%0.82177%0.767SS**  trans177110.6132.7-89.1152.7000108.3
11Q26.4Very low28.6Very low155 Ų155135.3 Ų135.372%0.72477%0.767SS**  51.3136.3104.8-87.7-172-5.500115.6
12K28.3Very low28.5Very low156 Ų156130.6 Ų130.668%0.67875%0.751SS**  cis-179.1146.737.4-128.4170.7-177.5169.90111.6
13N26.4Very low28.5Very low136 Ų136130.5 Ų130.573%0.72775%0.752SS**  trans52.7141.1137-69.4-1.8000124.3
14I27.7Very low28.6Very low160 Ų160128.9 Ų128.982%0.82175%0.754SS**  -166.6126.1120.1-92.3153.4000112.2
15S26.2Very low28.6Very low93 Ų93129.6 Ų129.665%0.6576%0.76SS**  trans47.6118.6152.963.20000122.4
16S25Very low28.6Very low112 Ų112127 Ų12778%0.78376%0.76SS**  62.4133.375.275.40000114
17S25.4Very low28.9Very low110 Ų110127.8 Ų127.877%0.76976%0.764SS**  cis-169.7143.625.948.80000112
18S26.1Very low28.7Very low114 Ų114128.6 Ų128.680%0.79777%0.774SS**  trans27.5123.1139.7159.10000121.9
19S27.1Very low28.9Very low118 Ų118125.3 Ų125.383%0.82577%0.771SS**  -173.6133.6120.239.60000111.7
20A30.7Very low28.7Very low93 Ų93124.4 Ų124.477%0.76977%0.77SS**  trans-81.1158.7167.200000110.3
21P33.6Very low28.6Very low117 Ų117126.1 Ų126.176%0.7677%0.772SS**  -151.8148.795.734.7-15000117.6
22V30.3Very low28.5Very low137 Ų137124.2 Ų124.283%0.8377%0.771SS**  trans59.7141.8131.9-176.50000121.5
23P32.1Very low28.5Very low117 Ų117125.3 Ų125.376%0.7678%0.779SS**  trans-102.1162.8-159.538.1-26.3000114.6
24V30.8Very low28.5Very low147 Ų147126.5 Ų126.589%0.89178%0.784SS**  trans-109.7130.3174.31800000110.5
25S27.8Very low28.6Very low101 Ų101126.7 Ų126.771%0.70678%0.782SS**  trans-83.3146.3176.650.40000111.4
26S31.1Very low28.7Very low111 Ų111128 Ų12878%0.77679%0.788SS**  153.5179.787.6630000108.8
27P36.3Very low28.7Very low115 Ų115130.4 Ų130.475%0.74779%0.791SS**  -126166.8-104.431-9000114.9
28S25.4Very low28.9Very low121 Ų121134.1 Ų134.185%0.84680%0.798SS**  trans-174.2151.9163.5-89.90000111.6
29P31.6Very low28.9Very low109 Ų109132.9 Ų132.971%0.70880%0.795SS**  -107.1150.1-96.629.8-16.5000113.9
30V26.2Very low28.8Very low130 Ų130132.7 Ų132.779%0.78879%0.794SS**  trans-70.3120.8166.2174.10000108.2T32V30-T32 PolarHBondContact O-N 3.36Å
31F25.6Very low28.9Very low197 Ų197133.8 Ų133.886%0.86479%0.793SS**  trans-76.6106.4165.7-95.5-87.3000108.7E33F31-E33 PolarHBondContact O-N 3.12Å
32T24.8Very low28.7Very low114 Ų114137.4 Ų137.470%0.69980%0.8SS**  trans-68.2115.8167.4-48.60000108.8V30 L34V30-T32 PolarHBondContact O-N 3.36Å; T32-L34 PolarHBondContact O-N 3.48Å
33E27.4Very low28.6Very low179 Ų179138.2 Ų138.284%0.83680%0.8SS**  trans-65.5114.9166.6-79.9-163.8152.300109.5F31 H35F31-E33 PolarHBondContact O-N 3.12Å; E33-H35 PolarHBondContact O-N 2.95Å
34L26.8Very low28.4Very low162 Ų162140.5 Ų140.585%0.84881%0.806SS**  trans-77.4102.3168.6-88146.9000109.2T32T32-L34 PolarHBondContact O-N 3.48Å
35H29.6Very low28.4Very low164 Ų164139.2 Ų139.276%0.75980%0.8SS**  trans-64.2132159.6-104.5-81.4000110.1E33 L37E33-H35 PolarHBondContact O-N 2.95Å; H35-L37 PolarHBondContact O-N 3.07Å
36P29.1Very low28.5Very low121 Ų121139.9 Ų139.979%0.78681%0.805SS**  trans-78.9104.2165.4-9.526.3000109.8M38P36-M38 PolarHBondContact O-N 3.45Å
37L24.3Very low28.4Very low161 Ų161143.3 Ų143.384%0.84381%0.809SS**  trans-67.5113.8157.2-98.2142.5000108.6H35H35-L37 PolarHBondContact O-N 3.07Å
38M29.1Very low28.2Very low188 Ų188147 Ų14793%0.92682%0.816SS**  trans-126.8104.6146.2-78.1-152.6165.500108.4P36P36-M38 PolarHBondContact O-N 3.45Å
39A26.3Very low28.6Very low89 Ų89147.9 Ų147.974%0.73681%0.811SS**  trans-66.6143.7161.300000109.2
40S25.8Very low28.5Very low114 Ų114154 Ų15480%0.79782%0.82SS**  trans-139.8144.7153.5-79.20000108.6
41P33.2Very low28.9Very low116 Ų116154.1 Ų154.175%0.75382%0.821SS**  trans-83.7153.2-157.14.314.3000111.7N43P41-N43 PolarHBondContact O-N 3.33Å
42E29.4Very low29.1Very low193 Ų193153.8 Ų153.890%0.90282%0.822SS**  trans-50.5124.5162.8-66.5175.4149.500110.4
43N26.9Very low29.7Very low154 Ų154152 Ų15282%0.82483%0.826SS**  trans-137104.4159.6-97.9-19.1000107.4P41 P45P41-N43 PolarHBondContact O-N 3.33Å; N43-P45 WeakPolarHBondContact O-CD 3.37Å
44N28.4Very low29.9Very low165 Ų165152.6 Ų152.688%0.88283%0.829SS**  trans-63133.2159.8-86.6-25.6000108.9
45P31.5Very low30.4Very low119 Ų119150.9 Ų150.977%0.77383%0.831SS**  trans-105121.8154.79.811.2000109.1N43N43-P45 WeakPolarHBondContact O-CD 3.37Å
46S29.9Very low30.6Very low116 Ų116145.8 Ų145.881%0.81182%0.822SS**  trans-48.2139.5159.641.50000111.7E48S46-E48 PolarHBondContact O-N 3.46Å
47Q29.7Very low31.4Very low182 Ų182146.3 Ų146.385%0.8583%0.826SS**  trans-60119.2172.2-166.5174.216.200110.9
48E32.2Very low32.5Very low193 Ų193143.5 Ų143.590%0.90283%0.826SS**  trans-151.1120.8154.9-118.5174.7-167.200110S46S46-E48 PolarHBondContact O-N 3.46Å
49D32Very low33.7Very low140 Ų140137.3 Ų137.375%0.74981%0.81SS**  trans-69.8139.2-179.6-70.5-54000112.3
50R30.6Very low35.1Very low236 Ų236137.6 Ų137.689%0.89180%0.804SS**  164.7112.2113.4-88.2174.1-176.9-171.21113.3
51V34.2Very low37.1Very low133 Ų133135.7 Ų135.781%0.80679%0.791SS**  trans10.9119.6140.4-159.30000117.9
52E30.4Very low39Very low191 Ų191135.5 Ų135.589%0.89379%0.792SS**  178.9128110.2-94.9-176.9173.100112.7
53G37Very low41.1Very low76 Ų76133.2 Ų133.278%0.78479%0.785SS**  trans80.969.7144.600000119.7
54Q31.3Very low43.4Very low192 Ų192131.4 Ų131.490%0.89777%0.771SS**  trans-135.4118.6152.6-73.2-171.13.900111.5G56Q54-G56 PolarHBondContact O-N 2.96Å
55S36.9Very low45.6Very low126 Ų126126.4 Ų126.488%0.88175%0.746SS**  trans-58.4101.6166.249.50000109.9
56G35.4Very low47.9Very low57 Ų57123.4 Ų123.459%0.58873%0.732SS**  trans-64.6156.6170.900000111.8Q54 A58Q54-G56 PolarHBondContact O-N 2.96Å; G56-A58 PolarHBondContact O-N 3.09Å
57P45.4Very low50.4Low131 Ų131125.3 Ų125.385%0.85172%0.721SS**  trans-61.6129.2177.427.2-31.6000108.5G59P57-G59 PolarHBondContact O-N 3.36Å
58A46.4Very low52.7Low103 Ų103119 Ų11985%0.85170%0.698SS**  trans-50.5115.2175.600000109.3G56G56-A58 PolarHBondContact O-N 3.09Å
59G55.5Low55Low58 Ų58119 Ų11960%0.59869%0.689SS**PPolyproline II helixtrans-54.1151.2175.800000110.6P57 S61P57-G59 PolarHBondContact O-N 3.36Å; G59-S61 PolarHBondContact O-N 3.25Å; G59-S61 VanDerWaalsContact O-N 3.12Å
60P54.8Low57.5Low94 Ų94118.2 Ų118.261%0.6168%0.679SS**PPolyproline II helixtrans-53.3125.6-178.120.7-30.9000109.4H64P60-H64 HydrophobicContact CB-CB 4.46Å
61S67.4Low59.9Low74 Ų74111 Ų11152%0.51766%0.658SS.*PPolyproline II helixtrans-50.1144.7-177.266.70000110.4G59 L63 H64 T65G59-S61 PolarHBondContact O-N 3.25Å; G59-S61 VanDerWaalsContact O-N 3.12Å; S61-L63 PolarHBondContact O-N 3.4Å; S61-H64 WeakPolarHBondContact O-CB 3.36Å; S61-H64 PolarHBondContact O-N 2.88Å; S61-T65 PolarHBondContact O-N 2.93Å
62C72.8Confident62.1Low113 Ų113111 Ų11176%0.76465%0.647SS**Hα-helixtrans-49.1-35.1-178.2-175.20000112.2T65 A66C62-T65 PolarHBondContact O-N 3.5Å; C62-A66 WeakPolarHBondContact O-CB 3.48Å; C62-A66 PolarHBondContact O-N 3.06Å
63L74.5Confident64.5Low145 Ų145103.6 Ų103.676%0.75962%0.621SS**Hα-helixtrans-63.3-42.4174.4-68.8170.8000113.6S61 T65 A66 W67S61-L63 PolarHBondContact O-N 3.4Å; L63-T65 VanDerWaalsContact C-N 3.34Å; L63-A66 PolarHBondContact O-N 3.45Å; L63-W67 WeakPolarHBondContact O-CB 3.47Å; L63-W67 PolarHBondContact O-N 3.16Å
64H74.7Confident66.7Low116 Ų116101.8 Ų101.854%0.53760%0.595SS.*Hα-helixtrans-66.4-38.2176.9-174.9-90.9000111.7P60 S61 S68P60-H64 HydrophobicContact CB-CB 4.46Å; S61-H64 WeakPolarHBondContact O-CB 3.36Å; S61-H64 PolarHBondContact O-N 2.88Å; H64-S68 WeakPolarHBondContact O-CB 3.39Å; H64-S68 PolarHBondContact O-N 3.38Å; H64-S68 PolarHBondContact O-OG 2.95Å; H64-S68 VanDerWaalsContact O-OG 3.07Å
65T76.1Confident69.3Low59 Ų5995.9 Ų95.936%0.36258%0.575SS.*Hα-helixtrans-69.1-41.2176-55.60000111.6S61 C62 L63 S68 R69S61-T65 PolarHBondContact O-N 2.93Å; C62-T65 PolarHBondContact O-N 3.5Å; L63-T65 VanDerWaalsContact C-N 3.34Å; T65-S68 PolarHBondContact O-OG 2.96Å; T65-R69 VanDerWaalsContact O-CG 3.3Å; T65-R69 WeakPolarHBondContact O-CG 3.48Å; T65-R69 PolarHBondContact O-N 3.45Å
66A79.4Confident71.7Confident56 Ų5695.8 Ų95.846%0.46356%0.556SS.*Hα-helixtrans-64.5-44.2174.200000111.8C62 L63 R69 F70C62-A66 WeakPolarHBondContact O-CB 3.48Å; C62-A66 PolarHBondContact O-N 3.06Å; L63-A66 PolarHBondContact O-N 3.45Å; A66-R69 PolarHBondContact O-N 3.22Å; A66-F70 PolarHBondContact O-N 3.19Å
67W81.1Confident74.3Confident156 Ų15697.2 Ų97.259%0.59155%0.547SS*.Hα-helixtrans-63.2-43.9178.5-175.7-107.7000112.8L63 R69 F70 L71L63-W67 WeakPolarHBondContact O-CB 3.47Å; L63-W67 PolarHBondContact O-N 3.16Å; W67-R69 VanDerWaalsContact C-N 3.34Å; W67-R69 PolarHBondContact O-N 3.44Å; W67-F70 HydrophobicContact CE3-CD1 4.32Å; W67-F70 HydrophobicContact CZ3-CD1 4.2Å; W67-F70 HydrophobicContact CZ3-CE1 4.42Å; W67-F70 WeakPolarHBondContact O-CB 3.48Å; W67-F70 PolarHBondContact O-N 3.47Å; W67-L71 HydrophobicContact CZ2-CD2 4.29Å; W67-L71 VanDerWaalsContact NE1-CD1 3.33Å; W67-L71 WeakPolarHBondContact O-CG 3.37Å; W67-L71 PolarHBondContact O-N 2.93Å
68S77.8Confident76.7Confident51 Ų5192.4 Ų92.436%0.35752%0.516SS..Hα-helixtrans-63.9-37.4176.4600000112.8H64 T65 K72H64-S68 WeakPolarHBondContact O-CB 3.39Å; H64-S68 PolarHBondContact O-N 3.38Å; H64-S68 PolarHBondContact O-OG 2.95Å; H64-S68 VanDerWaalsContact O-OG 3.07Å; T65-S68 PolarHBondContact O-OG 2.96Å; S68-K72 VanDerWaalsContact O-CB 3.31Å; S68-K72 WeakPolarHBondContact O-CB 3.42Å; S68-K72 PolarHBondContact O-N 2.93Å
69R81Confident79Confident193 Ų19387.6 Ų87.673%0.72848%0.476SS*.Hα-helixtrans-66.9-40.1174.2-68.6177.795166.67.3111.8T65 A66 W67 K72 G73T65-R69 VanDerWaalsContact O-CG 3.3Å; T65-R69 WeakPolarHBondContact O-CG 3.48Å; T65-R69 PolarHBondContact O-N 3.45Å; A66-R69 PolarHBondContact O-N 3.22Å; W67-R69 VanDerWaalsContact C-N 3.34Å; W67-R69 PolarHBondContact O-N 3.44Å; R69-K72 PolarHBondContact O-N 3.39Å; R69-G73 PolarHBondContact O-N 3.15Å
70F83.8Confident80.8Confident123 Ų12385.5 Ų85.554%0.53945%0.451SS..Hα-helixtrans-61.6-52174174.8-101.6000111.7A66 W67 K72 G73 V74A66-F70 PolarHBondContact O-N 3.19Å; W67-F70 HydrophobicContact CE3-CD1 4.32Å; W67-F70 HydrophobicContact CZ3-CD1 4.2Å; W67-F70 HydrophobicContact CZ3-CE1 4.42Å; W67-F70 WeakPolarHBondContact O-CB 3.48Å; W67-F70 PolarHBondContact O-N 3.47Å; F70-K72 VanDerWaalsContact C-N 3.27Å; F70-K72 PolarHBondContact O-N 2.93Å; F70-G73 WeakPolarHBondContact O-CA 3.45Å; F70-G73 PolarHBondContact O-N 2.93Å; F70-V74 HydrophobicContact CD1-CG2 4.27Å; F70-V74 HydrophobicContact CE1-CG2 3.83Å; F70-V74 HydrophobicContact CE2-CG2 4.15Å; F70-V74 HydrophobicContact CZ-CG2 3.77Å; F70-V74 WeakPolarHBondContact O-CG2 3.49Å; F70-V74 PolarHBondContact O-N 3.19Å
71L81.8Confident82.8Confident84 Ų8482 Ų8244%0.4443%0.427SS..Hα-helixtrans-58.8-38.7176.9-73.9178.1000112.4W67 G73 V74 S75W67-L71 HydrophobicContact CZ2-CD2 4.29Å; W67-L71 VanDerWaalsContact NE1-CD1 3.33Å; W67-L71 WeakPolarHBondContact O-CG 3.37Å; W67-L71 PolarHBondContact O-N 2.93Å; L71-G73 VanDerWaalsContact C-N 3.34Å; L71-V74 PolarHBondContact O-N 2.96Å; L71-S75 PolarHBondContact O-N 3.31Å
72K80.1Confident84Confident134 Ų13483.1 Ų83.158%0.58342%0.424SS*.Hα-helixtrans-62.9-41.7173.9-170.3173.6-177.51770111.3S68 R69 F70 S75 Y76S68-K72 VanDerWaalsContact O-CB 3.31Å; S68-K72 WeakPolarHBondContact O-CB 3.42Å; S68-K72 PolarHBondContact O-N 2.93Å; R69-K72 PolarHBondContact O-N 3.39Å; F70-K72 VanDerWaalsContact C-N 3.27Å; F70-K72 PolarHBondContact O-N 2.93Å; K72-S75 PolarHBondContact O-N 3.38Å; K72-S75 PolarHBondContact O-OG 3Å; K72-Y76 HydrophobicContact CG-CE2 4.32Å; K72-Y76 WeakPolarHBondContact O-CD2 3.5Å; K72-Y76 WeakPolarHBondContact O-CE2 3.47Å
73G81.4Confident85Confident34 Ų3482.1 Ų82.135%0.35141%0.414SS..Hα-helixtrans-59.2-47.7172.500000112.6R69 F70 L71 S75 Y76 F77R69-G73 PolarHBondContact O-N 3.15Å; F70-G73 WeakPolarHBondContact O-CA 3.45Å; F70-G73 PolarHBondContact O-N 2.93Å; L71-G73 VanDerWaalsContact C-N 3.34Å; G73-S75 VanDerWaalsContact C-N 3.28Å; G73-S75 PolarHBondContact O-N 3.29Å; G73-Y76 PolarHBondContact O-N 3.05Å; G73-F77 WeakPolarHBondContact O-CD1 3.38Å; G73-F77 WeakPolarHBondContact O-CE1 3.38Å
74V83.9Confident86Confident38 Ų3878.4 Ų78.423%0.2339%0.392CS..Hα-helixtrans-58.1-40.7177.1176.60000111.9F70 L71 Y76 F77 S78F70-V74 HydrophobicContact CD1-CG2 4.27Å; F70-V74 HydrophobicContact CE1-CG2 3.83Å; F70-V74 HydrophobicContact CE2-CG2 4.15Å; F70-V74 HydrophobicContact CZ-CG2 3.77Å; F70-V74 WeakPolarHBondContact O-CG2 3.49Å; F70-V74 PolarHBondContact O-N 3.19Å; L71-V74 PolarHBondContact O-N 2.96Å; V74-Y76 PolarHBondContact O-N 3.38Å; V74-F77 VanDerWaalsContact CA-CE1 3.45Å; V74-F77 HydrophobicContact CB-CE1 4.41Å; V74-F77 HydrophobicContact CB-CZ 4.09Å; V74-F77 HydrophobicContact CG1-CE2 4.17Å; V74-F77 HydrophobicContact CG1-CZ 4.11Å; V74-F77 HydrophobicContact CG2-CE1 4.42Å; V74-F77 HydrophobicContact CG2-CZ 3.93Å; V74-F77 PolarHBondContact O-N 2.9Å; V74-S78 PolarHBondContact O-N 3.4Å; V74-S78 PolarHBondContact O-OG 2.92Å
75S84.1Confident86.9Confident68 Ų6873.7 Ų73.748%0.47637%0.374SS..THydrogen-bonded Turntrans-61.3-17.8-178.276.20000115.2L71 K72 G73L71-S75 PolarHBondContact O-N 3.31Å; K72-S75 PolarHBondContact O-N 3.38Å; K72-S75 PolarHBondContact O-OG 3Å; G73-S75 VanDerWaalsContact C-N 3.28Å; G73-S75 PolarHBondContact O-N 3.29Å
76Y87.9Confident87.8Confident124 Ų12477.4 Ų77.449%0.48639%0.386SS..THydrogen-bonded Turntrans-75.6-27176.6-77.7-83.4000113.4K72 G73 V74 V83K72-Y76 HydrophobicContact CG-CE2 4.32Å; K72-Y76 WeakPolarHBondContact O-CD2 3.5Å; K72-Y76 WeakPolarHBondContact O-CE2 3.47Å; G73-Y76 PolarHBondContact O-N 3.05Å; V74-Y76 PolarHBondContact O-N 3.38Å; Y76-V83 HydrophobicContact CD1-CG1 4.38Å; Y76-V83 HydrophobicContact CE1-CG1 4.14Å
77F91.4Very high88.5Confident88 Ų8881 Ų8139%0.38639%0.387SS..THydrogen-bonded Turntrans-116.9-13.1-176.661.6-100.3000113.9G73 V74 N113 L115 I290G73-F77 WeakPolarHBondContact O-CD1 3.38Å; G73-F77 WeakPolarHBondContact O-CE1 3.38Å; V74-F77 VanDerWaalsContact CA-CE1 3.45Å; V74-F77 HydrophobicContact CB-CE1 4.41Å; V74-F77 HydrophobicContact CB-CZ 4.09Å; V74-F77 HydrophobicContact CG1-CE2 4.17Å; V74-F77 HydrophobicContact CG1-CZ 4.11Å; V74-F77 HydrophobicContact CG2-CE1 4.42Å; V74-F77 HydrophobicContact CG2-CZ 3.93Å; V74-F77 PolarHBondContact O-N 2.9Å; F77-N113 PolarHBondContact O-ND2 3.17Å; F77-L115 HydrophobicContact CB-CD2 4.02Å; F77-I290 HydrophobicContact CD2-CG2 4.3Å
78S93.9Very high89.3Confident30 Ų3074.1 Ų74.121%0.2136%0.362CS..SBendtrans-84.5170.8173.268.50000113.3V74 I290V74-S78 PolarHBondContact O-N 3.4Å; V74-S78 PolarHBondContact O-OG 2.92Å; S78-I290 VanDerWaalsContact CA-O 3.28Å; S78-I290 WeakPolarHBondContact CA-O 3.36Å; S78-I290 WeakPolarHBondContact CB-O 3.19Å
79G94.8Very high90Very high1 Ų178.4 Ų78.41%0.0138%0.376CS..THydrogen-bonded Turntrans59.6-136.1-179.900000111.8N113 S291G79-N113 WeakPolarHBondContact O-CB 3.28Å; G79-N113 PolarHBondContact O-ND2 2.96Å; G79-S291 WeakPolarHBondContact CA-O 3.48Å; G79-S291 PolarHBondContact N-O 3.35Å; G79-S291 PolarHBondContact O-OG 3.18Å
80D95.3Very high90.7Very high14 Ų1477.7 Ų77.78%0.07538%0.379CS..THydrogen-bonded Turntrans-89.60.3-175.3-61.7-16.7000114.4E82 R103 N112 T407D80-E82 VanDerWaalsContact C-N 3.34Å; D80-E82 HydrophobicContact CB-CG 4.3Å; D80-E82 PolarHBondContact O-N 2.95Å; D80-R103 PolarHBondContact O-NH1 2.94Å; D80-N112 CarbonylContact C-O 3.12Å; D80-N112 VanDerWaalsContact C-O 3.29Å; D80-N112 WeakPolarHBondContact CA-O 3.5Å; D80-N112 HydrophobicContact CB-CB 4.22Å; D80-T407 WeakPolarHBondContact OD2-CB 3.3Å
81M96Very high91.3Very high22 Ų2274.3 Ų74.311%0.10837%0.365CS..  trans49.747.9-174.1-62.7-178.661.800113.5V83 F84 G85 N113 P114 L115M81-V83 VanDerWaalsContact C-N 3.29Å; M81-V83 PolarHBondContact O-N 3.29Å; M81-F84 HydrophobicContact CB-CB 4.08Å; M81-F84 HydrophobicContact CE-CB 3.86Å; M81-F84 HydrophobicContact CE-CD1 4.02Å; M81-F84 HydrophobicContact CE-CD2 4.46Å; M81-F84 HydrophobicContact CE-CG 3.87Å; M81-F84 WeakPolarHBondContact O-CB 3.36Å; M81-F84 PolarHBondContact O-N 3.21Å; M81-F84 VanDerWaalsContact O-N 3.07Å; M81-G85 PolarHBondContact O-N 2.96Å; M81-N113 WeakPolarHBondContact CG-ND2 3.45Å; M81-N113 PolarHBondContact SD-OD1 3.15Å; M81-P114 HydrophobicContact CE-CG 4.27Å; M81-P114 HydrophobicContact SD-CG 3.86Å; M81-L115 HydrophobicContact SD-CB 3.97Å
82E92.6Very high92Very high97 Ų9776.2 Ų76.245%0.45337%0.37SS..Hα-helixtrans-57.3-37.4-174.4-66.9-178.7178.300113.6D80 F84 G85 K86 K411D80-E82 VanDerWaalsContact C-N 3.34Å; D80-E82 HydrophobicContact CB-CG 4.3Å; D80-E82 PolarHBondContact O-N 2.95Å; E82-F84 VanDerWaalsContact C-N 3.35Å; E82-G85 PolarHBondContact O-N 3.34Å; E82-K86 WeakPolarHBondContact O-CG 3.28Å; E82-K86 PolarHBondContact O-N 3.34Å; E82-K411 IonicContact OE1-NZ 2.67Å; E82-K411 PolarHBondContact OE1-NZ 2.94Å; E82-K411 IonicContact OE2-NZ 2.7Å
83V93.4Very high92.7Very high92 Ų9274.9 Ų74.956%0.55837%0.368SS*.Hα-helixtrans-64.2-42.3178-178.80000110.9Y76 M81 K86 W87Y76-V83 HydrophobicContact CD1-CG1 4.38Å; Y76-V83 HydrophobicContact CE1-CG1 4.14Å; M81-V83 VanDerWaalsContact C-N 3.29Å; M81-V83 PolarHBondContact O-N 3.29Å; V83-K86 PolarHBondContact O-N 3.45Å; V83-W87 PolarHBondContact O-N 2.9Å; V83-W87 VanDerWaalsContact O-N 3.15Å
84F94.7Very high93.5Very high67 Ų6779.3 Ų79.329%0.29438%0.383SS..Hα-helixtrans-66.6-40.5175.2-178.4-104000111.3M81 E82 K86 W87 M88 D99 P114M81-F84 HydrophobicContact CB-CB 4.08Å; M81-F84 HydrophobicContact CE-CB 3.86Å; M81-F84 HydrophobicContact CE-CD1 4.02Å; M81-F84 HydrophobicContact CE-CD2 4.46Å; M81-F84 HydrophobicContact CE-CG 3.87Å; M81-F84 WeakPolarHBondContact O-CB 3.36Å; M81-F84 PolarHBondContact O-N 3.21Å; M81-F84 VanDerWaalsContact O-N 3.07Å; E82-F84 VanDerWaalsContact C-N 3.35Å; F84-K86 PolarHBondContact O-N 2.94Å; F84-W87 AromaticContact CD2-CE3 3.96Å; F84-W87 HydrophobicContact CD2-CE3 3.96Å; F84-W87 HydrophobicContact CD2-CZ3 4.33Å; F84-W87 AromaticContact CE2-CE3 3.75Å; F84-W87 HydrophobicContact CE2-CE3 3.75Å; F84-W87 AromaticContact CE2-CZ3 3.65Å; F84-W87 HydrophobicContact CE2-CZ3 3.65Å; F84-W87 HydrophobicContact CZ-CE3 4.43Å; F84-W87 HydrophobicContact CZ-CZ3 4.15Å; F84-W87 WeakPolarHBondContact O-CB 3.42Å; F84-W87 PolarHBondContact O-N 3.17Å; F84-W87 VanDerWaalsContact O-N 3.16Å; F84-M88 HydrophobicContact CD1-CE 4.38Å; F84-M88 HydrophobicContact CE1-CE 3.43Å; F84-M88 VanDerWaalsContact CE1-CE 3.43Å; F84-M88 HydrophobicContact CE2-CE 3.94Å; F84-M88 HydrophobicContact CZ-CE 3.17Å; F84-M88 WeakPolarHBondContact O-CB 3.49Å; F84-M88 PolarHBondContact O-N 3.09Å; F84-D99 WeakPolarHBondContact CE1-OD1 3.36Å; F84-P114 HydrophobicContact CD1-CG 3.81Å; F84-P114 HydrophobicContact CE1-CB 4.46Å; F84-P114 HydrophobicContact CE1-CG 3.76Å
85G94.3Very high94.1Very high16 Ų1680.2 Ų80.217%0.16539%0.386CS..Hα-helixtrans-56.7-48.4174.300000112.6M81 E82 W87 M88 E89M81-G85 PolarHBondContact O-N 2.96Å; E82-G85 PolarHBondContact O-N 3.34Å; G85-W87 VanDerWaalsContact C-N 3.28Å; G85-W87 PolarHBondContact O-N 3.5Å; G85-M88 WeakPolarHBondContact O-CB 3.48Å; G85-M88 PolarHBondContact O-N 3.26Å; G85-E89 PolarHBondContact O-N 3.47Å; G85-E89 VanDerWaalsContact O-N 3.1Å
86K94.4Very high94.7Very high138 Ų13878.8 Ų78.860%0.637%0.372SS*.Hα-helixtrans-62.5-33.1176.1-71.8-178.3-179.8-178.50113.5E82 V83 F84E82-K86 WeakPolarHBondContact O-CG 3.28Å; E82-K86 PolarHBondContact O-N 3.34Å; V83-K86 PolarHBondContact O-N 3.45Å; F84-K86 PolarHBondContact O-N 2.94Å
87W95.8Very high95.2Very high130 Ų13074.2 Ų74.249%0.49236%0.356SS..Hα-helixtrans-71.2-37.7173.2173.385000111.6V83 F84 G85 E89 K90 Q91V83-W87 PolarHBondContact O-N 2.9Å; V83-W87 VanDerWaalsContact O-N 3.15Å; F84-W87 AromaticContact CD2-CE3 3.96Å; F84-W87 HydrophobicContact CD2-CE3 3.96Å; F84-W87 HydrophobicContact CD2-CZ3 4.33Å; F84-W87 AromaticContact CE2-CE3 3.75Å; F84-W87 HydrophobicContact CE2-CE3 3.75Å; F84-W87 AromaticContact CE2-CZ3 3.65Å; F84-W87 HydrophobicContact CE2-CZ3 3.65Å; F84-W87 HydrophobicContact CZ-CE3 4.43Å; F84-W87 HydrophobicContact CZ-CZ3 4.15Å; F84-W87 WeakPolarHBondContact O-CB 3.42Å; F84-W87 PolarHBondContact O-N 3.17Å; F84-W87 VanDerWaalsContact O-N 3.16Å; G85-W87 VanDerWaalsContact C-N 3.28Å; G85-W87 PolarHBondContact O-N 3.5Å; W87-E89 VanDerWaalsContact C-N 3.35Å; W87-E89 PolarHBondContact O-N 3.46Å; W87-K90 PolarHBondContact O-N 2.95Å; W87-Q91 HydrophobicContact CD2-CG 4.41Å; W87-Q91 VanDerWaalsContact CE2-NE2 3.35Å; W87-Q91 HydrophobicContact CE3-CG 4.23Å; W87-Q91 HydrophobicContact CH2-CG 3.93Å; W87-Q91 HydrophobicContact CZ2-CG 4.11Å; W87-Q91 HydrophobicContact CZ3-CG 3.99Å; W87-Q91 PolarHBondContact O-NE2 2.93Å
88M96.1Very high95.5Very high13 Ų1374.2 Ų74.26%0.06436%0.36CS..Hα-helixtrans-65.2-34.2-179.7-167.657.965.100112.8F84 G85 K90 Q91 L95 Q96 D99F84-M88 HydrophobicContact CD1-CE 4.38Å; F84-M88 HydrophobicContact CE1-CE 3.43Å; F84-M88 VanDerWaalsContact CE1-CE 3.43Å; F84-M88 HydrophobicContact CE2-CE 3.94Å; F84-M88 HydrophobicContact CZ-CE 3.17Å; F84-M88 WeakPolarHBondContact O-CB 3.49Å; F84-M88 PolarHBondContact O-N 3.09Å; G85-M88 WeakPolarHBondContact O-CB 3.48Å; G85-M88 PolarHBondContact O-N 3.26Å; M88-K90 PolarHBondContact O-N 2.95Å; M88-Q91 WeakPolarHBondContact O-CB 3.42Å; M88-Q91 PolarHBondContact O-N 3.38Å; M88-Q91 HydrophobicContact SD-CB 4.07Å; M88-Q91 HydrophobicContact SD-CG 4Å; M88-L95 HydrophobicContact SD-CB 4.02Å; M88-Q96 HydrophobicContact CG-CG 4.33Å; M88-Q96 WeakPolarHBondContact O-CG 3.44Å; M88-D99 HydrophobicContact CE-CB 4.07Å; M88-D99 HydrophobicContact CG-CB 3.82Å; M88-D99 HydrophobicContact SD-CB 4.17Å
89E94Very high95.8Very high140 Ų14073.2 Ų73.265%0.65435%0.352SS*.THydrogen-bonded Turntrans-54.6-26.9176.5-73.4172.1-172.100113.6G85 W87 Q96G85-E89 PolarHBondContact O-N 3.47Å; G85-E89 VanDerWaalsContact O-N 3.1Å; W87-E89 VanDerWaalsContact C-N 3.35Å; W87-E89 PolarHBondContact O-N 3.46Å; E89-Q96 PolarHBondContact O-NE2 3.4Å
90K94.9Very high95.9Very high179 Ų17973.7 Ų73.778%0.77835%0.353SS*.THydrogen-bonded Turntrans-92-4.7-179.1-57.6-178.9-176.1-179.30113.6W87 M88W87-K90 PolarHBondContact O-N 2.95Å; M88-K90 PolarHBondContact O-N 2.95Å
91Q96.8Very high96.1Very high52 Ų5273.1 Ų73.124%0.24335%0.35CS..SBendtrans-86.4169.4-178.4-55.6-50.9-48.700111.4W87 M88 L95 Q96W87-Q91 HydrophobicContact CD2-CG 4.41Å; W87-Q91 VanDerWaalsContact CE2-NE2 3.35Å; W87-Q91 HydrophobicContact CE3-CG 4.23Å; W87-Q91 HydrophobicContact CH2-CG 3.93Å; W87-Q91 HydrophobicContact CZ2-CG 4.11Å; W87-Q91 HydrophobicContact CZ3-CG 3.99Å; W87-Q91 PolarHBondContact O-NE2 2.93Å; M88-Q91 WeakPolarHBondContact O-CB 3.42Å; M88-Q91 PolarHBondContact O-N 3.38Å; M88-Q91 HydrophobicContact SD-CB 4.07Å; M88-Q91 HydrophobicContact SD-CG 4Å; Q91-L95 HydrophobicContact CB-CB 4.21Å; Q91-L95 HydrophobicContact CB-CD1 4.18Å; Q91-Q96 PolarHBondContact O-NE2 2.88Å
92F96Very high96.2Very high124 Ų12473.3 Ų73.354%0.54435%0.352SS..  trans-71156177.261.2-86.5000112.3L94 L95 Q96F92-L94 VanDerWaalsContact C-N 3.27Å; F92-L94 HydrophobicContact CD2-CB 3.79Å; F92-L94 HydrophobicContact CD2-CG 4.46Å; F92-L94 HydrophobicContact CE2-CB 3.72Å; F92-L94 HydrophobicContact CE2-CD1 4.41Å; F92-L94 PolarHBondContact O-N 3.03Å; F92-L94 VanDerWaalsContact O-N 3.11Å; F92-L95 HydrophobicContact CD1-CD1 3.76Å; F92-L95 HydrophobicContact CD1-CG 4.12Å; F92-L95 HydrophobicContact CD2-CG 4.33Å; F92-L95 HydrophobicContact CE1-CD1 3.17Å; F92-L95 HydrophobicContact CE1-CG 3.53Å; F92-L95 HydrophobicContact CE2-CD1 4.37Å; F92-L95 HydrophobicContact CE2-CG 3.78Å; F92-L95 HydrophobicContact CG-CG 4.49Å; F92-L95 HydrophobicContact CZ-CB 4.44Å; F92-L95 HydrophobicContact CZ-CD1 3.55Å; F92-L95 HydrophobicContact CZ-CD2 4.11Å; F92-L95 HydrophobicContact CZ-CG 3.35Å; F92-L95 PolarHBondContact O-N 3.12Å; F92-Q96 PolarHBondContact O-N 2.67Å
93L95.5Very high96.5Very high105 Ų10569.1 Ų69.155%0.5533%0.332SS..Hα-helixtrans-55.6-35.1-169.2-176.564.7000114.3Q96 L97 W100L93-Q96 PolarHBondContact O-N 3.47Å; L93-L97 VanDerWaalsContact O-CB 3.31Å; L93-L97 WeakPolarHBondContact O-CB 3.39Å; L93-L97 PolarHBondContact O-N 2.96Å; L93-W100 HydrophobicContact CD1-CH2 4.08Å; L93-W100 HydrophobicContact CD1-CZ3 4.25Å
94L96.8Very high96.8Very high127 Ų12764.7 Ų64.767%0.66531%0.305SS*.Hα-helixtrans-67.9-36.2179.6-65.2171.8000112.5F92 L97 L98F92-L94 VanDerWaalsContact C-N 3.27Å; F92-L94 HydrophobicContact CD2-CB 3.79Å; F92-L94 HydrophobicContact CD2-CG 4.46Å; F92-L94 HydrophobicContact CE2-CB 3.72Å; F92-L94 HydrophobicContact CE2-CD1 4.41Å; F92-L94 PolarHBondContact O-N 3.03Å; F92-L94 VanDerWaalsContact O-N 3.11Å; L94-L97 PolarHBondContact O-N 3.49Å; L94-L98 PolarHBondContact O-N 3.41Å
95L97.1Very high97Very high58 Ų5861.5 Ų61.530%0.30429%0.291SS..Hα-helixtrans-69.7-39.9173.2-73.7178.8000111.4M88 Q91 F92 L97 L98 D99M88-L95 HydrophobicContact SD-CB 4.02Å; Q91-L95 HydrophobicContact CB-CB 4.21Å; Q91-L95 HydrophobicContact CB-CD1 4.18Å; F92-L95 HydrophobicContact CD1-CD1 3.76Å; F92-L95 HydrophobicContact CD1-CG 4.12Å; F92-L95 HydrophobicContact CD2-CG 4.33Å; F92-L95 HydrophobicContact CE1-CD1 3.17Å; F92-L95 HydrophobicContact CE1-CG 3.53Å; F92-L95 HydrophobicContact CE2-CD1 4.37Å; F92-L95 HydrophobicContact CE2-CG 3.78Å; F92-L95 HydrophobicContact CG-CG 4.49Å; F92-L95 HydrophobicContact CZ-CB 4.44Å; F92-L95 HydrophobicContact CZ-CD1 3.55Å; F92-L95 HydrophobicContact CZ-CD2 4.11Å; F92-L95 HydrophobicContact CZ-CG 3.35Å; F92-L95 PolarHBondContact O-N 3.12Å; L95-L97 VanDerWaalsContact C-N 3.32Å; L95-L97 PolarHBondContact O-N 3.48Å; L95-L98 PolarHBondContact O-N 3.44Å; L95-D99 PolarHBondContact O-N 2.91Å
96Q97.7Very high97.2Very high38 Ų3860.8 Ų60.818%0.17828%0.283CS..Hα-helixtrans-60.4-45.7173.8-61-172.424.100110.7M88 E89 Q91 F92 L93 L98 D99 W100M88-Q96 HydrophobicContact CG-CG 4.33Å; M88-Q96 WeakPolarHBondContact O-CG 3.44Å; E89-Q96 PolarHBondContact O-NE2 3.4Å; Q91-Q96 PolarHBondContact O-NE2 2.88Å; F92-Q96 PolarHBondContact O-N 2.67Å; L93-Q96 PolarHBondContact O-N 3.47Å; Q96-L98 VanDerWaalsContact C-N 3.32Å; Q96-L98 PolarHBondContact O-N 3.35Å; Q96-D99 WeakPolarHBondContact O-CB 3.41Å; Q96-D99 PolarHBondContact O-N 2.97Å; Q96-W100 HydrophobicContact CB-CD2 4.45Å; Q96-W100 HydrophobicContact CB-CH2 4.14Å; Q96-W100 HydrophobicContact CB-CZ2 3.68Å; Q96-W100 HydrophobicContact CG-CZ2 4.48Å; Q96-W100 VanDerWaalsContact O-CD2 3.31Å; Q96-W100 PolarHBondContact O-N 3.38Å; Q96-W100 PolarHBondContact O-NE1 2.96Å; Q96-W100 VanDerWaalsContact OE1-CZ2 3.23Å
97L98Very high97.4Very high28 Ų2855.1 Ų55.115%0.14726%0.259CS..Hα-helixtrans-61.1-40.9178.3-173.163.1000111.8L93 L94 L95 W100 V101 L140 T143 L147L93-L97 VanDerWaalsContact O-CB 3.31Å; L93-L97 WeakPolarHBondContact O-CB 3.39Å; L93-L97 PolarHBondContact O-N 2.96Å; L94-L97 PolarHBondContact O-N 3.49Å; L95-L97 VanDerWaalsContact C-N 3.32Å; L95-L97 PolarHBondContact O-N 3.48Å; L97-W100 HydrophobicContact CD1-CE3 4.17Å; L97-W100 PolarHBondContact O-N 3.48Å; L97-V101 WeakPolarHBondContact O-CB 3.4Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.43Å; L97-V101 PolarHBondContact O-N 3.5Å; L97-L140 HydrophobicContact CD1-CD1 4.22Å; L97-L140 HydrophobicContact CD2-CD1 3.65Å; L97-L140 HydrophobicContact CG-CD1 3.92Å; L97-T143 HydrophobicContact CD1-CG2 3.68Å; L97-L147 HydrophobicContact CD1-CD1 4.39Å
98L98.3Very high97.5Very high88 Ų8849 Ų4946%0.46124%0.236SC..Hα-helixtrans-62.2-47.4173.8179.461.9000111.5L94 L95 Q96 W100 V101 L102L94-L98 PolarHBondContact O-N 3.41Å; L95-L98 PolarHBondContact O-N 3.44Å; Q96-L98 VanDerWaalsContact C-N 3.32Å; Q96-L98 PolarHBondContact O-N 3.35Å; L98-W100 VanDerWaalsContact C-N 3.32Å; L98-W100 PolarHBondContact O-N 3.36Å; L98-V101 PolarHBondContact O-N 2.91Å; L98-L102 HydrophobicContact CD1-CD1 4.47Å; L98-L102 HydrophobicContact CD1-CG 4.33Å; L98-L102 HydrophobicContact CG-CD1 4.3Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.5Å; L98-L102 PolarHBondContact O-N 3.4Å
99D98.5Very high97.6Very high8 Ų848.4 Ų48.44%0.04323%0.233CC..Hα-helixtrans-57-44.9175.3177.572000111.7F84 M88 L95 Q96 V101 L102 R103 P114F84-D99 WeakPolarHBondContact CE1-OD1 3.36Å; M88-D99 HydrophobicContact CE-CB 4.07Å; M88-D99 HydrophobicContact CG-CB 3.82Å; M88-D99 HydrophobicContact SD-CB 4.17Å; L95-D99 PolarHBondContact O-N 2.91Å; Q96-D99 WeakPolarHBondContact O-CB 3.41Å; Q96-D99 PolarHBondContact O-N 2.97Å; D99-V101 PolarHBondContact O-N 2.91Å; D99-L102 PolarHBondContact O-N 2.97Å; D99-R103 WeakPolarHBondContact O-CB 3.32Å; D99-R103 WeakPolarHBondContact O-CG 3.46Å; D99-R103 PolarHBondContact O-N 2.95Å; D99-R103 IonicContact OD1-CZ 2.56Å; D99-R103 IonicContact OD1-NE 3.56Å; D99-R103 PolarHBondContact OD1-NE 2.94Å; D99-R103 IonicContact OD1-NH2 3.57Å; D99-R103 WeakPolarHBondContact OD2-CD 3.49Å; D99-R103 IonicContact OD2-CZ 3.59Å; D99-R103 IonicContact OD2-NE 3.71Å; D99-R103 PolarHBondContact OD2-NE 3.23Å; D99-P114 VanDerWaalsContact OD1-CB 3.29Å; D99-P114 WeakPolarHBondContact OD1-CB 3.46Å; D99-P114 WeakPolarHBondContact OD1-CG 3.42Å
100W98.6Very high97.9Very high12 Ų1243 Ų435%0.04521%0.207CC..Hα-helixtrans-66-36.5179.2-55.5-12.4000112.4L93 Q96 L97 L98 G104 T143 L147 I156 A157L93-W100 HydrophobicContact CD1-CH2 4.08Å; L93-W100 HydrophobicContact CD1-CZ3 4.25Å; Q96-W100 HydrophobicContact CB-CD2 4.45Å; Q96-W100 HydrophobicContact CB-CH2 4.14Å; Q96-W100 HydrophobicContact CB-CZ2 3.68Å; Q96-W100 HydrophobicContact CG-CZ2 4.48Å; Q96-W100 VanDerWaalsContact O-CD2 3.31Å; Q96-W100 PolarHBondContact O-N 3.38Å; Q96-W100 PolarHBondContact O-NE1 2.96Å; Q96-W100 VanDerWaalsContact OE1-CZ2 3.23Å; L97-W100 HydrophobicContact CD1-CE3 4.17Å; L97-W100 PolarHBondContact O-N 3.48Å; L98-W100 VanDerWaalsContact C-N 3.32Å; L98-W100 PolarHBondContact O-N 3.36Å; W100-G104 PolarHBondContact O-N 3.05Å; W100-T143 HydrophobicContact CB-CG2 4.19Å; W100-T143 HydrophobicContact CE3-CG2 4Å; W100-L147 HydrophobicContact CH2-CD2 4.25Å; W100-L147 HydrophobicContact CZ3-CD1 3.94Å; W100-L147 HydrophobicContact CZ3-CD2 3.73Å; W100-L147 HydrophobicContact CZ3-CG 4.34Å; W100-I156 HydrophobicContact CD2-CG2 3.85Å; W100-I156 HydrophobicContact CE3-CG2 3.54Å; W100-I156 HydrophobicContact CG-CG2 4.4Å; W100-I156 HydrophobicContact CZ3-CG2 3.96Å; W100-A157 VanDerWaalsContact CD1-CA 3.44Å
101V98.8Very high98Very high2 Ų234.6 Ų34.61%0.01217%0.171CC..Hα-helixtrans-66.3-44.6173.6165.80000110.9L97 L98 D99 G104 A105 F121 F136 T139 L140L97-V101 WeakPolarHBondContact O-CB 3.4Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.43Å; L97-V101 PolarHBondContact O-N 3.5Å; L98-V101 PolarHBondContact O-N 2.91Å; D99-V101 PolarHBondContact O-N 2.91Å; V101-G104 PolarHBondContact O-N 3.32Å; V101-A105 PolarHBondContact O-N 3.22Å; V101-F121 HydrophobicContact CG1-CE2 4.05Å; V101-F121 HydrophobicContact CG1-CZ 4.11Å; V101-F136 HydrophobicContact CG1-CD2 3.96Å; V101-F136 HydrophobicContact CG1-CE2 3.98Å; V101-T139 HydrophobicContact CB-CG2 4.23Å; V101-T139 HydrophobicContact CG1-CG2 3.96Å; V101-T139 HydrophobicContact CG2-CG2 4.25Å; V101-L140 HydrophobicContact CG2-CB 4.43Å; V101-L140 HydrophobicContact CG2-CD1 4.24Å
102L98.8Very high98.1Very high26 Ų2633.6 Ų33.614%0.13617%0.167CC..Hα-helixtrans-63.8-47177.3-66.7176.9000111.3L98 D99 G104 A105 A106 P114 G117 L118 F121L98-L102 HydrophobicContact CD1-CD1 4.47Å; L98-L102 HydrophobicContact CD1-CG 4.33Å; L98-L102 HydrophobicContact CG-CD1 4.3Å; L98-L102 VanDerWaalsContact O-CG 3.31Å; L98-L102 WeakPolarHBondContact O-CG 3.5Å; L98-L102 PolarHBondContact O-N 3.4Å; D99-L102 PolarHBondContact O-N 2.97Å; L102-G104 VanDerWaalsContact C-N 3.28Å; L102-G104 PolarHBondContact O-N 3.42Å; L102-A105 WeakPolarHBondContact O-CB 3.43Å; L102-A105 PolarHBondContact O-N 3.25Å; L102-A106 PolarHBondContact O-N 3.03Å; L102-P114 HydrophobicContact CB-CB 3.98Å; L102-P114 HydrophobicContact CD1-CB 4.36Å; L102-G117 WeakPolarHBondContact O-CA 3.47Å; L102-L118 HydrophobicContact CD2-CB 4.26Å; L102-L118 HydrophobicContact CD2-CD1 4.44Å; L102-F121 HydrophobicContact CD2-CD2 3.72Å; L102-F121 HydrophobicContact CD2-CE2 4.09Å
103R98.8Very high98.2Very high8 Ų827.7 Ų27.73%0.0314%0.141CC..Hα-helixtrans-59.7-40.7173-70.5171.9-177.1-83.5-1.1111.2D80 D99 A105 A106 Q107 N112 P114 A157D80-R103 PolarHBondContact O-NH1 2.94Å; D99-R103 WeakPolarHBondContact O-CB 3.32Å; D99-R103 WeakPolarHBondContact O-CG 3.46Å; D99-R103 PolarHBondContact O-N 2.95Å; D99-R103 IonicContact OD1-CZ 2.56Å; D99-R103 IonicContact OD1-NE 3.56Å; D99-R103 PolarHBondContact OD1-NE 2.94Å; D99-R103 IonicContact OD1-NH2 3.57Å; D99-R103 WeakPolarHBondContact OD2-CD 3.49Å; D99-R103 IonicContact OD2-CZ 3.59Å; D99-R103 IonicContact OD2-NE 3.71Å; D99-R103 PolarHBondContact OD2-NE 3.23Å; R103-A105 VanDerWaalsContact C-N 3.32Å; R103-A105 PolarHBondContact O-N 3.29Å; R103-A106 PolarHBondContact O-N 2.89Å; R103-A106 VanDerWaalsContact O-N 3.17Å; R103-Q107 WeakPolarHBondContact O-CB 3.4Å; R103-Q107 VanDerWaalsContact O-CG 3.23Å; R103-Q107 WeakPolarHBondContact O-CG 3.42Å; R103-Q107 PolarHBondContact O-N 3.42Å; R103-N112 WeakPolarHBondContact CD-OD1 3.46Å; R103-N112 PolarHBondContact NH1-O 3.11Å; R103-N112 PolarHBondContact NH1-OD1 3.3Å; R103-P114 HydrophobicContact CG-CB 4.11Å; R103-P114 HydrophobicContact CG-CG 4.45Å; R103-A157 WeakPolarHBondContact CD-O 3.44Å
104G98.7Very high98.3Very high0 Ų023 Ų230%012%0.117CC..Hα-helixtrans-58.3-40.817500000113.1W100 V101 L102 Q107 G159 Y163W100-G104 PolarHBondContact O-N 3.05Å; V101-G104 PolarHBondContact O-N 3.32Å; L102-G104 VanDerWaalsContact C-N 3.28Å; L102-G104 PolarHBondContact O-N 3.42Å; G104-Q107 PolarHBondContact O-N 3.01Å; G104-G159 WeakPolarHBondContact CA-O 3.35Å; G104-Y163 WeakPolarHBondContact O-CA 3.13Å; G104-Y163 WeakPolarHBondContact O-CB 3.22Å
105A98.8Very high98.4Very high0 Ų019.9 Ų19.90%010%0.101CC..Hα-helixtrans-62.9-43.4174.600000112.1V101 L102 R103 I120 F121 I166 Y273V101-A105 PolarHBondContact O-N 3.22Å; L102-A105 WeakPolarHBondContact O-CB 3.43Å; L102-A105 PolarHBondContact O-N 3.25Å; R103-A105 VanDerWaalsContact C-N 3.32Å; R103-A105 PolarHBondContact O-N 3.29Å; A105-I120 HydrophobicContact CB-CG2 4.42Å; A105-F121 HydrophobicContact CB-CD2 3.97Å; A105-F121 HydrophobicContact CB-CE2 3.51Å; A105-F121 HydrophobicContact CB-CZ 4.1Å; A105-I166 HydrophobicContact CB-CD1 3.54Å; A105-Y273 WeakPolarHBondContact O-CE1 3.13Å; A105-Y273 PolarHBondContact O-OH 3.42Å
106A98.7Very high98.5Very high0 Ų017.1 Ų17.10%09%0.087CC..Hα-helixtrans-70.9-3017900000113.7L102 R103 V108 M109 V111 I120L102-A106 PolarHBondContact O-N 3.03Å; R103-A106 PolarHBondContact O-N 2.89Å; R103-A106 VanDerWaalsContact O-N 3.17Å; A106-V108 PolarHBondContact O-N 3.08Å; A106-V108 VanDerWaalsContact O-N 3.14Å; A106-M109 PolarHBondContact O-N 3.41Å; A106-M109 VanDerWaalsContact O-N 3.1Å; A106-V111 CarbonylContact C-O 3.18Å; A106-V111 HydrophobicContact CB-CB 4Å; A106-V111 HydrophobicContact CB-CG1 3.93Å; A106-V111 WeakPolarHBondContact CB-O 3.38Å; A106-V111 PolarHBondContact O-N 3.28Å; A106-I120 HydrophobicContact CB-CD1 4.08Å
107Q98.7Very high98.5Very high20 Ų2015.3 Ų15.39%0.0938%0.078CC..Hα-helixtrans-65.6-16.2-177.7-82.8-69.48.200114.4R103 G104 M109 F110 V111 A158 L160 Y163R103-Q107 WeakPolarHBondContact O-CB 3.4Å; R103-Q107 VanDerWaalsContact O-CG 3.23Å; R103-Q107 WeakPolarHBondContact O-CG 3.42Å; R103-Q107 PolarHBondContact O-N 3.42Å; G104-Q107 PolarHBondContact O-N 3.01Å; Q107-M109 PolarHBondContact O-N 3.03Å; Q107-F110 PolarHBondContact O-N 3.4Å; Q107-V111 WeakPolarHBondContact CA-O 3.45Å; Q107-V111 PolarHBondContact N-O 3Å; Q107-V111 VanDerWaalsContact N-O 3.14Å; Q107-A158 WeakPolarHBondContact CG-O 3.34Å; Q107-A158 PolarHBondContact NE2-O 3.4Å; Q107-L160 HydrophobicContact CG-CD2 4.49Å; Q107-Y163 HydrophobicContact CB-CD1 3.89Å; Q107-Y163 HydrophobicContact CB-CG 4.05Å
108V98.8Very high98.6Very high1 Ų118.7 Ų18.71%0.00610%0.096CC..THydrogen-bonded Turntrans-54.9-35.6170.9169.40000111.2A106 I166 L167 V272 Y273 L331A106-V108 PolarHBondContact O-N 3.08Å; A106-V108 VanDerWaalsContact O-N 3.14Å; V108-I166 HydrophobicContact CG2-CG2 3.32Å; V108-L167 HydrophobicContact CG1-CD1 4.1Å; V108-L167 HydrophobicContact CG1-CD2 3.88Å; V108-L167 HydrophobicContact CG1-CG 4.22Å; V108-L167 HydrophobicContact CG2-CD1 4.21Å; V108-L167 HydrophobicContact CG2-CD2 4.14Å; V108-L167 HydrophobicContact CG2-CG 3.87Å; V108-V272 HydrophobicContact CG1-CG1 3.58Å; V108-Y273 HydrophobicContact CB-CE1 3.71Å; V108-Y273 HydrophobicContact CB-CE2 4.42Å; V108-Y273 WeakPolarHBondContact CB-OH 3.39Å; V108-Y273 HydrophobicContact CG1-CD1 4.36Å; V108-Y273 HydrophobicContact CG1-CE1 3.85Å; V108-Y273 HydrophobicContact CG1-CE2 4.08Å; V108-Y273 HydrophobicContact CG2-CD1 4.41Å; V108-Y273 HydrophobicContact CG2-CE1 3.63Å; V108-L331 WeakPolarHBondContact O-CD2 3.33Å
109M98.5Very high98.6Very high1 Ų115.9 Ų15.91%0.0058%0.082CC..THydrogen-bonded Turntrans-106.126.4176.4-57.7-167.87500112.1A106 Q107 V111 I269 V272 Y273 L288 A299 V330 L331 I334A106-M109 PolarHBondContact O-N 3.41Å; A106-M109 VanDerWaalsContact O-N 3.1Å; Q107-M109 PolarHBondContact O-N 3.03Å; M109-V111 VanDerWaalsContact C-N 3.26Å; M109-V111 PolarHBondContact O-N 3.22Å; M109-I269 HydrophobicContact CE-CG2 4.18Å; M109-I269 HydrophobicContact SD-CG2 4.48Å; M109-V272 HydrophobicContact CE-CG2 4.26Å; M109-V272 HydrophobicContact CG-CG1 3.9Å; M109-V272 HydrophobicContact SD-CG1 4.29Å; M109-Y273 HydrophobicContact CG-CE2 4.01Å; M109-Y273 HydrophobicContact SD-CE2 3.95Å; M109-L288 HydrophobicContact CB-CD2 3.75Å; M109-L288 HydrophobicContact CE-CD1 3.56Å; M109-L288 HydrophobicContact CE-CD2 4.26Å; M109-L288 HydrophobicContact CE-CG 4.42Å; M109-L288 HydrophobicContact CG-CD2 4.45Å; M109-L288 HydrophobicContact SD-CD1 4.03Å; M109-L288 HydrophobicContact SD-CD2 3.96Å; M109-L288 HydrophobicContact SD-CG 4.31Å; M109-A299 HydrophobicContact CE-CB 4.36Å; M109-V330 HydrophobicContact CE-CG1 3.36Å; M109-L331 HydrophobicContact CG-CD2 4.31Å; M109-I334 HydrophobicContact CE-CD1 3.64Å
110F98.5Very high98.6Very high25 Ų2515.6 Ų15.611%0.118%0.081CC..THydrogen-bonded Turntrans63.421.9179.2-39.4-79.4000115.6Q107 F215 L331 I334 A335 M339 F340 F381Q107-F110 PolarHBondContact O-N 3.4Å; F110-F215 AromaticContact CE1-CD1 3.71Å; F110-F215 HydrophobicContact CE1-CD1 3.71Å; F110-F215 AromaticContact CE1-CE1 3.75Å; F110-F215 HydrophobicContact CE1-CE1 3.75Å; F110-F215 HydrophobicContact CZ-CD1 4.23Å; F110-F215 HydrophobicContact CZ-CE1 4.12Å; F110-L331 HydrophobicContact CE2-CD2 4.17Å; F110-I334 HydrophobicContact CD2-CB 4.24Å; F110-I334 HydrophobicContact CD2-CG2 3.51Å; F110-I334 HydrophobicContact CE2-CB 4.26Å; F110-I334 HydrophobicContact CE2-CG2 4.01Å; F110-A335 HydrophobicContact CE2-CB 4.13Å; F110-A335 HydrophobicContact CZ-CB 4.01Å; F110-M339 HydrophobicContact CB-CE 3.68Å; F110-M339 HydrophobicContact CB-CG 4.43Å; F110-M339 WeakPolarHBondContact O-CE 3.44Å; F110-F340 AromaticContact CD1-CE2 3.91Å; F110-F340 HydrophobicContact CD1-CE2 3.91Å; F110-F340 HydrophobicContact CD1-CZ 4.14Å; F110-F340 AromaticContact CE1-CE2 3.89Å; F110-F340 HydrophobicContact CE1-CE2 3.89Å; F110-F340 HydrophobicContact CE1-CZ 4.31Å; F110-F340 HydrophobicContact CZ-CE2 4.45Å; F110-F381 HydrophobicContact CE1-CZ 4.12Å; F110-F381 HydrophobicContact CZ-CE1 4.43Å; F110-F381 AromaticContact CZ-CE2 3.8Å; F110-F381 HydrophobicContact CZ-CE2 3.8Å; F110-F381 AromaticContact CZ-CZ 3.47Å; F110-F381 HydrophobicContact CZ-CZ 3.47Å; F110-F381 VanDerWaalsContact CZ-CZ 3.47Å
111V98.4Very high98.6Very high4 Ų416 Ų162%0.0248%0.083CC..  trans-98.2124.8-179.3171.30000110.2A106 Q107 M109 N113 L288 S291 T295A106-V111 CarbonylContact C-O 3.18Å; A106-V111 HydrophobicContact CB-CB 4Å; A106-V111 HydrophobicContact CB-CG1 3.93Å; A106-V111 WeakPolarHBondContact CB-O 3.38Å; A106-V111 PolarHBondContact O-N 3.28Å; Q107-V111 WeakPolarHBondContact CA-O 3.45Å; Q107-V111 PolarHBondContact N-O 3Å; Q107-V111 VanDerWaalsContact N-O 3.14Å; M109-V111 VanDerWaalsContact C-N 3.26Å; M109-V111 PolarHBondContact O-N 3.22Å; V111-N113 HydrophobicContact CG1-CB 3.54Å; V111-N113 PolarHBondContact O-N 3.31Å; V111-L288 HydrophobicContact CG2-CD2 3.75Å; V111-S291 VanDerWaalsContact CG1-CB 3.48Å; V111-S291 WeakPolarHBondContact CG1-OG 3.38Å; V111-T295 HydrophobicContact CG2-CG2 4.39Å
112N98.2Very high98.6Very high30 Ų3018.5 Ų18.516%0.1610%0.104CC..  trans-98.959.1175.4-173.911.6000111.5D80 R103 A158D80-N112 CarbonylContact C-O 3.12Å; D80-N112 VanDerWaalsContact C-O 3.29Å; D80-N112 WeakPolarHBondContact CA-O 3.5Å; D80-N112 HydrophobicContact CB-CB 4.22Å; R103-N112 WeakPolarHBondContact CD-OD1 3.46Å; R103-N112 PolarHBondContact NH1-O 3.11Å; R103-N112 PolarHBondContact NH1-OD1 3.3Å; N112-A158 PolarHBondContact OD1-O 3.44Å
113N98.5Very high98.6Very high0 Ų017.3 Ų17.30%010%0.097CC..  trans-136.3116.9-173.4-173.8-50.3000111.3F77 G79 M81 V111 L115 S116 G117F77-N113 PolarHBondContact O-ND2 3.17Å; G79-N113 WeakPolarHBondContact O-CB 3.28Å; G79-N113 PolarHBondContact O-ND2 2.96Å; M81-N113 WeakPolarHBondContact CG-ND2 3.45Å; M81-N113 PolarHBondContact SD-OD1 3.15Å; V111-N113 HydrophobicContact CG1-CB 3.54Å; V111-N113 PolarHBondContact O-N 3.31Å; N113-L115 VanDerWaalsContact C-N 3.33Å; N113-L115 PolarHBondContact O-N 2.87Å; N113-L115 WeakPolarHBondContact OD1-CA 3.42Å; N113-L115 VanDerWaalsContact OD1-CB 3.3Å; N113-L115 WeakPolarHBondContact OD1-CB 3.38Å; N113-L115 PolarHBondContact OD1-N 2.96Å; N113-S116 WeakPolarHBondContact O-CB 3.28Å; N113-S116 PolarHBondContact O-N 2.79Å; N113-S116 PolarHBondContact OD1-N 3.23Å; N113-G117 PolarHBondContact O-N 3.41Å
114P98.3Very high98.6Very high7 Ų717 Ų175%0.04510%0.096CC..Hα-helixtrans-69-29.4-177.927.2-34.6000112.8M81 F84 D99 L102 R103 G117 L118M81-P114 HydrophobicContact CE-CG 4.27Å; M81-P114 HydrophobicContact SD-CG 3.86Å; F84-P114 HydrophobicContact CD1-CG 3.81Å; F84-P114 HydrophobicContact CE1-CB 4.46Å; F84-P114 HydrophobicContact CE1-CG 3.76Å; D99-P114 VanDerWaalsContact OD1-CB 3.29Å; D99-P114 WeakPolarHBondContact OD1-CB 3.46Å; D99-P114 WeakPolarHBondContact OD1-CG 3.42Å; L102-P114 HydrophobicContact CB-CB 3.98Å; L102-P114 HydrophobicContact CD1-CB 4.36Å; R103-P114 HydrophobicContact CG-CB 4.11Å; R103-P114 HydrophobicContact CG-CG 4.45Å; P114-G117 PolarHBondContact O-N 3.5Å; P114-L118 PolarHBondContact O-N 3.27Å
115L98.3Very high98.6Very high62 Ų6220.7 Ų20.733%0.32512%0.115SC..Hα-helixtrans-68.3-44173.7178.462.9000110.7F77 M81 N113 G117 L118 V119 I290F77-L115 HydrophobicContact CB-CD2 4.02Å; M81-L115 HydrophobicContact SD-CB 3.97Å; N113-L115 VanDerWaalsContact C-N 3.33Å; N113-L115 PolarHBondContact O-N 2.87Å; N113-L115 WeakPolarHBondContact OD1-CA 3.42Å; N113-L115 VanDerWaalsContact OD1-CB 3.3Å; N113-L115 WeakPolarHBondContact OD1-CB 3.38Å; N113-L115 PolarHBondContact OD1-N 2.96Å; L115-G117 VanDerWaalsContact C-N 3.26Å; L115-G117 PolarHBondContact O-N 3.38Å; L115-L118 HydrophobicContact CD1-CD2 4.47Å; L115-L118 WeakPolarHBondContact O-CB 3.23Å; L115-L118 PolarHBondContact O-N 2.96Å; L115-V119 WeakPolarHBondContact O-CG2 3.23Å; L115-V119 PolarHBondContact O-N 2.87Å; L115-I290 HydrophobicContact CD2-CG2 3.98Å; L115-I290 HydrophobicContact CG-CG2 4.4Å
116S98.6Very high98.6Very high0 Ų024.9 Ų24.90%014%0.137CC..Hα-helixtrans-57.4-42.5170.9-65.10000111.2N113 L118 V119 I120 S287N113-S116 WeakPolarHBondContact O-CB 3.28Å; N113-S116 PolarHBondContact O-N 2.79Å; N113-S116 PolarHBondContact OD1-N 3.23Å; S116-L118 PolarHBondContact O-N 2.89Å; S116-V119 PolarHBondContact O-N 3.38Å; S116-I120 WeakPolarHBondContact O-CD1 3.37Å; S116-I120 WeakPolarHBondContact O-CG1 3.45Å; S116-I120 PolarHBondContact O-N 2.93Å; S116-S287 WeakPolarHBondContact CA-OG 3.47Å; S116-S287 WeakPolarHBondContact CB-O 3.3Å; S116-S287 WeakPolarHBondContact CB-OG 3.09Å; S116-S287 PolarHBondContact O-OG 3.46Å; S116-S287 PolarHBondContact OG-O 2.92Å
117G98.6Very high98.6Very high0 Ų026.4 Ų26.40%014%0.144CC..Hα-helixtrans-59.3-42.9174.800000113.7L102 N113 P114 L115 I120 F121L102-G117 WeakPolarHBondContact O-CA 3.47Å; N113-G117 PolarHBondContact O-N 3.41Å; P114-G117 PolarHBondContact O-N 3.5Å; L115-G117 VanDerWaalsContact C-N 3.26Å; L115-G117 PolarHBondContact O-N 3.38Å; G117-I120 PolarHBondContact O-N 3.47Å; G117-F121 WeakPolarHBondContact O-CD2 3.43Å; G117-F121 PolarHBondContact O-N 3.13Å
118L98.7Very high98.6Very high98 Ų9826.8 Ų26.851%0.51315%0.147SC..Hα-helixtrans-62.5-44.4175.7-179.366.1000111.6L102 P114 L115 S116 I120 F121 A122L102-L118 HydrophobicContact CD2-CB 4.26Å; L102-L118 HydrophobicContact CD2-CD1 4.44Å; P114-L118 PolarHBondContact O-N 3.27Å; L115-L118 HydrophobicContact CD1-CD2 4.47Å; L115-L118 WeakPolarHBondContact O-CB 3.23Å; L115-L118 PolarHBondContact O-N 2.96Å; S116-L118 PolarHBondContact O-N 2.89Å; L118-I120 VanDerWaalsContact C-N 3.31Å; L118-I120 PolarHBondContact O-N 3.31Å; L118-F121 PolarHBondContact O-N 3.04Å; L118-A122 PolarHBondContact O-N 3.29Å
119V98.8Very high98.6Very high30 Ų3034.4 Ų34.418%0.18218%0.177CC..Hα-helixtrans-63.7-38.1176.4176.80000110.9L115 S116 A122 G123 I283 I290L115-V119 WeakPolarHBondContact O-CG2 3.23Å; L115-V119 PolarHBondContact O-N 2.87Å; S116-V119 PolarHBondContact O-N 3.38Å; V119-A122 WeakPolarHBondContact O-CB 3.3Å; V119-A122 PolarHBondContact O-N 2.94Å; V119-G123 PolarHBondContact O-N 2.7Å; V119-I283 HydrophobicContact CG1-CG2 3.53Å; V119-I283 WeakPolarHBondContact O-CG2 3.31Å; V119-I290 HydrophobicContact CG2-CD1 4.1Å
120I98.8Very high98.6Very high2 Ų234.3 Ų34.31%0.0118%0.177CC..Hα-helixtrans-62.6-47.1173.5-74.4155.3000110.8A105 A106 S116 G117 L118 A122 G123 L124 Y273 F284 S287A105-I120 HydrophobicContact CB-CG2 4.42Å; A106-I120 HydrophobicContact CB-CD1 4.08Å; S116-I120 WeakPolarHBondContact O-CD1 3.37Å; S116-I120 WeakPolarHBondContact O-CG1 3.45Å; S116-I120 PolarHBondContact O-N 2.93Å; G117-I120 PolarHBondContact O-N 3.47Å; L118-I120 VanDerWaalsContact C-N 3.31Å; L118-I120 PolarHBondContact O-N 3.31Å; I120-A122 VanDerWaalsContact C-N 3.27Å; I120-A122 PolarHBondContact O-N 2.88Å; I120-G123 CarbonylContact O-C 3.59Å; I120-G123 WeakPolarHBondContact O-CA 3.49Å; I120-G123 PolarHBondContact O-N 3.22Å; I120-L124 HydrophobicContact CG2-CD1 4.16Å; I120-L124 HydrophobicContact CG2-CG 4.32Å; I120-L124 WeakPolarHBondContact O-CG 3.47Å; I120-L124 PolarHBondContact O-N 3.18Å; I120-Y273 WeakPolarHBondContact CD1-OH 3.09Å; I120-Y273 HydrophobicContact CG2-CD1 4.44Å; I120-Y273 HydrophobicContact CG2-CE1 3.85Å; I120-Y273 HydrophobicContact CG2-CE2 4.38Å; I120-F284 HydrophobicContact CB-CD1 4.35Å; I120-F284 HydrophobicContact CB-CE1 4.21Å; I120-F284 HydrophobicContact CG1-CD1 3.95Å; I120-F284 HydrophobicContact CG1-CE1 4.28Å; I120-F284 HydrophobicContact CG2-CD1 4.45Å; I120-F284 HydrophobicContact CG2-CE1 3.96Å; I120-F284 HydrophobicContact CG2-CZ 4.38Å; I120-F284 WeakPolarHBondContact O-CE1 3.28Å; I120-S287 WeakPolarHBondContact CD1-OG 3.48Å; I120-S287 WeakPolarHBondContact CG1-OG 3.3Å
121F98.8Very high98.6Very high21 Ų2135 Ų359%0.09218%0.178CC..Hα-helixtrans-59.7-37.5175.3-87.7-67.3000112.7V101 L102 A105 G117 L118 G123 L124 I125 F136 I166V101-F121 HydrophobicContact CG1-CE2 4.05Å; V101-F121 HydrophobicContact CG1-CZ 4.11Å; L102-F121 HydrophobicContact CD2-CD2 3.72Å; L102-F121 HydrophobicContact CD2-CE2 4.09Å; A105-F121 HydrophobicContact CB-CD2 3.97Å; A105-F121 HydrophobicContact CB-CE2 3.51Å; A105-F121 HydrophobicContact CB-CZ 4.1Å; G117-F121 WeakPolarHBondContact O-CD2 3.43Å; G117-F121 PolarHBondContact O-N 3.13Å; L118-F121 PolarHBondContact O-N 3.04Å; F121-G123 VanDerWaalsContact C-N 3.32Å; F121-G123 PolarHBondContact O-N 3.5Å; F121-L124 HydrophobicContact CD1-CD1 4.06Å; F121-L124 HydrophobicContact CE1-CD1 4.3Å; F121-L124 PolarHBondContact O-N 2.83Å; F121-I125 WeakPolarHBondContact O-CB 3.45Å; F121-I125 VanDerWaalsContact O-CG1 3.26Å; F121-I125 WeakPolarHBondContact O-CG1 3.49Å; F121-I125 PolarHBondContact O-N 2.99Å; F121-F136 HydrophobicContact CE1-CB 3.87Å; F121-F136 HydrophobicContact CE1-CD2 4.39Å; F121-F136 HydrophobicContact CZ-CB 4.27Å; F121-F136 HydrophobicContact CZ-CD2 4.19Å; F121-I166 HydrophobicContact CE1-CD1 4.2Å; F121-I166 HydrophobicContact CZ-CD1 3.95Å
122A98.7Very high98.6Very high54 Ų5435.1 Ų35.145%0.44618%0.18SC..Hα-helixtrans-60.9-40.9173.300000112L118 V119 I120 I125 L126L118-A122 PolarHBondContact O-N 3.29Å; V119-A122 WeakPolarHBondContact O-CB 3.3Å; V119-A122 PolarHBondContact O-N 2.94Å; I120-A122 VanDerWaalsContact C-N 3.27Å; I120-A122 PolarHBondContact O-N 2.88Å; A122-I125 PolarHBondContact O-N 3.22Å; A122-L126 PolarHBondContact O-N 3.22Å
123G98.8Very high98.6Very high0 Ų036.2 Ų36.20%019%0.185CC..Hα-helixtrans-66.2-38.7173.600000113.5V119 I120 F121 L126 Q127 T280V119-G123 PolarHBondContact O-N 2.7Å; I120-G123 CarbonylContact O-C 3.59Å; I120-G123 WeakPolarHBondContact O-CA 3.49Å; I120-G123 PolarHBondContact O-N 3.22Å; F121-G123 VanDerWaalsContact C-N 3.32Å; F121-G123 PolarHBondContact O-N 3.5Å; G123-L126 WeakPolarHBondContact O-CB 3.43Å; G123-L126 PolarHBondContact O-N 3.12Å; G123-Q127 PolarHBondContact O-N 3.35Å; G123-T280 WeakPolarHBondContact O-CG2 3.48Å; G123-T280 PolarHBondContact O-OG1 3.31Å
124L98.8Very high98.7Very high1 Ų136.2 Ų36.21%0.00519%0.185CC..Hα-helixtrans-64.7-40.7174.7-66.6175.5000111.6I120 F121 L126 Q127 N128 A132 I166 L170 Y273 F284I120-L124 HydrophobicContact CG2-CD1 4.16Å; I120-L124 HydrophobicContact CG2-CG 4.32Å; I120-L124 WeakPolarHBondContact O-CG 3.47Å; I120-L124 PolarHBondContact O-N 3.18Å; F121-L124 HydrophobicContact CD1-CD1 4.06Å; F121-L124 HydrophobicContact CE1-CD1 4.3Å; F121-L124 PolarHBondContact O-N 2.83Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-Q127 WeakPolarHBondContact O-CB 3.35Å; L124-Q127 PolarHBondContact O-N 3.08Å; L124-N128 CarbonylContact O-C 3.59Å; L124-N128 PolarHBondContact O-N 3.4Å; L124-A132 HydrophobicContact CB-CB 3.89Å; L124-I166 HydrophobicContact CD1-CD1 3.97Å; L124-L170 HydrophobicContact CD1-CD1 4.3Å; L124-L170 HydrophobicContact CD1-CD2 4.41Å; L124-L170 HydrophobicContact CD2-CD1 4.06Å; L124-L170 HydrophobicContact CD2-CD2 3.93Å; L124-Y273 HydrophobicContact CD2-CD1 4.42Å; L124-Y273 HydrophobicContact CD2-CG 4.38Å; L124-F284 HydrophobicContact CD2-CZ 3.9Å; L124-F284 HydrophobicContact CG-CZ 4.21Å
125I98.7Very high98.7Very high78 Ų7835.9 Ų35.940%0.418%0.183SC..Hα-helixtrans-63.6-41.1174.9-71.1166.6000110.7F121 A122 Q127 Y129 A132F121-I125 WeakPolarHBondContact O-CB 3.45Å; F121-I125 VanDerWaalsContact O-CG1 3.26Å; F121-I125 WeakPolarHBondContact O-CG1 3.49Å; F121-I125 PolarHBondContact O-N 2.99Å; A122-I125 PolarHBondContact O-N 3.22Å; I125-Q127 VanDerWaalsContact C-N 3.29Å; I125-Q127 PolarHBondContact O-N 3.16Å; I125-Y129 HydrophobicContact CG2-CD1 3.77Å; I125-Y129 HydrophobicContact CG2-CE1 3.44Å; I125-Y129 VanDerWaalsContact CG2-CE1 3.44Å; I125-A132 HydrophobicContact CG1-CB 3.88Å
126L98.6Very high98.7Very high89 Ų8936.7 Ų36.747%0.46618%0.184SC..Hα-helixtrans-63-35.7174.3179.466.5000112.3A122 G123 L124 W279 I283A122-L126 PolarHBondContact O-N 3.22Å; G123-L126 WeakPolarHBondContact O-CB 3.43Å; G123-L126 PolarHBondContact O-N 3.12Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L126-W279 HydrophobicContact CD2-CB 3.8Å; L126-I283 HydrophobicContact CD2-CD1 3.55Å
127Q98.6Very high98.7Very high31 Ų3137.4 Ų37.415%0.14519%0.189CC..Hα-helixtrans-67.1-61.8175.8175.367.944.200110.5G123 L124 I125 W131 C275 D276 T280G123-Q127 PolarHBondContact O-N 3.35Å; L124-Q127 WeakPolarHBondContact O-CB 3.35Å; L124-Q127 PolarHBondContact O-N 3.08Å; I125-Q127 VanDerWaalsContact C-N 3.29Å; I125-Q127 PolarHBondContact O-N 3.16Å; Q127-W131 HydrophobicContact CG-CE3 3.51Å; Q127-W131 HydrophobicContact CG-CZ3 3.53Å; Q127-W131 VanDerWaalsContact NE2-CZ3 3.32Å; Q127-C275 HydrophobicContact CB-CB 4.3Å; Q127-C275 HydrophobicContact CG-CB 3.89Å; Q127-D276 PolarHBondContact NE2-OD1 3.49Å; Q127-D276 PolarHBondContact OE1-OD1 3.28Å; Q127-T280 HydrophobicContact CB-CG2 4.22Å
128N98.7Very high98.7Very high29 Ų2937.4 Ų37.416%0.15519%0.189CC..  trans-165.9125.1-176.9-172.8-49.2000110.6L124 W130 W131 A132 D180L124-N128 CarbonylContact O-C 3.59Å; L124-N128 PolarHBondContact O-N 3.4Å; N128-W130 VanDerWaalsContact C-N 3.33Å; N128-W130 PolarHBondContact O-N 3.13Å; N128-W130 WeakPolarHBondContact OD1-CA 3.44Å; N128-W130 VanDerWaalsContact OD1-CB 3.26Å; N128-W130 WeakPolarHBondContact OD1-CB 3.33Å; N128-W130 PolarHBondContact OD1-N 3.4Å; N128-W131 HydrophobicContact CB-CB 4.02Å; N128-W131 HydrophobicContact CB-CD2 3.64Å; N128-W131 HydrophobicContact CB-CE3 4.03Å; N128-W131 HydrophobicContact CB-CG 3.64Å; N128-W131 PolarHBondContact O-N 3.38Å; N128-W131 PolarHBondContact OD1-N 2.91Å; N128-A132 WeakPolarHBondContact O-CB 3.43Å; N128-A132 PolarHBondContact O-N 3.03Å; N128-D180 PolarHBondContact ND2-OD2 3.22Å
129Y98.6Very high98.8Very high160 Ų16032.8 Ų32.863%0.62716%0.164SC*.Hα-helixtrans-58.4-39.9178.2-63.5-76.8000113.7I125 L133I125-Y129 HydrophobicContact CG2-CD1 3.77Å; I125-Y129 HydrophobicContact CG2-CE1 3.44Å; I125-Y129 VanDerWaalsContact CG2-CE1 3.44Å; Y129-L133 WeakPolarHBondContact O-CB 3.12Å; Y129-L133 PolarHBondContact O-N 3.45Å
130W98.8Very high98.8Very high0 Ų033 Ų330%016%0.164CC..Hα-helixtrans-67.9-39.9179.5176-118.1000111.9N128 L133 N134 D180 W181 Y182 W183 L185 L186N128-W130 VanDerWaalsContact C-N 3.33Å; N128-W130 PolarHBondContact O-N 3.13Å; N128-W130 WeakPolarHBondContact OD1-CA 3.44Å; N128-W130 VanDerWaalsContact OD1-CB 3.26Å; N128-W130 WeakPolarHBondContact OD1-CB 3.33Å; N128-W130 PolarHBondContact OD1-N 3.4Å; W130-L133 HydrophobicContact CE3-CD2 4.06Å; W130-L133 HydrophobicContact CZ3-CD2 3.95Å; W130-L133 PolarHBondContact O-N 3.04Å; W130-N134 VanDerWaalsContact CD2-ND2 3.29Å; W130-N134 WeakPolarHBondContact CZ2-ND2 3.42Å; W130-N134 PolarHBondContact O-N 3.43Å; W130-N134 PolarHBondContact O-ND2 3.43Å; W130-D180 HydrophobicContact CB-CB 4.04Å; W130-D180 VanDerWaalsContact CD1-OD1 3.24Å; W130-D180 HydrophobicContact CG-CB 4.08Å; W130-W181 VanDerWaalsContact CD2-N 3.31Å; W130-W181 HydrophobicContact CE3-CD2 4.25Å; W130-W181 AromaticContact CE3-CE3 3.79Å; W130-W181 HydrophobicContact CE3-CE3 3.79Å; W130-W181 HydrophobicContact CE3-CZ3 4.27Å; W130-W181 HydrophobicContact CZ3-CE3 4.27Å; W130-Y182 WeakPolarHBondContact CZ2-O 3.32Å; W130-W183 HydrophobicContact CH2-CE3 4.29Å; W130-W183 HydrophobicContact CZ3-CD2 4.34Å; W130-W183 AromaticContact CZ3-CE3 3.94Å; W130-W183 HydrophobicContact CZ3-CE3 3.94Å; W130-W183 HydrophobicContact CZ3-CH2 4.39Å; W130-W183 AromaticContact CZ3-CZ3 3.97Å; W130-W183 HydrophobicContact CZ3-CZ3 3.97Å; W130-L185 HydrophobicContact CZ2-CB 4.13Å; W130-L185 HydrophobicContact CZ2-CD2 4.12Å; W130-L186 HydrophobicContact CH2-CD2 4.2Å; W130-L186 HydrophobicContact CH2-CG 4.22Å
131W98.6Very high98.8Very high39 Ų3935.8 Ų35.815%0.14818%0.176CC..Hα-helixtrans-68-45.9176.9-58.11.9000110.2Q127 N128 L133 N134 G135 L170 A173 V174 D180 G274Q127-W131 HydrophobicContact CG-CE3 3.51Å; Q127-W131 HydrophobicContact CG-CZ3 3.53Å; Q127-W131 VanDerWaalsContact NE2-CZ3 3.32Å; N128-W131 HydrophobicContact CB-CB 4.02Å; N128-W131 HydrophobicContact CB-CD2 3.64Å; N128-W131 HydrophobicContact CB-CE3 4.03Å; N128-W131 HydrophobicContact CB-CG 3.64Å; N128-W131 PolarHBondContact O-N 3.38Å; N128-W131 PolarHBondContact OD1-N 2.91Å; W131-L133 VanDerWaalsContact C-N 3.29Å; W131-L133 PolarHBondContact O-N 3.4Å; W131-N134 PolarHBondContact O-N 3.26Å; W131-N134 VanDerWaalsContact O-N 3.15Å; W131-G135 PolarHBondContact O-N 3.25Å; W131-L170 HydrophobicContact CB-CD2 3.97Å; W131-L170 VanDerWaalsContact O-CD2 3.24Å; W131-L170 WeakPolarHBondContact O-CD2 3.47Å; W131-A173 HydrophobicContact CG-CB 4.45Å; W131-V174 HydrophobicContact CD2-CG2 3.83Å; W131-V174 HydrophobicContact CE3-CG2 3.81Å; W131-V174 HydrophobicContact CG-CG2 4.48Å; W131-V174 HydrophobicContact CH2-CG2 4.1Å; W131-V174 HydrophobicContact CZ2-CG2 4.11Å; W131-V174 HydrophobicContact CZ3-CG2 3.95Å; W131-D180 PolarHBondContact NE1-OD1 3.27Å; W131-G274 VanDerWaalsContact CZ3-O 3.28Å; W131-G274 WeakPolarHBondContact CZ3-O 3.15Å
132A98.8Very high98.8Very high7 Ų734.8 Ų34.86%0.05817%0.172CC..Hα-helixtrans-56.5-42.9175.800000112.2L124 I125 N128 G135 F136L124-A132 HydrophobicContact CB-CB 3.89Å; I125-A132 HydrophobicContact CG1-CB 3.88Å; N128-A132 WeakPolarHBondContact O-CB 3.43Å; N128-A132 PolarHBondContact O-N 3.03Å; A132-G135 PolarHBondContact O-N 2.98Å; A132-F136 WeakPolarHBondContact O-CB 3.46Å; A132-F136 PolarHBondContact O-N 3.23Å
133L98.8Very high98.8Very high52 Ų5232.3 Ų32.327%0.27215%0.152SC..Hα-helixtrans-62.1-47.7175.3177.462.5000111.9Y129 W130 W131 G135 F136 V137 W181 W183Y129-L133 WeakPolarHBondContact O-CB 3.12Å; Y129-L133 PolarHBondContact O-N 3.45Å; W130-L133 HydrophobicContact CE3-CD2 4.06Å; W130-L133 HydrophobicContact CZ3-CD2 3.95Å; W130-L133 PolarHBondContact O-N 3.04Å; W131-L133 VanDerWaalsContact C-N 3.29Å; W131-L133 PolarHBondContact O-N 3.4Å; L133-G135 VanDerWaalsContact C-N 3.35Å; L133-G135 PolarHBondContact O-N 3.49Å; L133-F136 PolarHBondContact O-N 2.82Å; L133-V137 HydrophobicContact CD1-CG2 4.23Å; L133-V137 WeakPolarHBondContact O-CG2 3.28Å; L133-V137 PolarHBondContact O-N 3.49Å; L133-W181 HydrophobicContact CD2-CZ3 4.47Å; L133-W183 HydrophobicContact CD2-CH2 3.92Å; L133-W183 HydrophobicContact CD2-CZ3 3.77Å
134N98.9Very high98.8Very high0 Ų034.7 Ų34.70%016%0.164CC..Hα-helixtrans-64.2-40179.4-84.9-88000112.1W130 W131 V137 G138 G169 A173 L186 N189W130-N134 VanDerWaalsContact CD2-ND2 3.29Å; W130-N134 WeakPolarHBondContact CZ2-ND2 3.42Å; W130-N134 PolarHBondContact O-N 3.43Å; W130-N134 PolarHBondContact O-ND2 3.43Å; W131-N134 PolarHBondContact O-N 3.26Å; W131-N134 VanDerWaalsContact O-N 3.15Å; N134-V137 PolarHBondContact O-N 3.35Å; N134-G138 PolarHBondContact O-N 3.28Å; N134-G169 WeakPolarHBondContact CB-O 3.36Å; N134-G169 WeakPolarHBondContact O-CA 3.3Å; N134-A173 HydrophobicContact CB-CB 4.04Å; N134-L186 WeakPolarHBondContact OD1-CD2 3.15Å; N134-N189 PolarHBondContact O-ND2 2.89Å; N134-N189 PolarHBondContact OD1-ND2 2.8Å
135G98.8Very high98.7Very high0 Ų035 Ų350%017%0.166CC..Hα-helixtrans-62.4-45172.900000112.4W131 A132 L133 G138 T139W131-G135 PolarHBondContact O-N 3.25Å; A132-G135 PolarHBondContact O-N 2.98Å; L133-G135 VanDerWaalsContact C-N 3.35Å; L133-G135 PolarHBondContact O-N 3.49Å; G135-G138 PolarHBondContact O-N 3Å; G135-T139 PolarHBondContact O-N 2.87Å; G135-T139 PolarHBondContact O-OG1 2.87Å
136F98.9Very high98.7Very high79 Ų7931.2 Ų31.235%0.34615%0.147SC..Hα-helixtrans-58.7-50.1175.1173.3-98.5000111.6V101 F121 A132 L133 G138 T139 L140V101-F136 HydrophobicContact CG1-CD2 3.96Å; V101-F136 HydrophobicContact CG1-CE2 3.98Å; F121-F136 HydrophobicContact CE1-CB 3.87Å; F121-F136 HydrophobicContact CE1-CD2 4.39Å; F121-F136 HydrophobicContact CZ-CB 4.27Å; F121-F136 HydrophobicContact CZ-CD2 4.19Å; A132-F136 WeakPolarHBondContact O-CB 3.46Å; A132-F136 PolarHBondContact O-N 3.23Å; L133-F136 PolarHBondContact O-N 2.82Å; F136-G138 VanDerWaalsContact C-N 3.32Å; F136-G138 PolarHBondContact O-N 2.94Å; F136-T139 PolarHBondContact O-N 3.27Å; F136-L140 HydrophobicContact CE1-CD2 4.02Å; F136-L140 HydrophobicContact CZ-CD2 4.24Å; F136-L140 VanDerWaalsContact O-CB 3.3Å; F136-L140 WeakPolarHBondContact O-CB 3.21Å; F136-L140 PolarHBondContact O-N 3.42Å
137V98.9Very high98.7Very high16 Ų1628.4 Ų28.410%0.09713%0.132CC..Hα-helixtrans-57.7-46.4176.8169.10000110.5L133 N134 T139 L140 F141 L186 I190L133-V137 HydrophobicContact CD1-CG2 4.23Å; L133-V137 WeakPolarHBondContact O-CG2 3.28Å; L133-V137 PolarHBondContact O-N 3.49Å; N134-V137 PolarHBondContact O-N 3.35Å; V137-T139 PolarHBondContact O-N 3.37Å; V137-L140 PolarHBondContact O-N 2.91Å; V137-F141 HydrophobicContact CG1-CD2 3.83Å; V137-F141 HydrophobicContact CG1-CE2 4.14Å; V137-F141 WeakPolarHBondContact O-CD2 3.43Å; V137-F141 PolarHBondContact O-N 2.92Å; V137-L186 HydrophobicContact CG1-CD2 4.45Å; V137-L186 HydrophobicContact CG2-CD2 4.29Å; V137-I190 HydrophobicContact CG1-CD1 4.24Å; V137-I190 HydrophobicContact CG1-CG1 3.6Å
138G98.9Very high98.7Very high0 Ų032.4 Ų32.40%015%0.153CC..Hα-helixtrans-61.9-45.1179.500000112.9N134 G135 F136 L140 A142 G165 S193N134-G138 PolarHBondContact O-N 3.28Å; G135-G138 PolarHBondContact O-N 3Å; F136-G138 VanDerWaalsContact C-N 3.32Å; F136-G138 PolarHBondContact O-N 2.94Å; G138-L140 PolarHBondContact O-N 3.4Å; G138-A142 VanDerWaalsContact O-CB 3.25Å; G138-A142 WeakPolarHBondContact O-CB 3.24Å; G138-A142 PolarHBondContact O-N 3.38Å; G138-G165 VanDerWaalsContact C-C 3.49Å; G138-G165 CarbonylContact C-O 3.5Å; G138-G165 WeakPolarHBondContact CA-O 3.4Å; G138-S193 WeakPolarHBondContact CA-OG 3.25Å; G138-S193 WeakPolarHBondContact O-CB 3.32Å
139T98.8Very high98.7Very high0 Ų034.4 Ų34.40%016%0.163CC..Hα-helixtrans-60.9-46.1176.1-440000111.8V101 G135 F136 V137 T143 I166V101-T139 HydrophobicContact CB-CG2 4.23Å; V101-T139 HydrophobicContact CG1-CG2 3.96Å; V101-T139 HydrophobicContact CG2-CG2 4.25Å; G135-T139 PolarHBondContact O-N 2.87Å; G135-T139 PolarHBondContact O-OG1 2.87Å; F136-T139 PolarHBondContact O-N 3.27Å; V137-T139 PolarHBondContact O-N 3.37Å; T139-T143 WeakPolarHBondContact O-CB 3.44Å; T139-T143 PolarHBondContact O-N 3.31Å; T139-T143 PolarHBondContact O-OG1 3.06Å; T139-I166 WeakPolarHBondContact OG1-CA 3.07Å; T139-I166 WeakPolarHBondContact OG1-CB 3.49Å; T139-I166 WeakPolarHBondContact OG1-CG1 3.48Å
140L98.8Very high98.6Very high35 Ų3534.7 Ų34.718%0.18317%0.17CC..Hα-helixtrans-61.8-50.5-178.3177.663.3000110.8L97 V101 F136 V137 G138 T143 I144L97-L140 HydrophobicContact CD1-CD1 4.22Å; L97-L140 HydrophobicContact CD2-CD1 3.65Å; L97-L140 HydrophobicContact CG-CD1 3.92Å; V101-L140 HydrophobicContact CG2-CB 4.43Å; V101-L140 HydrophobicContact CG2-CD1 4.24Å; F136-L140 HydrophobicContact CE1-CD2 4.02Å; F136-L140 HydrophobicContact CZ-CD2 4.24Å; F136-L140 VanDerWaalsContact O-CB 3.3Å; F136-L140 WeakPolarHBondContact O-CB 3.21Å; F136-L140 PolarHBondContact O-N 3.42Å; V137-L140 PolarHBondContact O-N 2.91Å; G138-L140 PolarHBondContact O-N 3.4Å; L140-T143 WeakPolarHBondContact O-CB 3.44Å; L140-T143 PolarHBondContact O-N 2.93Å; L140-I144 HydrophobicContact CD1-CD1 3.95Å; L140-I144 HydrophobicContact CD1-CG1 4.39Å; L140-I144 HydrophobicContact CG-CD1 3.86Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.48Å; L140-I144 PolarHBondContact O-N 3.44Å
141F98.8Very high98.6Very high60 Ų6036.6 Ų36.626%0.26318%0.179SC..Hα-helixtrans-74.9-28.9-176.8-82.1-87.1000113.4V137 S145 I190 M194V137-F141 HydrophobicContact CG1-CD2 3.83Å; V137-F141 HydrophobicContact CG1-CE2 4.14Å; V137-F141 WeakPolarHBondContact O-CD2 3.43Å; V137-F141 PolarHBondContact O-N 2.92Å; F141-S145 VanDerWaalsContact O-CB 3.26Å; F141-S145 WeakPolarHBondContact O-CB 3.36Å; F141-S145 PolarHBondContact O-N 3.28Å; F141-I190 HydrophobicContact CB-CG2 4.31Å; F141-I190 HydrophobicContact CD1-CG1 4.41Å; F141-I190 HydrophobicContact CD1-CG2 3.55Å; F141-I190 HydrophobicContact CD2-CD1 4.3Å; F141-I190 HydrophobicContact CD2-CG1 3.75Å; F141-I190 HydrophobicContact CD2-CG2 4.39Å; F141-I190 HydrophobicContact CE1-CD1 4.46Å; F141-I190 HydrophobicContact CE1-CG1 4.49Å; F141-I190 HydrophobicContact CE1-CG2 3.86Å; F141-I190 HydrophobicContact CE2-CD1 3.87Å; F141-I190 HydrophobicContact CE2-CG1 3.85Å; F141-I190 HydrophobicContact CG-CB 4.38Å; F141-I190 HydrophobicContact CG-CG1 4.03Å; F141-I190 HydrophobicContact CG-CG2 3.83Å; F141-I190 HydrophobicContact CZ-CD1 3.95Å; F141-I190 HydrophobicContact CZ-CG1 4.22Å; F141-I190 HydrophobicContact CZ-CG2 4.39Å; F141-M194 HydrophobicContact CB-CG 4.06Å; F141-M194 HydrophobicContact CD1-CG 4.39Å; F141-M194 HydrophobicContact CD1-SD 4.19Å
142A98.9Very high98.5Very high0 Ų038.3 Ų38.30%020%0.197CC..Hα-helixtrans-64-42.5167.400000111.3G138 S145 A146 Y161 S193 C196 P197G138-A142 VanDerWaalsContact O-CB 3.25Å; G138-A142 WeakPolarHBondContact O-CB 3.24Å; G138-A142 PolarHBondContact O-N 3.38Å; A142-S145 PolarHBondContact O-N 2.93Å; A142-A146 PolarHBondContact O-N 3.07Å; A142-Y161 WeakPolarHBondContact CB-O 3.06Å; A142-S193 WeakPolarHBondContact CA-O 3.37Å; A142-S193 WeakPolarHBondContact CB-O 3.5Å; A142-C196 HydrophobicContact CB-CB 4.32Å; A142-P197 WeakPolarHBondContact O-CG 3.4Å
143T98.8Very high98.3Very high3 Ų344.7 Ų44.72%0.01822%0.22CC..Hα-helixtrans-65.6-45177-54.80000111.6L97 W100 T139 L140 S145 A146 L147 I156L97-T143 HydrophobicContact CD1-CG2 3.68Å; W100-T143 HydrophobicContact CB-CG2 4.19Å; W100-T143 HydrophobicContact CE3-CG2 4Å; T139-T143 WeakPolarHBondContact O-CB 3.44Å; T139-T143 PolarHBondContact O-N 3.31Å; T139-T143 PolarHBondContact O-OG1 3.06Å; L140-T143 WeakPolarHBondContact O-CB 3.44Å; L140-T143 PolarHBondContact O-N 2.93Å; T143-S145 PolarHBondContact O-N 3.46Å; T143-A146 PolarHBondContact O-N 3.41Å; T143-L147 WeakPolarHBondContact O-CG 3.49Å; T143-L147 PolarHBondContact O-N 2.89Å; T143-L147 VanDerWaalsContact O-N 3.09Å; T143-I156 HydrophobicContact CG2-CG2 4.01Å
144I98.6Very high98.2Very high50 Ų5044.6 Ų44.626%0.25623%0.231SC..Hα-helixtrans-60.5-44.7174.8-69.5167.7000110.8L140 A146 L147 I148L140-I144 HydrophobicContact CD1-CD1 3.95Å; L140-I144 HydrophobicContact CD1-CG1 4.39Å; L140-I144 HydrophobicContact CG-CD1 3.86Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.48Å; L140-I144 PolarHBondContact O-N 3.44Å; I144-A146 VanDerWaalsContact C-N 3.32Å; I144-A146 PolarHBondContact O-N 3.41Å; I144-L147 WeakPolarHBondContact O-CB 3.47Å; I144-L147 PolarHBondContact O-N 2.99Å; I144-L147 VanDerWaalsContact O-N 3.12Å; I144-I148 HydrophobicContact CG2-CD1 3.8Å; I144-I148 HydrophobicContact CG2-CG1 4.37Å; I144-I148 WeakPolarHBondContact O-CG1 3.32Å; I144-I148 PolarHBondContact O-N 2.91Å
145S98.6Very high98.1Very high6 Ų645.5 Ų45.54%0.04224%0.239CC..Hα-helixtrans-59.7-42.7176.6-179.50000111.7F141 A142 T143 L147 I148 L149 M194F141-S145 VanDerWaalsContact O-CB 3.26Å; F141-S145 WeakPolarHBondContact O-CB 3.36Å; F141-S145 PolarHBondContact O-N 3.28Å; A142-S145 PolarHBondContact O-N 2.93Å; T143-S145 PolarHBondContact O-N 3.46Å; S145-L147 VanDerWaalsContact C-N 3.27Å; S145-L147 PolarHBondContact O-N 3.33Å; S145-I148 PolarHBondContact O-N 3.41Å; S145-L149 WeakPolarHBondContact O-CB 3.42Å; S145-L149 VanDerWaalsContact O-CG 3.3Å; S145-L149 WeakPolarHBondContact O-CG 3.32Å; S145-L149 PolarHBondContact O-N 2.93Å; S145-M194 WeakPolarHBondContact CB-O 3.45Å; S145-M194 PolarHBondContact OG-O 2.92Å
146A98.6Very high98Very high0 Ų045.6 Ų45.60%024%0.239CC..Hα-helixtrans-62-34.5175.900000112.9A142 T143 I144 Q150 Q151 I156 Y161 P197A142-A146 PolarHBondContact O-N 3.07Å; T143-A146 PolarHBondContact O-N 3.41Å; I144-A146 VanDerWaalsContact C-N 3.32Å; I144-A146 PolarHBondContact O-N 3.41Å; A146-Q150 PolarHBondContact O-N 3.06Å; A146-Q151 HydrophobicContact CB-CB 4.3Å; A146-Q151 HydrophobicContact CB-CG 4.29Å; A146-Q151 PolarHBondContact O-N 3.34Å; A146-I156 HydrophobicContact CB-CD1 3.94Å; A146-I156 HydrophobicContact CB-CG1 3.96Å; A146-Y161 HydrophobicContact CB-CD1 4.03Å; A146-Y161 HydrophobicContact CB-CD2 4.16Å; A146-Y161 HydrophobicContact CB-CG 3.67Å; A146-P197 HydrophobicContact CB-CB 4.09Å; A146-P197 HydrophobicContact CB-CG 3.9Å
147L98.3Very high98Very high30 Ų3043.4 Ų43.416%0.15724%0.236CC..Hα-helixtrans-67.6-45173.4-65.9168000112.1L97 W100 T143 I144 S145 L149 Q150 R153 I156L97-L147 HydrophobicContact CD1-CD1 4.39Å; W100-L147 HydrophobicContact CH2-CD2 4.25Å; W100-L147 HydrophobicContact CZ3-CD1 3.94Å; W100-L147 HydrophobicContact CZ3-CD2 3.73Å; W100-L147 HydrophobicContact CZ3-CG 4.34Å; T143-L147 WeakPolarHBondContact O-CG 3.49Å; T143-L147 PolarHBondContact O-N 2.89Å; T143-L147 VanDerWaalsContact O-N 3.09Å; I144-L147 WeakPolarHBondContact O-CB 3.47Å; I144-L147 PolarHBondContact O-N 2.99Å; I144-L147 VanDerWaalsContact O-N 3.12Å; S145-L147 VanDerWaalsContact C-N 3.27Å; S145-L147 PolarHBondContact O-N 3.33Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-L149 PolarHBondContact O-N 3.46Å; L147-Q150 PolarHBondContact O-N 3.5Å; L147-Q150 VanDerWaalsContact O-N 3.12Å; L147-R153 VanDerWaalsContact CD2-CZ 3.49Å; L147-I156 HydrophobicContact CD2-CD1 3.89Å; L147-I156 HydrophobicContact CD2-CG2 4.32Å; L147-I156 HydrophobicContact CG-CD1 4.33Å
148I98.4Very high97.9Very high114 Ų11443.6 Ų43.659%0.58524%0.239SC*.Hα-helixtrans-60.9-42.4177.1-67.5167.4000110.2I144 S145 Q150I144-I148 HydrophobicContact CG2-CD1 3.8Å; I144-I148 HydrophobicContact CG2-CG1 4.37Å; I144-I148 WeakPolarHBondContact O-CG1 3.32Å; I144-I148 PolarHBondContact O-N 2.91Å; S145-I148 PolarHBondContact O-N 3.41Å; I148-Q150 PolarHBondContact O-N 2.94Å
149L98.1Very high97.9Very high71 Ų7143.6 Ų43.637%0.37224%0.239SC..THydrogen-bonded Turntrans-79.46.6178.1-65.4170.7000113.8S145 L147 Q151 P197 I198S145-L149 WeakPolarHBondContact O-CB 3.42Å; S145-L149 VanDerWaalsContact O-CG 3.3Å; S145-L149 WeakPolarHBondContact O-CG 3.32Å; S145-L149 PolarHBondContact O-N 2.93Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-L149 PolarHBondContact O-N 3.46Å; L149-Q151 HydrophobicContact CB-CG 4.18Å; L149-Q151 PolarHBondContact O-N 3.37Å; L149-Q151 VanDerWaalsContact O-N 3.14Å; L149-Q151 PolarHBondContact O-NE2 3.04Å; L149-P197 HydrophobicContact CD1-CB 4.11Å; L149-I198 HydrophobicContact CD1-CD1 4.32Å; L149-I198 HydrophobicContact CD1-CG1 3.55Å
150Q97.8Very high97.8Very high167 Ų16747.2 Ų47.278%0.7826%0.258SS*.THydrogen-bonded Turntrans50.239.5178.2-57.2-175.32.800113.9A146 L147 I148A146-Q150 PolarHBondContact O-N 3.06Å; L147-Q150 PolarHBondContact O-N 3.5Å; L147-Q150 VanDerWaalsContact O-N 3.12Å; I148-Q150 PolarHBondContact O-N 2.94Å
151Q97.8Very high97.8Very high40 Ų4047 Ų4719%0.18726%0.255CS..  trans-67.7164.1175.4-60.2-58.3-65.300111.3A146 L149 R153 I156 Y161A146-Q151 HydrophobicContact CB-CB 4.3Å; A146-Q151 HydrophobicContact CB-CG 4.29Å; A146-Q151 PolarHBondContact O-N 3.34Å; L149-Q151 HydrophobicContact CB-CG 4.18Å; L149-Q151 PolarHBondContact O-N 3.37Å; L149-Q151 VanDerWaalsContact O-N 3.14Å; L149-Q151 PolarHBondContact O-NE2 3.04Å; Q151-R153 PolarHBondContact O-N 2.99Å; Q151-R153 VanDerWaalsContact O-N 3.13Å; Q151-I156 HydrophobicContact CB-CD1 4.29Å; Q151-Y161 HydrophobicContact CB-CD2 4.19Å; Q151-Y161 HydrophobicContact CB-CE1 4.32Å; Q151-Y161 HydrophobicContact CB-CE2 3.59Å; Q151-Y161 HydrophobicContact CG-CE1 4.01Å; Q151-Y161 HydrophobicContact CG-CE2 4.19Å; Q151-Y161 PolarHBondContact OE1-OH 3.34Å
152S96.1Very high97.7Very high75 Ų7544.2 Ų44.252%0.52424%0.243SC..  trans-49.4120.1-178.1170.60000112.2G154 A155 I156S152-G154 VanDerWaalsContact C-N 3.29Å; S152-G154 PolarHBondContact O-N 3.36Å; S152-A155 PolarHBondContact O-N 3.08Å; S152-A155 VanDerWaalsContact O-N 3.1Å; S152-A155 PolarHBondContact OG-N 3.18Å; S152-I156 WeakPolarHBondContact O-CG1 3.48Å; S152-I156 PolarHBondContact O-N 3.47Å
153R95.5Very high97.7Very high141 Ų14145.1 Ų45.153%0.53225%0.247SC..Hα-helixtrans-60.9-37.3-179.5-70-67.8179.7155.8-4.7112.6L147 Q151 I156 A157L147-R153 VanDerWaalsContact CD2-CZ 3.49Å; Q151-R153 PolarHBondContact O-N 2.99Å; Q151-R153 VanDerWaalsContact O-N 3.13Å; R153-I156 PolarHBondContact O-N 3Å; R153-A157 VanDerWaalsContact O-CB 3.26Å; R153-A157 WeakPolarHBondContact O-CB 3.49Å; R153-A157 PolarHBondContact O-N 3.24Å
154G95.8Very high97.7Very high50 Ų5045 Ų4552%0.51525%0.246SC..Hα-helixtrans-64.5-39.9174.800000112.5S152 A157 A158S152-G154 VanDerWaalsContact C-N 3.29Å; S152-G154 PolarHBondContact O-N 3.36Å; G154-A157 PolarHBondContact O-N 3.3Å; G154-A158 WeakPolarHBondContact O-CB 3.42Å; G154-A158 PolarHBondContact O-N 3.33Å
155A96.6Very high97.7Very high19 Ų1942.7 Ų42.716%0.15723%0.234CC..Hα-helixtrans-69.8-38.8177.100000112.3S152 A158 G159 L160 Y161S152-A155 PolarHBondContact O-N 3.08Å; S152-A155 VanDerWaalsContact O-N 3.1Å; S152-A155 PolarHBondContact OG-N 3.18Å; A155-A158 PolarHBondContact O-N 3.11Å; A155-G159 PolarHBondContact O-N 3.22Å; A155-L160 HydrophobicContact CB-CB 4.37Å; A155-L160 HydrophobicContact CB-CD1 4.09Å; A155-L160 WeakPolarHBondContact O-CB 3.46Å; A155-L160 PolarHBondContact O-N 3.39Å; A155-Y161 HydrophobicContact CB-CD2 4.2Å; A155-Y161 HydrophobicContact CB-CE2 3.88Å
156I98Very high97.7Very high2 Ų242.4 Ų42.41%0.0123%0.232CC..Hα-helixtrans-61.3-48.2171.8-65.8171.3000109.8W100 T143 A146 L147 Q151 S152 R153 A158 G159 Y161W100-I156 HydrophobicContact CD2-CG2 3.85Å; W100-I156 HydrophobicContact CE3-CG2 3.54Å; W100-I156 HydrophobicContact CG-CG2 4.4Å; W100-I156 HydrophobicContact CZ3-CG2 3.96Å; T143-I156 HydrophobicContact CG2-CG2 4.01Å; A146-I156 HydrophobicContact CB-CD1 3.94Å; A146-I156 HydrophobicContact CB-CG1 3.96Å; L147-I156 HydrophobicContact CD2-CD1 3.89Å; L147-I156 HydrophobicContact CD2-CG2 4.32Å; L147-I156 HydrophobicContact CG-CD1 4.33Å; Q151-I156 HydrophobicContact CB-CD1 4.29Å; S152-I156 WeakPolarHBondContact O-CG1 3.48Å; S152-I156 PolarHBondContact O-N 3.47Å; R153-I156 PolarHBondContact O-N 3Å; I156-A158 VanDerWaalsContact C-N 3.26Å; I156-A158 PolarHBondContact O-N 2.92Å; I156-G159 WeakPolarHBondContact O-CA 3.08Å; I156-G159 PolarHBondContact O-N 3.4Å; I156-Y161 HydrophobicContact CG1-CD2 3.77Å; I156-Y161 HydrophobicContact CG1-CE2 4.49Å; I156-Y161 HydrophobicContact CG1-CG 4.48Å
157A97.6Very high97.8Very high33 Ų3342.4 Ų42.427%0.27323%0.232SC..Hα-helixtrans-64-30.6-179.600000113.3W100 R103 R153 G154 G159W100-A157 VanDerWaalsContact CD1-CA 3.44Å; R103-A157 WeakPolarHBondContact CD-O 3.44Å; R153-A157 VanDerWaalsContact O-CB 3.26Å; R153-A157 WeakPolarHBondContact O-CB 3.49Å; R153-A157 PolarHBondContact O-N 3.24Å; G154-A157 PolarHBondContact O-N 3.3Å; A157-G159 PolarHBondContact O-N 3.17Å
158A97.4Very high97.8Very high19 Ų1941 Ų4116%0.15723%0.225CC..THydrogen-bonded Turntrans-78.3-0.6172.200000113.8Q107 N112 G154 A155 I156 L160Q107-A158 WeakPolarHBondContact CG-O 3.34Å; Q107-A158 PolarHBondContact NE2-O 3.4Å; N112-A158 PolarHBondContact OD1-O 3.44Å; G154-A158 WeakPolarHBondContact O-CB 3.42Å; G154-A158 PolarHBondContact O-N 3.33Å; A155-A158 PolarHBondContact O-N 3.11Å; I156-A158 VanDerWaalsContact C-N 3.26Å; I156-A158 PolarHBondContact O-N 2.92Å; A158-L160 VanDerWaalsContact C-N 3.33Å; A158-L160 HydrophobicContact CB-CD1 4.47Å; A158-L160 HydrophobicContact CB-CG 4.19Å; A158-L160 PolarHBondContact O-N 2.95Å
159G97.8Very high97.8Very high1 Ų135.6 Ų35.61%0.0120%0.197CC..THydrogen-bonded Turntrans79.16.3-179.500000115.2G104 A155 I156 A157 Y161 G162 Y163G104-G159 WeakPolarHBondContact CA-O 3.35Å; A155-G159 PolarHBondContact O-N 3.22Å; I156-G159 WeakPolarHBondContact O-CA 3.08Å; I156-G159 PolarHBondContact O-N 3.4Å; A157-G159 PolarHBondContact O-N 3.17Å; G159-Y161 PolarHBondContact O-N 2.88Å; G159-Y161 VanDerWaalsContact O-N 3.13Å; G159-G162 PolarHBondContact O-N 3.44Å; G159-Y163 PolarHBondContact O-N 3.48Å
160L97.6Very high97.8Very high76 Ų7632.2 Ų32.240%0.39818%0.179SC..THydrogen-bonded Turntrans-66.9-16.2-173.8-64.2177000113.9Q107 A155 A158 Y163Q107-L160 HydrophobicContact CG-CD2 4.49Å; A155-L160 HydrophobicContact CB-CB 4.37Å; A155-L160 HydrophobicContact CB-CD1 4.09Å; A155-L160 WeakPolarHBondContact O-CB 3.46Å; A155-L160 PolarHBondContact O-N 3.39Å; A158-L160 VanDerWaalsContact C-N 3.33Å; A158-L160 HydrophobicContact CB-CD1 4.47Å; A158-L160 HydrophobicContact CB-CG 4.19Å; A158-L160 PolarHBondContact O-N 2.95Å; L160-Y163 HydrophobicContact CD2-CE1 4.5Å; L160-Y163 WeakPolarHBondContact O-CD1 3.49Å; L160-Y163 WeakPolarHBondContact O-CE1 3.33Å
161Y98.3Very high97.9Very high30 Ų3024.9 Ų24.912%0.11815%0.145CC..THydrogen-bonded Turntrans-99.4-5.5174-77.7-73.5000113.9A142 A146 Q151 A155 I156 G159 P197A142-Y161 WeakPolarHBondContact CB-O 3.06Å; A146-Y161 HydrophobicContact CB-CD1 4.03Å; A146-Y161 HydrophobicContact CB-CD2 4.16Å; A146-Y161 HydrophobicContact CB-CG 3.67Å; Q151-Y161 HydrophobicContact CB-CD2 4.19Å; Q151-Y161 HydrophobicContact CB-CE1 4.32Å; Q151-Y161 HydrophobicContact CB-CE2 3.59Å; Q151-Y161 HydrophobicContact CG-CE1 4.01Å; Q151-Y161 HydrophobicContact CG-CE2 4.19Å; Q151-Y161 PolarHBondContact OE1-OH 3.34Å; A155-Y161 HydrophobicContact CB-CD2 4.2Å; A155-Y161 HydrophobicContact CB-CE2 3.88Å; I156-Y161 HydrophobicContact CG1-CD2 3.77Å; I156-Y161 HydrophobicContact CG1-CE2 4.49Å; I156-Y161 HydrophobicContact CG1-CG 4.48Å; G159-Y161 PolarHBondContact O-N 2.88Å; G159-Y161 VanDerWaalsContact O-N 3.13Å; Y161-P197 HydrophobicContact CD1-CB 3.6Å; Y161-P197 HydrophobicContact CD1-CG 4.02Å; Y161-P197 HydrophobicContact CE1-CB 3.93Å
162G98.1Very high97.9Very high1 Ų123 Ų231%0.0114%0.137CC..THydrogen-bonded Turntrans-94.7-36.5-178.500000114.1G159 N164 G165 I166G159-G162 PolarHBondContact O-N 3.44Å; G162-N164 PolarHBondContact O-N 2.98Å; G162-G165 WeakPolarHBondContact O-CA 3.42Å; G162-G165 PolarHBondContact O-N 2.94Å; G162-I166 PolarHBondContact O-N 2.97Å
163Y98.6Very high98Very high20 Ų2019.7 Ų19.78%0.07811%0.113CC..Hα-helixtrans-67.9-27.5-168.775.7-93000115.2G104 Q107 G159 L160 G165 I166 F215 T216G104-Y163 WeakPolarHBondContact O-CA 3.13Å; G104-Y163 WeakPolarHBondContact O-CB 3.22Å; Q107-Y163 HydrophobicContact CB-CD1 3.89Å; Q107-Y163 HydrophobicContact CB-CG 4.05Å; G159-Y163 PolarHBondContact O-N 3.48Å; L160-Y163 HydrophobicContact CD2-CE1 4.5Å; L160-Y163 WeakPolarHBondContact O-CD1 3.49Å; L160-Y163 WeakPolarHBondContact O-CE1 3.33Å; Y163-G165 VanDerWaalsContact C-N 3.33Å; Y163-I166 WeakPolarHBondContact O-CG2 3.5Å; Y163-F215 WeakPolarHBondContact CE2-O 3.24Å; Y163-F215 PolarHBondContact OH-O 3.4Å; Y163-T216 HydrophobicContact CD2-CG2 4.24Å; Y163-T216 HydrophobicContact CE2-CG2 4.03Å
164N98.8Very high98.2Very high1 Ų114.8 Ų14.81%0.00510%0.099CC..Hα-helixtrans-70.8-36.3170.9-80.2-73.3000110.5G162 L167 V168 C196 F215 T216 P218 F219G162-N164 PolarHBondContact O-N 2.98Å; N164-L167 PolarHBondContact O-N 2.84Å; N164-V168 WeakPolarHBondContact O-CG2 2.98Å; N164-V168 PolarHBondContact O-N 3.36Å; N164-C196 HydrophobicContact CB-CB 4Å; N164-F215 PolarHBondContact ND2-O 2.84Å; N164-T216 VanDerWaalsContact OD1-CA 3.3Å; N164-T216 WeakPolarHBondContact OD1-CA 3.4Å; N164-P218 HydrophobicContact CB-CB 4.08Å; N164-P218 WeakPolarHBondContact OD1-CD 3.39Å; N164-F219 HydrophobicContact CB-CB 4.22Å; N164-F219 VanDerWaalsContact OD1-CB 3.25Å; N164-F219 WeakPolarHBondContact OD1-CB 3.33Å; N164-F219 PolarHBondContact OD1-N 3.28Å
165G98.8Very high98.3Very high0 Ų014.1 Ų14.10%08%0.082CC..Hα-helixtrans-65-41.4177.200000113.3G138 G162 Y163 L167 V168 G169G138-G165 VanDerWaalsContact C-C 3.49Å; G138-G165 CarbonylContact C-O 3.5Å; G138-G165 WeakPolarHBondContact CA-O 3.4Å; G162-G165 WeakPolarHBondContact O-CA 3.42Å; G162-G165 PolarHBondContact O-N 2.94Å; Y163-G165 VanDerWaalsContact C-N 3.33Å; G165-L167 VanDerWaalsContact C-N 3.32Å; G165-L167 PolarHBondContact O-N 3.49Å; G165-V168 PolarHBondContact O-N 2.86Å; G165-G169 PolarHBondContact O-N 3.46Å
166I98.9Very high98.3Very high0 Ų013.6 Ų13.60%08%0.077CC..Hα-helixtrans-60.1-44.3177-159.5169.7000111.3A105 V108 F121 L124 T139 G162 Y163 G169 L170 Y273A105-I166 HydrophobicContact CB-CD1 3.54Å; V108-I166 HydrophobicContact CG2-CG2 3.32Å; F121-I166 HydrophobicContact CE1-CD1 4.2Å; F121-I166 HydrophobicContact CZ-CD1 3.95Å; L124-I166 HydrophobicContact CD1-CD1 3.97Å; T139-I166 WeakPolarHBondContact OG1-CA 3.07Å; T139-I166 WeakPolarHBondContact OG1-CB 3.49Å; T139-I166 WeakPolarHBondContact OG1-CG1 3.48Å; G162-I166 PolarHBondContact O-N 2.97Å; Y163-I166 WeakPolarHBondContact O-CG2 3.5Å; I166-G169 PolarHBondContact O-N 2.7Å; I166-L170 HydrophobicContact CG1-CD1 3.9Å; I166-L170 HydrophobicContact CG1-CG 4.39Å; I166-L170 WeakPolarHBondContact O-CB 3.2Å; I166-L170 VanDerWaalsContact O-CG 3.24Å; I166-L170 WeakPolarHBondContact O-CG 3.48Å; I166-L170 PolarHBondContact O-N 3.37Å; I166-Y273 HydrophobicContact CG2-CE1 4.44Å
167L98.9Very high98.3Very high1 Ų117.8 Ų17.81%0.00510%0.1CC..Hα-helixtrans-67.9-40.5179.7-67.3176.2000111.6V108 N164 G165 G169 L170 L171 T216 F219 V272 Y273V108-L167 HydrophobicContact CG1-CD1 4.1Å; V108-L167 HydrophobicContact CG1-CD2 3.88Å; V108-L167 HydrophobicContact CG1-CG 4.22Å; V108-L167 HydrophobicContact CG2-CD1 4.21Å; V108-L167 HydrophobicContact CG2-CD2 4.14Å; V108-L167 HydrophobicContact CG2-CG 3.87Å; N164-L167 PolarHBondContact O-N 2.84Å; G165-L167 VanDerWaalsContact C-N 3.32Å; G165-L167 PolarHBondContact O-N 3.49Å; L167-G169 PolarHBondContact O-N 3.27Å; L167-L170 PolarHBondContact O-N 3.41Å; L167-L171 HydrophobicContact CB-CD2 4.31Å; L167-L171 HydrophobicContact CD2-CD2 4.2Å; L167-L171 WeakPolarHBondContact O-CB 3.35Å; L167-L171 WeakPolarHBondContact O-CD2 3.46Å; L167-L171 PolarHBondContact O-N 3.34Å; L167-T216 HydrophobicContact CD1-CG2 3.58Å; L167-F219 HydrophobicContact CB-CB 4.11Å; L167-F219 HydrophobicContact CB-CD1 4.22Å; L167-F219 HydrophobicContact CB-CD2 3.29Å; L167-F219 HydrophobicContact CB-CE2 3.63Å; L167-F219 HydrophobicContact CB-CG 3.59Å; L167-F219 HydrophobicContact CB-CZ 4.25Å; L167-F219 HydrophobicContact CD1-CB 4.3Å; L167-F219 HydrophobicContact CD1-CD1 3.89Å; L167-F219 HydrophobicContact CD1-CD2 4.44Å; L167-F219 HydrophobicContact CD1-CE1 4.33Å; L167-F219 HydrophobicContact CD1-CG 3.93Å; L167-F219 HydrophobicContact CG-CD2 4.49Å; L167-F219 HydrophobicContact CG-CG 4.44Å; L167-F219 WeakPolarHBondContact O-CE2 3.31Å; L167-V272 WeakPolarHBondContact CD2-O 3.14Å; L167-Y273 HydrophobicContact CD2-CD1 4.4Å
168V98.9Very high98.3Very high0 Ų018.1 Ų18.10%010%0.102CC..Hα-helixtrans-57-51.7173.9166.90000110.1N164 G165 M172 M192 F219 L222 V223N164-V168 WeakPolarHBondContact O-CG2 2.98Å; N164-V168 PolarHBondContact O-N 3.36Å; G165-V168 PolarHBondContact O-N 2.86Å; V168-M172 HydrophobicContact CG1-CG 4.39Å; V168-M172 HydrophobicContact CG1-SD 3.63Å; V168-M172 VanDerWaalsContact O-CB 3.28Å; V168-M172 WeakPolarHBondContact O-CB 3.29Å; V168-M172 WeakPolarHBondContact O-CG 3.16Å; V168-M172 PolarHBondContact O-N 2.85Å; V168-M192 HydrophobicContact CG1-CB 3.67Å; V168-F219 HydrophobicContact CG2-CB 4.34Å; V168-F219 HydrophobicContact CG2-CD2 4.09Å; V168-L222 HydrophobicContact CG2-CB 4.17Å; V168-V223 HydrophobicContact CB-CG2 4.35Å; V168-V223 HydrophobicContact CG2-CG2 4.04Å
169G98.8Very high98.1Very high0 Ų018.7 Ų18.70%011%0.11CC..Hα-helixtrans-60.8-48.8179.800000113.1N134 G165 I166 L167 A173 N189N134-G169 WeakPolarHBondContact CB-O 3.36Å; N134-G169 WeakPolarHBondContact O-CA 3.3Å; G165-G169 PolarHBondContact O-N 3.46Å; I166-G169 PolarHBondContact O-N 2.7Å; L167-G169 PolarHBondContact O-N 3.27Å; G169-A173 PolarHBondContact O-N 3.44Å; G169-N189 WeakPolarHBondContact CA-ND2 3.42Å; G169-N189 VanDerWaalsContact CA-OD1 3.32Å; G169-N189 WeakPolarHBondContact CA-OD1 3.45Å
170L98.8Very high98.1Very high0 Ų022.2 Ų22.20%013%0.129CC..Hα-helixtrans-58.7-52.8178.8-74.6166.9000111.8L124 W131 I166 L167 M172 A173 V174 Y273L124-L170 HydrophobicContact CD1-CD1 4.3Å; L124-L170 HydrophobicContact CD1-CD2 4.41Å; L124-L170 HydrophobicContact CD2-CD1 4.06Å; L124-L170 HydrophobicContact CD2-CD2 3.93Å; W131-L170 HydrophobicContact CB-CD2 3.97Å; W131-L170 VanDerWaalsContact O-CD2 3.24Å; W131-L170 WeakPolarHBondContact O-CD2 3.47Å; I166-L170 HydrophobicContact CG1-CD1 3.9Å; I166-L170 HydrophobicContact CG1-CG 4.39Å; I166-L170 WeakPolarHBondContact O-CB 3.2Å; I166-L170 VanDerWaalsContact O-CG 3.24Å; I166-L170 WeakPolarHBondContact O-CG 3.48Å; I166-L170 PolarHBondContact O-N 3.37Å; L167-L170 PolarHBondContact O-N 3.41Å; L170-M172 PolarHBondContact O-N 3.4Å; L170-A173 WeakPolarHBondContact O-CB 3.36Å; L170-A173 PolarHBondContact O-N 2.99Å; L170-A173 VanDerWaalsContact O-N 3.09Å; L170-V174 WeakPolarHBondContact O-CG2 3.2Å; L170-V174 PolarHBondContact O-N 3.5Å; L170-Y273 HydrophobicContact CD1-CD1 3.78Å; L170-Y273 HydrophobicContact CD1-CG 4.4Å
171L98.4Very high98.2Very high13 Ų1324.7 Ų24.77%0.06813%0.133CC..Hα-helixtrans-76.6-25.2-172.3-76.3-51000112.6L167 A173 V174 F175 F219 V223L167-L171 HydrophobicContact CB-CD2 4.31Å; L167-L171 HydrophobicContact CD2-CD2 4.2Å; L167-L171 WeakPolarHBondContact O-CB 3.35Å; L167-L171 WeakPolarHBondContact O-CD2 3.46Å; L167-L171 PolarHBondContact O-N 3.34Å; L171-A173 VanDerWaalsContact C-N 3.28Å; L171-A173 PolarHBondContact O-N 3.43Å; L171-V174 HydrophobicContact CD1-CB 4.17Å; L171-V174 HydrophobicContact CD1-CG1 4.37Å; L171-V174 HydrophobicContact CD1-CG2 4.35Å; L171-V174 PolarHBondContact O-N 3.04Å; L171-F175 HydrophobicContact CB-CD2 4.06Å; L171-F175 HydrophobicContact CB-CE2 3.99Å; L171-F175 HydrophobicContact CD1-CD2 4.45Å; L171-F175 HydrophobicContact CD1-CE2 3.79Å; L171-F175 HydrophobicContact CD1-CZ 4.27Å; L171-F175 HydrophobicContact CG-CE2 4.16Å; L171-F175 WeakPolarHBondContact O-CB 3.26Å; L171-F175 WeakPolarHBondContact O-CD2 3.28Å; L171-F175 PolarHBondContact O-N 3.22Å; L171-F219 HydrophobicContact CB-CE2 3.94Å; L171-F219 HydrophobicContact CB-CZ 4.42Å; L171-F219 HydrophobicContact CD2-CE2 3.79Å; L171-F219 HydrophobicContact CD2-CZ 3.94Å; L171-F219 HydrophobicContact CG-CE2 3.83Å; L171-F219 HydrophobicContact CG-CZ 3.89Å; L171-V223 HydrophobicContact CB-CG1 4.42Å; L171-V223 HydrophobicContact CB-CG2 4.4Å
172M98.5Very high98.2Very high2 Ų226 Ų261%0.0114%0.138CC..Hα-helixtrans-63.9-35166.9-74.7-179.96200112V168 L170 S176 L185 P188 N189 M192V168-M172 HydrophobicContact CG1-CG 4.39Å; V168-M172 HydrophobicContact CG1-SD 3.63Å; V168-M172 VanDerWaalsContact O-CB 3.28Å; V168-M172 WeakPolarHBondContact O-CB 3.29Å; V168-M172 WeakPolarHBondContact O-CG 3.16Å; V168-M172 PolarHBondContact O-N 2.85Å; L170-M172 PolarHBondContact O-N 3.4Å; M172-S176 VanDerWaalsContact O-CB 3.32Å; M172-S176 WeakPolarHBondContact O-CB 3.37Å; M172-S176 PolarHBondContact O-N 2.91Å; M172-L185 HydrophobicContact CE-CD1 4.39Å; M172-P188 VanDerWaalsContact CE-C 3.49Å; M172-P188 HydrophobicContact CE-CB 3.76Å; M172-P188 HydrophobicContact CE-CG 3.88Å; M172-N189 HydrophobicContact CE-CB 4.15Å; M172-N189 VanDerWaalsContact CE-N 3.35Å; M172-N189 HydrophobicContact SD-CB 4.32Å; M172-M192 HydrophobicContact SD-CB 4.08Å; M172-M192 HydrophobicContact SD-CG 4.15Å
173A98.5Very high98.2Very high4 Ų432.8 Ų32.83%0.03316%0.164CC..Hα-helixtrans-71.5-46.2173.100000111.9W131 N134 G169 L170 L171 F175 S176 L185W131-A173 HydrophobicContact CG-CB 4.45Å; N134-A173 HydrophobicContact CB-CB 4.04Å; G169-A173 PolarHBondContact O-N 3.44Å; L170-A173 WeakPolarHBondContact O-CB 3.36Å; L170-A173 PolarHBondContact O-N 2.99Å; L170-A173 VanDerWaalsContact O-N 3.09Å; L171-A173 VanDerWaalsContact C-N 3.28Å; L171-A173 PolarHBondContact O-N 3.43Å; A173-F175 VanDerWaalsContact C-N 3.34Å; A173-F175 PolarHBondContact O-N 3.32Å; A173-S176 PolarHBondContact O-N 2.86Å; A173-L185 HydrophobicContact CB-CD2 4.19Å
174V98.2Very high98.2Very high38 Ų3839.5 Ų39.523%0.2319%0.189CC..Hα-helixtrans-60.7-40.5179.7171.20000112.1W131 L170 L171W131-V174 HydrophobicContact CD2-CG2 3.83Å; W131-V174 HydrophobicContact CE3-CG2 3.81Å; W131-V174 HydrophobicContact CG-CG2 4.48Å; W131-V174 HydrophobicContact CH2-CG2 4.1Å; W131-V174 HydrophobicContact CZ2-CG2 4.11Å; W131-V174 HydrophobicContact CZ3-CG2 3.95Å; L170-V174 WeakPolarHBondContact O-CG2 3.2Å; L170-V174 PolarHBondContact O-N 3.5Å; L171-V174 HydrophobicContact CD1-CB 4.17Å; L171-V174 HydrophobicContact CD1-CG1 4.37Å; L171-V174 HydrophobicContact CD1-CG2 4.35Å; L171-V174 PolarHBondContact O-N 3.04Å
175F98.2Very high98.1Very high36 Ų3639.4 Ų39.416%0.15819%0.189CC..THydrogen-bonded Turntrans-91.12.3-178.4-63.3-54.8000114.4L171 A173 V223 M227 Q239 V240 P375L171-F175 HydrophobicContact CB-CD2 4.06Å; L171-F175 HydrophobicContact CB-CE2 3.99Å; L171-F175 HydrophobicContact CD1-CD2 4.45Å; L171-F175 HydrophobicContact CD1-CE2 3.79Å; L171-F175 HydrophobicContact CD1-CZ 4.27Å; L171-F175 HydrophobicContact CG-CE2 4.16Å; L171-F175 WeakPolarHBondContact O-CB 3.26Å; L171-F175 WeakPolarHBondContact O-CD2 3.28Å; L171-F175 PolarHBondContact O-N 3.22Å; A173-F175 VanDerWaalsContact C-N 3.34Å; A173-F175 PolarHBondContact O-N 3.32Å; F175-V223 HydrophobicContact CD2-CG1 4.46Å; F175-M227 HydrophobicContact CB-CE 3.78Å; F175-M227 HydrophobicContact CB-SD 3.99Å; F175-M227 HydrophobicContact CD1-CE 4.34Å; F175-M227 HydrophobicContact CD2-CE 4.31Å; F175-M227 HydrophobicContact CD2-SD 3.72Å; F175-M227 HydrophobicContact CE2-SD 4.43Å; F175-M227 HydrophobicContact CG-CE 3.9Å; F175-M227 HydrophobicContact CG-SD 3.92Å; F175-Q239 CarbonylContact O-C 3.48Å; F175-Q239 VanDerWaalsContact O-CA 3.31Å; F175-Q239 WeakPolarHBondContact O-CA 3.33Å; F175-Q239 PolarHBondContact O-OE1 2.94Å; F175-V240 WeakPolarHBondContact O-CG2 3.47Å; F175-V240 PolarHBondContact O-N 3.38Å; F175-P375 HydrophobicContact CD2-CG 4.17Å; F175-P375 HydrophobicContact CE1-CB 4.04Å; F175-P375 HydrophobicContact CE1-CG 4.16Å; F175-P375 HydrophobicContact CE2-CB 4.1Å; F175-P375 HydrophobicContact CE2-CG 3.59Å; F175-P375 HydrophobicContact CZ-CB 3.58Å; F175-P375 HydrophobicContact CZ-CG 3.6Å
176S98.1Very high98.1Very high8 Ų841 Ų416%0.05620%0.196CC..BIsolated β-bridgetrans-78.5123175.5176.10000111.1M172 A173 A178M172-S176 VanDerWaalsContact O-CB 3.32Å; M172-S176 WeakPolarHBondContact O-CB 3.37Å; M172-S176 PolarHBondContact O-N 2.91Å; A173-S176 PolarHBondContact O-N 2.86Å; S176-A178 PolarHBondContact O-N 3.27Å; S176-A178 PolarHBondContact OG-N 3.39Å
177N97.5Very high98.1Very high91 Ų9145.8 Ų45.849%0.48722%0.222SC..THydrogen-bonded Turntrans-79.7-4.4173.1-163.551.4000112.7G179 P238N177-G179 PolarHBondContact O-N 3Å; N177-P238 HydrophobicContact CB-CB 4.22Å; N177-P238 HydrophobicContact CB-CG 4.39Å; N177-P238 WeakPolarHBondContact CB-O 3.46Å; N177-P238 PolarHBondContact N-O 3.16Å
178A96.9Very high98.1Very high39 Ų3946.6 Ų46.632%0.32223%0.227SC..THydrogen-bonded Turntrans-75.7-12.8173.900000112.9S176 Y182 P238S176-A178 PolarHBondContact O-N 3.27Å; S176-A178 PolarHBondContact OG-N 3.39Å; A178-Y182 HydrophobicContact CB-CD1 3.58Å; A178-Y182 HydrophobicContact CB-CD2 4Å; A178-Y182 HydrophobicContact CB-CE1 4.12Å; A178-Y182 HydrophobicContact CB-CE2 4.48Å; A178-Y182 HydrophobicContact CB-CG 3.53Å; A178-P238 HydrophobicContact CB-CG 4.46Å
179G94.6Very high98.1Very high32 Ų3246.6 Ų46.633%0.3323%0.227SC..  trans78.4-171.8178.300000114.6N177N177-G179 PolarHBondContact O-N 3Å
180D97.6Very high98.1Very high74 Ų7448.5 Ų48.540%0.39624%0.237SC..THydrogen-bonded Turntrans-69150.6-177.3-71.2-12.7000112.3N128 W130 W131 Y182N128-D180 PolarHBondContact ND2-OD2 3.22Å; W130-D180 HydrophobicContact CB-CB 4.04Å; W130-D180 VanDerWaalsContact CD1-OD1 3.24Å; W130-D180 HydrophobicContact CG-CB 4.08Å; W131-D180 PolarHBondContact NE1-OD1 3.27Å; D180-Y182 PolarHBondContact O-N 3.37Å
181W98.3Very high98.1Very high129 Ų12954.3 Ų54.349%0.48926%0.262SS..THydrogen-bonded Turntrans62.917.2178-50.4101.3000115.3W130 L133 W183W130-W181 VanDerWaalsContact CD2-N 3.31Å; W130-W181 HydrophobicContact CE3-CD2 4.25Å; W130-W181 AromaticContact CE3-CE3 3.79Å; W130-W181 HydrophobicContact CE3-CE3 3.79Å; W130-W181 HydrophobicContact CE3-CZ3 4.27Å; W130-W181 HydrophobicContact CZ3-CE3 4.27Å; L133-W181 HydrophobicContact CD2-CZ3 4.47Å; W181-W183 VanDerWaalsContact C-N 3.29Å; W181-W183 HydrophobicContact CE3-CH2 4.01Å; W181-W183 AromaticContact CE3-CZ2 3.62Å; W181-W183 HydrophobicContact CE3-CZ2 3.62Å; W181-W183 AromaticContact CZ3-CH2 4Å; W181-W183 HydrophobicContact CZ3-CH2 4Å; W181-W183 AromaticContact CZ3-CZ2 3.97Å; W181-W183 HydrophobicContact CZ3-CZ2 3.97Å; W181-W183 PolarHBondContact O-N 3.38Å
182Y98.2Very high98.1Very high57 Ų5754.3 Ų54.322%0.22426%0.262CS..  trans-72.283167.6-173.7-114.1000110.7W130 A178 D180 W184 L185 H236 F237W130-Y182 WeakPolarHBondContact CZ2-O 3.32Å; A178-Y182 HydrophobicContact CB-CD1 3.58Å; A178-Y182 HydrophobicContact CB-CD2 4Å; A178-Y182 HydrophobicContact CB-CE1 4.12Å; A178-Y182 HydrophobicContact CB-CE2 4.48Å; A178-Y182 HydrophobicContact CB-CG 3.53Å; D180-Y182 PolarHBondContact O-N 3.37Å; Y182-W184 HydrophobicContact CD1-CB 4.27Å; Y182-W184 HydrophobicContact CE1-CB 3.63Å; Y182-W184 HydrophobicContact CE2-CB 4.27Å; Y182-W184 AromaticContact CE2-CD1 3.84Å; Y182-W184 HydrophobicContact CE2-CG 4.45Å; Y182-W184 AromaticContact CZ-CD1 3.88Å; Y182-W184 PolarHBondContact O-N 3.3Å; Y182-L185 HydrophobicContact CD1-CB 4.09Å; Y182-L185 WeakPolarHBondContact O-CB 3.31Å; Y182-L185 PolarHBondContact O-N 2.96Å; Y182-H236 VanDerWaalsContact CE1-O 3.23Å; Y182-H236 WeakPolarHBondContact CE1-O 3.33Å; Y182-H236 VanDerWaalsContact CZ-O 3.27Å; Y182-H236 PolarHBondContact OH-O 2.87Å; Y182-F237 HydrophobicContact CE1-CD1 4.02Å; Y182-F237 HydrophobicContact CE1-CE1 4.16Å
183W98.4Very high98.1Very high144 Ų14454.2 Ų54.255%0.54526%0.262SS..G310 helixtrans-54-29.8-172-69.2106.5000115.4W130 L133 W181 L185 L186W130-W183 HydrophobicContact CH2-CE3 4.29Å; W130-W183 HydrophobicContact CZ3-CD2 4.34Å; W130-W183 AromaticContact CZ3-CE3 3.94Å; W130-W183 HydrophobicContact CZ3-CE3 3.94Å; W130-W183 HydrophobicContact CZ3-CH2 4.39Å; W130-W183 AromaticContact CZ3-CZ3 3.97Å; W130-W183 HydrophobicContact CZ3-CZ3 3.97Å; L133-W183 HydrophobicContact CD2-CH2 3.92Å; L133-W183 HydrophobicContact CD2-CZ3 3.77Å; W181-W183 VanDerWaalsContact C-N 3.29Å; W181-W183 HydrophobicContact CE3-CH2 4.01Å; W181-W183 AromaticContact CE3-CZ2 3.62Å; W181-W183 HydrophobicContact CE3-CZ2 3.62Å; W181-W183 AromaticContact CZ3-CH2 4Å; W181-W183 HydrophobicContact CZ3-CH2 4Å; W181-W183 AromaticContact CZ3-CZ2 3.97Å; W181-W183 HydrophobicContact CZ3-CZ2 3.97Å; W181-W183 PolarHBondContact O-N 3.38Å; W183-L185 PolarHBondContact O-N 3.18Å; W183-L186 HydrophobicContact CE3-CD1 3.62Å; W183-L186 HydrophobicContact CE3-CG 4.4Å; W183-L186 HydrophobicContact CZ3-CD1 3.9Å; W183-L186 WeakPolarHBondContact O-CB 3.41Å; W183-L186 PolarHBondContact O-N 2.89Å; W183-L186 VanDerWaalsContact O-N 3.1Å
184W98.3Very high98.1Very high160 Ų16056.6 Ų56.661%0.60627%0.273SS*.G310 helixtrans-60.4-25.7176.5-69.5110.8000112.9Y182 L186 L187 P188 F237Y182-W184 HydrophobicContact CD1-CB 4.27Å; Y182-W184 HydrophobicContact CE1-CB 3.63Å; Y182-W184 HydrophobicContact CE2-CB 4.27Å; Y182-W184 AromaticContact CE2-CD1 3.84Å; Y182-W184 HydrophobicContact CE2-CG 4.45Å; Y182-W184 AromaticContact CZ-CD1 3.88Å; Y182-W184 PolarHBondContact O-N 3.3Å; W184-L186 PolarHBondContact O-N 3.34Å; W184-L187 HydrophobicContact CE3-CD1 3.64Å; W184-L187 HydrophobicContact CZ3-CD1 3.84Å; W184-L187 PolarHBondContact O-N 3.43Å; W184-L187 VanDerWaalsContact O-N 3.13Å; W184-P188 WeakPolarHBondContact O-CD 3.46Å; W184-F237 HydrophobicContact CB-CE1 4.11Å; W184-F237 WeakPolarHBondContact O-CE1 3.3Å
185L98.5Very high98.2Very high0 Ų057.3 Ų57.30%027%0.274CS..G310 helixtrans-60.6-24.8176.1-16866.8000113.1W130 M172 A173 Y182 W183 L187 P188 N189W130-L185 HydrophobicContact CZ2-CB 4.13Å; W130-L185 HydrophobicContact CZ2-CD2 4.12Å; M172-L185 HydrophobicContact CE-CD1 4.39Å; A173-L185 HydrophobicContact CB-CD2 4.19Å; Y182-L185 HydrophobicContact CD1-CB 4.09Å; Y182-L185 WeakPolarHBondContact O-CB 3.31Å; Y182-L185 PolarHBondContact O-N 2.96Å; W183-L185 PolarHBondContact O-N 3.18Å; L185-L187 PolarHBondContact O-N 3.27Å; L185-P188 HydrophobicContact CD1-CG 4.42Å; L185-P188 WeakPolarHBondContact O-CD 3.47Å; L185-P188 WeakPolarHBondContact O-CG 3.48Å; L185-N189 VanDerWaalsContact O-CB 3.25Å; L185-N189 WeakPolarHBondContact O-CB 3.3Å; L185-N189 PolarHBondContact O-N 2.83Å; L185-N189 VanDerWaalsContact O-N 3.08Å
186L98.7Very high98.2Very high32 Ų3255.6 Ų55.617%0.16827%0.267CS..Hα-helixtrans-62-30.7176.8-65-175000112.1W130 N134 V137 W183 W184 N189 I190W130-L186 HydrophobicContact CH2-CD2 4.2Å; W130-L186 HydrophobicContact CH2-CG 4.22Å; N134-L186 WeakPolarHBondContact OD1-CD2 3.15Å; V137-L186 HydrophobicContact CG1-CD2 4.45Å; V137-L186 HydrophobicContact CG2-CD2 4.29Å; W183-L186 HydrophobicContact CE3-CD1 3.62Å; W183-L186 HydrophobicContact CE3-CG 4.4Å; W183-L186 HydrophobicContact CZ3-CD1 3.9Å; W183-L186 WeakPolarHBondContact O-CB 3.41Å; W183-L186 PolarHBondContact O-N 2.89Å; W183-L186 VanDerWaalsContact O-N 3.1Å; W184-L186 PolarHBondContact O-N 3.34Å; L186-N189 PolarHBondContact O-N 2.95Å; L186-I190 WeakPolarHBondContact O-CB 3.45Å; L186-I190 WeakPolarHBondContact O-CD1 3.33Å; L186-I190 WeakPolarHBondContact O-CG1 3.4Å; L186-I190 PolarHBondContact O-N 2.92Å
187L98.4Very high98.2Very high102 Ų10255.3 Ų55.353%0.53426%0.264SS..Hα-helixtrans-64.3-58.3179.6-63.7-178.2000112.7W184 L185 N189 I190 F191W184-L187 HydrophobicContact CE3-CD1 3.64Å; W184-L187 HydrophobicContact CZ3-CD1 3.84Å; W184-L187 PolarHBondContact O-N 3.43Å; W184-L187 VanDerWaalsContact O-N 3.13Å; L185-L187 PolarHBondContact O-N 3.27Å; L187-N189 VanDerWaalsContact C-N 3.26Å; L187-N189 PolarHBondContact O-N 2.91Å; L187-I190 PolarHBondContact O-N 3.27Å; L187-F191 PolarHBondContact O-N 3.32Å; L187-F191 VanDerWaalsContact O-N 3.1Å
188P98.4Very high98.2Very high17 Ų1754.7 Ų54.711%0.1126%0.26CS..Hα-helixtrans-66.5-29.6176.430-37.4000111.7M172 W184 L185 F191 M192 F237M172-P188 VanDerWaalsContact CE-C 3.49Å; M172-P188 HydrophobicContact CE-CB 3.76Å; M172-P188 HydrophobicContact CE-CG 3.88Å; W184-P188 WeakPolarHBondContact O-CD 3.46Å; L185-P188 HydrophobicContact CD1-CG 4.42Å; L185-P188 WeakPolarHBondContact O-CD 3.47Å; L185-P188 WeakPolarHBondContact O-CG 3.48Å; P188-F191 PolarHBondContact O-N 3.08Å; P188-M192 WeakPolarHBondContact O-CB 3.41Å; P188-M192 VanDerWaalsContact O-CG 3.31Å; P188-M192 WeakPolarHBondContact O-CG 3.39Å; P188-M192 PolarHBondContact O-N 3.18Å; P188-F237 HydrophobicContact CG-CD1 3.99Å; P188-F237 HydrophobicContact CG-CE1 3.78Å; P188-F237 HydrophobicContact CG-CG 4.48Å; P188-F237 HydrophobicContact CG-CZ 4.1Å
189N98.7Very high98.3Very high0 Ų054.2 Ų54.20%025%0.254CS..Hα-helixtrans-60.9-51.6174.2176.80.8000111.5N134 G169 M172 L185 L186 L187 F191 M192 S193N134-N189 PolarHBondContact O-ND2 2.89Å; N134-N189 PolarHBondContact OD1-ND2 2.8Å; G169-N189 WeakPolarHBondContact CA-ND2 3.42Å; G169-N189 VanDerWaalsContact CA-OD1 3.32Å; G169-N189 WeakPolarHBondContact CA-OD1 3.45Å; M172-N189 HydrophobicContact CE-CB 4.15Å; M172-N189 VanDerWaalsContact CE-N 3.35Å; M172-N189 HydrophobicContact SD-CB 4.32Å; L185-N189 VanDerWaalsContact O-CB 3.25Å; L185-N189 WeakPolarHBondContact O-CB 3.3Å; L185-N189 PolarHBondContact O-N 2.83Å; L185-N189 VanDerWaalsContact O-N 3.08Å; L186-N189 PolarHBondContact O-N 2.95Å; L187-N189 VanDerWaalsContact C-N 3.26Å; L187-N189 PolarHBondContact O-N 2.91Å; N189-F191 VanDerWaalsContact C-N 3.32Å; N189-F191 PolarHBondContact O-N 3.02Å; N189-M192 PolarHBondContact O-N 2.91Å; N189-S193 WeakPolarHBondContact O-CB 3.45Å; N189-S193 PolarHBondContact O-N 3.49Å; N189-S193 PolarHBondContact O-OG 3.21Å; N189-S193 PolarHBondContact OD1-OG 2.65Å; N189-S193 VanDerWaalsContact OD1-OG 3.09Å
190I98.9Very high98.5Very high41 Ų4153 Ų5321%0.2124%0.24CC..Hα-helixtrans-56.4-49.4176.4-72.3166.3000109.9V137 F141 L186 L187 S193 M194V137-I190 HydrophobicContact CG1-CD1 4.24Å; V137-I190 HydrophobicContact CG1-CG1 3.6Å; F141-I190 HydrophobicContact CB-CG2 4.31Å; F141-I190 HydrophobicContact CD1-CG1 4.41Å; F141-I190 HydrophobicContact CD1-CG2 3.55Å; F141-I190 HydrophobicContact CD2-CD1 4.3Å; F141-I190 HydrophobicContact CD2-CG1 3.75Å; F141-I190 HydrophobicContact CD2-CG2 4.39Å; F141-I190 HydrophobicContact CE1-CD1 4.46Å; F141-I190 HydrophobicContact CE1-CG1 4.49Å; F141-I190 HydrophobicContact CE1-CG2 3.86Å; F141-I190 HydrophobicContact CE2-CD1 3.87Å; F141-I190 HydrophobicContact CE2-CG1 3.85Å; F141-I190 HydrophobicContact CG-CB 4.38Å; F141-I190 HydrophobicContact CG-CG1 4.03Å; F141-I190 HydrophobicContact CG-CG2 3.83Å; F141-I190 HydrophobicContact CZ-CD1 3.95Å; F141-I190 HydrophobicContact CZ-CG1 4.22Å; F141-I190 HydrophobicContact CZ-CG2 4.39Å; L186-I190 WeakPolarHBondContact O-CB 3.45Å; L186-I190 WeakPolarHBondContact O-CD1 3.33Å; L186-I190 WeakPolarHBondContact O-CG1 3.4Å; L186-I190 PolarHBondContact O-N 2.92Å; L187-I190 PolarHBondContact O-N 3.27Å; I190-S193 PolarHBondContact O-N 3.41Å; I190-M194 HydrophobicContact CG2-CG 4.38Å; I190-M194 HydrophobicContact CG2-SD 3.87Å; I190-M194 WeakPolarHBondContact O-CB 3.3Å; I190-M194 VanDerWaalsContact O-CG 3.23Å; I190-M194 WeakPolarHBondContact O-CG 3.12Å; I190-M194 PolarHBondContact O-N 2.82Å
191F98.7Very high98.4Very high121 Ų12151.8 Ų51.853%0.53124%0.237SC..Hα-helixtrans-59.3-52.8-179.1178.1-100.9000112.2L187 P188 N189 S193 M194 M195L187-F191 PolarHBondContact O-N 3.32Å; L187-F191 VanDerWaalsContact O-N 3.1Å; P188-F191 PolarHBondContact O-N 3.08Å; N189-F191 VanDerWaalsContact C-N 3.32Å; N189-F191 PolarHBondContact O-N 3.02Å; F191-S193 VanDerWaalsContact C-N 3.33Å; F191-S193 PolarHBondContact O-N 3.06Å; F191-M194 PolarHBondContact O-N 2.86Å; F191-M195 HydrophobicContact CE1-CG 4.36Å; F191-M195 HydrophobicContact CE2-CE 4.41Å; F191-M195 HydrophobicContact CZ-CG 4.39Å; F191-M195 HydrophobicContact CZ-SD 4.45Å; F191-M195 WeakPolarHBondContact O-CG 3.31Å; F191-M195 PolarHBondContact O-N 3.14Å
192M98.7Very high98.4Very high14 Ų1448.3 Ų48.37%0.06924%0.236CC..Hα-helixtrans-64-39.1-179.8-68.6-51-153.700111.9V168 M172 P188 N189 M194 M195 C196 L222 L225 H226V168-M192 HydrophobicContact CG1-CB 3.67Å; M172-M192 HydrophobicContact SD-CB 4.08Å; M172-M192 HydrophobicContact SD-CG 4.15Å; P188-M192 WeakPolarHBondContact O-CB 3.41Å; P188-M192 VanDerWaalsContact O-CG 3.31Å; P188-M192 WeakPolarHBondContact O-CG 3.39Å; P188-M192 PolarHBondContact O-N 3.18Å; N189-M192 PolarHBondContact O-N 2.91Å; M192-M194 VanDerWaalsContact C-N 3.35Å; M192-M194 PolarHBondContact O-N 2.89Å; M192-M195 WeakPolarHBondContact O-CB 3.29Å; M192-M195 PolarHBondContact O-N 3.45Å; M192-M195 VanDerWaalsContact O-N 3.1Å; M192-C196 PolarHBondContact O-N 3.41Å; M192-L222 WeakPolarHBondContact O-CD1 3.45Å; M192-L222 HydrophobicContact SD-CD2 4.26Å; M192-L225 HydrophobicContact CE-CB 4.39Å; M192-L225 HydrophobicContact CE-CD2 4.17Å; M192-L225 HydrophobicContact CE-CG 4.07Å; M192-H226 HydrophobicContact CE-CB 3.55Å; M192-H226 HydrophobicContact CG-CB 4.36Å
193S98.8Very high98.3Very high0 Ų047.1 Ų47.10%023%0.233CC..Hα-helixtrans-64.9-38.4176.5-65.50000112.2G138 A142 N189 I190 F191 M195 C196G138-S193 WeakPolarHBondContact CA-OG 3.25Å; G138-S193 WeakPolarHBondContact O-CB 3.32Å; A142-S193 WeakPolarHBondContact CA-O 3.37Å; A142-S193 WeakPolarHBondContact CB-O 3.5Å; N189-S193 WeakPolarHBondContact O-CB 3.45Å; N189-S193 PolarHBondContact O-N 3.49Å; N189-S193 PolarHBondContact O-OG 3.21Å; N189-S193 PolarHBondContact OD1-OG 2.65Å; N189-S193 VanDerWaalsContact OD1-OG 3.09Å; I190-S193 PolarHBondContact O-N 3.41Å; F191-S193 VanDerWaalsContact C-N 3.33Å; F191-S193 PolarHBondContact O-N 3.06Å; S193-M195 PolarHBondContact O-N 2.98Å; S193-C196 VanDerWaalsContact O-CB 3.26Å; S193-C196 WeakPolarHBondContact O-CB 3.41Å; S193-C196 PolarHBondContact O-N 2.7Å; S193-C196 VanDerWaalsContact O-N 3.08Å
194M98.8Very high98.2Very high54 Ų5441.7 Ų41.727%0.26622%0.219SC..Hα-helixtrans-65.4-23.1173.6-71.5-18070.400113.1F141 S145 I190 F191 M192 C196 P197F141-M194 HydrophobicContact CB-CG 4.06Å; F141-M194 HydrophobicContact CD1-CG 4.39Å; F141-M194 HydrophobicContact CD1-SD 4.19Å; S145-M194 WeakPolarHBondContact CB-O 3.45Å; S145-M194 PolarHBondContact OG-O 2.92Å; I190-M194 HydrophobicContact CG2-CG 4.38Å; I190-M194 HydrophobicContact CG2-SD 3.87Å; I190-M194 WeakPolarHBondContact O-CB 3.3Å; I190-M194 VanDerWaalsContact O-CG 3.23Å; I190-M194 WeakPolarHBondContact O-CG 3.12Å; I190-M194 PolarHBondContact O-N 2.82Å; F191-M194 PolarHBondContact O-N 2.86Å; M192-M194 VanDerWaalsContact C-N 3.35Å; M192-M194 PolarHBondContact O-N 2.89Å; M194-C196 VanDerWaalsContact C-N 3.35Å; M194-P197 WeakPolarHBondContact O-CD 3.39Å
195M98.8Very high98Very high53 Ų5337.6 Ų37.626%0.26122%0.215SC..Hα-helixtrans-78.9-16.6173.7-62.8-60.9100.500113F191 M192 S193 I198 V199 L222F191-M195 HydrophobicContact CE1-CG 4.36Å; F191-M195 HydrophobicContact CE2-CE 4.41Å; F191-M195 HydrophobicContact CZ-CG 4.39Å; F191-M195 HydrophobicContact CZ-SD 4.45Å; F191-M195 WeakPolarHBondContact O-CG 3.31Å; F191-M195 PolarHBondContact O-N 3.14Å; M192-M195 WeakPolarHBondContact O-CB 3.29Å; M192-M195 PolarHBondContact O-N 3.45Å; M192-M195 VanDerWaalsContact O-N 3.1Å; S193-M195 PolarHBondContact O-N 2.98Å; M195-I198 HydrophobicContact CE-CD1 3.75Å; M195-I198 WeakPolarHBondContact O-CB 3.42Å; M195-I198 PolarHBondContact O-N 3.43Å; M195-I198 VanDerWaalsContact O-N 3.12Å; M195-I198 HydrophobicContact SD-CD1 3.8Å; M195-V199 PolarHBondContact O-N 2.85Å; M195-L222 HydrophobicContact CB-CD1 4.04Å; M195-L222 HydrophobicContact CB-CD2 3.67Å; M195-L222 HydrophobicContact CG-CD2 4.47Å
196C98.7Very high97.9Very high0 Ų042.2 Ų42.20%024%0.238CC..Hα-helixtrans-56-47.9-178.5-72.20000113.1A142 N164 M192 S193 M194 I198 V199 S200 L222A142-C196 HydrophobicContact CB-CB 4.32Å; N164-C196 HydrophobicContact CB-CB 4Å; M192-C196 PolarHBondContact O-N 3.41Å; S193-C196 VanDerWaalsContact O-CB 3.26Å; S193-C196 WeakPolarHBondContact O-CB 3.41Å; S193-C196 PolarHBondContact O-N 2.7Å; S193-C196 VanDerWaalsContact O-N 3.08Å; M194-C196 VanDerWaalsContact C-N 3.35Å; C196-I198 VanDerWaalsContact C-N 3.31Å; C196-I198 PolarHBondContact O-N 3.24Å; C196-V199 PolarHBondContact O-N 3.02Å; C196-S200 VanDerWaalsContact O-CB 3.27Å; C196-S200 WeakPolarHBondContact O-CB 3.45Å; C196-S200 PolarHBondContact O-N 3.41Å; C196-S200 PolarHBondContact O-OG 2.99Å; C196-L222 HydrophobicContact CB-CD1 4.22Å; C196-L222 WeakPolarHBondContact SG-CD1 3.5Å
197P98.6Very high97.6Very high1 Ų141.6 Ų41.61%0.00624%0.236CC..Hα-helixtrans-62.3-34.2176.7-25.636.3000114.1A142 A146 L149 Y161 M194 S200 S201A142-P197 WeakPolarHBondContact O-CG 3.4Å; A146-P197 HydrophobicContact CB-CB 4.09Å; A146-P197 HydrophobicContact CB-CG 3.9Å; L149-P197 HydrophobicContact CD1-CB 4.11Å; Y161-P197 HydrophobicContact CD1-CB 3.6Å; Y161-P197 HydrophobicContact CD1-CG 4.02Å; Y161-P197 HydrophobicContact CE1-CB 3.93Å; M194-P197 WeakPolarHBondContact O-CD 3.39Å; P197-S200 PolarHBondContact O-N 3.26Å; P197-S201 VanDerWaalsContact O-CB 3.29Å; P197-S201 WeakPolarHBondContact O-CB 3.48Å; P197-S201 PolarHBondContact O-N 2.87Å
198I98.4Very high97.3Very high78 Ų7840.9 Ų40.940%0.424%0.235SC..Hα-helixtrans-65.3-52178.7-59.2176.3000109.7L149 M195 C196 S200 S201 A202L149-I198 HydrophobicContact CD1-CD1 4.32Å; L149-I198 HydrophobicContact CD1-CG1 3.55Å; M195-I198 HydrophobicContact CE-CD1 3.75Å; M195-I198 WeakPolarHBondContact O-CB 3.42Å; M195-I198 PolarHBondContact O-N 3.43Å; M195-I198 VanDerWaalsContact O-N 3.12Å; M195-I198 HydrophobicContact SD-CD1 3.8Å; C196-I198 VanDerWaalsContact C-N 3.31Å; C196-I198 PolarHBondContact O-N 3.24Å; I198-S200 VanDerWaalsContact C-N 3.32Å; I198-S200 PolarHBondContact O-N 2.97Å; I198-S201 PolarHBondContact O-N 3.43Å; I198-A202 PolarHBondContact O-N 2.89Å
199V98.4Very high97Very high30 Ų3049.9 Ų49.918%0.18227%0.267CS..Hα-helixtrans-64.6-39.2178.41800000110.9M195 C196 S201 A202 L203 P218 I221 L222M195-V199 PolarHBondContact O-N 2.85Å; C196-V199 PolarHBondContact O-N 3.02Å; V199-S201 PolarHBondContact O-N 2.99Å; V199-A202 PolarHBondContact O-N 3.26Å; V199-L203 HydrophobicContact CG1-CD1 3.9Å; V199-L203 HydrophobicContact CG1-CG 4.3Å; V199-L203 WeakPolarHBondContact O-CB 3.32Å; V199-L203 WeakPolarHBondContact O-CG 3.39Å; V199-L203 PolarHBondContact O-N 2.97Å; V199-P218 HydrophobicContact CB-CB 4.1Å; V199-P218 HydrophobicContact CG1-CB 3.96Å; V199-P218 HydrophobicContact CG1-CG 4.35Å; V199-I221 HydrophobicContact CG1-CD1 3.95Å; V199-L222 HydrophobicContact CG2-CD1 4.22Å; V199-L222 HydrophobicContact CG2-CD2 4.23Å; V199-L222 HydrophobicContact CG2-CG 4.31Å
200S97.8Very high96.8Very high7 Ų757 Ų575%0.04929%0.294CS..Hα-helixtrans-59.3-46.8175.3-58.20000111.5C196 P197 I198 L203 A204 P218C196-S200 VanDerWaalsContact O-CB 3.27Å; C196-S200 WeakPolarHBondContact O-CB 3.45Å; C196-S200 PolarHBondContact O-N 3.41Å; C196-S200 PolarHBondContact O-OG 2.99Å; P197-S200 PolarHBondContact O-N 3.26Å; I198-S200 VanDerWaalsContact C-N 3.32Å; I198-S200 PolarHBondContact O-N 2.97Å; S200-L203 PolarHBondContact O-N 3.44Å; S200-A204 VanDerWaalsContact O-CB 3.23Å; S200-A204 WeakPolarHBondContact O-CB 3.39Å; S200-A204 PolarHBondContact O-N 3.19Å; S200-P218 VanDerWaalsContact OG-CG 3.23Å; S200-P218 WeakPolarHBondContact OG-CG 3.08Å
201S96.9Very high96.6Very high47 Ų4758 Ų5833%0.32930%0.3SS..Hα-helixtrans-64.2-44.3179.1-166.30000111.6P197 I198 V199 A204 S205P197-S201 VanDerWaalsContact O-CB 3.29Å; P197-S201 WeakPolarHBondContact O-CB 3.48Å; P197-S201 PolarHBondContact O-N 2.87Å; I198-S201 PolarHBondContact O-N 3.43Å; V199-S201 PolarHBondContact O-N 2.99Å; S201-A204 PolarHBondContact O-N 3.31Å; S201-S205 PolarHBondContact O-N 3.32Å
202A97.4Very high96.5Very high56 Ų5652.7 Ų52.746%0.46328%0.277SS..Hα-helixtrans-59.9-48.5176.600000111.9I198 V199 S205I198-A202 PolarHBondContact O-N 2.89Å; V199-A202 PolarHBondContact O-N 3.26Å; A202-S205 PolarHBondContact O-N 2.94Å; A202-S205 PolarHBondContact O-OG 3Å
203L97.1Very high96.4Very high33 Ų3353 Ų5317%0.17328%0.28CS..Hα-helixtrans-66.3-38.8177.7-69.5173.6000112.3V199 S200 S205 I206 N207 V214 L217 P218 I221V199-L203 HydrophobicContact CG1-CD1 3.9Å; V199-L203 HydrophobicContact CG1-CG 4.3Å; V199-L203 WeakPolarHBondContact O-CB 3.32Å; V199-L203 WeakPolarHBondContact O-CG 3.39Å; V199-L203 PolarHBondContact O-N 2.97Å; S200-L203 PolarHBondContact O-N 3.44Å; L203-S205 VanDerWaalsContact C-N 3.27Å; L203-S205 PolarHBondContact O-N 2.91Å; L203-I206 PolarHBondContact O-N 3.33Å; L203-I206 VanDerWaalsContact O-N 3.13Å; L203-N207 WeakPolarHBondContact O-CB 3.41Å; L203-N207 PolarHBondContact O-N 2.98Å; L203-V214 HydrophobicContact CB-CB 4.29Å; L203-V214 HydrophobicContact CB-CG1 3.77Å; L203-L217 HydrophobicContact CD1-CB 3.56Å; L203-L217 HydrophobicContact CD1-CD1 4.26Å; L203-P218 HydrophobicContact CD1-CG 4.1Å; L203-I221 HydrophobicContact CD1-CD1 4.11Å
204A94.9Very high96.4Very high30 Ų3054 Ų5425%0.24829%0.286CS..Hα-helixtrans-61.7-37176.900000111.5S200 S201 I206 N207 T208 V214S200-A204 VanDerWaalsContact O-CB 3.23Å; S200-A204 WeakPolarHBondContact O-CB 3.39Å; S200-A204 PolarHBondContact O-N 3.19Å; S201-A204 PolarHBondContact O-N 3.31Å; A204-I206 PolarHBondContact O-N 2.95Å; A204-N207 PolarHBondContact O-N 2.89Å; A204-T208 VanDerWaalsContact O-CB 3.3Å; A204-T208 WeakPolarHBondContact O-CB 3.5Å; A204-T208 WeakPolarHBondContact O-CG2 3.39Å; A204-T208 PolarHBondContact O-N 2.83Å; A204-T208 PolarHBondContact O-OG1 3.34Å; A204-V214 HydrophobicContact CB-CG1 3.84Å
205S95Very high96.3Very high74 Ų7451.5 Ų51.552%0.51727%0.274SS..Hα-helixtrans-60-27.417779.30000113.5S201 A202 L203S201-S205 PolarHBondContact O-N 3.32Å; A202-S205 PolarHBondContact O-N 2.94Å; A202-S205 PolarHBondContact O-OG 3Å; L203-S205 VanDerWaalsContact C-N 3.27Å; L203-S205 PolarHBondContact O-N 2.91Å
206I95.2Very high96.3Very high96 Ų9649.1 Ų49.149%0.49226%0.262SS..Hα-helixtrans-86.6-53.9175.7-59170.2000109.5L203 A204 T208 R209 W210L203-I206 PolarHBondContact O-N 3.33Å; L203-I206 VanDerWaalsContact O-N 3.13Å; A204-I206 PolarHBondContact O-N 2.95Å; I206-T208 VanDerWaalsContact C-N 3.32Å; I206-T208 PolarHBondContact O-N 3.2Å; I206-R209 WeakPolarHBondContact O-CB 3.48Å; I206-R209 WeakPolarHBondContact O-CG 3.36Å; I206-R209 PolarHBondContact O-N 3.11Å; I206-W210 HydrophobicContact CG2-CZ3 3.95Å; I206-W210 WeakPolarHBondContact O-CZ3 3.48Å
207N93.6Very high96.3Very high20 Ų2049.8 Ų49.811%0.10727%0.266CS..Hα-helixtrans-67.6-28.2-170.9-75.711.6000113.9L203 A204 R209 W210 D211 L212 P213L203-N207 WeakPolarHBondContact O-CB 3.41Å; L203-N207 PolarHBondContact O-N 2.98Å; A204-N207 PolarHBondContact O-N 2.89Å; N207-R209 PolarHBondContact O-N 3.07Å; N207-W210 PolarHBondContact O-N 3.19Å; N207-D211 PolarHBondContact O-N 3.35Å; N207-L212 HydrophobicContact CB-CB 3.98Å; N207-L212 WeakPolarHBondContact CB-O 3.43Å; N207-L212 PolarHBondContact O-N 3.36Å; N207-P213 PolarHBondContact ND2-O 3.38Å
208T91.6Very high96.3Very high86 Ų8649.8 Ų49.853%0.52827%0.265SS..G310 helixtrans-61.1-23.3176.648.50000113A204 I206 W210 D211A204-T208 VanDerWaalsContact O-CB 3.3Å; A204-T208 WeakPolarHBondContact O-CB 3.5Å; A204-T208 WeakPolarHBondContact O-CG2 3.39Å; A204-T208 PolarHBondContact O-N 2.83Å; A204-T208 PolarHBondContact O-OG1 3.34Å; I206-T208 VanDerWaalsContact C-N 3.32Å; I206-T208 PolarHBondContact O-N 3.2Å; T208-W210 PolarHBondContact O-N 3.24Å; T208-D211 PolarHBondContact O-N 2.97Å
209R92.9Very high96.4Very high206 Ų20646.2 Ų46.278%0.77725%0.247SC*.G310 helixtrans-62.9-25.1174.3-62.4-66.2-176.7163.70.1113.4I206 N207I206-R209 WeakPolarHBondContact O-CB 3.48Å; I206-R209 WeakPolarHBondContact O-CG 3.36Å; I206-R209 PolarHBondContact O-N 3.11Å; N207-R209 PolarHBondContact O-N 3.07Å
210W94.1Very high96.4Very high151 Ų15144.8 Ų44.857%0.57224%0.238SC*.G310 helixtrans-114.712.2178.1-63.8-85.5000112.9I206 N207 T208 L212 L390 K400I206-W210 HydrophobicContact CG2-CZ3 3.95Å; I206-W210 WeakPolarHBondContact O-CZ3 3.48Å; N207-W210 PolarHBondContact O-N 3.19Å; T208-W210 PolarHBondContact O-N 3.24Å; W210-L212 VanDerWaalsContact C-N 3.31Å; W210-L212 HydrophobicContact CB-CD1 3.82Å; W210-L212 HydrophobicContact CB-CG 3.88Å; W210-L212 PolarHBondContact O-N 3.34Å; W210-L390 HydrophobicContact CB-CD2 4.2Å; W210-L390 HydrophobicContact CG-CD2 4.26Å; W210-K400 PolarHBondContact O-NZ 2.92Å
211D95.2Very high96.4Very high60 Ų6047.3 Ų47.332%0.32125%0.251SS..THydrogen-bonded Turntrans50.452.4-173.4-162.543.1000111.1N207 T208 K400 P402 L403N207-D211 PolarHBondContact O-N 3.35Å; T208-D211 PolarHBondContact O-N 2.97Å; D211-K400 VanDerWaalsContact O-CE 3.3Å; D211-K400 WeakPolarHBondContact O-CE 3.43Å; D211-K400 PolarHBondContact O-NZ 2.89Å; D211-P402 VanDerWaalsContact OD2-CA 3.28Å; D211-P402 WeakPolarHBondContact OD2-CA 3.5Å; D211-L403 WeakPolarHBondContact O-CD1 3.28Å; D211-L403 VanDerWaalsContact OD1-CB 3.32Å; D211-L403 WeakPolarHBondContact OD1-CB 3.32Å; D211-L403 WeakPolarHBondContact OD1-CD1 3.39Å; D211-L403 WeakPolarHBondContact OD1-CG 3.12Å; D211-L403 PolarHBondContact OD2-N 3.47Å
212L96.6Very high96.5Very high10 Ų1045.3 Ų45.35%0.05224%0.236CC..  trans-112.6142.7179.6-66.5174.8000111.9N207 W210 L386 L389 L390 L403N207-L212 HydrophobicContact CB-CB 3.98Å; N207-L212 WeakPolarHBondContact CB-O 3.43Å; N207-L212 PolarHBondContact O-N 3.36Å; W210-L212 VanDerWaalsContact C-N 3.31Å; W210-L212 HydrophobicContact CB-CD1 3.82Å; W210-L212 HydrophobicContact CB-CG 3.88Å; W210-L212 PolarHBondContact O-N 3.34Å; L212-L386 HydrophobicContact CB-CD2 4.06Å; L212-L386 HydrophobicContact CD1-CD2 4.05Å; L212-L386 HydrophobicContact CD2-CD2 4.37Å; L212-L386 HydrophobicContact CG-CD2 4.4Å; L212-L389 HydrophobicContact CD2-CB 3.53Å; L212-L389 HydrophobicContact CD2-CD1 4.31Å; L212-L390 HydrophobicContact CD1-CD1 4.1Å; L212-L390 HydrophobicContact CD1-CD2 3.8Å; L212-L390 HydrophobicContact CD1-CG 3.82Å; L212-L390 HydrophobicContact CD2-CG 4.49Å; L212-L403 VanDerWaalsContact C-CD1 3.4Å
213P96.6Very high96.6Very high21 Ų2142.6 Ų42.614%0.13621%0.214CC..  trans-74.7163.7172.934.1-35000110.3N207 F215 F340 L389 L403N207-P213 PolarHBondContact ND2-O 3.38Å; P213-F215 HydrophobicContact CB-CD1 4.06Å; P213-F215 HydrophobicContact CB-CE1 4.09Å; P213-F215 HydrophobicContact CG-CD1 3.66Å; P213-F215 HydrophobicContact CG-CD2 4.19Å; P213-F215 HydrophobicContact CG-CE1 3.28Å; P213-F215 HydrophobicContact CG-CE2 3.81Å; P213-F215 HydrophobicContact CG-CG 4.13Å; P213-F215 HydrophobicContact CG-CZ 3.37Å; P213-F340 HydrophobicContact CB-CE1 4.05Å; P213-F340 HydrophobicContact CB-CZ 4.15Å; P213-F340 HydrophobicContact CG-CD1 4.37Å; P213-F340 HydrophobicContact CG-CE1 3.86Å; P213-F340 HydrophobicContact CG-CZ 3.95Å; P213-L389 HydrophobicContact CG-CD1 4.16Å; P213-L403 HydrophobicContact CB-CD2 4.49Å
214V97.4Very high96.6Very high20 Ų2041.7 Ų41.712%0.12121%0.21CC..  trans-84.7-17.3174.8-610000113.1L203 A204 L217L203-V214 HydrophobicContact CB-CB 4.29Å; L203-V214 HydrophobicContact CB-CG1 3.77Å; A204-V214 HydrophobicContact CB-CG1 3.84Å; V214-L217 VanDerWaalsContact O-CB 3.3Å; V214-L217 WeakPolarHBondContact O-CB 3.4Å; V214-L217 WeakPolarHBondContact O-CD1 3.47Å; V214-L217 WeakPolarHBondContact O-CG 3.41Å; V214-L217 PolarHBondContact O-N 3.46Å
215F98.4Very high96.8Very high3 Ų344.9 Ų44.91%0.01322%0.222CC..THydrogen-bonded Turntrans49.4-151.1-174.9-64.8-43.1000112.3F110 Y163 N164 P213 L217 P218 A335 F340 F381 A385 L386 L389F110-F215 AromaticContact CE1-CD1 3.71Å; F110-F215 HydrophobicContact CE1-CD1 3.71Å; F110-F215 AromaticContact CE1-CE1 3.75Å; F110-F215 HydrophobicContact CE1-CE1 3.75Å; F110-F215 HydrophobicContact CZ-CD1 4.23Å; F110-F215 HydrophobicContact CZ-CE1 4.12Å; Y163-F215 WeakPolarHBondContact CE2-O 3.24Å; Y163-F215 PolarHBondContact OH-O 3.4Å; N164-F215 PolarHBondContact ND2-O 2.84Å; P213-F215 HydrophobicContact CB-CD1 4.06Å; P213-F215 HydrophobicContact CB-CE1 4.09Å; P213-F215 HydrophobicContact CG-CD1 3.66Å; P213-F215 HydrophobicContact CG-CD2 4.19Å; P213-F215 HydrophobicContact CG-CE1 3.28Å; P213-F215 HydrophobicContact CG-CE2 3.81Å; P213-F215 HydrophobicContact CG-CG 4.13Å; P213-F215 HydrophobicContact CG-CZ 3.37Å; F215-L217 PolarHBondContact O-N 3.21Å; F215-P218 WeakPolarHBondContact O-CD 3.42Å; F215-A335 HydrophobicContact CE1-CB 4.48Å; F215-A335 HydrophobicContact CZ-CB 4.43Å; F215-F340 HydrophobicContact CE1-CD2 4.16Å; F215-F340 AromaticContact CE1-CE2 3.52Å; F215-F340 HydrophobicContact CE1-CE2 3.52Å; F215-F340 AromaticContact CE1-CZ 3.85Å; F215-F340 HydrophobicContact CE1-CZ 3.85Å; F215-F340 HydrophobicContact CZ-CD2 4.39Å; F215-F340 HydrophobicContact CZ-CE2 4.18Å; F215-F381 HydrophobicContact CB-CE1 3.81Å; F215-F381 HydrophobicContact CB-CZ 3.86Å; F215-F381 HydrophobicContact CD1-CE1 4.38Å; F215-F381 HydrophobicContact CD1-CE2 4.45Å; F215-F381 AromaticContact CD1-CZ 3.6Å; F215-F381 HydrophobicContact CD1-CZ 3.6Å; F215-F381 HydrophobicContact CD2-CZ 4.11Å; F215-F381 HydrophobicContact CE1-CE2 4.44Å; F215-F381 AromaticContact CE1-CZ 3.99Å; F215-F381 HydrophobicContact CE1-CZ 3.99Å; F215-F381 HydrophobicContact CG-CE1 4.11Å; F215-F381 AromaticContact CG-CZ 3.63Å; F215-F381 HydrophobicContact CG-CZ 3.63Å; F215-F381 HydrophobicContact CZ-CZ 4.42Å; F215-A385 HydrophobicContact CD2-CB 4.26Å; F215-A385 HydrophobicContact CE2-CB 3.42Å; F215-A385 VanDerWaalsContact CE2-CB 3.42Å; F215-A385 HydrophobicContact CZ-CB 3.61Å; F215-L386 HydrophobicContact CD2-CD2 3.96Å; F215-L386 HydrophobicContact CD2-CG 3.84Å; F215-L386 HydrophobicContact CE2-CD2 3.84Å; F215-L386 HydrophobicContact CE2-CG 3.85Å; F215-L389 HydrophobicContact CE2-CD1 4.01Å; F215-L389 HydrophobicContact CZ-CD1 3.55Å
216T98.6Very high96.9Very high3 Ų341.7 Ų41.72%0.01820%0.199CC..THydrogen-bonded Turntrans-85.318179560000112.4Y163 N164 L167 P218 F219 N220 T378 F381 C382Y163-T216 HydrophobicContact CD2-CG2 4.24Å; Y163-T216 HydrophobicContact CE2-CG2 4.03Å; N164-T216 VanDerWaalsContact OD1-CA 3.3Å; N164-T216 WeakPolarHBondContact OD1-CA 3.4Å; L167-T216 HydrophobicContact CD1-CG2 3.58Å; T216-P218 VanDerWaalsContact C-CD 3.48Å; T216-F219 WeakPolarHBondContact O-CB 3.31Å; T216-F219 PolarHBondContact O-N 3.09Å; T216-N220 PolarHBondContact O-N 2.68Å; T216-N220 PolarHBondContact O-ND2 3.11Å; T216-N220 PolarHBondContact OG1-ND2 2.76Å; T216-T378 WeakPolarHBondContact CB-OG1 3.48Å; T216-T378 PolarHBondContact OG1-OG1 3.13Å; T216-F381 HydrophobicContact CG2-CE1 4.32Å; T216-C382 PolarHBondContact OG1-SG 2.78Å
217L98.7Very high97Very high14 Ų1437.4 Ų37.47%0.07318%0.178CC..Hα-helixtrans-55.9-42.8176.6-70.8174.8000112.9L203 V214 F215 F219 N220 I221 W379 C382 L386L203-L217 HydrophobicContact CD1-CB 3.56Å; L203-L217 HydrophobicContact CD1-CD1 4.26Å; V214-L217 VanDerWaalsContact O-CB 3.3Å; V214-L217 WeakPolarHBondContact O-CB 3.4Å; V214-L217 WeakPolarHBondContact O-CD1 3.47Å; V214-L217 WeakPolarHBondContact O-CG 3.41Å; V214-L217 PolarHBondContact O-N 3.46Å; F215-L217 PolarHBondContact O-N 3.21Å; L217-F219 PolarHBondContact O-N 3.31Å; L217-N220 PolarHBondContact O-N 3.35Å; L217-I221 VanDerWaalsContact O-CG1 3.28Å; L217-I221 WeakPolarHBondContact O-CG1 3.45Å; L217-I221 PolarHBondContact O-N 3.27Å; L217-W379 HydrophobicContact CD2-CE3 3.89Å; L217-W379 HydrophobicContact CD2-CH2 4.24Å; L217-W379 HydrophobicContact CD2-CZ3 3.51Å; L217-C382 HydrophobicContact CD2-CB 3.56Å; L217-C382 HydrophobicContact CG-CB 3.96Å; L217-L386 HydrophobicContact CD1-CD1 4Å
218P98.7Very high97.2Very high0 Ų041 Ų410%020%0.2CC..Hα-helixtrans-56.8-47.2175.4-23.232.6000112.9N164 V199 S200 L203 F215 T216 I221 L222N164-P218 HydrophobicContact CB-CB 4.08Å; N164-P218 WeakPolarHBondContact OD1-CD 3.39Å; V199-P218 HydrophobicContact CB-CB 4.1Å; V199-P218 HydrophobicContact CG1-CB 3.96Å; V199-P218 HydrophobicContact CG1-CG 4.35Å; S200-P218 VanDerWaalsContact OG-CG 3.23Å; S200-P218 WeakPolarHBondContact OG-CG 3.08Å; L203-P218 HydrophobicContact CD1-CG 4.1Å; F215-P218 WeakPolarHBondContact O-CD 3.42Å; T216-P218 VanDerWaalsContact C-CD 3.48Å; P218-I221 PolarHBondContact O-N 2.98Å; P218-L222 WeakPolarHBondContact O-CB 3.29Å; P218-L222 WeakPolarHBondContact O-CD1 3.39Å; P218-L222 VanDerWaalsContact O-CG 3.28Å; P218-L222 WeakPolarHBondContact O-CG 3.27Å; P218-L222 PolarHBondContact O-N 3.06Å
219F98.8Very high97.4Very high3 Ų340.4 Ų40.41%0.01320%0.204CC..Hα-helixtrans-56.2-51.3174.2147.3-103.7000111.8N164 L167 V168 L171 T216 L217 I221 L222 V223 C377 T378N164-F219 HydrophobicContact CB-CB 4.22Å; N164-F219 VanDerWaalsContact OD1-CB 3.25Å; N164-F219 WeakPolarHBondContact OD1-CB 3.33Å; N164-F219 PolarHBondContact OD1-N 3.28Å; L167-F219 HydrophobicContact CB-CB 4.11Å; L167-F219 HydrophobicContact CB-CD1 4.22Å; L167-F219 HydrophobicContact CB-CD2 3.29Å; L167-F219 HydrophobicContact CB-CE2 3.63Å; L167-F219 HydrophobicContact CB-CG 3.59Å; L167-F219 HydrophobicContact CB-CZ 4.25Å; L167-F219 HydrophobicContact CD1-CB 4.3Å; L167-F219 HydrophobicContact CD1-CD1 3.89Å; L167-F219 HydrophobicContact CD1-CD2 4.44Å; L167-F219 HydrophobicContact CD1-CE1 4.33Å; L167-F219 HydrophobicContact CD1-CG 3.93Å; L167-F219 HydrophobicContact CG-CD2 4.49Å; L167-F219 HydrophobicContact CG-CG 4.44Å; L167-F219 WeakPolarHBondContact O-CE2 3.31Å; V168-F219 HydrophobicContact CG2-CB 4.34Å; V168-F219 HydrophobicContact CG2-CD2 4.09Å; L171-F219 HydrophobicContact CB-CE2 3.94Å; L171-F219 HydrophobicContact CB-CZ 4.42Å; L171-F219 HydrophobicContact CD2-CE2 3.79Å; L171-F219 HydrophobicContact CD2-CZ 3.94Å; L171-F219 HydrophobicContact CG-CE2 3.83Å; L171-F219 HydrophobicContact CG-CZ 3.89Å; T216-F219 WeakPolarHBondContact O-CB 3.31Å; T216-F219 PolarHBondContact O-N 3.09Å; L217-F219 PolarHBondContact O-N 3.31Å; F219-I221 VanDerWaalsContact C-N 3.32Å; F219-I221 PolarHBondContact O-N 2.91Å; F219-L222 PolarHBondContact O-N 3.23Å; F219-V223 HydrophobicContact CD2-CB 4.44Å; F219-V223 HydrophobicContact CD2-CG2 3.6Å; F219-V223 HydrophobicContact CE2-CB 4.18Å; F219-V223 HydrophobicContact CE2-CG2 3.49Å; F219-V223 VanDerWaalsContact CE2-CG2 3.49Å; F219-V223 PolarHBondContact O-N 2.81Å; F219-C377 HydrophobicContact CE1-CB 3.84Å; F219-C377 HydrophobicContact CZ-CB 3.88Å; F219-T378 HydrophobicContact CE1-CG2 4.42Å; F219-T378 VanDerWaalsContact CE1-OG1 3.3Å; F219-T378 WeakPolarHBondContact CE1-OG1 3.45Å
220N98.8Very high97.6Very high0 Ų031.8 Ų31.80%017%0.174CC..Hα-helixtrans-59.9-44.2-176.2-80.4-64.5000111.6T216 L217 C224 C377 T378 W379T216-N220 PolarHBondContact O-N 2.68Å; T216-N220 PolarHBondContact O-ND2 3.11Å; T216-N220 PolarHBondContact OG1-ND2 2.76Å; L217-N220 PolarHBondContact O-N 3.35Å; N220-C224 VanDerWaalsContact O-CB 3.28Å; N220-C224 WeakPolarHBondContact O-CB 3.45Å; N220-C224 PolarHBondContact O-N 3.48Å; N220-C224 VanDerWaalsContact O-N 3.14Å; N220-C224 PolarHBondContact O-SG 3.08Å; N220-C377 WeakPolarHBondContact OD1-CB 3.36Å; N220-T378 PolarHBondContact ND2-OG1 3.41Å; N220-T378 WeakPolarHBondContact OD1-CA 3.48Å; N220-T378 PolarHBondContact OD1-N 2.94Å; N220-T378 PolarHBondContact OD1-OG1 2.9Å; N220-W379 HydrophobicContact CB-CD2 3.97Å; N220-W379 HydrophobicContact CB-CG 4.15Å; N220-W379 HydrophobicContact CB-CZ2 4.04Å; N220-W379 PolarHBondContact OD1-N 3.35Å; N220-W379 VanDerWaalsContact OD1-N 3.09Å
221I98.8Very high97.7Very high60 Ų6025.7 Ų25.731%0.30816%0.159SC..Hα-helixtrans-62.3-48.2177.4-68.6165.3000110.6V199 L203 L217 P218 F219 L225 W379V199-I221 HydrophobicContact CG1-CD1 3.95Å; L203-I221 HydrophobicContact CD1-CD1 4.11Å; L217-I221 VanDerWaalsContact O-CG1 3.28Å; L217-I221 WeakPolarHBondContact O-CG1 3.45Å; L217-I221 PolarHBondContact O-N 3.27Å; P218-I221 PolarHBondContact O-N 2.98Å; F219-I221 VanDerWaalsContact C-N 3.32Å; F219-I221 PolarHBondContact O-N 2.91Å; I221-L225 VanDerWaalsContact O-CB 3.24Å; I221-L225 WeakPolarHBondContact O-CB 3.23Å; I221-L225 PolarHBondContact O-N 3.22Å; I221-W379 HydrophobicContact CD1-CH2 4.49Å; I221-W379 HydrophobicContact CG1-CH2 3.8Å; I221-W379 HydrophobicContact CG1-CZ2 3.83Å
222L98.8Very high97.8Very high5 Ų525.5 Ų25.53%0.02616%0.156CC..Hα-helixtrans-74.1-38-171.9-70.2165.3000113.1V168 M192 M195 C196 V199 P218 F219 L225 H226V168-L222 HydrophobicContact CG2-CB 4.17Å; M192-L222 WeakPolarHBondContact O-CD1 3.45Å; M192-L222 HydrophobicContact SD-CD2 4.26Å; M195-L222 HydrophobicContact CB-CD1 4.04Å; M195-L222 HydrophobicContact CB-CD2 3.67Å; M195-L222 HydrophobicContact CG-CD2 4.47Å; C196-L222 HydrophobicContact CB-CD1 4.22Å; C196-L222 WeakPolarHBondContact SG-CD1 3.5Å; V199-L222 HydrophobicContact CG2-CD1 4.22Å; V199-L222 HydrophobicContact CG2-CD2 4.23Å; V199-L222 HydrophobicContact CG2-CG 4.31Å; P218-L222 WeakPolarHBondContact O-CB 3.29Å; P218-L222 WeakPolarHBondContact O-CD1 3.39Å; P218-L222 VanDerWaalsContact O-CG 3.28Å; P218-L222 WeakPolarHBondContact O-CG 3.27Å; P218-L222 PolarHBondContact O-N 3.06Å; F219-L222 PolarHBondContact O-N 3.23Å; L222-L225 PolarHBondContact O-N 2.62Å; L222-H226 PolarHBondContact O-N 3.25Å
223V98.4Very high97.8Very high0 Ų034.3 Ų34.30%019%0.19CC..Hα-helixtrans-67.1-44.8173.2171.30000110.8V168 L171 F175 F219 L225 H226 M227V168-V223 HydrophobicContact CB-CG2 4.35Å; V168-V223 HydrophobicContact CG2-CG2 4.04Å; L171-V223 HydrophobicContact CB-CG1 4.42Å; L171-V223 HydrophobicContact CB-CG2 4.4Å; F175-V223 HydrophobicContact CD2-CG1 4.46Å; F219-V223 HydrophobicContact CD2-CB 4.44Å; F219-V223 HydrophobicContact CD2-CG2 3.6Å; F219-V223 HydrophobicContact CE2-CB 4.18Å; F219-V223 HydrophobicContact CE2-CG2 3.49Å; F219-V223 VanDerWaalsContact CE2-CG2 3.49Å; F219-V223 PolarHBondContact O-N 2.81Å; V223-L225 VanDerWaalsContact C-N 3.32Å; V223-L225 PolarHBondContact O-N 2.83Å; V223-H226 PolarHBondContact O-N 3.39Å; V223-M227 HydrophobicContact CG1-CG 4.29Å; V223-M227 HydrophobicContact CG1-SD 4.02Å; V223-M227 WeakPolarHBondContact O-CB 3.32Å; V223-M227 WeakPolarHBondContact O-CG 3.35Å; V223-M227 PolarHBondContact O-N 2.82Å
224C98.3Very high97.9Very high13 Ų1335.5 Ų35.59%0.08820%0.195CC..Hα-helixtrans-61.2-43.1175.7-67.50000111.3N220 H226 M227 V228 M369 L374N220-C224 VanDerWaalsContact O-CB 3.28Å; N220-C224 WeakPolarHBondContact O-CB 3.45Å; N220-C224 PolarHBondContact O-N 3.48Å; N220-C224 VanDerWaalsContact O-N 3.14Å; N220-C224 PolarHBondContact O-SG 3.08Å; C224-H226 VanDerWaalsContact C-N 3.35Å; C224-H226 PolarHBondContact O-N 3.09Å; C224-M227 PolarHBondContact O-N 3.44Å; C224-V228 WeakPolarHBondContact O-CG2 3.34Å; C224-V228 PolarHBondContact O-N 3.31Å; C224-M369 VanDerWaalsContact SG-CE 3.6Å; C224-L374 HydrophobicContact CB-CD1 4.14Å; C224-L374 HydrophobicContact CB-CD2 4.5Å
225L98.2Very high97.8Very high97 Ų9743.3 Ų43.351%0.50823%0.229SC..Hα-helixtrans-57.9-46.7175.8178.463.7000111.5M192 I221 L222 V223 A229M192-L225 HydrophobicContact CE-CB 4.39Å; M192-L225 HydrophobicContact CE-CD2 4.17Å; M192-L225 HydrophobicContact CE-CG 4.07Å; I221-L225 VanDerWaalsContact O-CB 3.24Å; I221-L225 WeakPolarHBondContact O-CB 3.23Å; I221-L225 PolarHBondContact O-N 3.22Å; L222-L225 PolarHBondContact O-N 2.62Å; V223-L225 VanDerWaalsContact C-N 3.32Å; V223-L225 PolarHBondContact O-N 2.83Å; L225-A229 WeakPolarHBondContact O-CB 3.41Å; L225-A229 PolarHBondContact O-N 2.95Å
226H98Very high97.7Very high7 Ų749 Ų493%0.03226%0.256CS..Hα-helixtrans-60.6-48.4177.2-179.265.5000111.7M192 L222 V223 C224 A229 T230 Q239M192-H226 HydrophobicContact CE-CB 3.55Å; M192-H226 HydrophobicContact CG-CB 4.36Å; L222-H226 PolarHBondContact O-N 3.25Å; V223-H226 PolarHBondContact O-N 3.39Å; C224-H226 VanDerWaalsContact C-N 3.35Å; C224-H226 PolarHBondContact O-N 3.09Å; H226-A229 PolarHBondContact O-N 3.31Å; H226-T230 PolarHBondContact O-N 2.91Å; H226-T230 PolarHBondContact O-OG1 3.01Å; H226-Q239 PolarHBondContact NE2-NE2 3.01Å
227M97.7Very high97.7Very high7 Ų750.9 Ų50.93%0.03426%0.264CS..Hα-helixtrans-67-39.2-176.3-71.6-172.274.200112.6F175 V223 C224 G231 Q239 I242 L374 P375F175-M227 HydrophobicContact CB-CE 3.78Å; F175-M227 HydrophobicContact CB-SD 3.99Å; F175-M227 HydrophobicContact CD1-CE 4.34Å; F175-M227 HydrophobicContact CD2-CE 4.31Å; F175-M227 HydrophobicContact CD2-SD 3.72Å; F175-M227 HydrophobicContact CE2-SD 4.43Å; F175-M227 HydrophobicContact CG-CE 3.9Å; F175-M227 HydrophobicContact CG-SD 3.92Å; V223-M227 HydrophobicContact CG1-CG 4.29Å; V223-M227 HydrophobicContact CG1-SD 4.02Å; V223-M227 WeakPolarHBondContact O-CB 3.32Å; V223-M227 WeakPolarHBondContact O-CG 3.35Å; V223-M227 PolarHBondContact O-N 2.82Å; C224-M227 PolarHBondContact O-N 3.44Å; M227-G231 VanDerWaalsContact O-CA 3.3Å; M227-G231 WeakPolarHBondContact O-CA 3.37Å; M227-G231 PolarHBondContact O-N 2.99Å; M227-Q239 HydrophobicContact CB-CG 4.46Å; M227-Q239 HydrophobicContact CE-CB 4.3Å; M227-Q239 HydrophobicContact CG-CG 4.36Å; M227-I242 HydrophobicContact CE-CD1 4.1Å; M227-L374 HydrophobicContact CB-CD2 3.5Å; M227-L374 HydrophobicContact SD-CD2 4.44Å; M227-P375 HydrophobicContact CE-CG 4.26Å; M227-P375 WeakPolarHBondContact SD-CD 3.48Å; M227-P375 HydrophobicContact SD-CG 3.75Å
228V96.4Very high97.7Very high94 Ų9451.4 Ų51.457%0.5727%0.268SS*.Hα-helixtrans-67.6-42.6174175.10000111.2C224 T230 L374C224-V228 WeakPolarHBondContact O-CG2 3.34Å; C224-V228 PolarHBondContact O-N 3.31Å; V228-T230 VanDerWaalsContact C-N 3.28Å; V228-T230 PolarHBondContact O-N 3Å; V228-L374 HydrophobicContact CG2-CD1 3.64Å; V228-L374 HydrophobicContact CG2-CD2 3.79Å; V228-L374 HydrophobicContact CG2-CG 3.97Å
229A97.2Very high97.6Very high75 Ų7551.6 Ų51.662%0.6227%0.269SS*.Hα-helixtrans-66.8-31.1-177.200000112.9L225 H226L225-A229 WeakPolarHBondContact O-CB 3.41Å; L225-A229 PolarHBondContact O-N 2.95Å; H226-A229 PolarHBondContact O-N 3.31Å
230T97Very high97.5Very high24 Ų2454.1 Ų54.115%0.14728%0.284CS..Hα-helixtrans-95.5-57.5-179.853.40000111.1H226 V228 N234 F237 Q239H226-T230 PolarHBondContact O-N 2.91Å; H226-T230 PolarHBondContact O-OG1 3.01Å; V228-T230 VanDerWaalsContact C-N 3.28Å; V228-T230 PolarHBondContact O-N 3Å; T230-N234 VanDerWaalsContact O-CB 3.27Å; T230-N234 WeakPolarHBondContact O-CB 3.16Å; T230-F237 WeakPolarHBondContact CB-O 3.31Å; T230-F237 HydrophobicContact CG2-CB 3.76Å; T230-F237 HydrophobicContact CG2-CD2 4.39Å; T230-F237 HydrophobicContact CG2-CG 4.49Å; T230-Q239 VanDerWaalsContact OG1-CG 3.23Å; T230-Q239 WeakPolarHBondContact OG1-CG 3.37Å; T230-Q239 PolarHBondContact OG1-NE2 3.35Å; T230-Q239 VanDerWaalsContact OG1-NE2 3.1Å
231G96.4Very high97.4Very high24 Ų2457.9 Ų57.925%0.24730%0.304CS..  trans69.3176.8-177.800000113.5M227 Y233 Q239M227-G231 VanDerWaalsContact O-CA 3.3Å; M227-G231 WeakPolarHBondContact O-CA 3.37Å; M227-G231 PolarHBondContact O-N 2.99Å; G231-Y233 VanDerWaalsContact C-N 3.31Å; G231-Y233 PolarHBondContact O-N 3.48Å; G231-Q239 PolarHBondContact O-N 3.4Å
232H97Very high97.3Very high56 Ų5656.9 Ų56.926%0.25930%0.299SS..THydrogen-bonded Turntrans-62.8-36.4-177.7-178.260.5000113.4N234 P238 Q239 L241H232-N234 PolarHBondContact O-N 3.37Å; H232-P238 WeakPolarHBondContact O-CB 3.45Å; H232-Q239 WeakPolarHBondContact CA-O 3.44Å; H232-Q239 PolarHBondContact ND1-O 3.46Å; H232-L241 HydrophobicContact CB-CD1 4.11Å
233Y95.9Very high97.1Very high195 Ų19563 Ų6377%0.76533%0.328SS*.THydrogen-bonded Turntrans-92.912-173.2-56.4-68.4000114.2G231 H235G231-Y233 VanDerWaalsContact C-N 3.31Å; G231-Y233 PolarHBondContact O-N 3.48Å; Y233-H235 PolarHBondContact O-N 3.36Å
234N97.8Very high97Very high46 Ų4665.7 Ų65.725%0.24635%0.345CS..  trans-64.2134.1175-158.2-92.8000111T230 H232 H236 F237 P238T230-N234 VanDerWaalsContact O-CB 3.27Å; T230-N234 WeakPolarHBondContact O-CB 3.16Å; H232-N234 PolarHBondContact O-N 3.37Å; N234-H236 VanDerWaalsContact C-N 3.33Å; N234-H236 PolarHBondContact O-N 3.4Å; N234-H236 PolarHBondContact OD1-N 3.07Å; N234-F237 PolarHBondContact OD1-N 2.56Å; N234-P238 WeakPolarHBondContact O-CB 3.34Å; N234-P238 WeakPolarHBondContact O-CD 3.48Å
235H96.4Very high96.5Very high183 Ų18371.8 Ų71.885%0.84737%0.366SS*.SBendtrans-69.8-28.7177.7-70.5-68.6000113.9Y233Y233-H235 PolarHBondContact O-N 3.36Å
236H96.7Very high96Very high123 Ų12372.6 Ų72.657%0.56938%0.38SS*.SBendtrans-100.9-44.2-176.2-65.2-63.9000112.2Y182 N234 P238Y182-H236 VanDerWaalsContact CE1-O 3.23Å; Y182-H236 WeakPolarHBondContact CE1-O 3.33Å; Y182-H236 VanDerWaalsContact CZ-O 3.27Å; Y182-H236 PolarHBondContact OH-O 2.87Å; N234-H236 VanDerWaalsContact C-N 3.33Å; N234-H236 PolarHBondContact O-N 3.4Å; N234-H236 PolarHBondContact OD1-N 3.07Å; H236-P238 WeakPolarHBondContact O-CD 3.33Å
237F97.9Very high95.5Very high42 Ų4280 Ų8018%0.18441%0.414CS..SBendtrans-126.760.6-173.9-52.7-68.2000110.9Y182 W184 P188 T230 N234 Q239Y182-F237 HydrophobicContact CE1-CD1 4.02Å; Y182-F237 HydrophobicContact CE1-CE1 4.16Å; W184-F237 HydrophobicContact CB-CE1 4.11Å; W184-F237 WeakPolarHBondContact O-CE1 3.3Å; P188-F237 HydrophobicContact CG-CD1 3.99Å; P188-F237 HydrophobicContact CG-CE1 3.78Å; P188-F237 HydrophobicContact CG-CG 4.48Å; P188-F237 HydrophobicContact CG-CZ 4.1Å; T230-F237 WeakPolarHBondContact CB-O 3.31Å; T230-F237 HydrophobicContact CG2-CB 3.76Å; T230-F237 HydrophobicContact CG2-CD2 4.39Å; T230-F237 HydrophobicContact CG2-CG 4.49Å; N234-F237 PolarHBondContact OD1-N 2.56Å; F237-Q239 PolarHBondContact O-N 3.25Å; F237-Q239 PolarHBondContact O-NE2 3.48Å
238P97.8Very high95Very high26 Ų2687.6 Ų87.617%0.16945%0.454CS..PPolyproline II helixtrans-64.6131.1-178.227.7-34.3000110.2N177 A178 H232 N234 H236N177-P238 HydrophobicContact CB-CB 4.22Å; N177-P238 HydrophobicContact CB-CG 4.39Å; N177-P238 WeakPolarHBondContact CB-O 3.46Å; N177-P238 PolarHBondContact N-O 3.16Å; A178-P238 HydrophobicContact CB-CG 4.46Å; H232-P238 WeakPolarHBondContact O-CB 3.45Å; N234-P238 WeakPolarHBondContact O-CB 3.34Å; N234-P238 WeakPolarHBondContact O-CD 3.48Å; H236-P238 WeakPolarHBondContact O-CD 3.33Å
239Q97.6Very high94.6Very high3 Ų385.7 Ų85.71%0.01444%0.444CS..BIsolated β-bridgetrans-91.5157.8177.3-54.3-59.4-54.600111.7F175 H226 M227 T230 G231 H232 F237F175-Q239 CarbonylContact O-C 3.48Å; F175-Q239 VanDerWaalsContact O-CA 3.31Å; F175-Q239 WeakPolarHBondContact O-CA 3.33Å; F175-Q239 PolarHBondContact O-OE1 2.94Å; H226-Q239 PolarHBondContact NE2-NE2 3.01Å; M227-Q239 HydrophobicContact CB-CG 4.46Å; M227-Q239 HydrophobicContact CE-CB 4.3Å; M227-Q239 HydrophobicContact CG-CG 4.36Å; T230-Q239 VanDerWaalsContact OG1-CG 3.23Å; T230-Q239 WeakPolarHBondContact OG1-CG 3.37Å; T230-Q239 PolarHBondContact OG1-NE2 3.35Å; T230-Q239 VanDerWaalsContact OG1-NE2 3.1Å; G231-Q239 PolarHBondContact O-N 3.4Å; H232-Q239 WeakPolarHBondContact CA-O 3.44Å; H232-Q239 PolarHBondContact ND1-O 3.46Å; F237-Q239 PolarHBondContact O-N 3.25Å; F237-Q239 PolarHBondContact O-NE2 3.48Å
240V96.9Very high94.2Very high56 Ų5689.6 Ų89.634%0.33946%0.455SS..PPolyproline II helixtrans-57.8138.1169.6172.70000109.4F175 I242F175-V240 WeakPolarHBondContact O-CG2 3.47Å; F175-V240 PolarHBondContact O-N 3.38Å; V240-I242 PolarHBondContact O-N 3.42Å
241L97Very high94Very high80 Ų8090.1 Ų90.142%0.41946%0.456SS..  trans-75.4115.1179.8-176.659.6000110.3H232 Q243H232-L241 HydrophobicContact CB-CD1 4.11Å; L241-Q243 HydrophobicContact CD1-CG 4.16Å; L241-Q243 HydrophobicContact CG-CG 4.05Å
242I96.3Very high93.9Very high39 Ų3991.2 Ų91.220%0.246%0.458CS..  trans-109.5128.4173.9-59.7173.6000108.1M227 V240 G373 P375M227-I242 HydrophobicContact CE-CD1 4.1Å; V240-I242 PolarHBondContact O-N 3.42Å; I242-G373 WeakPolarHBondContact O-CA 3.47Å; I242-P375 HydrophobicContact CD1-CB 3.99Å; I242-P375 HydrophobicContact CD1-CG 4.24Å
243Q95.2Very high93.8Very high133 Ų13394.8 Ų94.862%0.62147%0.47SS*.  trans-130.2149.8-178.3-70.1-175.6-1600111.3L241L241-Q243 HydrophobicContact CD1-CG 4.16Å; L241-Q243 HydrophobicContact CG-CG 4.05Å
244P94.6Very high93.7Very high57 Ų5790.8 Ų90.837%0.3747%0.47SS..  trans-65.4146.1171.429.4-34.5000110.2S246 S370P244-S246 PolarHBondContact O-N 3.11Å; P244-S370 VanDerWaalsContact CA-OG 3.31Å; P244-S370 WeakPolarHBondContact CA-OG 3.34Å
245R87.8Confident93.5Very high141 Ų14195.3 Ų95.353%0.53249%0.49SS..  trans-65.5125.4172.6-66-177.1-172.3169.92.9109.6P316 D319R245-P316 VanDerWaalsContact NH1-CD 3.31Å; R245-D319 IonicContact CZ-OD2 3.93Å; R245-D319 IonicContact NH1-OD2 2.88Å; R245-D319 IonicContact NH2-OD1 3.19Å; R245-D319 IonicContact NH2-OD2 3.83Å; R245-D319 PolarHBondContact NH2-OD2 2.94Å
246S87.7Confident93.4Very high114 Ų11488.9 Ų88.980%0.79746%0.461SS*.  trans-98.1-14.7177.2520000113.3P244P244-S246 PolarHBondContact O-N 3.11Å
247E88.1Confident93.5Very high161 Ų16186 Ų8675%0.75245%0.45SS*.SBendtrans-134.9156-171.9-65-179.3-170.800111.5
248L87.6Confident93.4Very high167 Ų16787.9 Ų87.987%0.87446%0.464SS*.  trans-70.7128.3173-72.7162.7000109.1N250L248-N250 PolarHBondContact O-N 3.5Å
249P87.3Confident93.4Very high55 Ų5589 Ų8936%0.35748%0.476SS..  trans-66132.1175.927.8-33.1000109.9I251 P316P249-I251 HydrophobicContact CB-CD1 4.39Å; P249-I251 HydrophobicContact CB-CG1 4.17Å; P249-I251 HydrophobicContact CG-CD1 4.03Å; P249-I251 HydrophobicContact CG-CG1 4.3Å; P249-I251 PolarHBondContact O-N 3.3Å; P249-I251 VanDerWaalsContact O-N 3.16Å; P249-P316 HydrophobicContact CB-CG 3.79Å; P249-P316 HydrophobicContact CG-CG 4.02Å
250N89.1Confident93.4Very high156 Ų15692.3 Ų92.383%0.83449%0.491SS*.  trans-77.399.5173.8-172.623.3000109.3L248L248-N250 PolarHBondContact O-N 3.5Å
251I93Very high93.4Very high36 Ų3690.5 Ų90.519%0.18548%0.479CS..  trans-105.7113.7-176.9-59.9172.8000109.5P249 S314 F317P249-I251 HydrophobicContact CB-CD1 4.39Å; P249-I251 HydrophobicContact CB-CG1 4.17Å; P249-I251 HydrophobicContact CG-CD1 4.03Å; P249-I251 HydrophobicContact CG-CG1 4.3Å; P249-I251 PolarHBondContact O-N 3.3Å; P249-I251 VanDerWaalsContact O-N 3.16Å; I251-S314 WeakPolarHBondContact CD1-O 3.23Å; I251-F317 HydrophobicContact CG2-CD2 4.5Å; I251-F317 HydrophobicContact CG2-CE1 4.16Å; I251-F317 HydrophobicContact CG2-CE2 3.85Å; I251-F317 HydrophobicContact CG2-CZ 3.65Å
252T94.3Very high93.5Very high47 Ų4793.7 Ų93.729%0.28849%0.49SS..  trans-98.2100.2172.8-49.10000109.4S254 E255T252-S254 WeakPolarHBondContact CG2-OG 3.48Å; T252-S254 PolarHBondContact O-N 3.12Å; T252-E255 HydrophobicContact CG2-CG 3.88Å; T252-E255 WeakPolarHBondContact O-CB 3.44Å; T252-E255 PolarHBondContact O-N 2.93Å
253W94.2Very high93.6Very high131 Ų13199 Ų9950%0.49651%0.507SS..G310 helixtrans-58.2-25.4-174.6-7289.5000115.1E255 I256 L311 F317W253-E255 PolarHBondContact O-N 3.49Å; W253-I256 WeakPolarHBondContact O-CB 3.12Å; W253-I256 VanDerWaalsContact O-CG2 3.24Å; W253-I256 WeakPolarHBondContact O-CG2 3.4Å; W253-I256 PolarHBondContact O-N 3.24Å; W253-L311 WeakPolarHBondContact CH2-O 3.46Å; W253-F317 HydrophobicContact CD2-CZ 4.29Å; W253-F317 HydrophobicContact CE3-CE1 4.29Å; W253-F317 AromaticContact CE3-CZ 3.99Å; W253-F317 HydrophobicContact CE3-CZ 3.99Å; W253-F317 HydrophobicContact CZ3-CE1 4.3Å; W253-F317 HydrophobicContact CZ3-CZ 4.45Å
254S94.8Very high93.7Very high111 Ų11192.9 Ų92.978%0.77648%0.479SS*.G310 helixtrans-71.7-15.7174.955.50000114T252 I256T252-S254 WeakPolarHBondContact CG2-OG 3.48Å; T252-S254 PolarHBondContact O-N 3.12Å; S254-I256 VanDerWaalsContact C-N 3.3Å
255E93.5Very high93.9Very high140 Ų14091.4 Ų91.465%0.65447%0.468SS*.G310 helixtrans-89.44.3178.6-63.7175.9175.400112.7T252 W253 D257T252-E255 HydrophobicContact CG2-CG 3.88Å; T252-E255 WeakPolarHBondContact O-CB 3.44Å; T252-E255 PolarHBondContact O-N 2.93Å; W253-E255 PolarHBondContact O-N 3.49Å; E255-D257 PolarHBondContact O-N 2.78Å
256I95.3Very high94.5Very high49 Ų4986 Ų8625%0.25145%0.451SS..  trans-62121.5179.2-163173.9000111W253 S254 V258 L261 L311 F317W253-I256 WeakPolarHBondContact O-CB 3.12Å; W253-I256 VanDerWaalsContact O-CG2 3.24Å; W253-I256 WeakPolarHBondContact O-CG2 3.4Å; W253-I256 PolarHBondContact O-N 3.24Å; S254-I256 VanDerWaalsContact C-N 3.3Å; I256-V258 PolarHBondContact O-N 3.16Å; I256-L261 HydrophobicContact CD1-CD1 3.62Å; I256-L261 HydrophobicContact CD1-CD2 4.48Å; I256-L261 HydrophobicContact CD1-CG 4.43Å; I256-L261 HydrophobicContact CG1-CD1 3.96Å; I256-L261 HydrophobicContact CG1-CG 4.43Å; I256-L311 HydrophobicContact CD1-CD2 3.84Å; I256-F317 HydrophobicContact CB-CE1 4.46Å; I256-F317 HydrophobicContact CB-CE2 3.95Å; I256-F317 HydrophobicContact CB-CZ 3.92Å; I256-F317 HydrophobicContact CD1-CE1 3.94Å; I256-F317 HydrophobicContact CD1-CZ 4.14Å; I256-F317 HydrophobicContact CG1-CD1 4.37Å; I256-F317 HydrophobicContact CG1-CE1 4.08Å; I256-F317 HydrophobicContact CG1-CE2 4.31Å; I256-F317 HydrophobicContact CG1-CZ 4.04Å
257D97.2Very high95Very high62 Ų6280.9 Ų80.933%0.33242%0.415SS..  trans-90102.3173.6-174.2-27.8000109.9E255 A259 K260 L261 Y321E255-D257 PolarHBondContact O-N 2.78Å; D257-A259 VanDerWaalsContact C-N 3.26Å; D257-A259 PolarHBondContact O-N 2.96Å; D257-A259 WeakPolarHBondContact OD1-CA 3.16Å; D257-A259 WeakPolarHBondContact OD1-CB 3.41Å; D257-A259 PolarHBondContact OD1-N 3Å; D257-K260 HydrophobicContact CB-CB 3.99Å; D257-K260 HydrophobicContact CB-CD 3.94Å; D257-K260 HydrophobicContact CB-CG 4Å; D257-K260 PolarHBondContact O-N 3.42Å; D257-K260 PolarHBondContact OD1-N 3.05Å; D257-K260 WeakPolarHBondContact OD2-CG 3.3Å; D257-L261 PolarHBondContact O-N 3.49Å; D257-L261 VanDerWaalsContact O-N 3.07Å; D257-Y321 HydrophobicContact CB-CE2 4.43Å; D257-Y321 PolarHBondContact N-OH 3.28Å
258V96.5Very high95.5Very high81 Ų8173.2 Ų73.249%0.49138%0.379SS..Hα-helixtrans-62.3-33.2179.5179.50000111.8I256 L261 F262I256-V258 PolarHBondContact O-N 3.16Å; V258-L261 WeakPolarHBondContact O-CB 3.25Å; V258-L261 PolarHBondContact O-N 3.35Å; V258-F262 HydrophobicContact CG1-CD2 3.97Å; V258-F262 HydrophobicContact CG1-CE2 3.68Å; V258-F262 VanDerWaalsContact O-CD2 3.25Å; V258-F262 WeakPolarHBondContact O-CD2 3.28Å; V258-F262 PolarHBondContact O-N 3.1Å; V258-F262 VanDerWaalsContact O-N 3.11Å
259A97.7Very high96Very high51 Ų5165.2 Ų65.242%0.42134%0.337SS..Hα-helixtrans-68.3-38.6177.500000110.9D257 L261 F262 R263D257-A259 VanDerWaalsContact C-N 3.26Å; D257-A259 PolarHBondContact O-N 2.96Å; D257-A259 WeakPolarHBondContact OD1-CA 3.16Å; D257-A259 WeakPolarHBondContact OD1-CB 3.41Å; D257-A259 PolarHBondContact OD1-N 3Å; A259-L261 VanDerWaalsContact C-N 3.33Å; A259-F262 PolarHBondContact O-N 2.97Å; A259-R263 VanDerWaalsContact O-CG 3.29Å; A259-R263 WeakPolarHBondContact O-CG 3.44Å; A259-R263 PolarHBondContact O-N 3.28Å
260K97.9Very high96.6Very high72 Ų7262.6 Ų62.631%0.31332%0.32SS..Hα-helixtrans-66.2-31.5172.1-70.9-177.7-172.6-179.50112.9D257 R263 S264 E318 Y321D257-K260 HydrophobicContact CB-CB 3.99Å; D257-K260 HydrophobicContact CB-CD 3.94Å; D257-K260 HydrophobicContact CB-CG 4Å; D257-K260 PolarHBondContact O-N 3.42Å; D257-K260 PolarHBondContact OD1-N 3.05Å; D257-K260 WeakPolarHBondContact OD2-CG 3.3Å; K260-R263 CarbonylContact O-C 3.59Å; K260-R263 PolarHBondContact O-N 3.4Å; K260-S264 PolarHBondContact O-N 3.23Å; K260-E318 IonicContact NZ-OE1 3.9Å; K260-Y321 HydrophobicContact CB-CD1 3.47Å; K260-Y321 VanDerWaalsContact CB-CD1 3.47Å; K260-Y321 HydrophobicContact CB-CD2 3.92Å; K260-Y321 HydrophobicContact CB-CE1 3.62Å; K260-Y321 HydrophobicContact CB-CE2 4.04Å; K260-Y321 HydrophobicContact CB-CG 3.64Å; K260-Y321 HydrophobicContact CD-CD2 3.44Å; K260-Y321 VanDerWaalsContact CD-CD2 3.44Å; K260-Y321 HydrophobicContact CD-CE2 3.63Å; K260-Y321 HydrophobicContact CD-CG 3.94Å; K260-Y321 HydrophobicContact CG-CD2 4.34Å; K260-Y321 HydrophobicContact CG-CG 4.41Å
261L97.4Very high97Very high18 Ų1856.2 Ų56.29%0.09429%0.285CS..Hα-helixtrans-61.9-48.1170.3-65.8173000111.6I256 D257 V258 A259 R263 S264 M307 L311 I320 Y321I256-L261 HydrophobicContact CD1-CD1 3.62Å; I256-L261 HydrophobicContact CD1-CD2 4.48Å; I256-L261 HydrophobicContact CD1-CG 4.43Å; I256-L261 HydrophobicContact CG1-CD1 3.96Å; I256-L261 HydrophobicContact CG1-CG 4.43Å; D257-L261 PolarHBondContact O-N 3.49Å; D257-L261 VanDerWaalsContact O-N 3.07Å; V258-L261 WeakPolarHBondContact O-CB 3.25Å; V258-L261 PolarHBondContact O-N 3.35Å; A259-L261 VanDerWaalsContact C-N 3.33Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.35Å; L261-S264 PolarHBondContact O-N 3.02Å; L261-S264 VanDerWaalsContact O-N 3.09Å; L261-S264 PolarHBondContact O-OG 2.87Å; L261-M307 HydrophobicContact CB-SD 3.87Å; L261-M307 HydrophobicContact CD2-CG 4.19Å; L261-M307 HydrophobicContact CD2-SD 4.27Å; L261-L311 HydrophobicContact CD1-CD1 4.35Å; L261-L311 HydrophobicContact CD2-CD1 4.17Å; L261-L311 HydrophobicContact CD2-CD2 4.16Å; L261-L311 HydrophobicContact CD2-CG 4.47Å; L261-I320 HydrophobicContact CD2-CG2 4.04Å; L261-Y321 HydrophobicContact CD2-CD1 4.26Å; L261-Y321 HydrophobicContact CD2-CE1 3.65Å; L261-Y321 HydrophobicContact CG-CE1 3.94Å
262F97.5Very high97.3Very high146 Ų14654.6 Ų54.664%0.6428%0.277SS*.Hα-helixtrans-64.1-36.1176.4-76.4-73.8000112.2V258 A259 S264 I265 P266V258-F262 HydrophobicContact CG1-CD2 3.97Å; V258-F262 HydrophobicContact CG1-CE2 3.68Å; V258-F262 VanDerWaalsContact O-CD2 3.25Å; V258-F262 WeakPolarHBondContact O-CD2 3.28Å; V258-F262 PolarHBondContact O-N 3.1Å; V258-F262 VanDerWaalsContact O-N 3.11Å; A259-F262 PolarHBondContact O-N 2.97Å; F262-S264 VanDerWaalsContact C-N 3.29Å; F262-S264 PolarHBondContact O-N 3.24Å; F262-I265 PolarHBondContact O-N 3.1Å; F262-P266 WeakPolarHBondContact O-CD 3.43Å
263R98.3Very high97.5Very high152 Ų15252.4 Ų52.457%0.57426%0.263SS*.Hα-helixtrans-67.2-27.1173.6-70.3172.4-177.5178.12.5112.8A259 K260 L261 I265 P266 V267A259-R263 VanDerWaalsContact O-CG 3.29Å; A259-R263 WeakPolarHBondContact O-CG 3.44Å; A259-R263 PolarHBondContact O-N 3.28Å; K260-R263 CarbonylContact O-C 3.59Å; K260-R263 PolarHBondContact O-N 3.4Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.35Å; R263-I265 PolarHBondContact O-N 3.03Å; R263-P266 WeakPolarHBondContact O-CD 3.22Å; R263-P266 VanDerWaalsContact O-CG 3.25Å; R263-P266 WeakPolarHBondContact O-CG 3.46Å; R263-V267 WeakPolarHBondContact O-CG2 3.5Å; R263-V267 PolarHBondContact O-N 3.18Å
264S98.6Very high97.7Very high3 Ų346.5 Ų46.52%0.02124%0.243CC..Hα-helixtrans-67.1-19178.675.60000113K260 L261 F262 G268 M307 I320K260-S264 PolarHBondContact O-N 3.23Å; L261-S264 PolarHBondContact O-N 3.02Å; L261-S264 VanDerWaalsContact O-N 3.09Å; L261-S264 PolarHBondContact O-OG 2.87Å; F262-S264 VanDerWaalsContact C-N 3.29Å; F262-S264 PolarHBondContact O-N 3.24Å; S264-G268 PolarHBondContact O-N 3.39Å; S264-M307 WeakPolarHBondContact OG-CG 3.4Å; S264-I320 WeakPolarHBondContact CB-O 3.31Å
265I98.8Very high97.9Very high27 Ų2741.2 Ų41.214%0.13821%0.206CC..Hα-helixtrans-65-59.4176.7-61.8174.4000111.2F262 R263 V267 G268 I269 V300 S303 A304 M307F262-I265 PolarHBondContact O-N 3.1Å; R263-I265 PolarHBondContact O-N 3.03Å; I265-V267 VanDerWaalsContact C-N 3.33Å; I265-V267 PolarHBondContact O-N 3Å; I265-G268 PolarHBondContact O-N 3.03Å; I265-I269 PolarHBondContact O-N 3.41Å; I265-V300 HydrophobicContact CG2-CG1 3.97Å; I265-S303 WeakPolarHBondContact CA-OG 3.21Å; I265-S303 WeakPolarHBondContact O-CB 3.49Å; I265-S303 PolarHBondContact O-OG 3.28Å; I265-A304 HydrophobicContact CD1-CB 4.14Å; I265-A304 HydrophobicContact CG1-CB 4.35Å; I265-M307 HydrophobicContact CG1-SD 4.35Å
266P98.8Very high98.1Very high27 Ų2737.4 Ų37.418%0.17519%0.19CC..Hα-helixtrans-63.9-36.317423.8-32.9000112.1F262 R263 G268 I269 G270 P278 G281 I285F262-P266 WeakPolarHBondContact O-CD 3.43Å; R263-P266 WeakPolarHBondContact O-CD 3.22Å; R263-P266 VanDerWaalsContact O-CG 3.25Å; R263-P266 WeakPolarHBondContact O-CG 3.46Å; P266-G268 VanDerWaalsContact C-N 3.34Å; P266-G268 PolarHBondContact O-N 3.2Å; P266-I269 WeakPolarHBondContact O-CB 3.41Å; P266-I269 PolarHBondContact O-N 3.05Å; P266-I269 VanDerWaalsContact O-N 3.09Å; P266-G270 PolarHBondContact O-N 3.35Å; P266-P278 HydrophobicContact CG-CB 4.42Å; P266-G281 WeakPolarHBondContact O-CA 3.38Å; P266-I285 HydrophobicContact CB-CD1 4.1Å
267V98.9Very high98.2Very high6 Ų637 Ų374%0.03619%0.189CC..Hα-helixtrans-61-42.2175.9177.20000111.3R263 I265 I269 G270 Q271 D276 P278 F322R263-V267 WeakPolarHBondContact O-CG2 3.5Å; R263-V267 PolarHBondContact O-N 3.18Å; I265-V267 VanDerWaalsContact C-N 3.33Å; I265-V267 PolarHBondContact O-N 3Å; V267-I269 PolarHBondContact O-N 3.22Å; V267-G270 CarbonylContact O-C 3.57Å; V267-G270 WeakPolarHBondContact O-CA 3.39Å; V267-G270 PolarHBondContact O-N 2.66Å; V267-Q271 HydrophobicContact CG1-CG 4.27Å; V267-Q271 WeakPolarHBondContact O-CG 3.33Å; V267-Q271 PolarHBondContact O-N 3.26Å; V267-D276 WeakPolarHBondContact CG2-O 3.45Å; V267-P278 HydrophobicContact CG2-CB 3.77Å; V267-P278 HydrophobicContact CG2-CG 4.43Å; V267-F322 WeakPolarHBondContact CG1-O 3.37Å
268G98.8Very high98.3Very high0 Ų036.2 Ų36.20%019%0.187CC..Hα-helixtrans-61.1-30.5175.100000113.2S264 I265 P266 Y327S264-G268 PolarHBondContact O-N 3.39Å; I265-G268 PolarHBondContact O-N 3.03Å; P266-G268 VanDerWaalsContact C-N 3.34Å; P266-G268 PolarHBondContact O-N 3.2Å; G268-Y327 WeakPolarHBondContact O-CA 3.42Å; G268-Y327 WeakPolarHBondContact O-CB 3.45Å; G268-Y327 PolarHBondContact O-N 2.94Å
269I98.9Very high98.4Very high0 Ų041.6 Ų41.60%020%0.199CC..Hα-helixtrans-73.9-40.2171.4-64.2170.3000110.7M109 I265 P266 V267 Q271 V272 F284 I285 A299 V300 V330M109-I269 HydrophobicContact CE-CG2 4.18Å; M109-I269 HydrophobicContact SD-CG2 4.48Å; I265-I269 PolarHBondContact O-N 3.41Å; P266-I269 WeakPolarHBondContact O-CB 3.41Å; P266-I269 PolarHBondContact O-N 3.05Å; P266-I269 VanDerWaalsContact O-N 3.09Å; V267-I269 PolarHBondContact O-N 3.22Å; I269-Q271 VanDerWaalsContact C-N 3.31Å; I269-Q271 PolarHBondContact O-N 3.3Å; I269-V272 VanDerWaalsContact O-CB 3.31Å; I269-V272 WeakPolarHBondContact O-CB 3.16Å; I269-V272 WeakPolarHBondContact O-CG2 3.23Å; I269-V272 PolarHBondContact O-N 3.25Å; I269-F284 HydrophobicContact CG2-CB 3.94Å; I269-I285 HydrophobicContact CD1-CD1 3.8Å; I269-I285 HydrophobicContact CD1-CG1 3.48Å; I269-I285 VanDerWaalsContact CD1-CG1 3.48Å; I269-I285 HydrophobicContact CG2-CG1 4.43Å; I269-A299 HydrophobicContact CD1-CB 4.23Å; I269-V300 HydrophobicContact CD1-CG2 4.02Å; I269-V330 HydrophobicContact CG1-CG1 4.39Å; I269-V330 HydrophobicContact CG1-CG2 3.81Å
270G98.8Very high98.4Very high0 Ų039.1 Ų39.10%018%0.179CC..Hα-helixtrans-57.4-42172.500000113P266 V267 V272 Y273 C275P266-G270 PolarHBondContact O-N 3.35Å; V267-G270 CarbonylContact O-C 3.57Å; V267-G270 WeakPolarHBondContact O-CA 3.39Å; V267-G270 PolarHBondContact O-N 2.66Å; G270-V272 PolarHBondContact O-N 3.36Å; G270-V272 VanDerWaalsContact O-N 3.08Å; G270-Y273 PolarHBondContact O-N 3.18Å; G270-C275 CarbonylContact C-O 3.45Å; G270-C275 WeakPolarHBondContact CA-O 3.37Å; G270-C275 WeakPolarHBondContact O-CB 3.31Å; G270-C275 PolarHBondContact O-N 3.25Å; G270-C275 VanDerWaalsContact O-N 3.08Å
271Q98.8Very high98.5Very high21 Ų2135.7 Ų35.710%0.09816%0.164CC..G310 helixtrans-65-13.3-178.4-75.6-65.82.100113.8V267 I269 Y273 G274 C275 F322 Y327V267-Q271 HydrophobicContact CG1-CG 4.27Å; V267-Q271 WeakPolarHBondContact O-CG 3.33Å; V267-Q271 PolarHBondContact O-N 3.26Å; I269-Q271 VanDerWaalsContact C-N 3.31Å; I269-Q271 PolarHBondContact O-N 3.3Å; Q271-Y273 PolarHBondContact O-N 2.9Å; Q271-G274 PolarHBondContact O-N 3.12Å; Q271-C275 PolarHBondContact N-O 3.41Å; Q271-F322 VanDerWaalsContact CG-O 3.23Å; Q271-F322 WeakPolarHBondContact CG-O 3.46Å; Q271-F322 PolarHBondContact NE2-O 3.49Å; Q271-Y327 HydrophobicContact CB-CD1 3.96Å; Q271-Y327 HydrophobicContact CB-CG 4Å
272V98.9Very high98.5Very high3 Ų336 Ų362%0.01817%0.171CC..G310 helixtrans-57.1-31.4168.11750000111.2V108 M109 L167 I269 G270 V330 L331V108-V272 HydrophobicContact CG1-CG1 3.58Å; M109-V272 HydrophobicContact CE-CG2 4.26Å; M109-V272 HydrophobicContact CG-CG1 3.9Å; M109-V272 HydrophobicContact SD-CG1 4.29Å; L167-V272 WeakPolarHBondContact CD2-O 3.14Å; I269-V272 VanDerWaalsContact O-CB 3.31Å; I269-V272 WeakPolarHBondContact O-CB 3.16Å; I269-V272 WeakPolarHBondContact O-CG2 3.23Å; I269-V272 PolarHBondContact O-N 3.25Å; G270-V272 PolarHBondContact O-N 3.36Å; G270-V272 VanDerWaalsContact O-N 3.08Å; V272-V330 HydrophobicContact CG2-CB 4.11Å; V272-V330 HydrophobicContact CG2-CG1 3.91Å; V272-L331 HydrophobicContact CG1-CD1 4.19Å; V272-L331 HydrophobicContact CG1-CD2 3.85Å; V272-L331 HydrophobicContact CG1-CG 4.15Å; V272-L331 HydrophobicContact CG2-CG 4.32Å
273Y98.8Very high98.6Very high0 Ų031 Ų310%015%0.151CC..G310 helixtrans-106.912.9174.5-64.8-96.5000112.7A105 V108 M109 I120 L124 I166 L167 L170 G270 Q271 F284A105-Y273 WeakPolarHBondContact O-CE1 3.13Å; A105-Y273 PolarHBondContact O-OH 3.42Å; V108-Y273 HydrophobicContact CB-CE1 3.71Å; V108-Y273 HydrophobicContact CB-CE2 4.42Å; V108-Y273 WeakPolarHBondContact CB-OH 3.39Å; V108-Y273 HydrophobicContact CG1-CD1 4.36Å; V108-Y273 HydrophobicContact CG1-CE1 3.85Å; V108-Y273 HydrophobicContact CG1-CE2 4.08Å; V108-Y273 HydrophobicContact CG2-CD1 4.41Å; V108-Y273 HydrophobicContact CG2-CE1 3.63Å; M109-Y273 HydrophobicContact CG-CE2 4.01Å; M109-Y273 HydrophobicContact SD-CE2 3.95Å; I120-Y273 WeakPolarHBondContact CD1-OH 3.09Å; I120-Y273 HydrophobicContact CG2-CD1 4.44Å; I120-Y273 HydrophobicContact CG2-CE1 3.85Å; I120-Y273 HydrophobicContact CG2-CE2 4.38Å; L124-Y273 HydrophobicContact CD2-CD1 4.42Å; L124-Y273 HydrophobicContact CD2-CG 4.38Å; I166-Y273 HydrophobicContact CG2-CE1 4.44Å; L167-Y273 HydrophobicContact CD2-CD1 4.4Å; L170-Y273 HydrophobicContact CD1-CD1 3.78Å; L170-Y273 HydrophobicContact CD1-CG 4.4Å; G270-Y273 PolarHBondContact O-N 3.18Å; Q271-Y273 PolarHBondContact O-N 2.9Å; Y273-F284 AromaticContact CD2-CD2 3.8Å; Y273-F284 HydrophobicContact CD2-CD2 3.8Å; Y273-F284 AromaticContact CD2-CE2 3.41Å; Y273-F284 HydrophobicContact CD2-CE2 3.41Å; Y273-F284 VanDerWaalsContact CD2-CE2 3.41Å; Y273-F284 HydrophobicContact CD2-CZ 4.03Å; Y273-F284 HydrophobicContact CE2-CD2 4.17Å; Y273-F284 HydrophobicContact CE2-CE2 4.11Å; Y273-F284 AromaticContact CG-CE2 3.94Å; Y273-F284 HydrophobicContact CG-CE2 3.94Å; Y273-F284 HydrophobicContact CG-CZ 4.26Å
274G98.1Very high98.6Very high7 Ų723.9 Ų23.97%0.07212%0.124CC..THydrogen-bonded Turntrans70.925.6-175.300000114.4W131 Q271W131-G274 VanDerWaalsContact CZ3-O 3.28Å; W131-G274 WeakPolarHBondContact CZ3-O 3.15Å; Q271-G274 PolarHBondContact O-N 3.12Å
275C98.6Very high98.6Very high0 Ų025.7 Ų25.70%013%0.133CC..  trans-101.2126.9-179.7-58.40000111Q127 G270 Q271 T280Q127-C275 HydrophobicContact CB-CB 4.3Å; Q127-C275 HydrophobicContact CG-CB 3.89Å; G270-C275 CarbonylContact C-O 3.45Å; G270-C275 WeakPolarHBondContact CA-O 3.37Å; G270-C275 WeakPolarHBondContact O-CB 3.31Å; G270-C275 PolarHBondContact O-N 3.25Å; G270-C275 VanDerWaalsContact O-N 3.08Å; Q271-C275 PolarHBondContact N-O 3.41Å; C275-T280 HydrophobicContact CB-CG2 3.7Å
276D97.5Very high98.6Very high60 Ų6029 Ų2932%0.32115%0.15SC..  trans-98.6-8.4-179.764.4-8.1000113.7Q127 V267 P278 F322Q127-D276 PolarHBondContact NE2-OD1 3.49Å; Q127-D276 PolarHBondContact OE1-OD1 3.28Å; V267-D276 WeakPolarHBondContact CG2-O 3.45Å; D276-P278 WeakPolarHBondContact O-CD 3.37Å; D276-F322 HydrophobicContact CB-CD2 3.96Å; D276-F322 HydrophobicContact CB-CE1 4.16Å; D276-F322 HydrophobicContact CB-CE2 3.34Å; D276-F322 HydrophobicContact CB-CZ 3.45Å; D276-F322 VanDerWaalsContact CB-CZ 3.45Å; D276-F322 WeakPolarHBondContact OD2-CE2 3.48Å; D276-F322 VanDerWaalsContact OD2-CZ 3.3Å; D276-F322 WeakPolarHBondContact OD2-CZ 3.17Å
277N98.4Very high98.6Very high40 Ų4027.8 Ų27.821%0.21414%0.142CC..  trans-74.6121.1178.8-173.9-22.9000111W279 T280 G281N277-W279 PolarHBondContact O-N 2.94Å; N277-W279 WeakPolarHBondContact OD1-CB 3.14Å; N277-W279 VanDerWaalsContact OD1-CD1 3.3Å; N277-W279 PolarHBondContact OD1-N 2.95Å; N277-T280 WeakPolarHBondContact O-CB 3.44Å; N277-T280 PolarHBondContact O-N 3.43Å; N277-T280 VanDerWaalsContact O-N 3.11Å; N277-G281 PolarHBondContact O-N 3.23Å; N277-G281 VanDerWaalsContact O-N 3.11Å
278P98.4Very high98.6Very high46 Ų4627.6 Ų27.630%0.29914%0.141SC..Hα-helixtrans-60.9-29.5179.723.4-33.9000113.1P266 V267 D276 G281 G282P266-P278 HydrophobicContact CG-CB 4.42Å; V267-P278 HydrophobicContact CG2-CB 3.77Å; V267-P278 HydrophobicContact CG2-CG 4.43Å; D276-P278 WeakPolarHBondContact O-CD 3.37Å; P278-G281 PolarHBondContact O-N 3.45Å; P278-G282 PolarHBondContact O-N 3.18Å
279W98.6Very high98.6Very high194 Ų19433.5 Ų33.574%0.73517%0.167SC*.Hα-helixtrans-70.5-39.2177.2-60.6109000111.7L126 N277 G281 G282 I283L126-W279 HydrophobicContact CD2-CB 3.8Å; N277-W279 PolarHBondContact O-N 2.94Å; N277-W279 WeakPolarHBondContact OD1-CB 3.14Å; N277-W279 VanDerWaalsContact OD1-CD1 3.3Å; N277-W279 PolarHBondContact OD1-N 2.95Å; W279-G281 VanDerWaalsContact C-N 3.32Å; W279-G282 PolarHBondContact O-N 2.99Å; W279-I283 WeakPolarHBondContact O-CG1 3.49Å; W279-I283 PolarHBondContact O-N 3.15Å
280T98.7Very high98.5Very high0 Ų035.2 Ų35.20%018%0.175CC..Hα-helixtrans-60.3-44.8171.7-65.70000110.6G123 Q127 C275 N277 G282 I283 F284G123-T280 WeakPolarHBondContact O-CG2 3.48Å; G123-T280 PolarHBondContact O-OG1 3.31Å; Q127-T280 HydrophobicContact CB-CG2 4.22Å; C275-T280 HydrophobicContact CB-CG2 3.7Å; N277-T280 WeakPolarHBondContact O-CB 3.44Å; N277-T280 PolarHBondContact O-N 3.43Å; N277-T280 VanDerWaalsContact O-N 3.11Å; T280-G282 VanDerWaalsContact C-N 3.34Å; T280-G282 PolarHBondContact O-N 2.82Å; T280-I283 WeakPolarHBondContact O-CB 3.3Å; T280-I283 PolarHBondContact O-N 3.25Å; T280-F284 HydrophobicContact CG2-CD1 4.48Å; T280-F284 HydrophobicContact CG2-CD2 4.41Å; T280-F284 HydrophobicContact CG2-CE1 3.8Å; T280-F284 HydrophobicContact CG2-CE2 3.71Å; T280-F284 HydrophobicContact CG2-CZ 3.36Å; T280-F284 WeakPolarHBondContact O-CD1 3.49Å; T280-F284 WeakPolarHBondContact O-CG 3.27Å; T280-F284 PolarHBondContact O-N 2.98Å
281G98.7Very high98.4Very high0 Ų035.4 Ų35.40%018%0.177CC..Hα-helixtrans-57.1-43.5171.700000113.7P266 N277 P278 W279 I283 F284 I285P266-G281 WeakPolarHBondContact O-CA 3.38Å; N277-G281 PolarHBondContact O-N 3.23Å; N277-G281 VanDerWaalsContact O-N 3.11Å; P278-G281 PolarHBondContact O-N 3.45Å; W279-G281 VanDerWaalsContact C-N 3.32Å; G281-I283 PolarHBondContact O-N 3.42Å; G281-F284 PolarHBondContact O-N 3.37Å; G281-I285 WeakPolarHBondContact O-CG1 3.32Å; G281-I285 PolarHBondContact O-N 2.91Å
282G98.7Very high98.4Very high24 Ų2434.4 Ų34.425%0.24717%0.172CC..Hα-helixtrans-61.6-40.1174.500000113.5P278 W279 T280 F284 I285 I286P278-G282 PolarHBondContact O-N 3.18Å; W279-G282 PolarHBondContact O-N 2.99Å; T280-G282 VanDerWaalsContact C-N 3.34Å; T280-G282 PolarHBondContact O-N 2.82Å; G282-F284 VanDerWaalsContact C-N 3.32Å; G282-F284 PolarHBondContact O-N 3.06Å; G282-I285 WeakPolarHBondContact O-CB 3.43Å; G282-I285 PolarHBondContact O-N 3.04Å; G282-I286 WeakPolarHBondContact O-CG1 3.3Å; G282-I286 PolarHBondContact O-N 3.09Å; G282-I286 VanDerWaalsContact O-N 3.12Å
283I98.8Very high98.3Very high42 Ų4237 Ų3722%0.21519%0.189CC..Hα-helixtrans-63.2-39.8174-70.1169.8000110.7V119 L126 W279 T280 G281 I286 S287V119-I283 HydrophobicContact CG1-CG2 3.53Å; V119-I283 WeakPolarHBondContact O-CG2 3.31Å; L126-I283 HydrophobicContact CD2-CD1 3.55Å; W279-I283 WeakPolarHBondContact O-CG1 3.49Å; W279-I283 PolarHBondContact O-N 3.15Å; T280-I283 WeakPolarHBondContact O-CB 3.3Å; T280-I283 PolarHBondContact O-N 3.25Å; G281-I283 PolarHBondContact O-N 3.42Å; I283-I286 PolarHBondContact O-N 2.99Å; I283-S287 PolarHBondContact O-N 3Å
284F98.8Very high98.3Very high1 Ų138.8 Ų38.80%0.00420%0.198CC..Hα-helixtrans-66.2-38.3175.8-62.6-9.8000112I120 L124 I269 Y273 T280 G281 G282 I286 S287 L288I120-F284 HydrophobicContact CB-CD1 4.35Å; I120-F284 HydrophobicContact CB-CE1 4.21Å; I120-F284 HydrophobicContact CG1-CD1 3.95Å; I120-F284 HydrophobicContact CG1-CE1 4.28Å; I120-F284 HydrophobicContact CG2-CD1 4.45Å; I120-F284 HydrophobicContact CG2-CE1 3.96Å; I120-F284 HydrophobicContact CG2-CZ 4.38Å; I120-F284 WeakPolarHBondContact O-CE1 3.28Å; L124-F284 HydrophobicContact CD2-CZ 3.9Å; L124-F284 HydrophobicContact CG-CZ 4.21Å; I269-F284 HydrophobicContact CG2-CB 3.94Å; Y273-F284 AromaticContact CD2-CD2 3.8Å; Y273-F284 HydrophobicContact CD2-CD2 3.8Å; Y273-F284 AromaticContact CD2-CE2 3.41Å; Y273-F284 HydrophobicContact CD2-CE2 3.41Å; Y273-F284 VanDerWaalsContact CD2-CE2 3.41Å; Y273-F284 HydrophobicContact CD2-CZ 4.03Å; Y273-F284 HydrophobicContact CE2-CD2 4.17Å; Y273-F284 HydrophobicContact CE2-CE2 4.11Å; Y273-F284 AromaticContact CG-CE2 3.94Å; Y273-F284 HydrophobicContact CG-CE2 3.94Å; Y273-F284 HydrophobicContact CG-CZ 4.26Å; T280-F284 HydrophobicContact CG2-CD1 4.48Å; T280-F284 HydrophobicContact CG2-CD2 4.41Å; T280-F284 HydrophobicContact CG2-CE1 3.8Å; T280-F284 HydrophobicContact CG2-CE2 3.71Å; T280-F284 HydrophobicContact CG2-CZ 3.36Å; T280-F284 WeakPolarHBondContact O-CD1 3.49Å; T280-F284 WeakPolarHBondContact O-CG 3.27Å; T280-F284 PolarHBondContact O-N 2.98Å; G281-F284 PolarHBondContact O-N 3.37Å; G282-F284 VanDerWaalsContact C-N 3.32Å; G282-F284 PolarHBondContact O-N 3.06Å; F284-I286 VanDerWaalsContact C-N 3.31Å; F284-I286 PolarHBondContact O-N 2.94Å; F284-S287 WeakPolarHBondContact O-CB 3.31Å; F284-S287 PolarHBondContact O-N 3.13Å; F284-S287 VanDerWaalsContact O-N 3.15Å; F284-L288 WeakPolarHBondContact O-CG 3.17Å; F284-L288 PolarHBondContact O-N 3.21Å
285I98.8Very high98.3Very high41 Ų4138.5 Ų38.521%0.2120%0.195CC..Hα-helixtrans-56.3-46.8171.6-67.1169.3000110.7P266 I269 G281 G282 S287 L288 F289 V300P266-I285 HydrophobicContact CB-CD1 4.1Å; I269-I285 HydrophobicContact CD1-CD1 3.8Å; I269-I285 HydrophobicContact CD1-CG1 3.48Å; I269-I285 VanDerWaalsContact CD1-CG1 3.48Å; I269-I285 HydrophobicContact CG2-CG1 4.43Å; G281-I285 WeakPolarHBondContact O-CG1 3.32Å; G281-I285 PolarHBondContact O-N 2.91Å; G282-I285 WeakPolarHBondContact O-CB 3.43Å; G282-I285 PolarHBondContact O-N 3.04Å; I285-S287 VanDerWaalsContact C-N 3.32Å; I285-S287 PolarHBondContact O-N 2.91Å; I285-L288 PolarHBondContact O-N 3Å; I285-F289 WeakPolarHBondContact O-CB 3.36Å; I285-F289 PolarHBondContact O-N 3.34Å; I285-V300 HydrophobicContact CD1-CG2 4.28Å; I285-V300 HydrophobicContact CG1-CG2 4.41Å
286I98.5Very high98.3Very high98 Ų9839 Ų3950%0.50320%0.199SC..Hα-helixtrans-60.9-43.6176.9-64.9166.7000110.5G282 I283 F284 L288 F289 I290G282-I286 WeakPolarHBondContact O-CG1 3.3Å; G282-I286 PolarHBondContact O-N 3.09Å; G282-I286 VanDerWaalsContact O-N 3.12Å; I283-I286 PolarHBondContact O-N 2.99Å; F284-I286 VanDerWaalsContact C-N 3.31Å; F284-I286 PolarHBondContact O-N 2.94Å; I286-L288 PolarHBondContact O-N 3.2Å; I286-F289 PolarHBondContact O-N 2.84Å; I286-I290 HydrophobicContact CG2-CD1 4.04Å; I286-I290 HydrophobicContact CG2-CG1 4.47Å; I286-I290 VanDerWaalsContact O-CG1 3.3Å; I286-I290 WeakPolarHBondContact O-CG1 3.48Å; I286-I290 PolarHBondContact O-N 2.78Å
287S98.4Very high98.4Very high1 Ų140 Ų401%0.00721%0.206CC..Hα-helixtrans-57.3-45.1177178.10000112.8S116 I120 I283 F284 I285S116-S287 WeakPolarHBondContact CA-OG 3.47Å; S116-S287 WeakPolarHBondContact CB-O 3.3Å; S116-S287 WeakPolarHBondContact CB-OG 3.09Å; S116-S287 PolarHBondContact O-OG 3.46Å; S116-S287 PolarHBondContact OG-O 2.92Å; I120-S287 WeakPolarHBondContact CD1-OG 3.48Å; I120-S287 WeakPolarHBondContact CG1-OG 3.3Å; I283-S287 PolarHBondContact O-N 3Å; F284-S287 WeakPolarHBondContact O-CB 3.31Å; F284-S287 PolarHBondContact O-N 3.13Å; F284-S287 VanDerWaalsContact O-N 3.15Å; I285-S287 VanDerWaalsContact C-N 3.32Å; I285-S287 PolarHBondContact O-N 2.91Å
288L98.7Very high98.4Very high2 Ų238.4 Ų38.41%0.0120%0.198CC..Hα-helixtrans-65.6-44176.1-62.9177.4000111.3M109 V111 F284 I285 I286 I290 S291 S292 T295 C296 A299M109-L288 HydrophobicContact CB-CD2 3.75Å; M109-L288 HydrophobicContact CE-CD1 3.56Å; M109-L288 HydrophobicContact CE-CD2 4.26Å; M109-L288 HydrophobicContact CE-CG 4.42Å; M109-L288 HydrophobicContact CG-CD2 4.45Å; M109-L288 HydrophobicContact SD-CD1 4.03Å; M109-L288 HydrophobicContact SD-CD2 3.96Å; M109-L288 HydrophobicContact SD-CG 4.31Å; V111-L288 HydrophobicContact CG2-CD2 3.75Å; F284-L288 WeakPolarHBondContact O-CG 3.17Å; F284-L288 PolarHBondContact O-N 3.21Å; I285-L288 PolarHBondContact O-N 3Å; I286-L288 PolarHBondContact O-N 3.2Å; L288-I290 VanDerWaalsContact C-N 3.29Å; L288-I290 PolarHBondContact O-N 3.39Å; L288-S291 PolarHBondContact O-N 3.07Å; L288-S291 VanDerWaalsContact O-N 3.13Å; L288-S292 CarbonylContact O-C 3.03Å; L288-S292 PolarHBondContact O-N 3.49Å; L288-S292 VanDerWaalsContact O-O 3.07Å; L288-T295 HydrophobicContact CD2-CG2 4.09Å; L288-C296 HydrophobicContact CB-CB 3.98Å; L288-A299 HydrophobicContact CD1-CB 3.47Å; L288-A299 VanDerWaalsContact CD1-CB 3.47Å
289F98.3Very high98.5Very high124 Ų12436.2 Ų36.254%0.54418%0.183SC..Hα-helixtrans-60.8-37.8-179.9-175.9-98.5000112.6I285 I286 S291 P293 C296I285-F289 WeakPolarHBondContact O-CB 3.36Å; I285-F289 PolarHBondContact O-N 3.34Å; I286-F289 PolarHBondContact O-N 2.84Å; F289-S291 VanDerWaalsContact C-N 3.29Å; F289-S291 PolarHBondContact O-N 3.35Å; F289-P293 HydrophobicContact CD2-CB 4.08Å; F289-P293 HydrophobicContact CD2-CG 4.16Å; F289-P293 HydrophobicContact CE2-CB 3.92Å; F289-P293 HydrophobicContact CE2-CG 3.93Å; F289-P293 HydrophobicContact CZ-CG 4.43Å; F289-C296 HydrophobicContact CB-CB 4.13Å; F289-C296 HydrophobicContact CD2-CB 4.44Å
290I96.4Very high98.5Very high36 Ų3629.3 Ų29.319%0.18516%0.162CC..Hα-helixtrans-56.6-44175.1-72.5164.7000110.9F77 S78 L115 V119 I286 L288F77-I290 HydrophobicContact CD2-CG2 4.3Å; S78-I290 VanDerWaalsContact CA-O 3.28Å; S78-I290 WeakPolarHBondContact CA-O 3.36Å; S78-I290 WeakPolarHBondContact CB-O 3.19Å; L115-I290 HydrophobicContact CD2-CG2 3.98Å; L115-I290 HydrophobicContact CG-CG2 4.4Å; V119-I290 HydrophobicContact CG2-CD1 4.1Å; I286-I290 HydrophobicContact CG2-CD1 4.04Å; I286-I290 HydrophobicContact CG2-CG1 4.47Å; I286-I290 VanDerWaalsContact O-CG1 3.3Å; I286-I290 WeakPolarHBondContact O-CG1 3.48Å; I286-I290 PolarHBondContact O-N 2.78Å; L288-I290 VanDerWaalsContact C-N 3.29Å; L288-I290 PolarHBondContact O-N 3.39Å
291S97.4Very high98.5Very high4 Ų432 Ų323%0.02818%0.177CC..Hα-helixtrans-81.1-53.8-179.3-179.60000112.2G79 V111 L288 F289G79-S291 WeakPolarHBondContact CA-O 3.48Å; G79-S291 PolarHBondContact N-O 3.35Å; G79-S291 PolarHBondContact O-OG 3.18Å; V111-S291 VanDerWaalsContact CG1-CB 3.48Å; V111-S291 WeakPolarHBondContact CG1-OG 3.38Å; L288-S291 PolarHBondContact O-N 3.07Å; L288-S291 VanDerWaalsContact O-N 3.13Å; F289-S291 VanDerWaalsContact C-N 3.29Å; F289-S291 PolarHBondContact O-N 3.35Å
292S98.2Very high98.5Very high0 Ų032 Ų320%018%0.177CC..  trans-149.2111.9-176.6169.30000111.2L288 I294 T295 C296 P409 E410L288-S292 CarbonylContact O-C 3.03Å; L288-S292 PolarHBondContact O-N 3.49Å; L288-S292 VanDerWaalsContact O-O 3.07Å; S292-I294 PolarHBondContact O-N 3.26Å; S292-I294 PolarHBondContact OG-N 3.27Å; S292-T295 WeakPolarHBondContact CB-OG1 3.3Å; S292-T295 PolarHBondContact O-N 3.33Å; S292-T295 PolarHBondContact OG-N 3.23Å; S292-T295 PolarHBondContact OG-OG1 2.89Å; S292-C296 PolarHBondContact O-N 2.94Å; S292-P409 WeakPolarHBondContact OG-CD 3.43Å; S292-E410 WeakPolarHBondContact CB-OE2 3.34Å; S292-E410 PolarHBondContact OG-OE1 2.93Å; S292-E410 PolarHBondContact OG-OE2 3.4Å
293P98.1Very high98.5Very high58 Ų5831 Ų3138%0.37717%0.165SC..Hα-helixtrans-54.8-35.7169.2-29.136.6000113.5F289 C296 V297 E410F289-P293 HydrophobicContact CD2-CB 4.08Å; F289-P293 HydrophobicContact CD2-CG 4.16Å; F289-P293 HydrophobicContact CE2-CB 3.92Å; F289-P293 HydrophobicContact CE2-CG 3.93Å; F289-P293 HydrophobicContact CZ-CG 4.43Å; P293-C296 WeakPolarHBondContact O-CB 3.44Å; P293-C296 PolarHBondContact O-N 2.83Å; P293-V297 WeakPolarHBondContact O-CG2 3.45Å; P293-V297 PolarHBondContact O-N 2.67Å; P293-E410 VanDerWaalsContact CD-OE1 3.3Å; P293-E410 WeakPolarHBondContact CD-OE1 3.38Å
294I98.6Very high98.5Very high36 Ų3630.1 Ų30.119%0.18517%0.165CC..Hα-helixtrans-65.9-44.8177.6-68.1173.8000111.4S292 C296 V297 H298 L343 P409 E410S292-I294 PolarHBondContact O-N 3.26Å; S292-I294 PolarHBondContact OG-N 3.27Å; I294-C296 VanDerWaalsContact C-N 3.31Å; I294-C296 PolarHBondContact O-N 3.43Å; I294-V297 PolarHBondContact O-N 3.47Å; I294-H298 PolarHBondContact O-N 2.72Å; I294-H298 PolarHBondContact O-ND1 3.45Å; I294-L343 HydrophobicContact CD1-CD2 4.03Å; I294-L343 HydrophobicContact CG1-CD2 4.41Å; I294-L343 HydrophobicContact CG2-CD2 3.64Å; I294-P409 HydrophobicContact CB-CB 3.77Å; I294-P409 HydrophobicContact CB-CG 4.2Å; I294-P409 HydrophobicContact CD1-CB 4.12Å; I294-P409 HydrophobicContact CG2-CB 3.43Å; I294-P409 VanDerWaalsContact CG2-CB 3.43Å; I294-P409 HydrophobicContact CG2-CG 3.89Å; I294-E410 WeakPolarHBondContact CB-OE1 3.17Å; I294-E410 HydrophobicContact CD1-CG 3.72Å; I294-E410 HydrophobicContact CG1-CG 4.28Å; I294-E410 VanDerWaalsContact CG1-OE1 3.32Å; I294-E410 WeakPolarHBondContact CG1-OE1 3.25Å; I294-E410 PolarHBondContact N-OE1 3.41Å
295T98.7Very high98.5Very high2 Ų230.8 Ų30.81%0.01217%0.169CC..Hα-helixtrans-59.5-45.2174.3-65.70000110.5V111 L288 S292 V297 H298 A299 I334 P409V111-T295 HydrophobicContact CG2-CG2 4.39Å; L288-T295 HydrophobicContact CD2-CG2 4.09Å; S292-T295 WeakPolarHBondContact CB-OG1 3.3Å; S292-T295 PolarHBondContact O-N 3.33Å; S292-T295 PolarHBondContact OG-N 3.23Å; S292-T295 PolarHBondContact OG-OG1 2.89Å; T295-V297 PolarHBondContact O-N 2.83Å; T295-H298 PolarHBondContact O-N 2.94Å; T295-A299 WeakPolarHBondContact O-CB 3.39Å; T295-A299 PolarHBondContact O-N 2.6Å; T295-I334 HydrophobicContact CG2-CD1 4.24Å; T295-I334 HydrophobicContact CG2-CG1 4.26Å; T295-I334 HydrophobicContact CG2-CG2 3.78Å; T295-P409 WeakPolarHBondContact OG1-CD 3.28Å; T295-P409 WeakPolarHBondContact OG1-CG 3.32Å
296C98.8Very high98.5Very high11 Ų1128.8 Ų28.87%0.07416%0.159CC..Hα-helixtrans-57.4-47.3176.4179.70000112.4L288 F289 S292 P293 I294 A299 V300L288-C296 HydrophobicContact CB-CB 3.98Å; F289-C296 HydrophobicContact CB-CB 4.13Å; F289-C296 HydrophobicContact CD2-CB 4.44Å; S292-C296 PolarHBondContact O-N 2.94Å; P293-C296 WeakPolarHBondContact O-CB 3.44Å; P293-C296 PolarHBondContact O-N 2.83Å; I294-C296 VanDerWaalsContact C-N 3.31Å; I294-C296 PolarHBondContact O-N 3.43Å; C296-A299 WeakPolarHBondContact O-CB 3.38Å; C296-A299 PolarHBondContact O-N 3.21Å; C296-V300 WeakPolarHBondContact O-CG2 3.45Å; C296-V300 PolarHBondContact O-N 3.48Å; C296-V300 VanDerWaalsContact O-N 3.11Å
297V98.8Very high98.5Very high80 Ų8025.3 Ų25.349%0.48514%0.141SC..Hα-helixtrans-62.3-45.5179.1167.70000111.1P293 I294 T295 A299 V300 L301P293-V297 WeakPolarHBondContact O-CG2 3.45Å; P293-V297 PolarHBondContact O-N 2.67Å; I294-V297 PolarHBondContact O-N 3.47Å; T295-V297 PolarHBondContact O-N 2.83Å; V297-A299 VanDerWaalsContact C-N 3.29Å; V297-A299 PolarHBondContact O-N 3.38Å; V297-V300 PolarHBondContact O-N 3.1Å; V297-L301 HydrophobicContact CG1-CD1 3.8Å; V297-L301 HydrophobicContact CG1-CG 4.28Å; V297-L301 WeakPolarHBondContact O-CB 3.46Å; V297-L301 VanDerWaalsContact O-CG 3.32Å; V297-L301 WeakPolarHBondContact O-CG 3.16Å; V297-L301 PolarHBondContact O-N 3.43Å
298H98.9Very high98.5Very high6 Ų628.6 Ų28.63%0.02816%0.161CC..Hα-helixtrans-69-27.7178.6-72.586.8000112.8I294 T295 G302 C333 I334 G337 H348I294-H298 PolarHBondContact O-N 2.72Å; I294-H298 PolarHBondContact O-ND1 3.45Å; T295-H298 PolarHBondContact O-N 2.94Å; H298-G302 PolarHBondContact O-N 3.32Å; H298-C333 WeakPolarHBondContact O-CB 3.45Å; H298-C333 PolarHBondContact O-SG 3.46Å; H298-C333 VanDerWaalsContact O-SG 3.41Å; H298-I334 HydrophobicContact CB-CG1 4.4Å; H298-G337 PolarHBondContact CE1-O 3.3Å; H298-G337 PolarHBondContact ND1-O 3.46Å; H298-H348 AromaticContact CD2-ND1 3.99Å; H298-H348 AromaticContact CE1-ND1 3.97Å; H298-H348 AromaticContact NE2-CE1 3.94Å; H298-H348 AromaticContact NE2-ND1 3.13Å; H298-H348 PolarHBondContact NE2-ND1 2.98Å; H298-H348 VanDerWaalsContact NE2-ND1 3.13Å
299A98.9Very high98.5Very high0 Ų028.6 Ų28.60%016%0.16CC..Hα-helixtrans-62.7-50.3170.700000111.3M109 I269 L288 T295 C296 V297 G302 S303 V330 I334M109-A299 HydrophobicContact CE-CB 4.36Å; I269-A299 HydrophobicContact CD1-CB 4.23Å; L288-A299 HydrophobicContact CD1-CB 3.47Å; L288-A299 VanDerWaalsContact CD1-CB 3.47Å; T295-A299 WeakPolarHBondContact O-CB 3.39Å; T295-A299 PolarHBondContact O-N 2.6Å; C296-A299 WeakPolarHBondContact O-CB 3.38Å; C296-A299 PolarHBondContact O-N 3.21Å; V297-A299 VanDerWaalsContact C-N 3.29Å; V297-A299 PolarHBondContact O-N 3.38Å; A299-G302 PolarHBondContact O-N 2.74Å; A299-S303 PolarHBondContact O-N 3.47Å; A299-V330 HydrophobicContact CB-CG1 3.97Å; A299-V330 WeakPolarHBondContact O-CG2 3.23Å; A299-I334 HydrophobicContact CB-CD1 3.74Å; A299-I334 HydrophobicContact CB-CG1 4.08Å
300V98.9Very high98.5Very high49 Ų4922.7 Ų22.730%0.29713%0.134SC..Hα-helixtrans-62.3-45.1178.5173.50000111.2I265 I269 I285 C296 V297 S303 A304I265-V300 HydrophobicContact CG2-CG1 3.97Å; I269-V300 HydrophobicContact CD1-CG2 4.02Å; I285-V300 HydrophobicContact CD1-CG2 4.28Å; I285-V300 HydrophobicContact CG1-CG2 4.41Å; C296-V300 WeakPolarHBondContact O-CG2 3.45Å; C296-V300 PolarHBondContact O-N 3.48Å; C296-V300 VanDerWaalsContact O-N 3.11Å; V297-V300 PolarHBondContact O-N 3.1Å; V300-S303 PolarHBondContact O-N 3.33Å; V300-A304 WeakPolarHBondContact O-CB 3.45Å; V300-A304 PolarHBondContact O-N 3.16Å
301L98.9Very high98.6Very high58 Ų5822.6 Ų22.630%0.30413%0.134SC..Hα-helixtrans-63.2-44.3176.9-70.8174.3000112.1V297 S303 A304 V305 I352V297-L301 HydrophobicContact CG1-CD1 3.8Å; V297-L301 HydrophobicContact CG1-CG 4.28Å; V297-L301 WeakPolarHBondContact O-CB 3.46Å; V297-L301 VanDerWaalsContact O-CG 3.32Å; V297-L301 WeakPolarHBondContact O-CG 3.16Å; V297-L301 PolarHBondContact O-N 3.43Å; L301-S303 VanDerWaalsContact C-N 3.35Å; L301-S303 PolarHBondContact O-N 3.28Å; L301-A304 PolarHBondContact O-N 3.23Å; L301-V305 WeakPolarHBondContact O-CB 3.37Å; L301-V305 VanDerWaalsContact O-CG2 3.28Å; L301-V305 WeakPolarHBondContact O-CG2 3.46Å; L301-V305 PolarHBondContact O-N 2.95Å; L301-I352 HydrophobicContact CB-CD1 4.12Å; L301-I352 HydrophobicContact CD1-CD1 4.37Å
302G98.9Very high98.6Very high0 Ų025.8 Ų25.80%016%0.161CC..Hα-helixtrans-59-45.7176.800000111.9H298 A299 A304 V305 G306 C329H298-G302 PolarHBondContact O-N 3.32Å; A299-G302 PolarHBondContact O-N 2.74Å; G302-A304 PolarHBondContact O-N 3.4Å; G302-V305 PolarHBondContact O-N 3.48Å; G302-G306 PolarHBondContact O-N 3.25Å; G302-C329 WeakPolarHBondContact O-CB 3.15Å
303S98.9Very high98.4Very high1 Ų129.1 Ų29.11%0.00718%0.178CC..Hα-helixtrans-61.7-44.3176.4-165.10000112.2I265 A299 V300 L301 G306 M307I265-S303 WeakPolarHBondContact CA-OG 3.21Å; I265-S303 WeakPolarHBondContact O-CB 3.49Å; I265-S303 PolarHBondContact O-OG 3.28Å; A299-S303 PolarHBondContact O-N 3.47Å; V300-S303 PolarHBondContact O-N 3.33Å; L301-S303 VanDerWaalsContact C-N 3.35Å; L301-S303 PolarHBondContact O-N 3.28Å; S303-G306 PolarHBondContact O-N 3.09Å; S303-M307 PolarHBondContact O-N 3.16Å
304A98.9Very high98.3Very high24 Ų2429.2 Ų29.220%0.19818%0.18CC..Hα-helixtrans-64.2-41.5177.200000112.7I265 V300 L301 G302 G306 M307 V308I265-A304 HydrophobicContact CD1-CB 4.14Å; I265-A304 HydrophobicContact CG1-CB 4.35Å; V300-A304 WeakPolarHBondContact O-CB 3.45Å; V300-A304 PolarHBondContact O-N 3.16Å; L301-A304 PolarHBondContact O-N 3.23Å; G302-A304 PolarHBondContact O-N 3.4Å; A304-G306 VanDerWaalsContact C-N 3.32Å; A304-G306 PolarHBondContact O-N 3.35Å; A304-M307 PolarHBondContact O-N 2.89Å; A304-V308 WeakPolarHBondContact O-CG2 3.42Å; A304-V308 PolarHBondContact O-N 3.02Å
305V98.8Very high98.2Very high15 Ų1527.7 Ų27.79%0.09117%0.173CC..Hα-helixtrans-61.2-42.8174.4167.60000110.8L301 G302 V308 S309 I352 A355 F356L301-V305 WeakPolarHBondContact O-CB 3.37Å; L301-V305 VanDerWaalsContact O-CG2 3.28Å; L301-V305 WeakPolarHBondContact O-CG2 3.46Å; L301-V305 PolarHBondContact O-N 2.95Å; G302-V305 PolarHBondContact O-N 3.48Å; V305-V308 PolarHBondContact O-N 3.32Å; V305-S309 WeakPolarHBondContact O-CB 3.39Å; V305-S309 PolarHBondContact O-N 3.17Å; V305-S309 PolarHBondContact O-OG 2.82Å; V305-I352 HydrophobicContact CG2-CD1 4.12Å; V305-I352 HydrophobicContact CG2-CG2 4.09Å; V305-A355 HydrophobicContact CB-CB 4.13Å; V305-A355 HydrophobicContact CG1-CB 3.72Å; V305-F356 HydrophobicContact CG1-CB 4.36Å; V305-F356 HydrophobicContact CG1-CD1 3.79Å; V305-F356 HydrophobicContact CG1-CD2 3.7Å; V305-F356 HydrophobicContact CG1-CE1 3.89Å; V305-F356 HydrophobicContact CG1-CE2 3.82Å; V305-F356 HydrophobicContact CG1-CG 3.67Å; V305-F356 HydrophobicContact CG1-CZ 3.91Å; V305-F356 HydrophobicContact CG2-CE2 4.28Å
306G98.8Very high98Very high0 Ų028.7 Ų28.70%018%0.18CC..Hα-helixtrans-57.9-50.9174.400000112.6G302 S303 A304 V308 S309 G310 W325G302-G306 PolarHBondContact O-N 3.25Å; S303-G306 PolarHBondContact O-N 3.09Å; A304-G306 VanDerWaalsContact C-N 3.32Å; A304-G306 PolarHBondContact O-N 3.35Å; G306-V308 PolarHBondContact O-N 3.13Å; G306-S309 WeakPolarHBondContact O-CB 3.44Å; G306-S309 PolarHBondContact O-N 2.93Å; G306-S309 VanDerWaalsContact O-N 3.17Å; G306-G310 PolarHBondContact O-N 2.92Å; G306-W325 CarbonylContact C-O 3.55Å; G306-W325 WeakPolarHBondContact CA-O 3.46Å; G306-W325 WeakPolarHBondContact O-CB 3.48Å
307M98.6Very high98Very high25 Ų2529.4 Ų29.412%0.12318%0.182CC..Hα-helixtrans-54.9-50.3175.2174.7-15968.800112.1L261 S264 I265 S303 A304 S309 G310 L311 I320L261-M307 HydrophobicContact CB-SD 3.87Å; L261-M307 HydrophobicContact CD2-CG 4.19Å; L261-M307 HydrophobicContact CD2-SD 4.27Å; S264-M307 WeakPolarHBondContact OG-CG 3.4Å; I265-M307 HydrophobicContact CG1-SD 4.35Å; S303-M307 PolarHBondContact O-N 3.16Å; A304-M307 PolarHBondContact O-N 2.89Å; M307-S309 VanDerWaalsContact C-N 3.29Å; M307-S309 PolarHBondContact O-N 3.35Å; M307-G310 PolarHBondContact O-N 3.38Å; M307-L311 PolarHBondContact O-N 3.11Å; M307-L311 VanDerWaalsContact O-N 3.11Å; M307-I320 HydrophobicContact CB-CG2 4.3Å; M307-I320 HydrophobicContact CG-CG2 3.7Å
308V98.5Very high97.8Very high70 Ų7031.2 Ų31.242%0.42419%0.185SC..Hα-helixtrans-62.6-37.5178.8172.20000111.4A304 V305 G306 L311 A312A304-V308 WeakPolarHBondContact O-CG2 3.42Å; A304-V308 PolarHBondContact O-N 3.02Å; V305-V308 PolarHBondContact O-N 3.32Å; G306-V308 PolarHBondContact O-N 3.13Å; V308-L311 PolarHBondContact O-N 2.9Å; V308-A312 WeakPolarHBondContact O-CB 3.48Å; V308-A312 PolarHBondContact O-N 2.77Å
309S98.6Very high97.8Very high1 Ų132.6 Ų32.61%0.00719%0.193CC..Hα-helixtrans-65.1-39.8176.6-56.80000112V305 G306 M307 L311 A312 L313 F356V305-S309 WeakPolarHBondContact O-CB 3.39Å; V305-S309 PolarHBondContact O-N 3.17Å; V305-S309 PolarHBondContact O-OG 2.82Å; G306-S309 WeakPolarHBondContact O-CB 3.44Å; G306-S309 PolarHBondContact O-N 2.93Å; G306-S309 VanDerWaalsContact O-N 3.17Å; M307-S309 VanDerWaalsContact C-N 3.29Å; M307-S309 PolarHBondContact O-N 3.35Å; S309-L311 VanDerWaalsContact C-N 3.34Å; S309-A312 PolarHBondContact O-N 3.49Å; S309-L313 PolarHBondContact O-N 3.19Å; S309-F356 WeakPolarHBondContact OG-CD1 3.39Å; S309-F356 WeakPolarHBondContact OG-CE1 3.38Å
310G98Very high97.7Very high0 Ų032.7 Ų32.70%019%0.193CC..Hα-helixtrans-61.5-42.2174.200000112.3G306 M307 L313 S314 A315G306-G310 PolarHBondContact O-N 2.92Å; M307-G310 PolarHBondContact O-N 3.38Å; G310-L313 PolarHBondContact O-N 3.11Å; G310-S314 PolarHBondContact O-N 3Å; G310-A315 VanDerWaalsContact O-CB 3.3Å; G310-A315 WeakPolarHBondContact O-CB 3.21Å; G310-A315 PolarHBondContact O-N 2.71Å
311L97.7Very high97.7Very high35 Ų3531.3 Ų31.318%0.18318%0.182CC..Hα-helixtrans-62.6-46.5173-66.8173.1000111.4W253 I256 L261 M307 V308 S309 L313 S314 F317 I320W253-L311 WeakPolarHBondContact CH2-O 3.46Å; I256-L311 HydrophobicContact CD1-CD2 3.84Å; L261-L311 HydrophobicContact CD1-CD1 4.35Å; L261-L311 HydrophobicContact CD2-CD1 4.17Å; L261-L311 HydrophobicContact CD2-CD2 4.16Å; L261-L311 HydrophobicContact CD2-CG 4.47Å; M307-L311 PolarHBondContact O-N 3.11Å; M307-L311 VanDerWaalsContact O-N 3.11Å; V308-L311 PolarHBondContact O-N 2.9Å; S309-L311 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.19Å; L311-S314 PolarHBondContact O-N 3.4Å; L311-F317 HydrophobicContact CD2-CD1 4.23Å; L311-F317 HydrophobicContact CD2-CE1 3.98Å; L311-I320 HydrophobicContact CD2-CD1 3.69Å; L311-I320 HydrophobicContact CG-CD1 4Å
312A97.4Very high97.7Very high71 Ų7132.8 Ų32.859%0.58719%0.187SC*.Hα-helixtrans-60.1-32.618000000112.8V308 S309 S314V308-A312 WeakPolarHBondContact O-CB 3.48Å; V308-A312 PolarHBondContact O-N 2.77Å; S309-A312 PolarHBondContact O-N 3.49Å; A312-S314 VanDerWaalsContact C-N 3.33Å
313L95.6Very high97.7Very high69 Ų6932.8 Ų32.836%0.36119%0.187SC..THydrogen-bonded Turntrans-89.98.1177.3-75.8177.5000114.3S309 G310 L311 A315 W325 Y360S309-L313 PolarHBondContact O-N 3.19Å; G310-L313 PolarHBondContact O-N 3.11Å; L311-L313 PolarHBondContact O-N 3.19Å; L313-A315 PolarHBondContact O-N 2.9Å; L313-W325 HydrophobicContact CB-CH2 3.95Å; L313-W325 HydrophobicContact CB-CZ3 4.49Å; L313-W325 HydrophobicContact CD1-CH2 3.51Å; L313-W325 HydrophobicContact CD1-CZ3 3.66Å; L313-W325 HydrophobicContact CG-CH2 4.39Å; L313-Y360 HydrophobicContact CD1-CD1 3.62Å; L313-Y360 HydrophobicContact CD1-CE1 3.59Å; L313-Y360 HydrophobicContact CD1-CG 4.2Å; L313-Y360 HydrophobicContact CD2-CD1 4.17Å; L313-Y360 HydrophobicContact CD2-CE1 3.46Å; L313-Y360 VanDerWaalsContact CD2-CE1 3.46Å; L313-Y360 HydrophobicContact CG-CD1 4.29Å; L313-Y360 HydrophobicContact CG-CE1 3.74Å
314S95.3Very high97.6Very high60 Ų6036.2 Ų36.242%0.4221%0.205SC..THydrogen-bonded Turntrans52.644.5-177.3-54.30000112.1I251 G310 L311 A312I251-S314 WeakPolarHBondContact CD1-O 3.23Å; G310-S314 PolarHBondContact O-N 3Å; L311-S314 PolarHBondContact O-N 3.4Å; A312-S314 VanDerWaalsContact C-N 3.33Å
315A96Very high97.6Very high4 Ų436.3 Ų36.33%0.03320%0.2CC..  trans-69.8149.7173.700000110.9G310 L313 F317 I320 W325G310-A315 VanDerWaalsContact O-CB 3.3Å; G310-A315 WeakPolarHBondContact O-CB 3.21Å; G310-A315 PolarHBondContact O-N 2.71Å; L313-A315 PolarHBondContact O-N 2.9Å; A315-F317 PolarHBondContact O-N 3.32Å; A315-I320 HydrophobicContact CB-CD1 4.21Å; A315-I320 HydrophobicContact CB-CG1 4.19Å; A315-W325 HydrophobicContact CB-CD2 4.45Å; A315-W325 HydrophobicContact CB-CH2 4.35Å; A315-W325 HydrophobicContact CB-CZ2 3.35Å; A315-W325 VanDerWaalsContact CB-NE1 3.3Å
316P95.6Very high97.6Very high24 Ų2435.8 Ų35.816%0.15620%0.197CC..  trans-51.3131.8170.7-23.932.1000111.1R245 P249 E318 D319 I320R245-P316 VanDerWaalsContact NH1-CD 3.31Å; P249-P316 HydrophobicContact CB-CG 3.79Å; P249-P316 HydrophobicContact CG-CG 4.02Å; P316-E318 PolarHBondContact O-N 3.47Å; P316-D319 WeakPolarHBondContact CB-OD2 3.02Å; P316-D319 VanDerWaalsContact CD-OD2 3.31Å; P316-D319 WeakPolarHBondContact CD-OD2 3.42Å; P316-D319 VanDerWaalsContact CG-OD2 3.31Å; P316-D319 WeakPolarHBondContact CG-OD2 3.42Å; P316-D319 PolarHBondContact O-N 2.95Å; P316-D319 VanDerWaalsContact O-N 3.08Å; P316-I320 PolarHBondContact O-N 3.33Å
317F97.3Very high97.6Very high25 Ų2537.1 Ų37.111%0.1120%0.203CC..Hα-helixtrans-59.5-34.9-175.1-65.1-36.1000112.9I251 W253 I256 L311 A315 D319 I320 Y321I251-F317 HydrophobicContact CG2-CD2 4.5Å; I251-F317 HydrophobicContact CG2-CE1 4.16Å; I251-F317 HydrophobicContact CG2-CE2 3.85Å; I251-F317 HydrophobicContact CG2-CZ 3.65Å; W253-F317 HydrophobicContact CD2-CZ 4.29Å; W253-F317 HydrophobicContact CE3-CE1 4.29Å; W253-F317 AromaticContact CE3-CZ 3.99Å; W253-F317 HydrophobicContact CE3-CZ 3.99Å; W253-F317 HydrophobicContact CZ3-CE1 4.3Å; W253-F317 HydrophobicContact CZ3-CZ 4.45Å; I256-F317 HydrophobicContact CB-CE1 4.46Å; I256-F317 HydrophobicContact CB-CE2 3.95Å; I256-F317 HydrophobicContact CB-CZ 3.92Å; I256-F317 HydrophobicContact CD1-CE1 3.94Å; I256-F317 HydrophobicContact CD1-CZ 4.14Å; I256-F317 HydrophobicContact CG1-CD1 4.37Å; I256-F317 HydrophobicContact CG1-CE1 4.08Å; I256-F317 HydrophobicContact CG1-CE2 4.31Å; I256-F317 HydrophobicContact CG1-CZ 4.04Å; L311-F317 HydrophobicContact CD2-CD1 4.23Å; L311-F317 HydrophobicContact CD2-CE1 3.98Å; A315-F317 PolarHBondContact O-N 3.32Å; F317-D319 VanDerWaalsContact C-N 3.33Å; F317-D319 PolarHBondContact O-N 2.94Å; F317-I320 HydrophobicContact CD1-CD1 4.42Å; F317-I320 CarbonylContact O-C 3.56Å; F317-I320 WeakPolarHBondContact O-CA 3.4Å; F317-I320 WeakPolarHBondContact O-CB 3.1Å; F317-I320 PolarHBondContact O-N 3.45Å; F317-I320 VanDerWaalsContact O-N 3.09Å; F317-Y321 HydrophobicContact CB-CD2 4.24Å; F317-Y321 HydrophobicContact CB-CE1 4.35Å; F317-Y321 HydrophobicContact CB-CE2 3.61Å; F317-Y321 WeakPolarHBondContact O-CD1 3.25Å; F317-Y321 VanDerWaalsContact O-CD2 3.31Å; F317-Y321 WeakPolarHBondContact O-CD2 3.3Å; F317-Y321 PolarHBondContact O-N 3.23Å
318E96.4Very high97.6Very high119 Ų11936.2 Ų36.256%0.55620%0.198SC*.Hα-helixtrans-62.4-36.3177.5-65.1-58140.900112.6K260 P316 I320 Y321 F322K260-E318 IonicContact NZ-OE1 3.9Å; P316-E318 PolarHBondContact O-N 3.47Å; E318-I320 VanDerWaalsContact C-N 3.28Å; E318-I320 PolarHBondContact O-N 3.29Å; E318-Y321 PolarHBondContact O-N 3.07Å; E318-F322 WeakPolarHBondContact O-CB 3.21Å; E318-F322 PolarHBondContact O-N 3.23Å
319D97Very high97.6Very high35 Ų3532.9 Ų32.919%0.18718%0.178CC..Hα-helixtrans-65.6-35.4174.8-59.5-38.7000111.7R245 P316 F317 G323 L324R245-D319 IonicContact CZ-OD2 3.93Å; R245-D319 IonicContact NH1-OD2 2.88Å; R245-D319 IonicContact NH2-OD1 3.19Å; R245-D319 IonicContact NH2-OD2 3.83Å; R245-D319 PolarHBondContact NH2-OD2 2.94Å; P316-D319 WeakPolarHBondContact CB-OD2 3.02Å; P316-D319 VanDerWaalsContact CD-OD2 3.31Å; P316-D319 WeakPolarHBondContact CD-OD2 3.42Å; P316-D319 VanDerWaalsContact CG-OD2 3.31Å; P316-D319 WeakPolarHBondContact CG-OD2 3.42Å; P316-D319 PolarHBondContact O-N 2.95Å; P316-D319 VanDerWaalsContact O-N 3.08Å; F317-D319 VanDerWaalsContact C-N 3.33Å; F317-D319 PolarHBondContact O-N 2.94Å; D319-G323 PolarHBondContact O-N 2.97Å; D319-L324 HydrophobicContact CB-CD1 4.3Å; D319-L324 WeakPolarHBondContact O-CB 3.36Å; D319-L324 PolarHBondContact O-N 2.92Å
320I98.3Very high97.6Very high1 Ų132.9 Ų32.91%0.00518%0.178CC..Hα-helixtrans-69.3-50.1176.6-57.7175.7000108.9L261 S264 M307 L311 A315 P316 F317 E318 F322 G323 W325L261-I320 HydrophobicContact CD2-CG2 4.04Å; S264-I320 WeakPolarHBondContact CB-O 3.31Å; M307-I320 HydrophobicContact CB-CG2 4.3Å; M307-I320 HydrophobicContact CG-CG2 3.7Å; L311-I320 HydrophobicContact CD2-CD1 3.69Å; L311-I320 HydrophobicContact CG-CD1 4Å; A315-I320 HydrophobicContact CB-CD1 4.21Å; A315-I320 HydrophobicContact CB-CG1 4.19Å; P316-I320 PolarHBondContact O-N 3.33Å; F317-I320 HydrophobicContact CD1-CD1 4.42Å; F317-I320 CarbonylContact O-C 3.56Å; F317-I320 WeakPolarHBondContact O-CA 3.4Å; F317-I320 WeakPolarHBondContact O-CB 3.1Å; F317-I320 PolarHBondContact O-N 3.45Å; F317-I320 VanDerWaalsContact O-N 3.09Å; E318-I320 VanDerWaalsContact C-N 3.28Å; E318-I320 PolarHBondContact O-N 3.29Å; I320-F322 VanDerWaalsContact C-N 3.27Å; I320-F322 PolarHBondContact O-N 3.15Å; I320-G323 WeakPolarHBondContact O-CA 3.44Å; I320-G323 PolarHBondContact O-N 3.06Å; I320-W325 HydrophobicContact CG1-CG 4.41Å
321Y98.6Very high97.7Very high20 Ų2032.9 Ų32.98%0.07818%0.178CC..Hα-helixtrans-60.5-36.7179.6-59.8-23000112.5D257 K260 L261 F317 E318 G323D257-Y321 HydrophobicContact CB-CE2 4.43Å; D257-Y321 PolarHBondContact N-OH 3.28Å; K260-Y321 HydrophobicContact CB-CD1 3.47Å; K260-Y321 VanDerWaalsContact CB-CD1 3.47Å; K260-Y321 HydrophobicContact CB-CD2 3.92Å; K260-Y321 HydrophobicContact CB-CE1 3.62Å; K260-Y321 HydrophobicContact CB-CE2 4.04Å; K260-Y321 HydrophobicContact CB-CG 3.64Å; K260-Y321 HydrophobicContact CD-CD2 3.44Å; K260-Y321 VanDerWaalsContact CD-CD2 3.44Å; K260-Y321 HydrophobicContact CD-CE2 3.63Å; K260-Y321 HydrophobicContact CD-CG 3.94Å; K260-Y321 HydrophobicContact CG-CD2 4.34Å; K260-Y321 HydrophobicContact CG-CG 4.41Å; L261-Y321 HydrophobicContact CD2-CD1 4.26Å; L261-Y321 HydrophobicContact CD2-CE1 3.65Å; L261-Y321 HydrophobicContact CG-CE1 3.94Å; F317-Y321 HydrophobicContact CB-CD2 4.24Å; F317-Y321 HydrophobicContact CB-CE1 4.35Å; F317-Y321 HydrophobicContact CB-CE2 3.61Å; F317-Y321 WeakPolarHBondContact O-CD1 3.25Å; F317-Y321 VanDerWaalsContact O-CD2 3.31Å; F317-Y321 WeakPolarHBondContact O-CD2 3.3Å; F317-Y321 PolarHBondContact O-N 3.23Å; E318-Y321 PolarHBondContact O-N 3.07Å; Y321-G323 PolarHBondContact O-N 3.34Å
322F98.3Very high97.7Very high89 Ų8931.2 Ų31.239%0.3917%0.169SC..THydrogen-bonded Turntrans-75.20.7175.3-154-108.7000113.3V267 Q271 D276 E318 I320 L324V267-F322 WeakPolarHBondContact CG1-O 3.37Å; Q271-F322 VanDerWaalsContact CG-O 3.23Å; Q271-F322 WeakPolarHBondContact CG-O 3.46Å; Q271-F322 PolarHBondContact NE2-O 3.49Å; D276-F322 HydrophobicContact CB-CD2 3.96Å; D276-F322 HydrophobicContact CB-CE1 4.16Å; D276-F322 HydrophobicContact CB-CE2 3.34Å; D276-F322 HydrophobicContact CB-CZ 3.45Å; D276-F322 VanDerWaalsContact CB-CZ 3.45Å; D276-F322 WeakPolarHBondContact OD2-CE2 3.48Å; D276-F322 VanDerWaalsContact OD2-CZ 3.3Å; D276-F322 WeakPolarHBondContact OD2-CZ 3.17Å; E318-F322 WeakPolarHBondContact O-CB 3.21Å; E318-F322 PolarHBondContact O-N 3.23Å; I320-F322 VanDerWaalsContact C-N 3.27Å; I320-F322 PolarHBondContact O-N 3.15Å; F322-L324 VanDerWaalsContact C-N 3.29Å; F322-L324 HydrophobicContact CB-CG 4.35Å; F322-L324 HydrophobicContact CD1-CD1 4.28Å; F322-L324 HydrophobicContact CD1-CD2 3.84Å; F322-L324 HydrophobicContact CD1-CG 3.92Å; F322-L324 HydrophobicContact CE1-CD2 4.46Å; F322-L324 PolarHBondContact O-N 2.94Å
323G98.3Very high97.8Very high1 Ų127.9 Ų27.91%0.0114%0.141CC..THydrogen-bonded Turntrans769.1173.600000115D319 I320 Y321 W325 G326 Y327D319-G323 PolarHBondContact O-N 2.97Å; I320-G323 WeakPolarHBondContact O-CA 3.44Å; I320-G323 PolarHBondContact O-N 3.06Å; Y321-G323 PolarHBondContact O-N 3.34Å; G323-W325 PolarHBondContact O-N 3.08Å; G323-G326 PolarHBondContact O-N 3.08Å; G323-Y327 PolarHBondContact O-N 2.97Å
324L98.1Very high97.9Very high72 Ų7224.6 Ų24.638%0.37712%0.124SC..THydrogen-bonded Turntrans-64.2-24-176.3-61.9-178.2000113D319 F322 Y327D319-L324 HydrophobicContact CB-CD1 4.3Å; D319-L324 WeakPolarHBondContact O-CB 3.36Å; D319-L324 PolarHBondContact O-N 2.92Å; F322-L324 VanDerWaalsContact C-N 3.29Å; F322-L324 HydrophobicContact CB-CG 4.35Å; F322-L324 HydrophobicContact CD1-CD1 4.28Å; F322-L324 HydrophobicContact CD1-CD2 3.84Å; F322-L324 HydrophobicContact CD1-CG 3.92Å; F322-L324 HydrophobicContact CE1-CD2 4.46Å; F322-L324 PolarHBondContact O-N 2.94Å; L324-Y327 WeakPolarHBondContact O-CD1 3.03Å; L324-Y327 WeakPolarHBondContact O-CE1 3.38Å
325W98.6Very high98.1Very high27 Ų2721.8 Ų21.810%0.10210%0.104CC..THydrogen-bonded Turntrans-84-16174.8-7682.8000113.8G306 L313 A315 I320 G323 C329 A359G306-W325 CarbonylContact C-O 3.55Å; G306-W325 WeakPolarHBondContact CA-O 3.46Å; G306-W325 WeakPolarHBondContact O-CB 3.48Å; L313-W325 HydrophobicContact CB-CH2 3.95Å; L313-W325 HydrophobicContact CB-CZ3 4.49Å; L313-W325 HydrophobicContact CD1-CH2 3.51Å; L313-W325 HydrophobicContact CD1-CZ3 3.66Å; L313-W325 HydrophobicContact CG-CH2 4.39Å; A315-W325 HydrophobicContact CB-CD2 4.45Å; A315-W325 HydrophobicContact CB-CH2 4.35Å; A315-W325 HydrophobicContact CB-CZ2 3.35Å; A315-W325 VanDerWaalsContact CB-NE1 3.3Å; I320-W325 HydrophobicContact CG1-CG 4.41Å; G323-W325 PolarHBondContact O-N 3.08Å; W325-C329 PolarHBondContact O-SG 3.21Å; W325-A359 HydrophobicContact CE3-CB 4.35Å
326G98.3Very high98.2Very high3 Ų321.6 Ų21.63%0.03110%0.103CC..THydrogen-bonded Turntrans-92.1-45-171.300000114.5G323 N328 C329 V330G323-G326 PolarHBondContact O-N 3.08Å; G326-N328 PolarHBondContact O-N 2.63Å; G326-C329 CarbonylContact O-C 3.16Å; G326-C329 WeakPolarHBondContact O-CA 3.44Å; G326-C329 VanDerWaalsContact O-CB 3.28Å; G326-C329 WeakPolarHBondContact O-CB 3.45Å; G326-C329 PolarHBondContact O-N 3.14Å; G326-V330 WeakPolarHBondContact O-CG2 3.27Å; G326-V330 PolarHBondContact O-N 3.1Å
327Y98.6Very high98.3Very high29 Ų2920.4 Ų20.411%0.11410%0.095CC..Hα-helixtrans-64.8-37.3-16272.2-87000115.5G268 Q271 G323 L324 C329 V330 L331 C377 T378G268-Y327 WeakPolarHBondContact O-CA 3.42Å; G268-Y327 WeakPolarHBondContact O-CB 3.45Å; G268-Y327 PolarHBondContact O-N 2.94Å; Q271-Y327 HydrophobicContact CB-CD1 3.96Å; Q271-Y327 HydrophobicContact CB-CG 4Å; G323-Y327 PolarHBondContact O-N 2.97Å; L324-Y327 WeakPolarHBondContact O-CD1 3.03Å; L324-Y327 WeakPolarHBondContact O-CE1 3.38Å; Y327-C329 VanDerWaalsContact C-N 3.33Å; Y327-V330 WeakPolarHBondContact O-CB 3.28Å; Y327-V330 PolarHBondContact O-N 3.44Å; Y327-L331 PolarHBondContact O-N 2.8Å; Y327-C377 WeakPolarHBondContact CE2-O 3.38Å; Y327-C377 PolarHBondContact OH-O 3.19Å; Y327-T378 HydrophobicContact CD2-CG2 3.99Å; Y327-T378 HydrophobicContact CE2-CG2 3.81Å
328N98.9Very high98.3Very high5 Ų519.2 Ų19.23%0.0279%0.09CC..Hα-helixtrans-65.3-40.4173.7-87.8-65.7000111.2G326 V330 L331 A332 C377 T378 P380 F381G326-N328 PolarHBondContact O-N 2.63Å; N328-V330 VanDerWaalsContact C-N 3.35Å; N328-L331 PolarHBondContact O-N 3.17Å; N328-A332 WeakPolarHBondContact O-CB 3.35Å; N328-A332 PolarHBondContact O-N 3.14Å; N328-C377 PolarHBondContact ND2-O 3.49Å; N328-C377 VanDerWaalsContact ND2-O 3.1Å; N328-T378 VanDerWaalsContact OD1-CA 3.27Å; N328-T378 WeakPolarHBondContact OD1-CA 3.41Å; N328-P380 HydrophobicContact CB-CB 4.22Å; N328-P380 WeakPolarHBondContact OD1-CD 3.4Å; N328-F381 HydrophobicContact CB-CB 4.3Å; N328-F381 VanDerWaalsContact OD1-CB 3.23Å; N328-F381 WeakPolarHBondContact OD1-CB 3.26Å; N328-F381 PolarHBondContact OD1-N 3.33Å
329C98.9Very high98.4Very high1 Ų113.7 Ų13.71%0.0076%0.064CC..Hα-helixtrans-67.6-34.9179.2-52.80000111.9G302 W325 G326 Y327 C333 A355 A359G302-C329 WeakPolarHBondContact O-CB 3.15Å; W325-C329 PolarHBondContact O-SG 3.21Å; G326-C329 CarbonylContact O-C 3.16Å; G326-C329 WeakPolarHBondContact O-CA 3.44Å; G326-C329 VanDerWaalsContact O-CB 3.28Å; G326-C329 WeakPolarHBondContact O-CB 3.45Å; G326-C329 PolarHBondContact O-N 3.14Å; Y327-C329 VanDerWaalsContact C-N 3.33Å; C329-C333 WeakPolarHBondContact O-CB 3.23Å; C329-C333 PolarHBondContact O-N 2.81Å; C329-A355 HydrophobicContact CB-CB 4.22Å; C329-A355 PolarHBondContact SG-O 3.44Å; C329-A355 VanDerWaalsContact SG-O 3.38Å; C329-A359 VanDerWaalsContact SG-CA 3.6Å; C329-A359 VanDerWaalsContact SG-CB 3.52Å
330V98.9Very high98.5Very high0 Ų012.8 Ų12.80%06%0.059CC..Hα-helixtrans-54.3-56.8170.8170.70000110.3M109 I269 V272 A299 G326 Y327 N328 A332 C333 I334M109-V330 HydrophobicContact CE-CG1 3.36Å; I269-V330 HydrophobicContact CG1-CG1 4.39Å; I269-V330 HydrophobicContact CG1-CG2 3.81Å; V272-V330 HydrophobicContact CG2-CB 4.11Å; V272-V330 HydrophobicContact CG2-CG1 3.91Å; A299-V330 HydrophobicContact CB-CG1 3.97Å; A299-V330 WeakPolarHBondContact O-CG2 3.23Å; G326-V330 WeakPolarHBondContact O-CG2 3.27Å; G326-V330 PolarHBondContact O-N 3.1Å; Y327-V330 WeakPolarHBondContact O-CB 3.28Å; Y327-V330 PolarHBondContact O-N 3.44Å; N328-V330 VanDerWaalsContact C-N 3.35Å; V330-A332 PolarHBondContact O-N 2.88Å; V330-C333 PolarHBondContact O-N 3.43Å; V330-I334 HydrophobicContact CG1-CD1 3.8Å; V330-I334 VanDerWaalsContact O-CG1 3.24Å; V330-I334 WeakPolarHBondContact O-CG1 3.28Å; V330-I334 PolarHBondContact O-N 3.4Å
331L98.9Very high98.5Very high1 Ų112.9 Ų12.91%0.0056%0.059CC..Hα-helixtrans-64.8-41.4-177.4-66.8176.3000112.1V108 M109 F110 V272 Y327 N328 I334 A335 T378 F381V108-L331 WeakPolarHBondContact O-CD2 3.33Å; M109-L331 HydrophobicContact CG-CD2 4.31Å; F110-L331 HydrophobicContact CE2-CD2 4.17Å; V272-L331 HydrophobicContact CG1-CD1 4.19Å; V272-L331 HydrophobicContact CG1-CD2 3.85Å; V272-L331 HydrophobicContact CG1-CG 4.15Å; V272-L331 HydrophobicContact CG2-CG 4.32Å; Y327-L331 PolarHBondContact O-N 2.8Å; N328-L331 PolarHBondContact O-N 3.17Å; L331-I334 PolarHBondContact O-N 2.97Å; L331-A335 VanDerWaalsContact O-CB 3.29Å; L331-A335 WeakPolarHBondContact O-CB 3.5Å; L331-A335 PolarHBondContact O-N 3.3Å; L331-T378 HydrophobicContact CD1-CG2 3.86Å; L331-F381 HydrophobicContact CB-CB 4.11Å; L331-F381 HydrophobicContact CB-CD1 3.96Å; L331-F381 HydrophobicContact CB-CD2 3.33Å; L331-F381 HydrophobicContact CB-CE1 4.27Å; L331-F381 HydrophobicContact CB-CE2 3.73Å; L331-F381 HydrophobicContact CB-CG 3.47Å; L331-F381 VanDerWaalsContact CB-CG 3.47Å; L331-F381 HydrophobicContact CB-CZ 4.2Å; L331-F381 HydrophobicContact CD1-CB 4.34Å; L331-F381 HydrophobicContact CD1-CD1 3.6Å; L331-F381 HydrophobicContact CD1-CE1 4.05Å; L331-F381 HydrophobicContact CD1-CG 3.86Å; L331-F381 HydrophobicContact CG-CD1 4.43Å; L331-F381 HydrophobicContact CG-CG 4.34Å
332A98.9Very high98.4Very high0 Ų012 Ų120%06%0.055CC..Hα-helixtrans-63.6-43.6177.700000112.1N328 V330 A335 V336 C358 F381N328-A332 WeakPolarHBondContact O-CB 3.35Å; N328-A332 PolarHBondContact O-N 3.14Å; V330-A332 PolarHBondContact O-N 2.88Å; A332-A335 PolarHBondContact O-N 2.91Å; A332-V336 PolarHBondContact O-N 2.93Å; A332-C358 HydrophobicContact CB-CB 3.81Å; A332-F381 HydrophobicContact CB-CD2 4.32Å
333C98.8Very high98.4Very high0 Ų09.4 Ų9.40%05%0.046CC..Hα-helixtrans-67.6-39.6179.7-162.90000111.7H298 C329 V330 G337 A355H298-C333 WeakPolarHBondContact O-CB 3.45Å; H298-C333 PolarHBondContact O-SG 3.46Å; H298-C333 VanDerWaalsContact O-SG 3.41Å; C329-C333 WeakPolarHBondContact O-CB 3.23Å; C329-C333 PolarHBondContact O-N 2.81Å; V330-C333 PolarHBondContact O-N 3.43Å; C333-G337 WeakPolarHBondContact O-CA 3.41Å; C333-G337 PolarHBondContact O-N 3.39Å; C333-A355 HydrophobicContact CB-CB 4.06Å
334I98.8Very high98.3Very high1 Ų110.4 Ų10.41%0.0055%0.052CC..Hα-helixtrans-64.3-48.7174.1-66.6165000110.5M109 F110 T295 H298 A299 V330 L331 V336 G337 M339M109-I334 HydrophobicContact CE-CD1 3.64Å; F110-I334 HydrophobicContact CD2-CB 4.24Å; F110-I334 HydrophobicContact CD2-CG2 3.51Å; F110-I334 HydrophobicContact CE2-CB 4.26Å; F110-I334 HydrophobicContact CE2-CG2 4.01Å; T295-I334 HydrophobicContact CG2-CD1 4.24Å; T295-I334 HydrophobicContact CG2-CG1 4.26Å; T295-I334 HydrophobicContact CG2-CG2 3.78Å; H298-I334 HydrophobicContact CB-CG1 4.4Å; A299-I334 HydrophobicContact CB-CD1 3.74Å; A299-I334 HydrophobicContact CB-CG1 4.08Å; V330-I334 HydrophobicContact CG1-CD1 3.8Å; V330-I334 VanDerWaalsContact O-CG1 3.24Å; V330-I334 WeakPolarHBondContact O-CG1 3.28Å; V330-I334 PolarHBondContact O-N 3.4Å; L331-I334 PolarHBondContact O-N 2.97Å; I334-V336 VanDerWaalsContact C-N 3.35Å; I334-V336 PolarHBondContact O-N 3.42Å; I334-G337 PolarHBondContact O-N 3.45Å; I334-M339 HydrophobicContact CG2-CG 3.54Å; I334-M339 HydrophobicContact CG2-SD 4.45Å; I334-M339 WeakPolarHBondContact O-CB 3.46Å; I334-M339 WeakPolarHBondContact O-CG 3.45Å
335A98.7Very high98.3Very high0 Ų014.9 Ų14.90%06%0.064CC..Iπ-helixtrans-57.1-46.7-175.700000112.2F110 F215 L331 A332 F340 F381 A385F110-A335 HydrophobicContact CE2-CB 4.13Å; F110-A335 HydrophobicContact CZ-CB 4.01Å; F215-A335 HydrophobicContact CE1-CB 4.48Å; F215-A335 HydrophobicContact CZ-CB 4.43Å; L331-A335 VanDerWaalsContact O-CB 3.29Å; L331-A335 WeakPolarHBondContact O-CB 3.5Å; L331-A335 PolarHBondContact O-N 3.3Å; A332-A335 PolarHBondContact O-N 2.91Å; A335-F340 HydrophobicContact CB-CD2 3.94Å; A335-F340 HydrophobicContact CB-CE2 4.22Å; A335-F340 WeakPolarHBondContact O-CD2 3.45Å; A335-F340 PolarHBondContact O-N 3.32Å; A335-F381 HydrophobicContact CB-CE2 4.22Å; A335-A385 HydrophobicContact CB-CB 4.21Å
336V98.7Very high98.2Very high0 Ų014.9 Ų14.90%07%0.065CC..Iπ-helixtrans-81.6-34.4178.8-179.60000111.6A332 I334 G338 Y341 V347 L350 A351 C354 F388A332-V336 PolarHBondContact O-N 2.93Å; I334-V336 VanDerWaalsContact C-N 3.35Å; I334-V336 PolarHBondContact O-N 3.42Å; V336-G338 PolarHBondContact O-N 2.92Å; V336-Y341 HydrophobicContact CG1-CD2 4.09Å; V336-V347 WeakPolarHBondContact O-CG1 3.21Å; V336-L350 HydrophobicContact CG1-CB 4.23Å; V336-L350 HydrophobicContact CG1-CD2 4.07Å; V336-L350 HydrophobicContact CG1-CG 3.97Å; V336-A351 HydrophobicContact CB-CB 3.92Å; V336-A351 HydrophobicContact CG1-CB 3.89Å; V336-C354 HydrophobicContact CG2-CB 3.97Å; V336-F388 HydrophobicContact CG2-CB 4.16Å
337G98.1Very high98.2Very high0 Ų014.7 Ų14.70%06%0.063CC..Iπ-helixtrans-77.550.6-173.900000115.3H298 C333 I334H298-G337 PolarHBondContact CE1-O 3.3Å; H298-G337 PolarHBondContact ND1-O 3.46Å; C333-G337 WeakPolarHBondContact O-CA 3.41Å; C333-G337 PolarHBondContact O-N 3.39Å; I334-G337 PolarHBondContact O-N 3.45Å
338G96.9Very high98.2Very high0 Ų016.4 Ų16.40%07%0.072CC..Iπ-helixtrans111.4-16.4173.400000115.6V336 Y341 P409 N412V336-G338 PolarHBondContact O-N 2.92Å; G338-Y341 CarbonylContact C-O 3.58Å; G338-Y341 WeakPolarHBondContact CA-O 3.3Å; G338-P409 WeakPolarHBondContact O-CA 3.31Å; G338-N412 PolarHBondContact O-ND2 2.81Å
339M98.3Very high98.2Very high3 Ų320.5 Ų20.52%0.0159%0.093CC..Iπ-helixtrans-75.3-60.6178.1-66.4-56.3-56.300111.8F110 I334 V406 T407 P409 N412F110-M339 HydrophobicContact CB-CE 3.68Å; F110-M339 HydrophobicContact CB-CG 4.43Å; F110-M339 WeakPolarHBondContact O-CE 3.44Å; I334-M339 HydrophobicContact CG2-CG 3.54Å; I334-M339 HydrophobicContact CG2-SD 4.45Å; I334-M339 WeakPolarHBondContact O-CB 3.46Å; I334-M339 WeakPolarHBondContact O-CG 3.45Å; M339-V406 WeakPolarHBondContact O-CG1 3.08Å; M339-T407 WeakPolarHBondContact CE-O 3.36Å; M339-P409 HydrophobicContact CG-CG 4.34Å; M339-P409 WeakPolarHBondContact SD-CD 3.35Å; M339-P409 HydrophobicContact SD-CG 3.49Å; M339-P409 WeakPolarHBondContact SD-CG 3.16Å; M339-N412 PolarHBondContact O-ND2 2.94Å
340F98.3Very high98.2Very high16 Ų1621.6 Ų21.67%0.0710%0.099CC..SBendtrans-103-9-177.4-62.7-78.6000113.7F110 P213 F215 A335 L389 L401 L403 V406F110-F340 AromaticContact CD1-CE2 3.91Å; F110-F340 HydrophobicContact CD1-CE2 3.91Å; F110-F340 HydrophobicContact CD1-CZ 4.14Å; F110-F340 AromaticContact CE1-CE2 3.89Å; F110-F340 HydrophobicContact CE1-CE2 3.89Å; F110-F340 HydrophobicContact CE1-CZ 4.31Å; F110-F340 HydrophobicContact CZ-CE2 4.45Å; P213-F340 HydrophobicContact CB-CE1 4.05Å; P213-F340 HydrophobicContact CB-CZ 4.15Å; P213-F340 HydrophobicContact CG-CD1 4.37Å; P213-F340 HydrophobicContact CG-CE1 3.86Å; P213-F340 HydrophobicContact CG-CZ 3.95Å; F215-F340 HydrophobicContact CE1-CD2 4.16Å; F215-F340 AromaticContact CE1-CE2 3.52Å; F215-F340 HydrophobicContact CE1-CE2 3.52Å; F215-F340 AromaticContact CE1-CZ 3.85Å; F215-F340 HydrophobicContact CE1-CZ 3.85Å; F215-F340 HydrophobicContact CZ-CD2 4.39Å; F215-F340 HydrophobicContact CZ-CE2 4.18Å; A335-F340 HydrophobicContact CB-CD2 3.94Å; A335-F340 HydrophobicContact CB-CE2 4.22Å; A335-F340 WeakPolarHBondContact O-CD2 3.45Å; A335-F340 PolarHBondContact O-N 3.32Å; F340-L389 HydrophobicContact CB-CD1 4.23Å; F340-L389 HydrophobicContact CB-CD2 3.45Å; F340-L389 VanDerWaalsContact CB-CD2 3.45Å; F340-L389 HydrophobicContact CB-CG 4.43Å; F340-L389 HydrophobicContact CD2-CD1 4.49Å; F340-L389 HydrophobicContact CG-CD1 4.23Å; F340-L389 HydrophobicContact CG-CD2 4.32Å; F340-L401 PolarHBondContact O-N 3.47Å; F340-L403 HydrophobicContact CD1-CD2 3.63Å; F340-L403 HydrophobicContact CE1-CD2 3.65Å; F340-V406 HydrophobicContact CD1-CG1 4.29Å; F340-V406 HydrophobicContact CD1-CG2 4.08Å; F340-V406 HydrophobicContact CE1-CG1 4.16Å
341Y98.1Very high98.1Very high3 Ų321.6 Ų21.61%0.01210%0.099CC..BIsolated β-bridgetrans-118.7147.1166.6-77.4-90.1000110.4V336 G338 L343 V347 F388 L389 I398 F399 K400V336-Y341 HydrophobicContact CG1-CD2 4.09Å; G338-Y341 CarbonylContact C-O 3.58Å; G338-Y341 WeakPolarHBondContact CA-O 3.3Å; Y341-L343 PolarHBondContact O-N 3.3Å; Y341-V347 VanDerWaalsContact CB-CG1 3.47Å; Y341-V347 HydrophobicContact CD1-CG2 4.34Å; Y341-V347 HydrophobicContact CG-CG1 4.31Å; Y341-V347 HydrophobicContact CG-CG2 4.44Å; Y341-F388 PolarHBondContact OH-O 3.1Å; Y341-L389 HydrophobicContact CD2-CD2 3.95Å; Y341-L389 HydrophobicContact CE2-CD2 3.46Å; Y341-L389 VanDerWaalsContact CE2-CD2 3.46Å; Y341-L389 HydrophobicContact CE2-CG 4.33Å; Y341-I398 HydrophobicContact CD1-CG2 3.81Å; Y341-I398 HydrophobicContact CE1-CG2 3.52Å; Y341-F399 CarbonylContact C-O 3.29Å; Y341-F399 WeakPolarHBondContact CA-O 3.18Å; Y341-F399 VanDerWaalsContact CD1-C 3.45Å; Y341-F399 WeakPolarHBondContact CD1-O 3.42Å; Y341-K400 HydrophobicContact CD1-CB 4.15Å; Y341-K400 HydrophobicContact CE1-CB 3.72Å
342A97.1Very high98.1Very high0 Ų023.1 Ų23.10%011%0.107CC..  trans-68.2126.5171.900000109.8T344 V347 F399 L401 Y416A342-T344 PolarHBondContact O-N 3.34Å; A342-V347 WeakPolarHBondContact O-CG2 3.33Å; A342-F399 HydrophobicContact CB-CB 4.38Å; A342-F399 HydrophobicContact CB-CD1 4.15Å; A342-F399 PolarHBondContact N-O 3.06Å; A342-L401 HydrophobicContact CB-CD1 4.48Å; A342-L401 VanDerWaalsContact N-CD1 3.35Å; A342-Y416 VanDerWaalsContact CB-CB 3.5Å; A342-Y416 HydrophobicContact CB-CD1 4.12Å; A342-Y416 HydrophobicContact CB-CD2 3.68Å; A342-Y416 HydrophobicContact CB-CE2 4.4Å; A342-Y416 HydrophobicContact CB-CG 3.49Å; A342-Y416 VanDerWaalsContact CB-CG 3.49Å
343L97.8Very high98.1Very high36 Ų3626.8 Ų26.819%0.18813%0.129CC..  trans-69.1102.5-172.4-173.167.7000112.1I294 Y341 H348 L413I294-L343 HydrophobicContact CD1-CD2 4.03Å; I294-L343 HydrophobicContact CG1-CD2 4.41Å; I294-L343 HydrophobicContact CG2-CD2 3.64Å; Y341-L343 PolarHBondContact O-N 3.3Å; L343-H348 HydrophobicContact CD1-CB 4.3Å; L343-L413 VanDerWaalsContact O-CD1 3.23Å; L343-L413 WeakPolarHBondContact O-CD1 3.47Å
344T97.2Very high98.1Very high21 Ų2126.8 Ų26.813%0.12913%0.129CC..  trans-113.9168.9165.765.80000109.3A342 Q346 V347 H348 R397 Y416A342-T344 PolarHBondContact O-N 3.34Å; T344-Q346 PolarHBondContact O-N 3.14Å; T344-Q346 PolarHBondContact OG1-OE1 2.97Å; T344-V347 PolarHBondContact O-N 3Å; T344-V347 VanDerWaalsContact O-N 3.15Å; T344-V347 WeakPolarHBondContact OG1-CG2 3.41Å; T344-V347 PolarHBondContact OG1-N 3.38Å; T344-H348 PolarHBondContact O-N 3.41Å; T344-R397 WeakPolarHBondContact CG2-O 3.34Å; T344-R397 PolarHBondContact OG1-O 2.98Å; T344-Y416 HydrophobicContact CG2-CE1 4.22Å
345W96.9Very high98.1Very high166 Ų16626.7 Ų26.763%0.62913%0.129SC*.Hα-helixtrans-63.6-30.3176.572.6-101.5000112.3H348 L349W345-H348 PolarHBondContact O-N 3.07Å; W345-L349 HydrophobicContact CE3-CD1 3.72Å; W345-L349 HydrophobicContact CE3-CG 4.39Å; W345-L349 HydrophobicContact CZ3-CD1 3.6Å; W345-L349 WeakPolarHBondContact O-CG 3.41Å; W345-L349 PolarHBondContact O-N 3.43Å; W345-L349 VanDerWaalsContact O-N 3.11Å
346Q97.6Very high98.1Very high27 Ų2730.6 Ų30.613%0.12615%0.146CC..Hα-helixtrans-64.9-44.9172.8-67.381.21.200111.3T344 H348 L349 L350 R397 I398T344-Q346 PolarHBondContact O-N 3.14Å; T344-Q346 PolarHBondContact OG1-OE1 2.97Å; Q346-H348 VanDerWaalsContact C-N 3.3Å; Q346-L349 PolarHBondContact O-N 3.26Å; Q346-L350 WeakPolarHBondContact O-CB 3.41Å; Q346-L350 PolarHBondContact O-N 2.94Å; Q346-R397 HydrophobicContact CG-CB 4.33Å; Q346-I398 HydrophobicContact CB-CD1 4.49Å; Q346-I398 HydrophobicContact CB-CG1 3.97Å
347V98.1Very high98.1Very high0 Ų034.7 Ų34.70%016%0.164CC..Hα-helixtrans-67.2-35178.4168.80000110.9V336 Y341 A342 T344 L350 A351 I398V336-V347 WeakPolarHBondContact O-CG1 3.21Å; Y341-V347 VanDerWaalsContact CB-CG1 3.47Å; Y341-V347 HydrophobicContact CD1-CG2 4.34Å; Y341-V347 HydrophobicContact CG-CG1 4.31Å; Y341-V347 HydrophobicContact CG-CG2 4.44Å; A342-V347 WeakPolarHBondContact O-CG2 3.33Å; T344-V347 PolarHBondContact O-N 3Å; T344-V347 VanDerWaalsContact O-N 3.15Å; T344-V347 WeakPolarHBondContact OG1-CG2 3.41Å; T344-V347 PolarHBondContact OG1-N 3.38Å; V347-L350 CarbonylContact O-C 3.58Å; V347-L350 WeakPolarHBondContact O-CB 3.49Å; V347-L350 PolarHBondContact O-N 3.39Å; V347-A351 WeakPolarHBondContact O-CB 3.46Å; V347-A351 PolarHBondContact O-N 3.33Å; V347-I398 HydrophobicContact CG2-CB 4.48Å; V347-I398 HydrophobicContact CG2-CG1 4.39Å; V347-I398 HydrophobicContact CG2-CG2 4.42Å
348H98.5Very high98.2Very high65 Ų6534.7 Ų34.730%0.30116%0.164SC..Hα-helixtrans-59.6-48.7171.9179.469.2000111.7H298 L343 T344 W345 Q346 L350 A351 I352H298-H348 AromaticContact CD2-ND1 3.99Å; H298-H348 AromaticContact CE1-ND1 3.97Å; H298-H348 AromaticContact NE2-CE1 3.94Å; H298-H348 AromaticContact NE2-ND1 3.13Å; H298-H348 PolarHBondContact NE2-ND1 2.98Å; H298-H348 VanDerWaalsContact NE2-ND1 3.13Å; L343-H348 HydrophobicContact CD1-CB 4.3Å; T344-H348 PolarHBondContact O-N 3.41Å; W345-H348 PolarHBondContact O-N 3.07Å; Q346-H348 VanDerWaalsContact C-N 3.3Å; H348-L350 VanDerWaalsContact C-N 3.3Å; H348-L350 PolarHBondContact O-N 3.47Å; H348-A351 WeakPolarHBondContact O-CB 3.29Å; H348-A351 PolarHBondContact O-N 2.8Å; H348-A351 VanDerWaalsContact O-N 3.16Å; H348-I352 WeakPolarHBondContact O-CG1 3.46Å; H348-I352 PolarHBondContact O-N 3.23Å; H348-I352 VanDerWaalsContact O-N 3.08Å
349L98.4Very high98.2Very high91 Ų9134.9 Ų34.948%0.47617%0.165SC..Hα-helixtrans-62.8-37174.5-65.4180000112.4W345 Q346 A351 I352 T353W345-L349 HydrophobicContact CE3-CD1 3.72Å; W345-L349 HydrophobicContact CE3-CG 4.39Å; W345-L349 HydrophobicContact CZ3-CD1 3.6Å; W345-L349 WeakPolarHBondContact O-CG 3.41Å; W345-L349 PolarHBondContact O-N 3.43Å; W345-L349 VanDerWaalsContact O-N 3.11Å; Q346-L349 PolarHBondContact O-N 3.26Å; L349-A351 VanDerWaalsContact C-N 3.32Å; L349-A351 PolarHBondContact O-N 2.93Å; L349-I352 PolarHBondContact O-N 3.11Å; L349-T353 WeakPolarHBondContact O-CB 3.35Å; L349-T353 PolarHBondContact O-N 3.35Å; L349-T353 PolarHBondContact O-OG1 3.05Å
350L98.4Very high98.2Very high23 Ų2340.3 Ų40.312%0.1219%0.187CC..Hα-helixtrans-63.6-38174.9-172.367000111.5V336 Q346 V347 H348 T353 C354 F388 L391 I398V336-L350 HydrophobicContact CG1-CB 4.23Å; V336-L350 HydrophobicContact CG1-CD2 4.07Å; V336-L350 HydrophobicContact CG1-CG 3.97Å; Q346-L350 WeakPolarHBondContact O-CB 3.41Å; Q346-L350 PolarHBondContact O-N 2.94Å; V347-L350 CarbonylContact O-C 3.58Å; V347-L350 WeakPolarHBondContact O-CB 3.49Å; V347-L350 PolarHBondContact O-N 3.39Å; H348-L350 VanDerWaalsContact C-N 3.3Å; H348-L350 PolarHBondContact O-N 3.47Å; L350-T353 PolarHBondContact O-N 3.45Å; L350-C354 WeakPolarHBondContact O-CB 3.28Å; L350-C354 PolarHBondContact O-N 3.48Å; L350-F388 HydrophobicContact CD1-CD1 3.71Å; L350-F388 HydrophobicContact CD1-CE1 3.77Å; L350-F388 HydrophobicContact CG-CD1 3.98Å; L350-F388 HydrophobicContact CG-CE1 4.37Å; L350-L391 HydrophobicContact CD1-CD2 3.98Å; L350-L391 HydrophobicContact CD2-CD2 4.26Å; L350-I398 HydrophobicContact CD2-CG2 4.05Å
351A98.8Very high98.2Very high0 Ų041.5 Ų41.50%019%0.193CC..Hα-helixtrans-66.1-43.7176.700000111.9V336 V347 H348 L349 T353 C354 A355V336-A351 HydrophobicContact CB-CB 3.92Å; V336-A351 HydrophobicContact CG1-CB 3.89Å; V347-A351 WeakPolarHBondContact O-CB 3.46Å; V347-A351 PolarHBondContact O-N 3.33Å; H348-A351 WeakPolarHBondContact O-CB 3.29Å; H348-A351 PolarHBondContact O-N 2.8Å; H348-A351 VanDerWaalsContact O-N 3.16Å; L349-A351 VanDerWaalsContact C-N 3.32Å; L349-A351 PolarHBondContact O-N 2.93Å; A351-T353 VanDerWaalsContact C-N 3.33Å; A351-T353 PolarHBondContact O-N 3.04Å; A351-C354 WeakPolarHBondContact O-CB 3.41Å; A351-C354 PolarHBondContact O-N 2.87Å; A351-A355 WeakPolarHBondContact O-CB 2.97Å; A351-A355 PolarHBondContact O-N 3.47Å
352I98.8Very high98.3Very high33 Ų3342 Ų4217%0.16920%0.2CC..Hα-helixtrans-62.1-42.2173.4-61-58.6000110.8L301 V305 H348 L349 C354 A355 F356L301-I352 HydrophobicContact CB-CD1 4.12Å; L301-I352 HydrophobicContact CD1-CD1 4.37Å; V305-I352 HydrophobicContact CG2-CD1 4.12Å; V305-I352 HydrophobicContact CG2-CG2 4.09Å; H348-I352 WeakPolarHBondContact O-CG1 3.46Å; H348-I352 PolarHBondContact O-N 3.23Å; H348-I352 VanDerWaalsContact O-N 3.08Å; L349-I352 PolarHBondContact O-N 3.11Å; I352-C354 PolarHBondContact O-N 2.98Å; I352-A355 WeakPolarHBondContact O-CB 3.35Å; I352-A355 PolarHBondContact O-N 3.29Å; I352-F356 HydrophobicContact CG2-CD2 3.88Å; I352-F356 HydrophobicContact CG2-CE2 3.71Å; I352-F356 VanDerWaalsContact O-CD2 3.3Å; I352-F356 WeakPolarHBondContact O-CD2 3.12Å; I352-F356 PolarHBondContact O-N 2.64Å
353T98.6Very high98.2Very high77 Ų7743.7 Ų43.747%0.47221%0.211SC..Hα-helixtrans-62.5-42.5176-55.50000111.5L349 L350 A351 A355 F356 F357 F388L349-T353 WeakPolarHBondContact O-CB 3.35Å; L349-T353 PolarHBondContact O-N 3.35Å; L349-T353 PolarHBondContact O-OG1 3.05Å; L350-T353 PolarHBondContact O-N 3.45Å; A351-T353 VanDerWaalsContact C-N 3.33Å; A351-T353 PolarHBondContact O-N 3.04Å; T353-A355 VanDerWaalsContact C-N 3.34Å; T353-F356 PolarHBondContact O-N 3.27Å; T353-F357 WeakPolarHBondContact O-CB 3.24Å; T353-F357 PolarHBondContact O-N 3.2Å; T353-F388 HydrophobicContact CG2-CE1 4.16Å; T353-F388 HydrophobicContact CG2-CZ 4.19Å
354C98.8Very high98.2Very high0 Ų044 Ų440%022%0.22CC..Hα-helixtrans-61.7-42174.8-171.80000111.3V336 L350 A351 I352 F357 C358 F388V336-C354 HydrophobicContact CG2-CB 3.97Å; L350-C354 WeakPolarHBondContact O-CB 3.28Å; L350-C354 PolarHBondContact O-N 3.48Å; A351-C354 WeakPolarHBondContact O-CB 3.41Å; A351-C354 PolarHBondContact O-N 2.87Å; I352-C354 PolarHBondContact O-N 2.98Å; C354-F357 PolarHBondContact O-N 3.4Å; C354-C358 WeakPolarHBondContact O-CB 3.35Å; C354-C358 PolarHBondContact O-N 3.45Å; C354-F388 HydrophobicContact CB-CD1 3.59Å; C354-F388 HydrophobicContact CB-CD2 4.23Å; C354-F388 HydrophobicContact CB-CE1 3.67Å; C354-F388 HydrophobicContact CB-CE2 4.31Å; C354-F388 HydrophobicContact CB-CG 3.88Å; C354-F388 HydrophobicContact CB-CZ 4.04Å
355A98.8Very high98.3Very high0 Ų044.1 Ų44.10%022%0.219CC..Hα-helixtrans-63.1-43.5176.600000112.3V305 C329 C333 A351 I352 T353 C358 A359V305-A355 HydrophobicContact CB-CB 4.13Å; V305-A355 HydrophobicContact CG1-CB 3.72Å; C329-A355 HydrophobicContact CB-CB 4.22Å; C329-A355 PolarHBondContact SG-O 3.44Å; C329-A355 VanDerWaalsContact SG-O 3.38Å; C333-A355 HydrophobicContact CB-CB 4.06Å; A351-A355 WeakPolarHBondContact O-CB 2.97Å; A351-A355 PolarHBondContact O-N 3.47Å; I352-A355 WeakPolarHBondContact O-CB 3.35Å; I352-A355 PolarHBondContact O-N 3.29Å; T353-A355 VanDerWaalsContact C-N 3.34Å; A355-C358 WeakPolarHBondContact O-CB 3.36Å; A355-C358 PolarHBondContact O-N 3Å; A355-A359 PolarHBondContact O-N 3.28Å
356F98.6Very high98.3Very high81 Ų8138 Ų3836%0.35520%0.204SC..Hα-helixtrans-60-52.7172.5-85.2-69000111.3V305 S309 I352 T353 C358 A359 Y360V305-F356 HydrophobicContact CG1-CB 4.36Å; V305-F356 HydrophobicContact CG1-CD1 3.79Å; V305-F356 HydrophobicContact CG1-CD2 3.7Å; V305-F356 HydrophobicContact CG1-CE1 3.89Å; V305-F356 HydrophobicContact CG1-CE2 3.82Å; V305-F356 HydrophobicContact CG1-CG 3.67Å; V305-F356 HydrophobicContact CG1-CZ 3.91Å; V305-F356 HydrophobicContact CG2-CE2 4.28Å; S309-F356 WeakPolarHBondContact OG-CD1 3.39Å; S309-F356 WeakPolarHBondContact OG-CE1 3.38Å; I352-F356 HydrophobicContact CG2-CD2 3.88Å; I352-F356 HydrophobicContact CG2-CE2 3.71Å; I352-F356 VanDerWaalsContact O-CD2 3.3Å; I352-F356 WeakPolarHBondContact O-CD2 3.12Å; I352-F356 PolarHBondContact O-N 2.64Å; T353-F356 PolarHBondContact O-N 3.27Å; F356-C358 PolarHBondContact O-N 3.01Å; F356-A359 WeakPolarHBondContact O-CB 3.08Å; F356-A359 PolarHBondContact O-N 2.73Å; F356-Y360 WeakPolarHBondContact O-CD2 3.44Å; F356-Y360 PolarHBondContact O-N 2.94Å
357F98.8Very high98.2Very high86 Ų8640.9 Ų40.938%0.37722%0.22SC..Hα-helixtrans-53.4-41.9176.8176.5-94.8000111.5T353 C354 Y360 L361 S384 F388T353-F357 WeakPolarHBondContact O-CB 3.24Å; T353-F357 PolarHBondContact O-N 3.2Å; C354-F357 PolarHBondContact O-N 3.4Å; F357-Y360 PolarHBondContact O-N 2.94Å; F357-L361 HydrophobicContact CE1-CD2 3.92Å; F357-L361 HydrophobicContact CZ-CD2 4.39Å; F357-L361 WeakPolarHBondContact O-CB 3.32Å; F357-L361 PolarHBondContact O-N 3.25Å; F357-S384 WeakPolarHBondContact CD1-OG 3.26Å; F357-F388 HydrophobicContact CB-CE2 3.97Å; F357-F388 HydrophobicContact CB-CZ 4.1Å; F357-F388 HydrophobicContact CD1-CD2 4.49Å; F357-F388 AromaticContact CD1-CE2 3.79Å; F357-F388 HydrophobicContact CD1-CE2 3.79Å; F357-F388 HydrophobicContact CE1-CE2 4.46Å; F357-F388 AromaticContact CG-CE2 3.85Å; F357-F388 HydrophobicContact CG-CE2 3.85Å; F357-F388 HydrophobicContact CG-CZ 4.4Å
358C98.8Very high98.2Very high0 Ų046 Ų460%025%0.246CC..Hα-helixtrans-65.2-38.1178.6-164.40000113.1A332 C354 A355 F356 L361 G362 P380 F381 S384A332-C358 HydrophobicContact CB-CB 3.81Å; C354-C358 WeakPolarHBondContact O-CB 3.35Å; C354-C358 PolarHBondContact O-N 3.45Å; A355-C358 WeakPolarHBondContact O-CB 3.36Å; A355-C358 PolarHBondContact O-N 3Å; F356-C358 PolarHBondContact O-N 3.01Å; C358-L361 PolarHBondContact O-N 3.31Å; C358-G362 WeakPolarHBondContact O-CA 3.38Å; C358-G362 PolarHBondContact O-N 2.99Å; C358-P380 VanDerWaalsContact SG-C 3.55Å; C358-P380 PolarHBondContact SG-O 3.32Å; C358-F381 VanDerWaalsContact SG-CA 3.52Å; C358-S384 VanDerWaalsContact CA-OG 3.29Å; C358-S384 WeakPolarHBondContact CA-OG 3.48Å; C358-S384 WeakPolarHBondContact CB-OG 3.31Å
359A98.6Very high98.1Very high4 Ų444.2 Ų44.23%0.03324%0.239CC..Hα-helixtrans-62.1-48.4175.100000111.8W325 C329 A355 F356 G362 S363W325-A359 HydrophobicContact CE3-CB 4.35Å; C329-A359 VanDerWaalsContact SG-CA 3.6Å; C329-A359 VanDerWaalsContact SG-CB 3.52Å; A355-A359 PolarHBondContact O-N 3.28Å; F356-A359 WeakPolarHBondContact O-CB 3.08Å; F356-A359 PolarHBondContact O-N 2.73Å; A359-G362 WeakPolarHBondContact O-CA 3.47Å; A359-G362 PolarHBondContact O-N 3.27Å; A359-G362 VanDerWaalsContact O-N 3.16Å; A359-S363 PolarHBondContact O-N 3.28Å; A359-S363 VanDerWaalsContact O-N 3.12Å
360Y98Very high98Very high118 Ų11840.5 Ų40.546%0.46322%0.22SC..Hα-helixtrans-61.6-47.5176.8-82-91.7000111.4L313 F356 F357 G362 S363 A364L313-Y360 HydrophobicContact CD1-CD1 3.62Å; L313-Y360 HydrophobicContact CD1-CE1 3.59Å; L313-Y360 HydrophobicContact CD1-CG 4.2Å; L313-Y360 HydrophobicContact CD2-CD1 4.17Å; L313-Y360 HydrophobicContact CD2-CE1 3.46Å; L313-Y360 VanDerWaalsContact CD2-CE1 3.46Å; L313-Y360 HydrophobicContact CG-CD1 4.29Å; L313-Y360 HydrophobicContact CG-CE1 3.74Å; F356-Y360 WeakPolarHBondContact O-CD2 3.44Å; F356-Y360 PolarHBondContact O-N 2.94Å; F357-Y360 PolarHBondContact O-N 2.94Å; Y360-G362 PolarHBondContact O-N 3.46Å; Y360-S363 PolarHBondContact O-N 3.22Å; Y360-A364 PolarHBondContact O-N 2.86Å; Y360-A364 VanDerWaalsContact O-N 3.08Å
361L98.5Very high97.9Very high40 Ų4048.3 Ų48.321%0.20925%0.248CC..Hα-helixtrans-62.3-32.6176.2-172.461.4000111.4F357 C358 A364 I365 P380 L383F357-L361 HydrophobicContact CE1-CD2 3.92Å; F357-L361 HydrophobicContact CZ-CD2 4.39Å; F357-L361 WeakPolarHBondContact O-CB 3.32Å; F357-L361 PolarHBondContact O-N 3.25Å; C358-L361 PolarHBondContact O-N 3.31Å; L361-A364 PolarHBondContact O-N 2.84Å; L361-I365 HydrophobicContact CD1-CD1 3.93Å; L361-I365 HydrophobicContact CD1-CG1 4.04Å; L361-I365 HydrophobicContact CD2-CD1 4.18Å; L361-I365 HydrophobicContact CG-CD1 3.7Å; L361-I365 HydrophobicContact CG-CG1 4.19Å; L361-I365 WeakPolarHBondContact O-CB 3.2Å; L361-I365 WeakPolarHBondContact O-CG1 3.4Å; L361-I365 PolarHBondContact O-N 3.34Å; L361-P380 HydrophobicContact CG-CB 4.47Å; L361-L383 HydrophobicContact CD2-CB 3.83Å
362G98.3Very high97.7Very high14 Ų1455.5 Ų55.514%0.14428%0.28CS..Hα-helixtrans-56.9-53.1173.800000112.6C358 A359 Y360 A364 A366 P380C358-G362 WeakPolarHBondContact O-CA 3.38Å; C358-G362 PolarHBondContact O-N 2.99Å; A359-G362 WeakPolarHBondContact O-CA 3.47Å; A359-G362 PolarHBondContact O-N 3.27Å; A359-G362 VanDerWaalsContact O-N 3.16Å; Y360-G362 PolarHBondContact O-N 3.46Å; G362-A364 PolarHBondContact O-N 2.94Å; G362-A366 VanDerWaalsContact O-CB 3.27Å; G362-A366 WeakPolarHBondContact O-CB 3.48Å; G362-A366 PolarHBondContact O-N 3.47Å; G362-P380 VanDerWaalsContact CA-CG 3.48Å
363S97Very high97.5Very high35 Ų3555.2 Ų55.225%0.24529%0.285CS..Hα-helixtrans-60.6-45.3175.7-172.80000112A359 Y360 A366 N367A359-S363 PolarHBondContact O-N 3.28Å; A359-S363 VanDerWaalsContact O-N 3.12Å; Y360-S363 PolarHBondContact O-N 3.22Å; S363-A366 PolarHBondContact O-N 2.9Å; S363-N367 VanDerWaalsContact O-CG 3.25Å; S363-N367 PolarHBondContact O-N 3.47Å; S363-N367 PolarHBondContact O-ND2 2.81Å
364A97.6Very high97.4Very high44 Ų4452.1 Ų52.136%0.36427%0.266SS..Hα-helixtrans-61.3-48.4-179.800000112.4Y360 L361 G362 N367 I368Y360-A364 PolarHBondContact O-N 2.86Å; Y360-A364 VanDerWaalsContact O-N 3.08Å; L361-A364 PolarHBondContact O-N 2.84Å; G362-A364 PolarHBondContact O-N 2.94Å; A364-N367 PolarHBondContact O-N 3.16Å; A364-I368 WeakPolarHBondContact O-CG1 3.26Å; A364-I368 PolarHBondContact O-N 3.06Å; A364-I368 VanDerWaalsContact O-N 3.1Å
365I98.1Very high97.3Very high22 Ų2253 Ų5311%0.11327%0.271CS..Hα-helixtrans-67.4-40.6179.2-68.6176.6000110.8L361 N367 I368 M369 A376 W379 P380 L383L361-I365 HydrophobicContact CD1-CD1 3.93Å; L361-I365 HydrophobicContact CD1-CG1 4.04Å; L361-I365 HydrophobicContact CD2-CD1 4.18Å; L361-I365 HydrophobicContact CG-CD1 3.7Å; L361-I365 HydrophobicContact CG-CG1 4.19Å; L361-I365 WeakPolarHBondContact O-CB 3.2Å; L361-I365 WeakPolarHBondContact O-CG1 3.4Å; L361-I365 PolarHBondContact O-N 3.34Å; I365-N367 VanDerWaalsContact C-N 3.31Å; I365-N367 PolarHBondContact O-N 3.23Å; I365-I368 PolarHBondContact O-N 2.85Å; I365-M369 HydrophobicContact CG2-CG 3.72Å; I365-M369 VanDerWaalsContact O-CB 3.28Å; I365-M369 WeakPolarHBondContact O-CB 3.12Å; I365-M369 WeakPolarHBondContact O-CG 3.34Å; I365-M369 PolarHBondContact O-N 3.18Å; I365-A376 HydrophobicContact CG2-CB 3.98Å; I365-W379 HydrophobicContact CD1-CB 4.23Å; I365-W379 HydrophobicContact CG2-CB 4.16Å; I365-P380 HydrophobicContact CB-CG 4.2Å; I365-P380 HydrophobicContact CD1-CB 4.32Å; I365-P380 HydrophobicContact CD1-CG 4.06Å; I365-P380 HydrophobicContact CG2-CG 4.41Å; I365-L383 HydrophobicContact CD1-CD1 3.75Å
366A97.3Very high97.3Very high39 Ų3953.3 Ų53.332%0.32227%0.274SS..Hα-helixtrans-58.3-44.3176.300000111.7G362 S363 M369 S370 A376G362-A366 VanDerWaalsContact O-CB 3.27Å; G362-A366 WeakPolarHBondContact O-CB 3.48Å; G362-A366 PolarHBondContact O-N 3.47Å; S363-A366 PolarHBondContact O-N 2.9Å; A366-M369 PolarHBondContact O-N 2.93Å; A366-S370 VanDerWaalsContact O-CB 3.31Å; A366-S370 WeakPolarHBondContact O-CB 3.5Å; A366-S370 PolarHBondContact O-N 3.4Å; A366-S370 PolarHBondContact O-OG 3.1Å; A366-A376 HydrophobicContact CB-CB 3.99Å
367N95.8Very high97.2Very high86 Ų8649.9 Ų49.946%0.4626%0.26SS..Hα-helixtrans-62.1-44.8176.6-69.5-25.2000111.8S363 A364 I365 S370S363-N367 VanDerWaalsContact O-CG 3.25Å; S363-N367 PolarHBondContact O-N 3.47Å; S363-N367 PolarHBondContact O-ND2 2.81Å; A364-N367 PolarHBondContact O-N 3.16Å; I365-N367 VanDerWaalsContact C-N 3.31Å; I365-N367 PolarHBondContact O-N 3.23Å; N367-S370 PolarHBondContact O-OG 2.91Å
368I96.9Very high97.2Very high107 Ų10746 Ų4655%0.54924%0.243SC..Hα-helixtrans-64.4-49.7178-67.1166.2000111.1A364 I365 S370 R371A364-I368 WeakPolarHBondContact O-CG1 3.26Å; A364-I368 PolarHBondContact O-N 3.06Å; A364-I368 VanDerWaalsContact O-N 3.1Å; I365-I368 PolarHBondContact O-N 2.85Å; I368-S370 VanDerWaalsContact C-N 3.32Å; I368-S370 PolarHBondContact O-N 2.88Å; I368-R371 VanDerWaalsContact O-CB 3.3Å; I368-R371 WeakPolarHBondContact O-CB 3.39Å; I368-R371 PolarHBondContact O-N 2.93Å; I368-R371 VanDerWaalsContact O-N 3.16Å
369M97.3Very high97.2Very high29 Ų2948.9 Ų48.914%0.14325%0.254CS..Hα-helixtrans-66-34.4-175.5-68.6-67.5-102.800112C224 I365 A366 R371 F372 G373 L374C224-M369 VanDerWaalsContact SG-CE 3.6Å; I365-M369 HydrophobicContact CG2-CG 3.72Å; I365-M369 VanDerWaalsContact O-CB 3.28Å; I365-M369 WeakPolarHBondContact O-CB 3.12Å; I365-M369 WeakPolarHBondContact O-CG 3.34Å; I365-M369 PolarHBondContact O-N 3.18Å; A366-M369 PolarHBondContact O-N 2.93Å; M369-R371 PolarHBondContact O-N 3.41Å; M369-R371 VanDerWaalsContact O-N 3.11Å; M369-F372 WeakPolarHBondContact O-CA 3.4Å; M369-F372 PolarHBondContact O-N 3.43Å; M369-G373 PolarHBondContact O-N 3.27Å; M369-L374 CarbonylContact C-O 3.6Å; M369-L374 HydrophobicContact CB-CB 4Å; M369-L374 WeakPolarHBondContact CB-O 3.45Å; M369-L374 HydrophobicContact CE-CB 4.3Å; M369-L374 HydrophobicContact CE-CD1 3.99Å; M369-L374 PolarHBondContact O-N 2.92Å; M369-L374 HydrophobicContact SD-CB 4.45Å; M369-L374 HydrophobicContact SD-CD1 4.23Å
370S96.4Very high97.2Very high13 Ų1348.7 Ų48.79%0.09125%0.253CS..Hα-helixtrans-58.5-26.517673.80000113.1P244 A366 N367 I368 F372 G373 L374P244-S370 VanDerWaalsContact CA-OG 3.31Å; P244-S370 WeakPolarHBondContact CA-OG 3.34Å; A366-S370 VanDerWaalsContact O-CB 3.31Å; A366-S370 WeakPolarHBondContact O-CB 3.5Å; A366-S370 PolarHBondContact O-N 3.4Å; A366-S370 PolarHBondContact O-OG 3.1Å; N367-S370 PolarHBondContact O-OG 2.91Å; I368-S370 VanDerWaalsContact C-N 3.32Å; I368-S370 PolarHBondContact O-N 2.88Å; S370-F372 PolarHBondContact O-N 3.19Å; S370-G373 PolarHBondContact O-N 3.46Å; S370-L374 PolarHBondContact N-O 3.4Å
371R95.9Very high97.2Very high187 Ų18743 Ų4371%0.70623%0.231SC*.THydrogen-bonded Turntrans-66.3-25.3176.4-164.765-177.7100.8-7.3112.9I368 M369I368-R371 VanDerWaalsContact O-CB 3.3Å; I368-R371 WeakPolarHBondContact O-CB 3.39Å; I368-R371 PolarHBondContact O-N 2.93Å; I368-R371 VanDerWaalsContact O-N 3.16Å; M369-R371 PolarHBondContact O-N 3.41Å; M369-R371 VanDerWaalsContact O-N 3.11Å
372F94.2Very high97.3Very high150 Ų15041.1 Ų41.166%0.65822%0.221SC*.THydrogen-bonded Turntrans-99.36.6175.6-58.4-81000112.6M369 S370 L374M369-F372 WeakPolarHBondContact O-CA 3.4Å; M369-F372 PolarHBondContact O-N 3.43Å; S370-F372 PolarHBondContact O-N 3.19Å; F372-L374 VanDerWaalsContact C-N 3.3Å; F372-L374 HydrophobicContact CB-CD1 4.28Å; F372-L374 HydrophobicContact CB-CG 4.28Å
373G95.4Very high97.3Very high28 Ų2843.8 Ų43.829%0.28923%0.231SC..THydrogen-bonded Turntrans69.826.8-174.700000113.6I242 M369 S370I242-G373 WeakPolarHBondContact O-CA 3.47Å; M369-G373 PolarHBondContact O-N 3.27Å; S370-G373 PolarHBondContact O-N 3.46Å
374L97.4Very high97.4Very high12 Ų1242.1 Ų42.16%0.06322%0.219CC..  trans-111.8147.6-177.5-68.4178.3000112.7C224 M227 V228 M369 S370 F372C224-L374 HydrophobicContact CB-CD1 4.14Å; C224-L374 HydrophobicContact CB-CD2 4.5Å; M227-L374 HydrophobicContact CB-CD2 3.5Å; M227-L374 HydrophobicContact SD-CD2 4.44Å; V228-L374 HydrophobicContact CG2-CD1 3.64Å; V228-L374 HydrophobicContact CG2-CD2 3.79Å; V228-L374 HydrophobicContact CG2-CG 3.97Å; M369-L374 CarbonylContact C-O 3.6Å; M369-L374 HydrophobicContact CB-CB 4Å; M369-L374 WeakPolarHBondContact CB-O 3.45Å; M369-L374 HydrophobicContact CE-CB 4.3Å; M369-L374 HydrophobicContact CE-CD1 3.99Å; M369-L374 PolarHBondContact O-N 2.92Å; M369-L374 HydrophobicContact SD-CB 4.45Å; M369-L374 HydrophobicContact SD-CD1 4.23Å; S370-L374 PolarHBondContact N-O 3.4Å; F372-L374 VanDerWaalsContact C-N 3.3Å; F372-L374 HydrophobicContact CB-CD1 4.28Å; F372-L374 HydrophobicContact CB-CG 4.28Å
375P96.6Very high97.4Very high17 Ų1740 Ų4011%0.1120%0.202CC..  trans-76.1160.6166.633.9-35000110.8F175 M227 I242 C377F175-P375 HydrophobicContact CD2-CG 4.17Å; F175-P375 HydrophobicContact CE1-CB 4.04Å; F175-P375 HydrophobicContact CE1-CG 4.16Å; F175-P375 HydrophobicContact CE2-CB 4.1Å; F175-P375 HydrophobicContact CE2-CG 3.59Å; F175-P375 HydrophobicContact CZ-CB 3.58Å; F175-P375 HydrophobicContact CZ-CG 3.6Å; M227-P375 HydrophobicContact CE-CG 4.26Å; M227-P375 WeakPolarHBondContact SD-CD 3.48Å; M227-P375 HydrophobicContact SD-CG 3.75Å; I242-P375 HydrophobicContact CD1-CB 3.99Å; I242-P375 HydrophobicContact CD1-CG 4.24Å; P375-C377 VanDerWaalsContact C-N 3.25Å; P375-C377 VanDerWaalsContact CG-SG 3.58Å; P375-C377 PolarHBondContact O-N 3.05Å
376A97.2Very high97.4Very high8 Ų840 Ų407%0.06620%0.202CC..  trans-69.5-24.9171.700000112.9I365 A366 T378 W379 P380I365-A376 HydrophobicContact CG2-CB 3.98Å; A366-A376 HydrophobicContact CB-CB 3.99Å; A376-T378 PolarHBondContact O-N 3.3Å; A376-W379 WeakPolarHBondContact O-CB 3.28Å; A376-W379 PolarHBondContact O-N 2.85Å; A376-P380 HydrophobicContact CB-CG 4.2Å
377C97.3Very high97.5Very high8 Ų841.9 Ų41.95%0.05421%0.209CC..THydrogen-bonded Turntrans45.5-134.2-169.9-720000110.2F219 N220 Y327 N328 P375F219-C377 HydrophobicContact CE1-CB 3.84Å; F219-C377 HydrophobicContact CZ-CB 3.88Å; N220-C377 WeakPolarHBondContact OD1-CB 3.36Å; Y327-C377 WeakPolarHBondContact CE2-O 3.38Å; Y327-C377 PolarHBondContact OH-O 3.19Å; N328-C377 PolarHBondContact ND2-O 3.49Å; N328-C377 VanDerWaalsContact ND2-O 3.1Å; P375-C377 VanDerWaalsContact C-N 3.25Å; P375-C377 VanDerWaalsContact CG-SG 3.58Å; P375-C377 PolarHBondContact O-N 3.05Å
378T98.5Very high97.6Very high4 Ų439 Ų393%0.02519%0.193CC..THydrogen-bonded Turntrans-106.619.9178.456.70000113.5T216 F219 N220 Y327 N328 L331 A376 P380 F381 C382T216-T378 WeakPolarHBondContact CB-OG1 3.48Å; T216-T378 PolarHBondContact OG1-OG1 3.13Å; F219-T378 HydrophobicContact CE1-CG2 4.42Å; F219-T378 VanDerWaalsContact CE1-OG1 3.3Å; F219-T378 WeakPolarHBondContact CE1-OG1 3.45Å; N220-T378 PolarHBondContact ND2-OG1 3.41Å; N220-T378 WeakPolarHBondContact OD1-CA 3.48Å; N220-T378 PolarHBondContact OD1-N 2.94Å; N220-T378 PolarHBondContact OD1-OG1 2.9Å; Y327-T378 HydrophobicContact CD2-CG2 3.99Å; Y327-T378 HydrophobicContact CE2-CG2 3.81Å; N328-T378 VanDerWaalsContact OD1-CA 3.27Å; N328-T378 WeakPolarHBondContact OD1-CA 3.41Å; L331-T378 HydrophobicContact CD1-CG2 3.86Å; A376-T378 PolarHBondContact O-N 3.3Å; T378-P380 VanDerWaalsContact C-N 3.31Å; T378-F381 PolarHBondContact O-N 3.49Å; T378-C382 PolarHBondContact O-N 3.13Å; T378-C382 PolarHBondContact O-SG 3Å
379W98.8Very high97.6Very high61 Ų6134.1 Ų34.123%0.23117%0.168CC..Hα-helixtrans-51.6-44.7168.2-79.4109.3000112.8L217 N220 I221 I365 A376 F381 C382 L383L217-W379 HydrophobicContact CD2-CE3 3.89Å; L217-W379 HydrophobicContact CD2-CH2 4.24Å; L217-W379 HydrophobicContact CD2-CZ3 3.51Å; N220-W379 HydrophobicContact CB-CD2 3.97Å; N220-W379 HydrophobicContact CB-CG 4.15Å; N220-W379 HydrophobicContact CB-CZ2 4.04Å; N220-W379 PolarHBondContact OD1-N 3.35Å; N220-W379 VanDerWaalsContact OD1-N 3.09Å; I221-W379 HydrophobicContact CD1-CH2 4.49Å; I221-W379 HydrophobicContact CG1-CH2 3.8Å; I221-W379 HydrophobicContact CG1-CZ2 3.83Å; I365-W379 HydrophobicContact CD1-CB 4.23Å; I365-W379 HydrophobicContact CG2-CB 4.16Å; A376-W379 WeakPolarHBondContact O-CB 3.28Å; A376-W379 PolarHBondContact O-N 2.85Å; W379-F381 VanDerWaalsContact C-N 3.35Å; W379-F381 PolarHBondContact O-N 3.43Å; W379-C382 PolarHBondContact O-N 3.24Å; W379-L383 WeakPolarHBondContact O-CG 3.47Å; W379-L383 PolarHBondContact O-N 2.91Å
380P98.8Very high97.6Very high0 Ų037 Ų370%018%0.184CC..Hα-helixtrans-59.7-43.9179-21.431.9000112.8N328 C358 L361 G362 I365 A376 T378 S384N328-P380 HydrophobicContact CB-CB 4.22Å; N328-P380 WeakPolarHBondContact OD1-CD 3.4Å; C358-P380 VanDerWaalsContact SG-C 3.55Å; C358-P380 PolarHBondContact SG-O 3.32Å; L361-P380 HydrophobicContact CG-CB 4.47Å; G362-P380 VanDerWaalsContact CA-CG 3.48Å; I365-P380 HydrophobicContact CB-CG 4.2Å; I365-P380 HydrophobicContact CD1-CB 4.32Å; I365-P380 HydrophobicContact CD1-CG 4.06Å; I365-P380 HydrophobicContact CG2-CG 4.41Å; A376-P380 HydrophobicContact CB-CG 4.2Å; T378-P380 VanDerWaalsContact C-N 3.31Å; P380-S384 WeakPolarHBondContact O-CB 3.47Å; P380-S384 PolarHBondContact O-N 3Å; P380-S384 PolarHBondContact O-OG 2.96Å
381F98.8Very high97.5Very high0 Ų040.3 Ų40.30%020%0.2CC..Hα-helixtrans-58.4-54.7174.1149.3-111.5000111.3F110 F215 T216 N328 L331 A332 A335 C358 T378 W379 L383 S384 A385F110-F381 HydrophobicContact CE1-CZ 4.12Å; F110-F381 HydrophobicContact CZ-CE1 4.43Å; F110-F381 AromaticContact CZ-CE2 3.8Å; F110-F381 HydrophobicContact CZ-CE2 3.8Å; F110-F381 AromaticContact CZ-CZ 3.47Å; F110-F381 HydrophobicContact CZ-CZ 3.47Å; F110-F381 VanDerWaalsContact CZ-CZ 3.47Å; F215-F381 HydrophobicContact CB-CE1 3.81Å; F215-F381 HydrophobicContact CB-CZ 3.86Å; F215-F381 HydrophobicContact CD1-CE1 4.38Å; F215-F381 HydrophobicContact CD1-CE2 4.45Å; F215-F381 AromaticContact CD1-CZ 3.6Å; F215-F381 HydrophobicContact CD1-CZ 3.6Å; F215-F381 HydrophobicContact CD2-CZ 4.11Å; F215-F381 HydrophobicContact CE1-CE2 4.44Å; F215-F381 AromaticContact CE1-CZ 3.99Å; F215-F381 HydrophobicContact CE1-CZ 3.99Å; F215-F381 HydrophobicContact CG-CE1 4.11Å; F215-F381 AromaticContact CG-CZ 3.63Å; F215-F381 HydrophobicContact CG-CZ 3.63Å; F215-F381 HydrophobicContact CZ-CZ 4.42Å; T216-F381 HydrophobicContact CG2-CE1 4.32Å; N328-F381 HydrophobicContact CB-CB 4.3Å; N328-F381 VanDerWaalsContact OD1-CB 3.23Å; N328-F381 WeakPolarHBondContact OD1-CB 3.26Å; N328-F381 PolarHBondContact OD1-N 3.33Å; L331-F381 HydrophobicContact CB-CB 4.11Å; L331-F381 HydrophobicContact CB-CD1 3.96Å; L331-F381 HydrophobicContact CB-CD2 3.33Å; L331-F381 HydrophobicContact CB-CE1 4.27Å; L331-F381 HydrophobicContact CB-CE2 3.73Å; L331-F381 HydrophobicContact CB-CG 3.47Å; L331-F381 VanDerWaalsContact CB-CG 3.47Å; L331-F381 HydrophobicContact CB-CZ 4.2Å; L331-F381 HydrophobicContact CD1-CB 4.34Å; L331-F381 HydrophobicContact CD1-CD1 3.6Å; L331-F381 HydrophobicContact CD1-CE1 4.05Å; L331-F381 HydrophobicContact CD1-CG 3.86Å; L331-F381 HydrophobicContact CG-CD1 4.43Å; L331-F381 HydrophobicContact CG-CG 4.34Å; A332-F381 HydrophobicContact CB-CD2 4.32Å; A335-F381 HydrophobicContact CB-CE2 4.22Å; C358-F381 VanDerWaalsContact SG-CA 3.52Å; T378-F381 PolarHBondContact O-N 3.49Å; W379-F381 VanDerWaalsContact C-N 3.35Å; W379-F381 PolarHBondContact O-N 3.43Å; F381-L383 VanDerWaalsContact C-N 3.34Å; F381-L383 PolarHBondContact O-N 2.95Å; F381-S384 PolarHBondContact O-N 3.35Å; F381-A385 HydrophobicContact CD2-CB 4.08Å; F381-A385 HydrophobicContact CE2-CB 3.69Å; F381-A385 WeakPolarHBondContact O-CB 3.4Å; F381-A385 PolarHBondContact O-N 3.47Å
382C98.8Very high97.4Very high0 Ų037.7 Ų37.70%021%0.205CC..Hα-helixtrans-56.7-48.6-175.8-72.10000111.6T216 L217 T378 W379 L386T216-C382 PolarHBondContact OG1-SG 2.78Å; L217-C382 HydrophobicContact CD2-CB 3.56Å; L217-C382 HydrophobicContact CG-CB 3.96Å; T378-C382 PolarHBondContact O-N 3.13Å; T378-C382 PolarHBondContact O-SG 3Å; W379-C382 PolarHBondContact O-N 3.24Å; C382-L386 VanDerWaalsContact O-CB 3.31Å; C382-L386 WeakPolarHBondContact O-CB 3.29Å; C382-L386 WeakPolarHBondContact O-CD1 3.24Å; C382-L386 WeakPolarHBondContact O-CG 3.35Å; C382-L386 PolarHBondContact O-N 3.43Å
383L98.7Very high97.2Very high69 Ų6933.8 Ų33.836%0.36119%0.193SC..Hα-helixtrans-68-38.6-178.3-65176.6000112L361 I365 W379 F381 T387L361-L383 HydrophobicContact CD2-CB 3.83Å; I365-L383 HydrophobicContact CD1-CD1 3.75Å; W379-L383 WeakPolarHBondContact O-CG 3.47Å; W379-L383 PolarHBondContact O-N 2.91Å; F381-L383 VanDerWaalsContact C-N 3.34Å; F381-L383 PolarHBondContact O-N 2.95Å; L383-T387 VanDerWaalsContact O-CB 3.31Å; L383-T387 WeakPolarHBondContact O-CB 3.47Å; L383-T387 PolarHBondContact O-N 3.23Å; L383-T387 PolarHBondContact O-OG1 2.86Å
384S98.8Very high96.9Very high0 Ų036.3 Ų36.30%022%0.219CC..Hα-helixtrans-65.2-52.7176.7-58.10000111.6F357 C358 P380 F381 L386 T387 F388F357-S384 WeakPolarHBondContact CD1-OG 3.26Å; C358-S384 VanDerWaalsContact CA-OG 3.29Å; C358-S384 WeakPolarHBondContact CA-OG 3.48Å; C358-S384 WeakPolarHBondContact CB-OG 3.31Å; P380-S384 WeakPolarHBondContact O-CB 3.47Å; P380-S384 PolarHBondContact O-N 3Å; P380-S384 PolarHBondContact O-OG 2.96Å; F381-S384 PolarHBondContact O-N 3.35Å; S384-L386 VanDerWaalsContact C-N 3.35Å; S384-L386 PolarHBondContact O-N 2.92Å; S384-T387 PolarHBondContact O-N 3.04Å; S384-F388 VanDerWaalsContact O-CD2 3.28Å; S384-F388 WeakPolarHBondContact O-CD2 3.46Å; S384-F388 PolarHBondContact O-N 3.38Å
385A98.6Very high96.5Very high0 Ų037.8 Ų37.80%023%0.231CC..Hα-helixtrans-63.8-39.5-178.200000111.8F215 A335 F381 F388 L389F215-A385 HydrophobicContact CD2-CB 4.26Å; F215-A385 HydrophobicContact CE2-CB 3.42Å; F215-A385 VanDerWaalsContact CE2-CB 3.42Å; F215-A385 HydrophobicContact CZ-CB 3.61Å; A335-A385 HydrophobicContact CB-CB 4.21Å; F381-A385 HydrophobicContact CD2-CB 4.08Å; F381-A385 HydrophobicContact CE2-CB 3.69Å; F381-A385 WeakPolarHBondContact O-CB 3.4Å; F381-A385 PolarHBondContact O-N 3.47Å; A385-F388 PolarHBondContact O-N 2.66Å; A385-L389 WeakPolarHBondContact O-CB 3.28Å; A385-L389 VanDerWaalsContact O-CG 3.26Å; A385-L389 WeakPolarHBondContact O-CG 3.45Å; A385-L389 PolarHBondContact O-N 2.88Å
386L98.4Very high95.9Very high23 Ų2345.1 Ų45.112%0.1226%0.261CS..Hα-helixtrans-64.7-43.3175-71.5170.2000112L212 F215 L217 C382 S384 F388 L389 L390L212-L386 HydrophobicContact CB-CD2 4.06Å; L212-L386 HydrophobicContact CD1-CD2 4.05Å; L212-L386 HydrophobicContact CD2-CD2 4.37Å; L212-L386 HydrophobicContact CG-CD2 4.4Å; F215-L386 HydrophobicContact CD2-CD2 3.96Å; F215-L386 HydrophobicContact CD2-CG 3.84Å; F215-L386 HydrophobicContact CE2-CD2 3.84Å; F215-L386 HydrophobicContact CE2-CG 3.85Å; L217-L386 HydrophobicContact CD1-CD1 4Å; C382-L386 VanDerWaalsContact O-CB 3.31Å; C382-L386 WeakPolarHBondContact O-CB 3.29Å; C382-L386 WeakPolarHBondContact O-CD1 3.24Å; C382-L386 WeakPolarHBondContact O-CG 3.35Å; C382-L386 PolarHBondContact O-N 3.43Å; S384-L386 VanDerWaalsContact C-N 3.35Å; S384-L386 PolarHBondContact O-N 2.92Å; L386-F388 VanDerWaalsContact C-N 3.31Å; L386-F388 PolarHBondContact O-N 3.48Å; L386-L389 PolarHBondContact O-N 2.94Å; L386-L390 WeakPolarHBondContact O-CB 3.24Å; L386-L390 WeakPolarHBondContact O-CG 3.38Å; L386-L390 PolarHBondContact O-N 2.89Å
387T98.1Very high95.6Very high77 Ų7751.3 Ų51.347%0.47228%0.283SS..Hα-helixtrans-58.3-46.2176.4-60.70000110.6L383 S384 L390 L391L383-T387 VanDerWaalsContact O-CB 3.31Å; L383-T387 WeakPolarHBondContact O-CB 3.47Å; L383-T387 PolarHBondContact O-N 3.23Å; L383-T387 PolarHBondContact O-OG1 2.86Å; S384-T387 PolarHBondContact O-N 3.04Å; T387-L390 PolarHBondContact O-N 3.44Å; T387-L391 PolarHBondContact O-N 3.44Å
388F98.2Very high95.5Very high26 Ų2652.7 Ų52.711%0.11429%0.289CS..Hα-helixtrans-72-31-179.9-82.7-113.3000112.6V336 Y341 L350 T353 C354 F357 S384 A385 L386 L390 L391V336-F388 HydrophobicContact CG2-CB 4.16Å; Y341-F388 PolarHBondContact OH-O 3.1Å; L350-F388 HydrophobicContact CD1-CD1 3.71Å; L350-F388 HydrophobicContact CD1-CE1 3.77Å; L350-F388 HydrophobicContact CG-CD1 3.98Å; L350-F388 HydrophobicContact CG-CE1 4.37Å; T353-F388 HydrophobicContact CG2-CE1 4.16Å; T353-F388 HydrophobicContact CG2-CZ 4.19Å; C354-F388 HydrophobicContact CB-CD1 3.59Å; C354-F388 HydrophobicContact CB-CD2 4.23Å; C354-F388 HydrophobicContact CB-CE1 3.67Å; C354-F388 HydrophobicContact CB-CE2 4.31Å; C354-F388 HydrophobicContact CB-CG 3.88Å; C354-F388 HydrophobicContact CB-CZ 4.04Å; F357-F388 HydrophobicContact CB-CE2 3.97Å; F357-F388 HydrophobicContact CB-CZ 4.1Å; F357-F388 HydrophobicContact CD1-CD2 4.49Å; F357-F388 AromaticContact CD1-CE2 3.79Å; F357-F388 HydrophobicContact CD1-CE2 3.79Å; F357-F388 HydrophobicContact CE1-CE2 4.46Å; F357-F388 AromaticContact CG-CE2 3.85Å; F357-F388 HydrophobicContact CG-CE2 3.85Å; F357-F388 HydrophobicContact CG-CZ 4.4Å; S384-F388 VanDerWaalsContact O-CD2 3.28Å; S384-F388 WeakPolarHBondContact O-CD2 3.46Å; S384-F388 PolarHBondContact O-N 3.38Å; A385-F388 PolarHBondContact O-N 2.66Å; L386-F388 VanDerWaalsContact C-N 3.31Å; L386-F388 PolarHBondContact O-N 3.48Å; F388-L390 VanDerWaalsContact C-N 3.29Å; F388-L391 WeakPolarHBondContact O-CB 3.4Å; F388-L391 PolarHBondContact O-N 2.87Å
389L97.6Very high95.3Very high4 Ų455 Ų552%0.02130%0.298CS..Hα-helixtrans-74.8-17.6173.9-76.2171.6000114.3L212 P213 F215 F340 Y341 A385 L386 K400L212-L389 HydrophobicContact CD2-CB 3.53Å; L212-L389 HydrophobicContact CD2-CD1 4.31Å; P213-L389 HydrophobicContact CG-CD1 4.16Å; F215-L389 HydrophobicContact CE2-CD1 4.01Å; F215-L389 HydrophobicContact CZ-CD1 3.55Å; F340-L389 HydrophobicContact CB-CD1 4.23Å; F340-L389 HydrophobicContact CB-CD2 3.45Å; F340-L389 VanDerWaalsContact CB-CD2 3.45Å; F340-L389 HydrophobicContact CB-CG 4.43Å; F340-L389 HydrophobicContact CD2-CD1 4.49Å; F340-L389 HydrophobicContact CG-CD1 4.23Å; F340-L389 HydrophobicContact CG-CD2 4.32Å; Y341-L389 HydrophobicContact CD2-CD2 3.95Å; Y341-L389 HydrophobicContact CE2-CD2 3.46Å; Y341-L389 VanDerWaalsContact CE2-CD2 3.46Å; Y341-L389 HydrophobicContact CE2-CG 4.33Å; A385-L389 WeakPolarHBondContact O-CB 3.28Å; A385-L389 VanDerWaalsContact O-CG 3.26Å; A385-L389 WeakPolarHBondContact O-CG 3.45Å; A385-L389 PolarHBondContact O-N 2.88Å; L386-L389 PolarHBondContact O-N 2.94Å; L389-K400 HydrophobicContact CD2-CD 4.43Å; L389-K400 HydrophobicContact CD2-CG 4.33Å
390L96.8Very high95.2Very high91 Ų9154.6 Ų54.648%0.47630%0.299SS..THydrogen-bonded Turntrans-87.5-7.5171.7-78.1167.9000112.7W210 L212 L386 T387 F388 T392W210-L390 HydrophobicContact CB-CD2 4.2Å; W210-L390 HydrophobicContact CG-CD2 4.26Å; L212-L390 HydrophobicContact CD1-CD1 4.1Å; L212-L390 HydrophobicContact CD1-CD2 3.8Å; L212-L390 HydrophobicContact CD1-CG 3.82Å; L212-L390 HydrophobicContact CD2-CG 4.49Å; L386-L390 WeakPolarHBondContact O-CB 3.24Å; L386-L390 WeakPolarHBondContact O-CG 3.38Å; L386-L390 PolarHBondContact O-N 2.89Å; T387-L390 PolarHBondContact O-N 3.44Å; F388-L390 VanDerWaalsContact C-N 3.29Å; L390-T392 PolarHBondContact O-N 3.07Å
391L95.3Very high95.1Very high81 Ų8154.7 Ų54.742%0.42430%0.299SS..  trans-59.8121.9177.1179.265.7000110.5L350 T387 F388L350-L391 HydrophobicContact CD1-CD2 3.98Å; L350-L391 HydrophobicContact CD2-CD2 4.26Å; T387-L391 PolarHBondContact O-N 3.44Å; F388-L391 WeakPolarHBondContact O-CB 3.4Å; F388-L391 PolarHBondContact O-N 2.87Å
392T92.5Very high94.9Very high132 Ų13257.1 Ų57.181%0.8132%0.315SS*.  trans-98.1140.7169.4590000109.8L390L390-T392 PolarHBondContact O-N 3.07Å
393T90.9Very high94.7Very high68 Ų6859.1 Ų59.142%0.41733%0.325SS..  trans-150.2145.1-178179.20000111.1S395 I398T393-S395 PolarHBondContact O-N 3.12Å; T393-S395 PolarHBondContact OG1-N 3.46Å; T393-I398 HydrophobicContact CG2-CB 3.77Å; T393-I398 HydrophobicContact CG2-CD1 4.24Å; T393-I398 HydrophobicContact CG2-CG2 3.88Å
394G88.6Confident94.4Very high81 Ų8160.6 Ų60.684%0.83535%0.347SS*.SBendtrans-73.8-8.9172.700000113.7K396G394-K396 PolarHBondContact O-N 3.04Å
395S88.9Confident94.1Very high44 Ų4463.9 Ų63.931%0.30837%0.365SS..  trans-78.5115-178.7-1790000112.1T393 R397 I398T393-S395 PolarHBondContact O-N 3.12Å; T393-S395 PolarHBondContact OG1-N 3.46Å; S395-R397 PolarHBondContact O-N 3.3Å; S395-R397 PolarHBondContact OG-N 3.36Å; S395-I398 PolarHBondContact O-N 3.28Å
396K85.1Confident94Very high170 Ų17065.5 Ų65.574%0.73938%0.375SS*.THydrogen-bonded Turntrans-65.7-4.6174.5-59.4-175.2-179.2-176.20114.5G394 Y416G394-K396 PolarHBondContact O-N 3.04Å; K396-Y416 PolarHBondContact O-OH 3.43Å
397R89.9Confident93.9Very high139 Ų13965.9 Ų65.953%0.52538%0.378SS..THydrogen-bonded Turntrans-92.8-16.9179.3-61.3-175.7-178.5169.9-1113.1T344 Q346 S395T344-R397 WeakPolarHBondContact CG2-O 3.34Å; T344-R397 PolarHBondContact OG1-O 2.98Å; Q346-R397 HydrophobicContact CG-CB 4.33Å; S395-R397 PolarHBondContact O-N 3.3Å; S395-R397 PolarHBondContact OG-N 3.36Å
398I95.1Very high93.9Very high37 Ų3764.8 Ų64.819%0.1937%0.366CS..SBendtrans-99.895170.9-62.7172.7000106Y341 Q346 V347 L350 T393 S395Y341-I398 HydrophobicContact CD1-CG2 3.81Å; Y341-I398 HydrophobicContact CE1-CG2 3.52Å; Q346-I398 HydrophobicContact CB-CD1 4.49Å; Q346-I398 HydrophobicContact CB-CG1 3.97Å; V347-I398 HydrophobicContact CG2-CB 4.48Å; V347-I398 HydrophobicContact CG2-CG1 4.39Å; V347-I398 HydrophobicContact CG2-CG2 4.42Å; L350-I398 HydrophobicContact CD2-CG2 4.05Å; T393-I398 HydrophobicContact CG2-CB 3.77Å; T393-I398 HydrophobicContact CG2-CD1 4.24Å; T393-I398 HydrophobicContact CG2-CG2 3.88Å; S395-I398 PolarHBondContact O-N 3.28Å
399F95.3Very high93.9Very high51 Ų5163.6 Ų63.622%0.22436%0.36CS..  trans-114.3108.5-173.4-178.5-93.9000110Y341 A342 Y416 L419Y341-F399 CarbonylContact C-O 3.29Å; Y341-F399 WeakPolarHBondContact CA-O 3.18Å; Y341-F399 VanDerWaalsContact CD1-C 3.45Å; Y341-F399 WeakPolarHBondContact CD1-O 3.42Å; A342-F399 HydrophobicContact CB-CB 4.38Å; A342-F399 HydrophobicContact CB-CD1 4.15Å; A342-F399 PolarHBondContact N-O 3.06Å; F399-Y416 HydrophobicContact CB-CD2 3.91Å; F399-Y416 HydrophobicContact CB-CE2 3.6Å; F399-Y416 AromaticContact CD1-CD2 3.67Å; F399-Y416 HydrophobicContact CD1-CD2 3.67Å; F399-Y416 HydrophobicContact CD1-CE2 4.2Å; F399-Y416 HydrophobicContact CD2-CE2 4.38Å; F399-Y416 HydrophobicContact CE1-CD2 4.32Å; F399-Y416 AromaticContact CG-CD2 3.77Å; F399-Y416 HydrophobicContact CG-CD2 3.77Å; F399-Y416 AromaticContact CG-CE2 3.81Å; F399-Y416 HydrophobicContact CG-CE2 3.81Å; F399-L419 HydrophobicContact CE1-CD1 4.29Å; F399-L419 HydrophobicContact CZ-CD1 3.96Å
400K96.5Very high93.9Very high54 Ų5466.1 Ų66.124%0.23537%0.372CS..BIsolated β-bridgetrans-70.6129.7171.3-178.6-177.1170.2-174.40108.6W210 D211 Y341 L389W210-K400 PolarHBondContact O-NZ 2.92Å; D211-K400 VanDerWaalsContact O-CE 3.3Å; D211-K400 WeakPolarHBondContact O-CE 3.43Å; D211-K400 PolarHBondContact O-NZ 2.89Å; Y341-K400 HydrophobicContact CD1-CB 4.15Å; Y341-K400 HydrophobicContact CE1-CB 3.72Å; L389-K400 HydrophobicContact CD2-CD 4.43Å; L389-K400 HydrophobicContact CD2-CG 4.33Å
401L95.7Very high93.9Very high1 Ų165.3 Ų65.31%0.00537%0.365CS..PPolyproline II helixtrans-76.5140.4175.4-72.8118.5000110.3F340 A342 L403 V406 N412 F415F340-L401 PolarHBondContact O-N 3.47Å; A342-L401 HydrophobicContact CB-CD1 4.48Å; A342-L401 VanDerWaalsContact N-CD1 3.35Å; L401-L403 PolarHBondContact O-N 3.34Å; L401-V406 HydrophobicContact CB-CG2 3.86Å; L401-N412 HydrophobicContact CD1-CB 3.92Å; L401-N412 HydrophobicContact CD2-CB 3.76Å; L401-F415 HydrophobicContact CD2-CD1 3.84Å; L401-F415 HydrophobicContact CD2-CE1 4.37Å
402P95.1Very high94Very high51 Ų5161.5 Ų61.533%0.33135%0.345SS..PPolyproline II helixtrans-59.5132.5164.8-2031.9000109.9D211 A404 N405 V406D211-P402 VanDerWaalsContact OD2-CA 3.28Å; D211-P402 WeakPolarHBondContact OD2-CA 3.5Å; P402-A404 PolarHBondContact O-N 3.32Å; P402-A404 VanDerWaalsContact O-N 3.14Å; P402-N405 PolarHBondContact O-N 3.47Å; P402-V406 PolarHBondContact O-N 3.35Å
403L93.6Very high94.2Very high43 Ų4357 Ų5723%0.22532%0.316CS..G310 helixtrans-57.3-35.3-173.9-71.4-179.9000113.8D211 L212 P213 F340 L401 N405 V406D211-L403 WeakPolarHBondContact O-CD1 3.28Å; D211-L403 VanDerWaalsContact OD1-CB 3.32Å; D211-L403 WeakPolarHBondContact OD1-CB 3.32Å; D211-L403 WeakPolarHBondContact OD1-CD1 3.39Å; D211-L403 WeakPolarHBondContact OD1-CG 3.12Å; D211-L403 PolarHBondContact OD2-N 3.47Å; L212-L403 VanDerWaalsContact C-CD1 3.4Å; P213-L403 HydrophobicContact CB-CD2 4.49Å; F340-L403 HydrophobicContact CD1-CD2 3.63Å; F340-L403 HydrophobicContact CE1-CD2 3.65Å; L401-L403 PolarHBondContact O-N 3.34Å; L403-N405 PolarHBondContact O-N 2.8Å; L403-N405 VanDerWaalsContact O-N 3.1Å; L403-V406 HydrophobicContact CD2-CG2 4.39Å; L403-V406 PolarHBondContact O-N 3.48Å; L403-V406 VanDerWaalsContact O-N 3.11Å
404A92.8Very high94.4Very high99 Ų9956.6 Ų56.682%0.81832%0.319SS*.G310 helixtrans-60.4-19.4177.700000113.9P402P402-A404 PolarHBondContact O-N 3.32Å; P402-A404 VanDerWaalsContact O-N 3.14Å
405N93.7Very high94.7Very high69 Ų6955.5 Ų55.537%0.36929%0.291SS..G310 helixtrans-106.6-0.7-179.9-63.9-38.9000113.2P402 L403 T407 F415P402-N405 PolarHBondContact O-N 3.47Å; L403-N405 PolarHBondContact O-N 2.8Å; L403-N405 VanDerWaalsContact O-N 3.1Å; N405-T407 PolarHBondContact O-N 2.89Å; N405-F415 HydrophobicContact CB-CE1 4.13Å; N405-F415 HydrophobicContact CB-CZ 4.12Å; N405-F415 WeakPolarHBondContact ND2-CZ 3.43Å
406V96.7Very high95Very high35 Ų3554 Ų5421%0.21228%0.279CS..  trans-71.9125.2179.6172.50000109.5M339 F340 L401 P402 L403M339-V406 WeakPolarHBondContact O-CG1 3.08Å; F340-V406 HydrophobicContact CD1-CG1 4.29Å; F340-V406 HydrophobicContact CD1-CG2 4.08Å; F340-V406 HydrophobicContact CE1-CG1 4.16Å; L401-V406 HydrophobicContact CB-CG2 3.86Å; P402-V406 PolarHBondContact O-N 3.35Å; L403-V406 HydrophobicContact CD2-CG2 4.39Å; L403-V406 PolarHBondContact O-N 3.48Å; L403-V406 VanDerWaalsContact O-N 3.11Å
407T95.9Very high95.5Very high30 Ų3053 Ų5318%0.18427%0.271CS..  trans-128.5-102.7173.4510000108.4D80 M339 N405 K411 N412D80-T407 WeakPolarHBondContact OD2-CB 3.3Å; M339-T407 WeakPolarHBondContact CE-O 3.36Å; N405-T407 PolarHBondContact O-N 2.89Å; T407-K411 HydrophobicContact CG2-CD 4.22Å; T407-K411 WeakPolarHBondContact OG1-CB 3.48Å; T407-K411 WeakPolarHBondContact OG1-CD 3.43Å; T407-K411 WeakPolarHBondContact OG1-CG 3.5Å; T407-N412 PolarHBondContact N-OD1 3.49Å; T407-N412 PolarHBondContact OG1-OD1 3.15Å; T407-N412 VanDerWaalsContact OG1-OD1 3.07Å
408Y97.4Very high95.8Very high55 Ų5552.8 Ų52.822%0.21627%0.274CS..  trans-128.2158.7175.259.9-86.6000110.4E410 K411 N412Y408-E410 VanDerWaalsContact C-N 3.35Å; Y408-E410 HydrophobicContact CD2-CB 3.97Å; Y408-E410 WeakPolarHBondContact CD2-OE2 3.18Å; Y408-E410 HydrophobicContact CE2-CB 3.83Å; Y408-E410 PolarHBondContact O-N 3.29Å; Y408-K411 HydrophobicContact CD1-CB 4.11Å; Y408-K411 HydrophobicContact CD1-CD 4.49Å; Y408-K411 HydrophobicContact CD2-CB 4.14Å; Y408-K411 HydrophobicContact CE1-CB 3.72Å; Y408-K411 HydrophobicContact CE1-CD 3.77Å; Y408-K411 HydrophobicContact CE1-CG 4.4Å; Y408-K411 HydrophobicContact CE2-CB 3.77Å; Y408-K411 HydrophobicContact CG-CB 4.31Å; Y408-K411 PolarHBondContact O-N 2.86Å; Y408-N412 WeakPolarHBondContact O-CB 3.37Å; Y408-N412 PolarHBondContact O-N 3.39Å; Y408-N412 PolarHBondContact O-ND2 3.33Å; Y408-N412 PolarHBondContact O-OD1 2.86Å
409P98.3Very high95.6Very high0 Ų053.2 Ų53.20%028%0.276CS..Hα-helixtrans-57.8-39.5-163.9-28.137.9000115.2S292 I294 T295 G338 M339 K411 N412 L413S292-P409 WeakPolarHBondContact OG-CD 3.43Å; I294-P409 HydrophobicContact CB-CB 3.77Å; I294-P409 HydrophobicContact CB-CG 4.2Å; I294-P409 HydrophobicContact CD1-CB 4.12Å; I294-P409 HydrophobicContact CG2-CB 3.43Å; I294-P409 VanDerWaalsContact CG2-CB 3.43Å; I294-P409 HydrophobicContact CG2-CG 3.89Å; T295-P409 WeakPolarHBondContact OG1-CD 3.28Å; T295-P409 WeakPolarHBondContact OG1-CG 3.32Å; G338-P409 WeakPolarHBondContact O-CA 3.31Å; M339-P409 HydrophobicContact CG-CG 4.34Å; M339-P409 WeakPolarHBondContact SD-CD 3.35Å; M339-P409 HydrophobicContact SD-CG 3.49Å; M339-P409 WeakPolarHBondContact SD-CG 3.16Å; P409-K411 PolarHBondContact O-N 3.18Å; P409-N412 PolarHBondContact O-N 3.32Å; P409-L413 VanDerWaalsContact O-CB 3.23Å; P409-L413 WeakPolarHBondContact O-CB 3.31Å; P409-L413 PolarHBondContact O-N 3.47Å
410E97.4Very high95.5Very high58 Ų5852.4 Ų52.427%0.27127%0.272SS..Hα-helixtrans-63.1-43178.9-66.578.6177.700111.1S292 P293 I294 Y408 A414S292-E410 WeakPolarHBondContact CB-OE2 3.34Å; S292-E410 PolarHBondContact OG-OE1 2.93Å; S292-E410 PolarHBondContact OG-OE2 3.4Å; P293-E410 VanDerWaalsContact CD-OE1 3.3Å; P293-E410 WeakPolarHBondContact CD-OE1 3.38Å; I294-E410 WeakPolarHBondContact CB-OE1 3.17Å; I294-E410 HydrophobicContact CD1-CG 3.72Å; I294-E410 HydrophobicContact CG1-CG 4.28Å; I294-E410 VanDerWaalsContact CG1-OE1 3.32Å; I294-E410 WeakPolarHBondContact CG1-OE1 3.25Å; I294-E410 PolarHBondContact N-OE1 3.41Å; Y408-E410 VanDerWaalsContact C-N 3.35Å; Y408-E410 HydrophobicContact CD2-CB 3.97Å; Y408-E410 WeakPolarHBondContact CD2-OE2 3.18Å; Y408-E410 HydrophobicContact CE2-CB 3.83Å; Y408-E410 PolarHBondContact O-N 3.29Å; E410-A414 PolarHBondContact O-N 3.24Å; E410-A414 VanDerWaalsContact O-N 3.08Å
411K96.3Very high95.4Very high74 Ų7457.6 Ų57.632%0.32230%0.295SS..Hα-helixtrans-74.7-37.6177.8-177.2169.2175.2174.40112E82 T407 Y408 P409 L413 A414 F415E82-K411 IonicContact OE1-NZ 2.67Å; E82-K411 PolarHBondContact OE1-NZ 2.94Å; E82-K411 IonicContact OE2-NZ 2.7Å; T407-K411 HydrophobicContact CG2-CD 4.22Å; T407-K411 WeakPolarHBondContact OG1-CB 3.48Å; T407-K411 WeakPolarHBondContact OG1-CD 3.43Å; T407-K411 WeakPolarHBondContact OG1-CG 3.5Å; Y408-K411 HydrophobicContact CD1-CB 4.11Å; Y408-K411 HydrophobicContact CD1-CD 4.49Å; Y408-K411 HydrophobicContact CD2-CB 4.14Å; Y408-K411 HydrophobicContact CE1-CB 3.72Å; Y408-K411 HydrophobicContact CE1-CD 3.77Å; Y408-K411 HydrophobicContact CE1-CG 4.4Å; Y408-K411 HydrophobicContact CE2-CB 3.77Å; Y408-K411 HydrophobicContact CG-CB 4.31Å; Y408-K411 PolarHBondContact O-N 2.86Å; P409-K411 PolarHBondContact O-N 3.18Å; K411-L413 VanDerWaalsContact C-N 3.3Å; K411-L413 PolarHBondContact O-N 2.81Å; K411-A414 PolarHBondContact O-N 3.34Å; K411-F415 WeakPolarHBondContact O-CB 3.4Å; K411-F415 PolarHBondContact O-N 3.21Å
412N97.7Very high95.3Very high0 Ų061.9 Ų61.90%032%0.315CS..Hα-helixtrans-60.3-41.3173.1-64.9-16.4000111.4G338 M339 L401 T407 Y408 P409 F415 Y416G338-N412 PolarHBondContact O-ND2 2.81Å; M339-N412 PolarHBondContact O-ND2 2.94Å; L401-N412 HydrophobicContact CD1-CB 3.92Å; L401-N412 HydrophobicContact CD2-CB 3.76Å; T407-N412 PolarHBondContact N-OD1 3.49Å; T407-N412 PolarHBondContact OG1-OD1 3.15Å; T407-N412 VanDerWaalsContact OG1-OD1 3.07Å; Y408-N412 WeakPolarHBondContact O-CB 3.37Å; Y408-N412 PolarHBondContact O-N 3.39Å; Y408-N412 PolarHBondContact O-ND2 3.33Å; Y408-N412 PolarHBondContact O-OD1 2.86Å; P409-N412 PolarHBondContact O-N 3.32Å; N412-F415 WeakPolarHBondContact O-CB 3.23Å; N412-F415 PolarHBondContact O-N 3.26Å; N412-Y416 PolarHBondContact O-N 3.01Å
413L96.4Very high95.1Very high39 Ų3963.9 Ų63.920%0.20432%0.32CS..Hα-helixtrans-66-43.8175.8-176.158.5000111.5L343 P409 K411 F415 Y416 W417L343-L413 VanDerWaalsContact O-CD1 3.23Å; L343-L413 WeakPolarHBondContact O-CD1 3.47Å; P409-L413 VanDerWaalsContact O-CB 3.23Å; P409-L413 WeakPolarHBondContact O-CB 3.31Å; P409-L413 PolarHBondContact O-N 3.47Å; K411-L413 VanDerWaalsContact C-N 3.3Å; K411-L413 PolarHBondContact O-N 2.81Å; L413-F415 VanDerWaalsContact C-N 3.31Å; L413-F415 PolarHBondContact O-N 2.76Å; L413-Y416 HydrophobicContact CD1-CD1 4.4Å; L413-Y416 WeakPolarHBondContact O-CB 3.38Å; L413-Y416 PolarHBondContact O-N 3.42Å; L413-W417 VanDerWaalsContact CD1-NE1 3.31Å; L413-W417 PolarHBondContact O-N 3.41Å
414A96Very high95Very high59 Ų5969.3 Ų69.349%0.48834%0.341SS..Hα-helixtrans-59.9-41.7174.800000112E410 K411 W417 K418E410-A414 PolarHBondContact O-N 3.24Å; E410-A414 VanDerWaalsContact O-N 3.08Å; K411-A414 PolarHBondContact O-N 3.34Å; A414-W417 PolarHBondContact O-N 2.94Å; A414-K418 PolarHBondContact O-N 3.09Å
415F95.6Very high95.1Very high57 Ų5767.5 Ų67.525%0.2533%0.327CS..Hα-helixtrans-60.2-46.6174.3173.5-102.6000112L401 N405 K411 N412 L413 W417 K418 L419L401-F415 HydrophobicContact CD2-CD1 3.84Å; L401-F415 HydrophobicContact CD2-CE1 4.37Å; N405-F415 HydrophobicContact CB-CE1 4.13Å; N405-F415 HydrophobicContact CB-CZ 4.12Å; N405-F415 WeakPolarHBondContact ND2-CZ 3.43Å; K411-F415 WeakPolarHBondContact O-CB 3.4Å; K411-F415 PolarHBondContact O-N 3.21Å; N412-F415 WeakPolarHBondContact O-CB 3.23Å; N412-F415 PolarHBondContact O-N 3.26Å; L413-F415 VanDerWaalsContact C-N 3.31Å; L413-F415 PolarHBondContact O-N 2.76Å; F415-W417 PolarHBondContact O-N 3.46Å; F415-K418 WeakPolarHBondContact O-CB 3.3Å; F415-K418 PolarHBondContact O-N 3.24Å; F415-L419 HydrophobicContact CD1-CD1 3.98Å; F415-L419 HydrophobicContact CE1-CD1 3.34Å; F415-L419 HydrophobicContact CE1-CG 4.14Å; F415-L419 HydrophobicContact CE2-CD1 4.27Å; F415-L419 HydrophobicContact CE2-CD2 4.45Å; F415-L419 HydrophobicContact CE2-CG 4.27Å; F415-L419 HydrophobicContact CZ-CD1 3.51Å; F415-L419 HydrophobicContact CZ-CD2 4.26Å; F415-L419 HydrophobicContact CZ-CG 3.99Å; F415-L419 PolarHBondContact O-N 2.95Å
416Y95Very high95.1Very high12 Ų1270 Ų705%0.04734%0.336CS..Hα-helixtrans-57.8-45.8176.1171-103.9000113A342 T344 K396 F399 N412 L413 K418 L419 K420A342-Y416 VanDerWaalsContact CB-CB 3.5Å; A342-Y416 HydrophobicContact CB-CD1 4.12Å; A342-Y416 HydrophobicContact CB-CD2 3.68Å; A342-Y416 HydrophobicContact CB-CE2 4.4Å; A342-Y416 HydrophobicContact CB-CG 3.49Å; A342-Y416 VanDerWaalsContact CB-CG 3.49Å; T344-Y416 HydrophobicContact CG2-CE1 4.22Å; K396-Y416 PolarHBondContact O-OH 3.43Å; F399-Y416 HydrophobicContact CB-CD2 3.91Å; F399-Y416 HydrophobicContact CB-CE2 3.6Å; F399-Y416 AromaticContact CD1-CD2 3.67Å; F399-Y416 HydrophobicContact CD1-CD2 3.67Å; F399-Y416 HydrophobicContact CD1-CE2 4.2Å; F399-Y416 HydrophobicContact CD2-CE2 4.38Å; F399-Y416 HydrophobicContact CE1-CD2 4.32Å; F399-Y416 AromaticContact CG-CD2 3.77Å; F399-Y416 HydrophobicContact CG-CD2 3.77Å; F399-Y416 AromaticContact CG-CE2 3.81Å; F399-Y416 HydrophobicContact CG-CE2 3.81Å; N412-Y416 PolarHBondContact O-N 3.01Å; L413-Y416 HydrophobicContact CD1-CD1 4.4Å; L413-Y416 WeakPolarHBondContact O-CB 3.38Å; L413-Y416 PolarHBondContact O-N 3.42Å; Y416-K418 VanDerWaalsContact C-N 3.32Å; Y416-K418 PolarHBondContact O-N 3.49Å; Y416-L419 PolarHBondContact O-N 3.05Å; Y416-K420 HydrophobicContact CD1-CG 4.48Å; Y416-K420 HydrophobicContact CD2-CG 4.39Å; Y416-K420 HydrophobicContact CE1-CG 4.04Å; Y416-K420 HydrophobicContact CE2-CD 4.38Å; Y416-K420 HydrophobicContact CE2-CG 3.96Å; Y416-K420 WeakPolarHBondContact O-CG 3.2Å; Y416-K420 PolarHBondContact O-N 3.48Å; Y416-K420 WeakPolarHBondContact OH-CE 3.46Å
417W95.4Very high94.9Very high151 Ų15174.4 Ų74.457%0.57235%0.352SS*.Hα-helixtrans-66-35.6178.3-72.6116.5000112.7L413 A414 F415 K420 K421L413-W417 VanDerWaalsContact CD1-NE1 3.31Å; L413-W417 PolarHBondContact O-N 3.41Å; A414-W417 PolarHBondContact O-N 2.94Å; F415-W417 PolarHBondContact O-N 3.46Å; W417-K420 PolarHBondContact O-N 2.92Å; W417-K421 WeakPolarHBondContact O-CB 3.41Å; W417-K421 PolarHBondContact O-N 3.28Å
418K95.1Very high94.8Very high134 Ų13475.3 Ų75.358%0.58336%0.363SS*.Hα-helixtrans-61.6-47.9173.7-173.7-178.9177.8-176.30111A414 F415 Y416 K420 K421 Q422A414-K418 PolarHBondContact O-N 3.09Å; F415-K418 WeakPolarHBondContact O-CB 3.3Å; F415-K418 PolarHBondContact O-N 3.24Å; Y416-K418 VanDerWaalsContact C-N 3.32Å; Y416-K418 PolarHBondContact O-N 3.49Å; K418-K420 PolarHBondContact O-N 3.47Å; K418-K421 PolarHBondContact O-N 2.98Å; K418-Q422 WeakPolarHBondContact O-CG 3.37Å; K418-Q422 PolarHBondContact O-N 2.92Å
419L92.7Very high94.6Very high46 Ų4675.6 Ų75.624%0.24138%0.377CS..Hα-helixtrans-58.8-46.4175.2-72.1178.5000111.5F399 F415 Y416 K421 Q422 E423F399-L419 HydrophobicContact CE1-CD1 4.29Å; F399-L419 HydrophobicContact CZ-CD1 3.96Å; F415-L419 HydrophobicContact CD1-CD1 3.98Å; F415-L419 HydrophobicContact CE1-CD1 3.34Å; F415-L419 HydrophobicContact CE1-CG 4.14Å; F415-L419 HydrophobicContact CE2-CD1 4.27Å; F415-L419 HydrophobicContact CE2-CD2 4.45Å; F415-L419 HydrophobicContact CE2-CG 4.27Å; F415-L419 HydrophobicContact CZ-CD1 3.51Å; F415-L419 HydrophobicContact CZ-CD2 4.26Å; F415-L419 HydrophobicContact CZ-CG 3.99Å; F415-L419 PolarHBondContact O-N 2.95Å; Y416-L419 PolarHBondContact O-N 3.05Å; L419-K421 VanDerWaalsContact C-N 3.27Å; L419-K421 PolarHBondContact O-N 3.47Å; L419-Q422 PolarHBondContact O-N 3.32Å; L419-Q422 VanDerWaalsContact O-N 3.13Å; L419-E423 WeakPolarHBondContact O-CG 3.3Å; L419-E423 PolarHBondContact O-N 3.47Å
420K91.8Very high94.4Very high33 Ų3382.4 Ų82.414%0.14341%0.406CS..Hα-helixtrans-61.6-34178.1-75.1-73.2162.8-141.70113.2Y416 W417 K418 E423 K424Y416-K420 HydrophobicContact CD1-CG 4.48Å; Y416-K420 HydrophobicContact CD2-CG 4.39Å; Y416-K420 HydrophobicContact CE1-CG 4.04Å; Y416-K420 HydrophobicContact CE2-CD 4.38Å; Y416-K420 HydrophobicContact CE2-CG 3.96Å; Y416-K420 WeakPolarHBondContact O-CG 3.2Å; Y416-K420 PolarHBondContact O-N 3.48Å; Y416-K420 WeakPolarHBondContact OH-CE 3.46Å; W417-K420 PolarHBondContact O-N 2.92Å; K418-K420 PolarHBondContact O-N 3.47Å; K420-E423 IonicContact NZ-OE1 3.84Å; K420-E423 IonicContact NZ-OE2 3.87Å; K420-E423 PolarHBondContact NZ-OE2 3.31Å; K420-K424 WeakPolarHBondContact O-CG 3.43Å; K420-K424 PolarHBondContact O-N 2.92Å
421K94.3Very high94.2Very high164 Ų16483.7 Ų83.771%0.71341%0.412SS*.Hα-helixtrans-69.5-41.5175.1-171.6178.1178.7-178.80111.3W417 K418 L419 K424 A425W417-K421 WeakPolarHBondContact O-CB 3.41Å; W417-K421 PolarHBondContact O-N 3.28Å; K418-K421 PolarHBondContact O-N 2.98Å; L419-K421 VanDerWaalsContact C-N 3.27Å; L419-K421 PolarHBondContact O-N 3.47Å; K421-K424 PolarHBondContact O-N 3.46Å; K421-A425 PolarHBondContact O-N 2.88Å
422Q93.4Very high94Very high91 Ų9183.5 Ų83.543%0.42542%0.42SS..Hα-helixtrans-64-48176.2-71173-33.700111.5K418 L419 K424 A425 E426K418-Q422 WeakPolarHBondContact O-CG 3.37Å; K418-Q422 PolarHBondContact O-N 2.92Å; L419-Q422 PolarHBondContact O-N 3.32Å; L419-Q422 VanDerWaalsContact O-N 3.13Å; Q422-K424 VanDerWaalsContact C-N 3.27Å; Q422-K424 PolarHBondContact O-N 3.42Å; Q422-A425 PolarHBondContact O-N 2.72Å; Q422-A425 VanDerWaalsContact O-N 3.08Å; Q422-E426 WeakPolarHBondContact O-CG 3.26Å; Q422-E426 PolarHBondContact O-N 2.99Å
423E91.8Very high93.7Very high93 Ų9388.2 Ų88.244%0.43544%0.442SS..Hα-helixtrans-55.2-41.3175.7-74.1177.5177.900112.4L419 K420 K427L419-E423 WeakPolarHBondContact O-CG 3.3Å; L419-E423 PolarHBondContact O-N 3.47Å; K420-E423 IonicContact NZ-OE1 3.84Å; K420-E423 IonicContact NZ-OE2 3.87Å; K420-E423 PolarHBondContact NZ-OE2 3.31Å; E423-K427 WeakPolarHBondContact O-CB 3.31Å; E423-K427 PolarHBondContact O-N 2.74Å
424K92.3Very high93.5Very high156 Ų15692.7 Ų92.768%0.67846%0.462SS*.Hα-helixtrans-68.2-41.7177.2-75.8179.1-179.4-173.50112.3K420 K421 Q422 K427 A428K420-K424 WeakPolarHBondContact O-CG 3.43Å; K420-K424 PolarHBondContact O-N 2.92Å; K421-K424 PolarHBondContact O-N 3.46Å; Q422-K424 VanDerWaalsContact C-N 3.27Å; Q422-K424 PolarHBondContact O-N 3.42Å; K424-K427 PolarHBondContact O-N 3.31Å; K424-A428 WeakPolarHBondContact O-CB 3.49Å; K424-A428 PolarHBondContact O-N 2.79Å
425A93.8Very high93.3Very high61 Ų6196.2 Ų96.250%0.50447%0.469SS..Hα-helixtrans-65.2-42.3178.300000111.4K421 Q422 A428 A429K421-A425 PolarHBondContact O-N 2.88Å; Q422-A425 PolarHBondContact O-N 2.72Å; Q422-A425 VanDerWaalsContact O-N 3.08Å; A425-A428 PolarHBondContact O-N 2.79Å; A425-A429 WeakPolarHBondContact O-CB 3.42Å; A425-A429 PolarHBondContact O-N 3.09Å
426E93.7Very high93.1Very high121 Ų12197.6 Ų97.657%0.56548%0.478SS*.Hα-helixtrans-64.1-40.7175-72.1174.3-167.400112.2Q422 A429 K430Q422-E426 WeakPolarHBondContact O-CG 3.26Å; Q422-E426 PolarHBondContact O-N 2.99Å; E426-A429 PolarHBondContact O-N 2.9Å; E426-K430 WeakPolarHBondContact O-CG 3.32Å; E426-K430 PolarHBondContact O-N 2.96Å
427K92.8Very high93Very high128 Ų128100.7 Ų100.756%0.55750%0.496SS*.Hα-helixtrans-64.3-44.7176-165.6178.5-173.7-94.50111.5E423 K424 A429 K430 E431E423-K427 WeakPolarHBondContact O-CB 3.31Å; E423-K427 PolarHBondContact O-N 2.74Å; K424-K427 PolarHBondContact O-N 3.31Å; K427-A429 VanDerWaalsContact C-N 3.33Å; K427-A429 PolarHBondContact O-N 2.98Å; K427-K430 PolarHBondContact O-N 2.85Å; K427-E431 WeakPolarHBondContact CE-OE1 3.47Å; K427-E431 IonicContact NZ-OE1 2.6Å; K427-E431 PolarHBondContact NZ-OE1 3.38Å; K427-E431 WeakPolarHBondContact O-CG 3.35Å; K427-E431 PolarHBondContact O-N 3.24Å
428A93.9Very high92.9Very high49 Ų4996.5 Ų96.541%0.40549%0.493SS..Hα-helixtrans-61.6-41.9175.900000111.5K424 A425 K430 E431 S432K424-A428 WeakPolarHBondContact O-CB 3.49Å; K424-A428 PolarHBondContact O-N 2.79Å; A425-A428 PolarHBondContact O-N 2.79Å; A428-K430 PolarHBondContact O-N 3.31Å; A428-E431 PolarHBondContact O-N 3.3Å; A428-S432 PolarHBondContact O-N 2.96Å; A428-S432 PolarHBondContact O-OG 3.48Å; A428-S432 VanDerWaalsContact O-OG 3.12Å
429A93.1Very high92.8Very high61 Ų6195.7 Ų95.750%0.50449%0.491SS..Hα-helixtrans-63.5-40.5176.300000112.6A425 E426 K427 S432 Q433A425-A429 WeakPolarHBondContact O-CB 3.42Å; A425-A429 PolarHBondContact O-N 3.09Å; E426-A429 PolarHBondContact O-N 2.9Å; K427-A429 VanDerWaalsContact C-N 3.33Å; K427-A429 PolarHBondContact O-N 2.98Å; A429-S432 PolarHBondContact O-N 2.98Å; A429-Q433 WeakPolarHBondContact O-CB 3.37Å; A429-Q433 PolarHBondContact O-N 3.03Å
430K93.3Very high92.8Very high143 Ų14397.2 Ų97.262%0.62250%0.499SS*.Hα-helixtrans-64.1-45.1174.4-76.1-178.7179.5-177.60112.1E426 K427 A428 S432 Q433 E434E426-K430 WeakPolarHBondContact O-CG 3.32Å; E426-K430 PolarHBondContact O-N 2.96Å; K427-K430 PolarHBondContact O-N 2.85Å; A428-K430 PolarHBondContact O-N 3.31Å; K430-S432 PolarHBondContact O-N 3.09Å; K430-Q433 PolarHBondContact O-N 3.4Å; K430-E434 WeakPolarHBondContact O-CB 3.24Å; K430-E434 WeakPolarHBondContact O-CG 3.34Å; K430-E434 PolarHBondContact O-N 2.95Å
431E93.1Very high92.8Very high86 Ų8698.7 Ų98.740%0.40251%0.511SS..Hα-helixtrans-61.6-42.8176.8-72.6171.2-17600111.3K427 A428 E434 Q435K427-E431 WeakPolarHBondContact CE-OE1 3.47Å; K427-E431 IonicContact NZ-OE1 2.6Å; K427-E431 PolarHBondContact NZ-OE1 3.38Å; K427-E431 WeakPolarHBondContact O-CG 3.35Å; K427-E431 PolarHBondContact O-N 3.24Å; A428-E431 PolarHBondContact O-N 3.3Å; E431-E434 PolarHBondContact O-N 3.29Å; E431-Q435 WeakPolarHBondContact O-CB 3.36Å; E431-Q435 VanDerWaalsContact O-CG 3.28Å; E431-Q435 WeakPolarHBondContact O-CG 3.25Å; E431-Q435 PolarHBondContact O-N 3.3Å
432S91.8Very high92.7Very high70 Ų7095.5 Ų95.549%0.4950%0.501SS..Hα-helixtrans-64.6-38.6174.7-63.50000112.7A428 A429 K430 Q435 L436A428-S432 PolarHBondContact O-N 2.96Å; A428-S432 PolarHBondContact O-OG 3.48Å; A428-S432 VanDerWaalsContact O-OG 3.12Å; A429-S432 PolarHBondContact O-N 2.98Å; K430-S432 PolarHBondContact O-N 3.09Å; S432-Q435 PolarHBondContact O-N 3.08Å; S432-L436 WeakPolarHBondContact O-CB 3.38Å; S432-L436 PolarHBondContact O-N 3.25Å
433Q91.7Very high92.7Very high99 Ų9995 Ų9546%0.46350%0.501SS..Hα-helixtrans-68-40176.2-172.364.747.400111.9A429 K430 L436 N437A429-Q433 WeakPolarHBondContact O-CB 3.37Å; A429-Q433 PolarHBondContact O-N 3.03Å; K430-Q433 PolarHBondContact O-N 3.4Å; Q433-L436 PolarHBondContact O-N 3.21Å; Q433-N437 PolarHBondContact NE2-OD1 3.39Å; Q433-N437 WeakPolarHBondContact O-CB 3.21Å; Q433-N437 PolarHBondContact O-N 3.38Å; Q433-N437 PolarHBondContact O-OD1 3.1Å
434E92.5Very high92.7Very high132 Ų13295.6 Ų95.662%0.61750%0.504SS*.Hα-helixtrans-64.3-40.8175.3-75.9173.5-172.700111.5K430 E431 N437 A438K430-E434 WeakPolarHBondContact O-CB 3.24Å; K430-E434 WeakPolarHBondContact O-CG 3.34Å; K430-E434 PolarHBondContact O-N 2.95Å; E431-E434 PolarHBondContact O-N 3.29Å; E434-N437 PolarHBondContact O-N 2.72Å; E434-A438 WeakPolarHBondContact O-CB 3.38Å; E434-A438 PolarHBondContact O-N 2.69Å
435Q91.3Very high92.7Very high134 Ų13494.4 Ų94.463%0.62650%0.499SS*.Hα-helixtrans-62.2-47.1173.8-74.8172.1-1.500111.7E431 S432 N437 A438 E439E431-Q435 WeakPolarHBondContact O-CB 3.36Å; E431-Q435 VanDerWaalsContact O-CG 3.28Å; E431-Q435 WeakPolarHBondContact O-CG 3.25Å; E431-Q435 PolarHBondContact O-N 3.3Å; S432-Q435 PolarHBondContact O-N 3.08Å; Q435-N437 VanDerWaalsContact C-N 3.35Å; Q435-N437 PolarHBondContact O-N 3.39Å; Q435-A438 PolarHBondContact O-N 3.29Å; Q435-E439 WeakPolarHBondContact O-CB 3.3Å; Q435-E439 PolarHBondContact O-N 3.1Å
436L93.1Very high92.5Very high85 Ų8596.6 Ų96.645%0.44550%0.499SS..Hα-helixtrans-60.9-43.9177.3-176.667000111.6S432 Q433 A438 E439 I440S432-L436 WeakPolarHBondContact O-CB 3.38Å; S432-L436 PolarHBondContact O-N 3.25Å; Q433-L436 PolarHBondContact O-N 3.21Å; L436-A438 PolarHBondContact O-N 3.46Å; L436-E439 PolarHBondContact O-N 3.24Å; L436-I440 HydrophobicContact CG-CD1 4.11Å; L436-I440 VanDerWaalsContact O-CG1 3.28Å; L436-I440 WeakPolarHBondContact O-CG1 3.18Å; L436-I440 PolarHBondContact O-N 2.9Å
437N92.8Very high92.3Very high78 Ų7897.1 Ų97.142%0.41750%0.501SS..Hα-helixtrans-64.2-40.9177.4-70.1-6.4000111.7Q433 E434 Q435 E439 I440 T441Q433-N437 PolarHBondContact NE2-OD1 3.39Å; Q433-N437 WeakPolarHBondContact O-CB 3.21Å; Q433-N437 PolarHBondContact O-N 3.38Å; Q433-N437 PolarHBondContact O-OD1 3.1Å; E434-N437 PolarHBondContact O-N 2.72Å; Q435-N437 VanDerWaalsContact C-N 3.35Å; Q435-N437 PolarHBondContact O-N 3.39Å; N437-E439 VanDerWaalsContact C-N 3.34Å; N437-I440 PolarHBondContact O-N 2.87Å; N437-T441 PolarHBondContact O-N 3.47Å; N437-T441 PolarHBondContact O-OG1 3.43Å
438A92.6Very high92.2Very high62 Ų6295.9 Ų95.951%0.51250%0.5SS..Hα-helixtrans-64.4-38.8176.900000112.1E434 Q435 L436 T441 L442E434-A438 WeakPolarHBondContact O-CB 3.38Å; E434-A438 PolarHBondContact O-N 2.69Å; Q435-A438 PolarHBondContact O-N 3.29Å; L436-A438 PolarHBondContact O-N 3.46Å; A438-T441 PolarHBondContact O-N 3.32Å; A438-L442 WeakPolarHBondContact O-CB 3.36Å; A438-L442 PolarHBondContact O-N 3.21Å
439E92.7Very high92Very high118 Ų118100.5 Ų100.555%0.55151%0.511SS*.Hα-helixtrans-66.5-42.4175.5-169.4171.8-170.500111.7Q435 L436 N437 L442 N443Q435-E439 WeakPolarHBondContact O-CB 3.3Å; Q435-E439 PolarHBondContact O-N 3.1Å; L436-E439 PolarHBondContact O-N 3.24Å; N437-E439 VanDerWaalsContact C-N 3.34Å; E439-L442 PolarHBondContact O-N 3.18Å; E439-N443 WeakPolarHBondContact O-CB 3.34Å; E439-N443 PolarHBondContact O-N 3.28Å
440I93Very high91.7Very high77 Ų77102.1 Ų102.140%0.39551%0.511SS..Hα-helixtrans-59.9-49173.5-68.4165.1000110.7L436 N437 L442 N443 E444L436-I440 HydrophobicContact CG-CD1 4.11Å; L436-I440 VanDerWaalsContact O-CG1 3.28Å; L436-I440 WeakPolarHBondContact O-CG1 3.18Å; L436-I440 PolarHBondContact O-N 2.9Å; N437-I440 PolarHBondContact O-N 2.87Å; I440-L442 VanDerWaalsContact C-N 3.28Å; I440-L442 PolarHBondContact O-N 3.14Å; I440-N443 PolarHBondContact O-N 2.8Å; I440-E444 HydrophobicContact CG2-CG 4.44Å; I440-E444 WeakPolarHBondContact O-CG 3.26Å; I440-E444 PolarHBondContact O-N 3.39Å
441T92.3Very high91.4Very high65 Ų65100.3 Ų100.340%0.39950%0.504SS..Hα-helixtrans-62.2-35.6178.8-58.60000112.2N437 A438 K445N437-T441 PolarHBondContact O-N 3.47Å; N437-T441 PolarHBondContact O-OG1 3.43Å; A438-T441 PolarHBondContact O-N 3.32Å; T441-K445 WeakPolarHBondContact O-CG 3.33Å; T441-K445 PolarHBondContact O-N 2.96Å; T441-K445 VanDerWaalsContact O-N 3.09Å
442L92.5Very high91Very high97 Ų97101.2 Ų101.251%0.50851%0.511SS..Hα-helixtrans-65.9-47.5175.3-175.169.7000110.8A438 E439 I440 E444 K445 E446A438-L442 WeakPolarHBondContact O-CB 3.36Å; A438-L442 PolarHBondContact O-N 3.21Å; E439-L442 PolarHBondContact O-N 3.18Å; I440-L442 VanDerWaalsContact C-N 3.28Å; I440-L442 PolarHBondContact O-N 3.14Å; L442-E444 VanDerWaalsContact C-N 3.35Å; L442-E444 PolarHBondContact O-N 3.02Å; L442-K445 WeakPolarHBondContact O-CB 3.37Å; L442-K445 PolarHBondContact O-N 3.12Å; L442-E446 PolarHBondContact O-N 3.01Å
443N92.4Very high90.6Very high79 Ų79103 Ų10342%0.42251%0.512SS..Hα-helixtrans-61.1-41.5178.1-73.4-16.6000112E439 I440 E446 Q447E439-N443 WeakPolarHBondContact O-CB 3.34Å; E439-N443 PolarHBondContact O-N 3.28Å; I440-N443 PolarHBondContact O-N 2.8Å; N443-E446 PolarHBondContact O-N 2.9Å; N443-Q447 WeakPolarHBondContact O-CG 3.4Å; N443-Q447 PolarHBondContact O-N 2.76Å
444E91.9Very high90.2Very high106 Ų106106.1 Ų106.150%0.49552%0.519SS..Hα-helixtrans-61.5-42.5174.3-74.1175.9168.600111.9I440 L442 Q447 L448I440-E444 HydrophobicContact CG2-CG 4.44Å; I440-E444 WeakPolarHBondContact O-CG 3.26Å; I440-E444 PolarHBondContact O-N 3.39Å; L442-E444 VanDerWaalsContact C-N 3.35Å; L442-E444 PolarHBondContact O-N 3.02Å; E444-Q447 PolarHBondContact O-N 2.99Å; E444-L448 WeakPolarHBondContact O-CG 3.27Å; E444-L448 PolarHBondContact O-N 3.48Å
445K91.6Very high89.6Confident132 Ų132105.2 Ų105.257%0.57452%0.518SS*.Hα-helixtrans-64.8-38.4175.7-78-179.1178.6-179.20112.7T441 L442 K449T441-K445 WeakPolarHBondContact O-CG 3.33Å; T441-K445 PolarHBondContact O-N 2.96Å; T441-K445 VanDerWaalsContact O-N 3.09Å; L442-K445 WeakPolarHBondContact O-CB 3.37Å; L442-K445 PolarHBondContact O-N 3.12Å; K445-K449 WeakPolarHBondContact O-CG 3.44Å; K445-K449 PolarHBondContact O-N 3.34Å
446E90.8Very high88.9Confident107 Ų107104.9 Ų104.950%0.552%0.516SS..Hα-helixtrans-67-42.1175.5-74.1-169.8168.300111.7L442 N443 K449 L450L442-E446 PolarHBondContact O-N 3.01Å; N443-E446 PolarHBondContact O-N 2.9Å; E446-K449 PolarHBondContact O-N 3.04Å; E446-L450 WeakPolarHBondContact O-CG 3.21Å; E446-L450 PolarHBondContact O-N 3.46Å
447Q89.6Confident88Confident132 Ų132107.1 Ų107.162%0.61752%0.524SS*.Hα-helixtrans-60.3-46.6174-77.4-173.6-12.800112.1N443 E444 K449 L450 E451N443-Q447 WeakPolarHBondContact O-CG 3.4Å; N443-Q447 PolarHBondContact O-N 2.76Å; E444-Q447 PolarHBondContact O-N 2.99Å; Q447-K449 VanDerWaalsContact C-N 3.32Å; Q447-K449 PolarHBondContact O-N 3.03Å; Q447-L450 PolarHBondContact O-N 3.48Å; Q447-E451 PolarHBondContact O-N 2.99Å
448L89.9Confident86.7Confident101 Ų101105.7 Ų105.753%0.52953%0.528SS..Hα-helixtrans-60.8-39.5176.8-75.5168.7000112.4E444 E451 L452E444-L448 WeakPolarHBondContact O-CG 3.27Å; E444-L448 PolarHBondContact O-N 3.48Å; L448-E451 PolarHBondContact O-N 2.94Å; L448-L452 WeakPolarHBondContact O-CB 3.23Å; L448-L452 WeakPolarHBondContact O-CG 3.46Å; L448-L452 PolarHBondContact O-N 2.9Å
449K89.7Confident85.2Confident146 Ų146111.4 Ų111.464%0.63554%0.536SS*.Hα-helixtrans-62.1-43.9174-82.9-177.4176.5-178.30112.2K445 E446 Q447 E451 L452 Q453K445-K449 WeakPolarHBondContact O-CG 3.44Å; K445-K449 PolarHBondContact O-N 3.34Å; E446-K449 PolarHBondContact O-N 3.04Å; Q447-K449 VanDerWaalsContact C-N 3.32Å; Q447-K449 PolarHBondContact O-N 3.03Å; K449-E451 VanDerWaalsContact C-N 3.33Å; K449-L452 PolarHBondContact O-N 3.11Å; K449-Q453 PolarHBondContact O-N 3.28Å
450L88.1Confident83.4Confident96 Ų96112 Ų11250%0.50354%0.539SS..Hα-helixtrans-66.8-33.9178-72168.4000112.2E446 Q447 R454E446-L450 WeakPolarHBondContact O-CG 3.21Å; E446-L450 PolarHBondContact O-N 3.46Å; Q447-L450 PolarHBondContact O-N 3.48Å; L450-R454 PolarHBondContact O-N 3.4Å; L450-R454 VanDerWaalsContact O-N 3.15Å
451E86.3Confident81.5Confident104 Ų104110.2 Ų110.249%0.48654%0.54SS..Hα-helixtrans-68.7-44.8172.4-76.2-172.3165.100112.2Q447 L448 K449 Q453 R454 I455Q447-E451 PolarHBondContact O-N 2.99Å; L448-E451 PolarHBondContact O-N 2.94Å; K449-E451 VanDerWaalsContact C-N 3.33Å; E451-Q453 VanDerWaalsContact C-N 3.35Å; E451-Q453 PolarHBondContact O-N 3.08Å; E451-R454 PolarHBondContact O-N 2.86Å; E451-I455 WeakPolarHBondContact O-CG1 3.49Å; E451-I455 PolarHBondContact O-N 3.4Å
452L85.4Confident79.5Confident105 Ų105110.3 Ų110.355%0.5554%0.543SS..Hα-helixtrans-58.5-44.8174.9-83.3159.8000112L448 K449 R454 I455 E456L448-L452 WeakPolarHBondContact O-CB 3.23Å; L448-L452 WeakPolarHBondContact O-CG 3.46Å; L448-L452 PolarHBondContact O-N 2.9Å; K449-L452 PolarHBondContact O-N 3.11Å; L452-R454 PolarHBondContact O-N 3.48Å; L452-I455 PolarHBondContact O-N 2.8Å; L452-E456 PolarHBondContact O-N 3.27Å
453Q82.7Confident77.5Confident108 Ų108111.9 Ų111.951%0.50555%0.548SS..Hα-helixtrans-59.8-43.9174.8-81.8-177.5-28.900112.2K449 E451 I455 E456 E457K449-Q453 PolarHBondContact O-N 3.28Å; E451-Q453 VanDerWaalsContact C-N 3.35Å; E451-Q453 PolarHBondContact O-N 3.08Å; Q453-I455 VanDerWaalsContact C-N 3.3Å; Q453-I455 PolarHBondContact O-N 2.88Å; Q453-E456 PolarHBondContact O-N 3.41Å; Q453-E457 WeakPolarHBondContact O-CB 3.19Å; Q453-E457 WeakPolarHBondContact O-CG 3.39Å; Q453-E457 PolarHBondContact O-N 3.42Å
454R82.4Confident75.3Confident165 Ų165114.1 Ų114.162%0.62356%0.56SS**Hα-helixtrans-62.4-36.5175.6-88.8-171.4-80.9171.1-4.2112.8L450 E451 L452 G458L450-R454 PolarHBondContact O-N 3.4Å; L450-R454 VanDerWaalsContact O-N 3.15Å; E451-R454 PolarHBondContact O-N 2.86Å; L452-R454 PolarHBondContact O-N 3.48Å; R454-G458 PolarHBondContact O-N 3.12Å
455I80.9Confident73Confident113 Ų113115.1 Ų115.158%0.57957%0.568SS**Hα-helixtrans-67.7-43.1175.8-68.2167000110.5E451 L452 Q453 G458 R459E451-I455 WeakPolarHBondContact O-CG1 3.49Å; E451-I455 PolarHBondContact O-N 3.4Å; L452-I455 PolarHBondContact O-N 2.8Å; Q453-I455 VanDerWaalsContact C-N 3.3Å; Q453-I455 PolarHBondContact O-N 2.88Å; I455-G458 PolarHBondContact O-N 3.42Å; I455-R459 WeakPolarHBondContact O-CB 3.23Å; I455-R459 PolarHBondContact O-N 3.49Å
456E76.2Confident70.7Confident127 Ų127114 Ų11459%0.59357%0.569SS**Hα-helixtrans-63.5-43.9175.7-80.9179.115800112.4L452 Q453 G458 R459 Q460L452-E456 PolarHBondContact O-N 3.27Å; Q453-E456 PolarHBondContact O-N 3.41Å; E456-G458 PolarHBondContact O-N 2.89Å; E456-R459 PolarHBondContact O-N 2.95Å; E456-R459 VanDerWaalsContact O-N 3.16Å; E456-Q460 PolarHBondContact O-N 2.87Å
457E73.9Confident68.3Low132 Ų132114 Ų11462%0.61758%0.577SS**Hα-helixtrans-63-40.8175-73.2178.117300111.8Q453 R459 Q460 G461Q453-E457 WeakPolarHBondContact O-CB 3.19Å; Q453-E457 WeakPolarHBondContact O-CG 3.39Å; Q453-E457 PolarHBondContact O-N 3.42Å; E457-R459 VanDerWaalsContact C-N 3.29Å; E457-R459 PolarHBondContact O-N 3.45Å; E457-Q460 PolarHBondContact O-N 3.41Å; E457-G461 PolarHBondContact O-N 2.91Å
458G66.4Low66.1Low48 Ų48114.8 Ų114.850%0.49559%0.585SS.*Hα-helixtrans-63.7-33.8173.300000113.1R454 I455 E456 S462R454-G458 PolarHBondContact O-N 3.12Å; I455-G458 PolarHBondContact O-N 3.42Å; E456-G458 PolarHBondContact O-N 2.89Å; G458-S462 PolarHBondContact O-N 3.05Å
459R60.1Low63.9Low181 Ų181115.1 Ų115.168%0.68359%0.591SS**Hα-helixtrans-73.9-39.9177.9-155.2171.9179.4166.4-0111.9I455 E456 E457 S462 E463I455-R459 WeakPolarHBondContact O-CB 3.23Å; I455-R459 PolarHBondContact O-N 3.49Å; E456-R459 PolarHBondContact O-N 2.95Å; E456-R459 VanDerWaalsContact O-N 3.16Å; E457-R459 VanDerWaalsContact C-N 3.29Å; E457-R459 PolarHBondContact O-N 3.45Å; R459-S462 WeakPolarHBondContact O-CB 3.46Å; R459-S462 PolarHBondContact O-N 2.84Å; R459-E463 PolarHBondContact O-N 3.21Å
460Q54.6Low61.4Low131 Ų131116.7 Ų116.761%0.61260%0.6SS**Hα-helixtrans-67.4-34.1171.9-73.1-174.9-1.700112.8E456 E457 S462 E463 N464E456-Q460 PolarHBondContact O-N 2.87Å; E457-Q460 PolarHBondContact O-N 3.41Å; Q460-S462 VanDerWaalsContact C-N 3.31Å; Q460-E463 PolarHBondContact O-N 3.1Å; Q460-N464 PolarHBondContact O-N 3.19Å
461G54.6Low59Low40 Ų40121.2 Ų121.241%0.41262%0.619SS.*Hα-helixtrans-66.2-32.1170.900000113.3E457 N465E457-G461 PolarHBondContact O-N 2.91Å; G461-N465 PolarHBondContact O-N 2.94Å
462S49.8Very low56.8Low67 Ų67122.3 Ų122.347%0.46963%0.633SS.*Hα-helixtrans-75.5-35.8174.5-1650000112.7G458 R459 Q460 N465 N466G458-S462 PolarHBondContact O-N 3.05Å; R459-S462 WeakPolarHBondContact O-CB 3.46Å; R459-S462 PolarHBondContact O-N 2.84Å; Q460-S462 VanDerWaalsContact C-N 3.31Å; S462-N465 PolarHBondContact O-N 3.13Å; S462-N466 PolarHBondContact O-N 2.96Å; S462-N466 VanDerWaalsContact O-N 3.09Å
463E49.5Very low54.3Low129 Ų129125 Ų12560%0.60365%0.648SS**Hα-helixtrans-70.5-32.6174.5-78.4-179.7167.800113R459 Q460 N465 N466 T467R459-E463 PolarHBondContact O-N 3.21Å; Q460-E463 PolarHBondContact O-N 3.1Å; E463-N465 VanDerWaalsContact C-N 3.33Å; E463-N466 PolarHBondContact O-N 3.1Å; E463-T467 PolarHBondContact O-N 3.44Å; E463-T467 PolarHBondContact O-OG1 2.86Å; E463-T467 VanDerWaalsContact O-OG1 3.12Å
464N46Very low52.3Low127 Ų127131.6 Ų131.668%0.67967%0.668SS**Hα-helixtrans-75.5-17.6172.4-88.9-13.8000114.1Q460 T467Q460-N464 PolarHBondContact O-N 3.19Å; N464-T467 PolarHBondContact O-OG1 3.19Å
465N44.6Very low50.1Low126 Ų126127.2 Ų127.267%0.67467%0.674SS**Hα-helixtrans-88.8-24.7171.1-96.4-9.4000112.7G461 S462 E463 T467G461-N465 PolarHBondContact O-N 2.94Å; S462-N465 PolarHBondContact O-N 3.13Å; E463-N465 VanDerWaalsContact C-N 3.33Å; N465-T467 VanDerWaalsContact C-N 3.32Å
466N42.7Very low48Very low110 Ų110128.5 Ų128.559%0.58868%0.682SS**THydrogen-bonded Turntrans-82.8-2.4175.5-91.111.5000114.4S462 E463 N468S462-N466 PolarHBondContact O-N 2.96Å; S462-N466 VanDerWaalsContact O-N 3.09Å; E463-N466 PolarHBondContact O-N 3.1Å; N466-N468 VanDerWaalsContact C-N 3.29Å
467T41.8Very low46Very low107 Ų107128.5 Ų128.566%0.65669%0.686SS**THydrogen-bonded Turntrans-83.90.3171.913.70000113.9E463 N464 N465E463-T467 PolarHBondContact O-N 3.44Å; E463-T467 PolarHBondContact O-OG1 2.86Å; E463-T467 VanDerWaalsContact O-OG1 3.12Å; N464-T467 PolarHBondContact O-OG1 3.19Å; N465-T467 VanDerWaalsContact C-N 3.32Å
468N41.8Very low44.4Very low148 Ų148126.9 Ų126.979%0.79169%0.689SS**SBendtrans-115.2-0.2175.9-87.9-27.7000115.2N466N466-N468 VanDerWaalsContact C-N 3.29Å
469V44.3Very low43Very low107 Ų107131 Ų13165%0.64871%0.705SS**SBendtrans-146.384177.1-1720000108.9
470E37.3Very low42Very low179 Ų179130.6 Ų130.684%0.83671%0.711SS**  trans172.562.9149.3-96.5170-172.600111.4
471E38Very low41.1Very low192 Ų192132.6 Ų132.690%0.89773%0.725SS**  trans-100.183.7146.1-100-166.7165.800107.1
472T38.7Very low40.6Very low126 Ų126136.2 Ų136.277%0.77374%0.739SS**  trans160.494.6148.331.70000110.5
473N34.1Very low39.9Very low163 Ų163140.8 Ų140.887%0.87276%0.757SS**  178.1143.4107.6-109.3-31.9000111.9
474R39.5Very low39.4Very low246 Ų246138.4 Ų138.493%0.92876%0.759SS**  trans-75.4151173.2-100.6171.5166176.3-3.9111.3
475G36.3Very low39.3Very low72 Ų72140.1 Ų140.174%0.74277%0.768SS**  trans113.7125.8169.900000108.7
476D36.9Very low39.2Very low140 Ų140145.1 Ų145.175%0.74978%0.78SS**  cis-171.1165.947.2-15818.3000112.2
477N36Very low39.4Very low127 Ų127150 Ų15068%0.67981%0.813SS**  trans20.9129.4146.7-74.8-39.1000122.8
478S40.1Very low39.2Very low98 Ų98152.2 Ų152.269%0.68582%0.821SS**  trans-20.1140.3142.644.60000117.1
479T36.3Very low39.1Very low136 Ų136152.4 Ų152.483%0.83482%0.823SS**  -175.8138.7108.5-53.70000110.2
480E39.2Very low38.8Very low171 Ų171154.9 Ų154.980%0.79983%0.832SS**  trans-58.3147.4170.6-71.7168.711800113.7
481L35.8Very low38.9Very low173 Ų173153.5 Ų153.591%0.90683%0.832SS**  trans-161.9129.9133.5-117.2132.1000112.8
482V43.8Very low39Very low116 Ų116151.1 Ų151.170%0.70383%0.828SS**  trans-84.7143.4-177.9171.60000110.9
483L35.8Very low39Very low164 Ų164152.8 Ų152.886%0.85983%0.832SS**  trans-175.4109.1141.7-120.492.5000107.8
484A39.3Very low39.3Very low78 Ų78152.1 Ų152.165%0.64583%0.829SS**  95108.579.600000112.4
485D43.4Very low39.3Very low163 Ų163144.8 Ų144.887%0.87282%0.821SS**  trans-58.1144.3170.2-66.8-51000112.4
486Y41.4Very low39.5Very low232 Ų232150.9 Ų150.991%0.9183%0.828SS**  trans-134.7134156.5-100.8-87.7000110.8
487V46.6Very low39.8Very low213 Ų213151.9 Ų151.9100%1.29184%0.835SS**  trans-54.60174.1172.80000112.9

Retrieved 487 of 487 residues in 205.9 ms (Link to these results)