A0A087X2T1_POEFO Loading...

Transmembrane protein 184B

AlphaFold DB , UniProt , Accession A0A087X2T1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 426 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
1M35.2Very low30.8Very low231 Ų231171.4 Ų171.4100%1.13878%0.782SS**  038.20-66.4-178.3-141.500109.9
2S24.8Very low30.9Very low71 Ų71165.9 Ų165.950%0.49778%0.779SS.*  61.310268.364.60000110.4L4S2-L4 PolarHBondContact O-N 3.23Å
3Q28.5Very low31.1Very low183 Ų183166.9 Ų166.986%0.85578%0.783SS**SBend59.8-1.486.5-68.3-147.9-7.600115.5
4L30.8Very low31Very low127 Ų127171.1 Ų171.167%0.66579%0.788SS**  trans-80-25.6175.7-86.6150.2000112.5S2S2-L4 PolarHBondContact O-N 3.23Å
5W31.2Very low31.1Very low234 Ų234171.4 Ų171.489%0.88680%0.797SS**Hα-helixtrans-73.2-29-176.7-98.677.8000114.5
6W29.7Very low30.9Very low223 Ų223165 Ų16585%0.84579%0.792SS**Hα-helixtrans-80.4-19.8-179.5-92.893.4000114.2
7R30.4Very low30.8Very low209 Ų209162.7 Ų162.779%0.78980%0.797SS**Hα-helixtrans-85.8-26177.8-96.4-179.7170.2173.5-2.9113.5K9R7-K9 PolarHBondContact O-N 2.88Å
8A34.5Very low30.7Very low73 Ų73162.7 Ų162.760%0.60380%0.801SS**Hα-helixtrans-70.2-29.5-177.900000113.4R10A8-R10 PolarHBondContact O-N 2.98Å
9K33.1Very low30.8Very low182 Ų182160 Ų16079%0.79180%0.8SS**THydrogen-bonded Turntrans-77.2-19.9-177.1-138.9175.2-172.6-177.80114R7R7-K9 PolarHBondContact O-N 2.88Å
10R30.5Very low31.5Very low210 Ų210157.4 Ų157.479%0.79280%0.795SS**THydrogen-bonded Turntrans-92.4-5.1-174.8-148.3-176.8-90.2-162.3-5.1114A8A8-R10 PolarHBondContact O-N 2.98Å
11L30.1Very low31.4Very low142 Ų142158 Ų15874%0.74380%0.8SS**SBendtrans-102-10.4-178.2-98.7154.7000114
12S31.6Very low31.1Very low106 Ų106150.8 Ų150.874%0.74179%0.785SS**THydrogen-bonded Turntrans-86.4-9.8-177.5-171.10000114.7
13E34.1Very low31.2Very low179 Ų179155.3 Ų155.384%0.83680%0.803SS**THydrogen-bonded Turntrans-102.814.9-176.7-76.7-179137.600113.7
14R29.2Very low31.9Very low225 Ų225151.6 Ų151.685%0.84979%0.794SS**SBendtrans-117.714.2-173.2-118.8-177.9-170.9-135.61.4116.5
15L32.3Very low32.4Very low176 Ų176151.6 Ų151.692%0.92180%0.802SS**  trans-125.9100.1167.3-9993.2000109.8
16G28.9Very low32.3Very low69 Ų69144 Ų14471%0.71180%0.797SS**  trans-16994.7174.400000111.2
17S29.4Very low32.2Very low126 Ų126143.5 Ų143.588%0.88180%0.801SS**  trans60.8108.8157.760.20000119.7
18D28.4Very low32.8Very low163 Ų163138.7 Ų138.787%0.87280%0.797SS**  trans-106.7146.1161.2-108.2-27.5000110.7
19S33.1Very low32.6Very low111 Ų111140.7 Ų140.778%0.77681%0.806SS**  trans100.2151.3159.4-48.70000118.8
20P43.5Very low32.3Very low108 Ų108138 Ų13870%0.70181%0.805SS**  -136.1168.6-5037.1-21.5000111.6
21D30.5Very low32.2Very low169 Ų169134.6 Ų134.690%0.90481%0.807SS**  trans-178.2125.3140.6-91.8-25000114.5
22G28.5Very low32Very low80 Ų80132 Ų13283%0.82581%0.806SS**  trans60.2107.9131.400000123.4
23L27.7Very low32.5Very low167 Ų167132.5 Ų132.587%0.87481%0.807SS**  trans-80.8-179.6157.1-122.584.7000111.4
24P42.6Very low32.1Very low104 Ų104133.4 Ų133.468%0.67581%0.812SS**  cis-139.5-142.7-25.931.1-4.8000113
25P41.5Very low31.9Very low127 Ų127126 Ų12683%0.82581%0.805SS**  -121.6169.6-87.738.6-20.6000114.8
26G28.6Very low31.9Very low75 Ų75123 Ų12377%0.77380%0.798SS**  trans-168.6136.5170.500000115.3
27F27.1Very low31.9Very low212 Ų212127.2 Ų127.293%0.9381%0.805SS**  trans-83.4-176.8-165.9-94.7-73.2000115.2
28P44Very low32.3Very low108 Ų108126.6 Ų126.670%0.70180%0.801SS**  trans-107172-139.343.5-33.8000115.3
29S29.6Very low32.3Very low116 Ų116124 Ų12481%0.81180%0.795SS**  trans-162.1114.9161.2-690000108.9
30T26.2Very low32.4Very low125 Ų125130.9 Ų130.977%0.76780%0.804SS**  77.3104.575.8-52.40000114.8
31V29Very low31.9Very low138 Ų138129.3 Ų129.384%0.83680%0.8SS**  trans48.6125.8136-1710000117.7
32A27.1Very low32Very low87 Ų87127.1 Ų127.172%0.71980%0.795SS**  177.4178.559.900000111.4
33P42.1Very low32.3Very low117 Ų117130.3 Ų130.376%0.7679%0.792SS**  trans-104.1-171.6-156.642.2-35.9000116.1
34Q24.6Very low32.7Very low199 Ų199127.4 Ų127.493%0.9378%0.783SS**  trans100132.3177.4-61.1-177.412.400113.7
35G25.8Very low32.3Very low69 Ų69129.5 Ų129.571%0.71179%0.788SS**  cis-165.7162.410.300000110.5
36S32.6Very low32Very low112 Ų112129.6 Ų129.678%0.78379%0.786SS**  trans-47.3126.3175.949.30000113.5
37N28.9Very low32.1Very low159 Ų159133.4 Ų133.485%0.8578%0.781SS**  trans-132.8103.9147.8-88.1-23.7000108.5S39N37-S39 PolarHBondContact O-N 3.04Å
38S36.7Very low32.2Very low113 Ų113133.7 Ų133.779%0.7978%0.776SS**  trans-54.9109.5169.547.30000111
39S28.3Very low32.1Very low108 Ų108134.3 Ų134.376%0.75578%0.78SS**  trans-110.9118.1153.150.10000107.7N37 A41N37-S39 PolarHBondContact O-N 3.04Å; S39-A41 VanDerWaalsContact C-N 3.3Å; S39-A41 PolarHBondContact O-N 3.2Å
40W35.6Very low32.4Very low256 Ų256136.3 Ų136.397%0.9778%0.777SS**  trans-63.588.9173.6-80.476.7000109.4
41A32.7Very low33.2Very low74 Ų74138.3 Ų138.361%0.61278%0.777SS**  trans-91.4130.8159.200000107.4S39 I43S39-A41 VanDerWaalsContact C-N 3.3Å; S39-A41 PolarHBondContact O-N 3.2Å; A41-I43 PolarHBondContact O-N 2.78Å
42P33.7Very low33.9Very low124 Ų124139.1 Ų139.181%0.80577%0.772SS**  trans-61.9115.9168.23.36.9000106.9P44P42-P44 WeakPolarHBondContact O-CD 3.33Å; P42-P44 VanDerWaalsContact O-N 3.15Å
43I35.1Very low35.4Very low146 Ų146137.6 Ų137.675%0.74975%0.749SS**  trans-53.6119.4170.2-61.7163.6000106A41 L45A41-I43 PolarHBondContact O-N 2.78Å; I43-L45 PolarHBondContact O-N 2.76Å
44P35.5Very low36.7Very low106 Ų106137 Ų13769%0.68874%0.735SS**  trans-62.4112.8164.6-8.223.2000104.4P42 V46P42-P44 WeakPolarHBondContact O-CD 3.33Å; P42-P44 VanDerWaalsContact O-N 3.15Å; P44-V46 PolarHBondContact O-N 2.97Å
45L33.2Very low38.7Very low148 Ų148127.8 Ų127.878%0.77569%0.692SS**  trans-56.798.6167.2-80169000106I43 F47I43-L45 PolarHBondContact O-N 2.76Å; L45-F47 PolarHBondContact O-N 3.07Å
46V35.8Very low40.6Very low130 Ų130129.2 Ų129.279%0.78868%0.681SS**  trans-67.384.4167.2177.90000105.1P44 R48P44-V46 PolarHBondContact O-N 2.97Å; V46-R48 PolarHBondContact O-N 3.25Å
47F31.1Very low42.8Very low155 Ų155125.7 Ų125.768%0.6866%0.655SS**  trans-57.8116.5164.6-116.3-94.7000106.1L45 P49L45-F47 PolarHBondContact O-N 3.07Å; F47-P49 WeakPolarHBondContact O-CD 3.48Å
48R29.8Very low45Very low218 Ų218122.2 Ų122.282%0.82364%0.644SS**  trans-56.6126.3176-81.7-177173.9-179.3-1.4108.8V46 E50V46-R48 PolarHBondContact O-N 3.25Å; R48-E50 PolarHBondContact O-N 3.27Å
49P40Very low47.2Very low120 Ų120120.7 Ų120.778%0.77963%0.629SS**SBendtrans-82.765.1175.834.1-32.6000109.7F47F47-P49 WeakPolarHBondContact O-CD 3.48Å
50E37.1Very low49.7Very low159 Ų159115.6 Ų115.674%0.74359%0.594SS**  trans-158.644.5173.1-85.5-61.6156.500109.7R48R48-E50 PolarHBondContact O-N 3.27Å
51E42.5Very low51.9Low166 Ų166105.9 Ų105.978%0.77656%0.56SS**  trans-93.895.2157.9-76.7-163.2171.400107.3F53E51-F53 PolarHBondContact O-N 3.31Å
52Q44.3Very low54.5Low155 Ų155107.2 Ų107.272%0.72456%0.56SS**  trans-50.7116.4163-71.1178.4-14.300107.4F54Q52-F54 PolarHBondContact O-N 3.48Å; Q52-F54 VanDerWaalsContact O-N 3.07Å
53F59Low57.2Low56 Ų56105 Ų10525%0.24654%0.541CS..  trans-44120176.2-101.9-88.8000109.8E51 L55 M56 T57 I292 V304E51-F53 PolarHBondContact O-N 3.31Å; F53-L55 PolarHBondContact O-N 3.29Å; F53-L55 VanDerWaalsContact O-N 3.12Å; F53-M56 HydrophobicContact CB-CB 3.81Å; F53-M56 HydrophobicContact CB-CG 3.95Å; F53-M56 WeakPolarHBondContact O-CA 3.44Å; F53-M56 PolarHBondContact O-N 3.15Å; F53-T57 PolarHBondContact O-N 3.14Å; F53-T57 PolarHBondContact O-OG1 3.18Å; F53-I292 HydrophobicContact CD2-CD1 4.09Å; F53-I292 HydrophobicContact CE1-CD1 4.14Å; F53-I292 HydrophobicContact CE2-CB 4.01Å; F53-I292 HydrophobicContact CE2-CD1 3.21Å; F53-I292 HydrophobicContact CE2-CG1 4.16Å; F53-I292 HydrophobicContact CE2-CG2 4.04Å; F53-I292 HydrophobicContact CZ-CB 4.3Å; F53-I292 HydrophobicContact CZ-CD1 3.25Å; F53-I292 HydrophobicContact CZ-CG1 4.26Å; F53-V304 HydrophobicContact CE1-CB 4.2Å; F53-V304 HydrophobicContact CE1-CG1 3.63Å; F53-V304 HydrophobicContact CE1-CG2 3.58Å; F53-V304 HydrophobicContact CZ-CG1 4.31Å; F53-V304 HydrophobicContact CZ-CG2 3.53Å
54F69.6Low59.7Low103 Ų10398.1 Ų98.145%0.45251%0.505SS..G310 helixtrans-52.2-38.3179.1175.7-100.9000111.5Q52 M56 T57 A60 Y308 F311Q52-F54 PolarHBondContact O-N 3.48Å; Q52-F54 VanDerWaalsContact O-N 3.07Å; F54-M56 PolarHBondContact O-N 3.43Å; F54-T57 WeakPolarHBondContact O-CB 3.14Å; F54-T57 PolarHBondContact O-N 3.21Å; F54-T57 PolarHBondContact O-OG1 3.47Å; F54-A60 HydrophobicContact CE1-CB 4.28Å; F54-A60 HydrophobicContact CZ-CB 4.48Å; F54-A60 WeakPolarHBondContact O-CB 3.47Å; F54-Y308 HydrophobicContact CD1-CE1 4.35Å; F54-F311 HydrophobicContact CE1-CE1 4.24Å; F54-F311 HydrophobicContact CE1-CZ 4.27Å
55L66.3Low62.3Low6 Ų693.4 Ų93.43%0.03148%0.476CS..G310 helixtrans-67.6-28.8176.6-66.7170.3000114.5F53 T57 L113 F116 Y308 F311F53-L55 PolarHBondContact O-N 3.29Å; F53-L55 VanDerWaalsContact O-N 3.12Å; L55-T57 VanDerWaalsContact C-N 3.32Å; L55-L113 HydrophobicContact CD2-CD2 4.4Å; L55-F116 HydrophobicContact CB-CE2 4.27Å; L55-F116 HydrophobicContact CB-CZ 4.33Å; L55-F116 HydrophobicContact CD1-CZ 4.18Å; L55-Y308 HydrophobicContact CD1-CD1 4Å; L55-Y308 HydrophobicContact CD1-CD2 3.59Å; L55-Y308 HydrophobicContact CD1-CE1 4.06Å; L55-Y308 HydrophobicContact CD1-CE2 3.66Å; L55-Y308 HydrophobicContact CD1-CG 3.76Å; L55-Y308 HydrophobicContact CD2-CD1 4Å; L55-Y308 HydrophobicContact CD2-CE1 4.17Å; L55-Y308 HydrophobicContact CD2-CG 4.43Å; L55-Y308 HydrophobicContact CG-CD1 4.09Å; L55-Y308 HydrophobicContact CG-CD2 4.47Å; L55-Y308 HydrophobicContact CG-CE1 3.9Å; L55-Y308 HydrophobicContact CG-CE2 4.3Å; L55-Y308 HydrophobicContact CG-CG 4.37Å; L55-F311 HydrophobicContact CD2-CB 3.73Å; L55-F311 HydrophobicContact CD2-CG 4.14Å
56M64.2Low65.1Low99 Ų9993 Ų9349%0.48847%0.469SS..G310 helixtrans-85.8-6.2175.7-78.5-83.6170.800112.4F53 F54 F116F53-M56 HydrophobicContact CB-CB 3.81Å; F53-M56 HydrophobicContact CB-CG 3.95Å; F53-M56 WeakPolarHBondContact O-CA 3.44Å; F53-M56 PolarHBondContact O-N 3.15Å; F54-M56 PolarHBondContact O-N 3.43Å; M56-F116 HydrophobicContact CE-CB 3.45Å; M56-F116 VanDerWaalsContact CE-CB 3.45Å; M56-F116 HydrophobicContact CE-CD2 4.3Å; M56-F116 HydrophobicContact CE-CG 4.09Å
57T79Confident67.8Low38 Ų3889.2 Ų89.223%0.23344%0.441CS..SBendtrans-73.9134.4179.2-500000109.5F53 F54 L55 T59 A60 Q61F53-T57 PolarHBondContact O-N 3.14Å; F53-T57 PolarHBondContact O-OG1 3.18Å; F54-T57 WeakPolarHBondContact O-CB 3.14Å; F54-T57 PolarHBondContact O-N 3.21Å; F54-T57 PolarHBondContact O-OG1 3.47Å; L55-T57 VanDerWaalsContact C-N 3.32Å; T57-T59 HydrophobicContact CG2-CG2 4.3Å; T57-T59 WeakPolarHBondContact CG2-OG1 3.32Å; T57-T59 PolarHBondContact O-N 3.12Å; T57-A60 PolarHBondContact O-N 2.88Å; T57-Q61 PolarHBondContact O-N 3.35Å
58S76.1Confident70.7Confident87 Ų8781.8 Ų81.861%0.60841%0.409SS*.Hα-helixtrans-57.5-23.9179.1-54.10000113.3T62S58-T62 WeakPolarHBondContact O-CB 3.39Å; S58-T62 PolarHBondContact O-N 3.2Å; S58-T62 PolarHBondContact O-OG1 3.41Å
59T82.6Confident73.8Confident80 Ų8078 Ų7849%0.49140%0.395SS..Hα-helixtrans-65.8-48.6174.454.30000111.9T57 Q61 T62 I63T57-T59 HydrophobicContact CG2-CG2 4.3Å; T57-T59 WeakPolarHBondContact CG2-OG1 3.32Å; T57-T59 PolarHBondContact O-N 3.12Å; T59-Q61 PolarHBondContact O-N 3.47Å; T59-T62 PolarHBondContact O-N 3.04Å; T59-I63 WeakPolarHBondContact O-CB 3.39Å; T59-I63 WeakPolarHBondContact O-CD1 3.48Å; T59-I63 WeakPolarHBondContact O-CG1 3.34Å; T59-I63 PolarHBondContact O-N 2.92Å
60A80.1Confident76.4Confident2 Ų274.1 Ų74.12%0.01737%0.369CS..Hα-helixtrans-63.1-42.9179.700000111.5F54 T57 T62 I63 S64 F311F54-A60 HydrophobicContact CE1-CB 4.28Å; F54-A60 HydrophobicContact CZ-CB 4.48Å; F54-A60 WeakPolarHBondContact O-CB 3.47Å; T57-A60 PolarHBondContact O-N 2.88Å; A60-T62 PolarHBondContact O-N 2.73Å; A60-I63 PolarHBondContact O-N 3.43Å; A60-S64 PolarHBondContact O-N 3.03Å; A60-S64 PolarHBondContact O-OG 3.48Å; A60-F311 HydrophobicContact CB-CE2 4.15Å
61Q82.5Confident79Confident52 Ų5266.6 Ų66.624%0.24333%0.334CS..Hα-helixtrans-65.2-36.7176.7-66.4179.4-1000112.9T57 T59 S64 G65T57-Q61 PolarHBondContact O-N 3.35Å; T59-Q61 PolarHBondContact O-N 3.47Å; Q61-S64 PolarHBondContact O-OG 2.85Å; Q61-S64 VanDerWaalsContact O-OG 3.1Å; Q61-G65 PolarHBondContact O-N 3.06Å
62T87.4Confident81.5Confident101 Ų10159.8 Ų59.862%0.6230%0.302SS*.Hα-helixtrans-69.9-42.1176.8-58.10000111.1S58 T59 A60 G65 F66S58-T62 WeakPolarHBondContact O-CB 3.39Å; S58-T62 PolarHBondContact O-N 3.2Å; S58-T62 PolarHBondContact O-OG1 3.41Å; T59-T62 PolarHBondContact O-N 3.04Å; A60-T62 PolarHBondContact O-N 2.73Å; T62-G65 PolarHBondContact O-N 3.38Å; T62-F66 PolarHBondContact O-N 3.42Å
63I89.4Confident83.9Confident78 Ų7858.1 Ų58.140%0.430%0.298SS..Hα-helixtrans-64-49.2178.3-68.5164.3000110.3T59 A60 G65 F66 F67T59-I63 WeakPolarHBondContact O-CB 3.39Å; T59-I63 WeakPolarHBondContact O-CD1 3.48Å; T59-I63 WeakPolarHBondContact O-CG1 3.34Å; T59-I63 PolarHBondContact O-N 2.92Å; A60-I63 PolarHBondContact O-N 3.43Å; I63-G65 VanDerWaalsContact C-N 3.34Å; I63-G65 PolarHBondContact O-N 3.16Å; I63-F66 PolarHBondContact O-N 2.84Å; I63-F67 HydrophobicContact CG2-CD2 3.85Å; I63-F67 HydrophobicContact CG2-CE2 3.64Å; I63-F67 WeakPolarHBondContact O-CD2 3.48Å; I63-F67 PolarHBondContact O-N 3.38Å; I63-F67 VanDerWaalsContact O-N 3.17Å
64S87.7Confident85.5Confident1 Ų156.8 Ų56.81%0.00729%0.293CS..Hα-helixtrans-62-43178.363.90000111.5A60 Q61 F66 F67 V68A60-S64 PolarHBondContact O-N 3.03Å; A60-S64 PolarHBondContact O-OG 3.48Å; Q61-S64 PolarHBondContact O-OG 2.85Å; Q61-S64 VanDerWaalsContact O-OG 3.1Å; S64-F66 PolarHBondContact O-N 2.7Å; S64-F67 PolarHBondContact O-N 3.28Å; S64-V68 WeakPolarHBondContact O-CB 3.41Å; S64-V68 WeakPolarHBondContact O-CG2 2.89Å; S64-V68 PolarHBondContact O-N 3.48Å
65G90Very high86.6Confident8 Ų851.9 Ų51.98%0.08227%0.272CS..Hα-helixtrans-57.9-43.8174.700000112.9Q61 T62 I63 V68 W69Q61-G65 PolarHBondContact O-N 3.06Å; T62-G65 PolarHBondContact O-N 3.38Å; I63-G65 VanDerWaalsContact C-N 3.34Å; I63-G65 PolarHBondContact O-N 3.16Å; G65-V68 PolarHBondContact O-N 3.04Å; G65-W69 WeakPolarHBondContact O-CB 3.47Å; G65-W69 PolarHBondContact O-N 2.7Å
66F93Very high87.8Confident139 Ų13955 Ų5561%0.6129%0.293SS*.Hα-helixtrans-61-46.4177.7176.4-97.7000112.6T62 I63 S64 T70T62-F66 PolarHBondContact O-N 3.42Å; I63-F66 PolarHBondContact O-N 2.84Å; S64-F66 PolarHBondContact O-N 2.7Å; F66-T70 WeakPolarHBondContact O-CB 3.21Å; F66-T70 PolarHBondContact O-N 2.95Å; F66-T70 PolarHBondContact O-OG1 3.02Å
67F92.2Very high89.1Confident50 Ų5054 Ų5422%0.21929%0.287CS..Hα-helixtrans-63.6-42.8177.2-77.8-66.9000111.9I63 S64 T70 A71 I315 F318I63-F67 HydrophobicContact CG2-CD2 3.85Å; I63-F67 HydrophobicContact CG2-CE2 3.64Å; I63-F67 WeakPolarHBondContact O-CD2 3.48Å; I63-F67 PolarHBondContact O-N 3.38Å; I63-F67 VanDerWaalsContact O-N 3.17Å; S64-F67 PolarHBondContact O-N 3.28Å; F67-T70 PolarHBondContact O-N 3.35Å; F67-A71 WeakPolarHBondContact O-CB 3.36Å; F67-A71 PolarHBondContact O-N 3.31Å; F67-I315 HydrophobicContact CD2-CG1 4.09Å; F67-I315 HydrophobicContact CE2-CG1 4.39Å; F67-F318 HydrophobicContact CB-CB 4.31Å; F67-F318 HydrophobicContact CD1-CB 3.97Å; F67-F318 AromaticContact CD1-CD1 3.87Å; F67-F318 HydrophobicContact CD1-CD1 3.87Å; F67-F318 HydrophobicContact CD1-CD2 4.37Å; F67-F318 HydrophobicContact CD1-CE1 4.49Å; F67-F318 AromaticContact CD1-CG 3.8Å; F67-F318 HydrophobicContact CD1-CG 3.8Å; F67-F318 HydrophobicContact CE1-CD1 4.08Å; F67-F318 HydrophobicContact CE1-CE1 4.39Å; F67-F318 HydrophobicContact CE1-CG 4.46Å
68V92.8Very high89.7Confident0 Ų052.2 Ų52.20%028%0.276CS..Hα-helixtrans-63.4-50.4179.5168.60000111.1S64 G65 T70 A71 L72 A106 W110 C314S64-V68 WeakPolarHBondContact O-CB 3.41Å; S64-V68 WeakPolarHBondContact O-CG2 2.89Å; S64-V68 PolarHBondContact O-N 3.48Å; G65-V68 PolarHBondContact O-N 3.04Å; V68-T70 VanDerWaalsContact C-N 3.29Å; V68-T70 PolarHBondContact O-N 3.18Å; V68-A71 WeakPolarHBondContact O-CB 3.14Å; V68-A71 PolarHBondContact O-N 3.11Å; V68-L72 HydrophobicContact CG1-CD1 4.11Å; V68-L72 HydrophobicContact CG1-CG 4.42Å; V68-L72 WeakPolarHBondContact O-CB 3.33Å; V68-L72 VanDerWaalsContact O-CG 3.3Å; V68-L72 WeakPolarHBondContact O-CG 3.2Å; V68-L72 PolarHBondContact O-N 3.48Å; V68-A106 HydrophobicContact CB-CB 4.49Å; V68-A106 HydrophobicContact CG1-CB 4.03Å; V68-A106 HydrophobicContact CG2-CB 4.25Å; V68-W110 HydrophobicContact CB-CB 4.36Å; V68-W110 HydrophobicContact CB-CG 4.48Å; V68-W110 HydrophobicContact CG1-CB 4.01Å; V68-W110 HydrophobicContact CG1-CG 4.28Å; V68-W110 HydrophobicContact CG2-CB 3.92Å; V68-W110 HydrophobicContact CG2-CG 4.36Å; V68-C314 HydrophobicContact CG2-CB 3.71Å
69W93.9Very high90.3Very high139 Ų13948.6 Ų48.653%0.52725%0.25SC..Hα-helixtrans-61.3-38.6177.7-83.4106.6000112.4G65 L72 L73 W110G65-W69 WeakPolarHBondContact O-CB 3.47Å; G65-W69 PolarHBondContact O-N 2.7Å; W69-L72 HydrophobicContact CE3-CD1 4.26Å; W69-L72 PolarHBondContact O-N 3.03Å; W69-L73 WeakPolarHBondContact O-CG 3.5Å; W69-L73 PolarHBondContact O-N 2.79Å; W69-W110 AromaticContact NE1-CH2 3.78Å
70T94.1Very high90.6Very high38 Ų3849.5 Ų49.523%0.23325%0.245CC..Hα-helixtrans-66.1-43.6176.1-53.50000111.4F66 F67 V68 L72 L73 I74 F318F66-T70 WeakPolarHBondContact O-CB 3.21Å; F66-T70 PolarHBondContact O-N 2.95Å; F66-T70 PolarHBondContact O-OG1 3.02Å; F67-T70 PolarHBondContact O-N 3.35Å; V68-T70 VanDerWaalsContact C-N 3.29Å; V68-T70 PolarHBondContact O-N 3.18Å; T70-L72 VanDerWaalsContact C-N 3.35Å; T70-L72 PolarHBondContact O-N 2.93Å; T70-L73 PolarHBondContact O-N 3.04Å; T70-I74 HydrophobicContact CG2-CD1 4.05Å; T70-I74 VanDerWaalsContact O-CG1 3.3Å; T70-I74 WeakPolarHBondContact O-CG1 3.5Å; T70-I74 PolarHBondContact O-N 3.19Å; T70-F318 HydrophobicContact CG2-CD2 3.98Å; T70-F318 HydrophobicContact CG2-CE2 3.56Å
71A93.2Very high90.9Very high0 Ų050.5 Ų50.50%025%0.249CC..Hα-helixtrans-60.8-42.7175.200000111.9F67 V68 I74 T75 V102 F318 A321F67-A71 WeakPolarHBondContact O-CB 3.36Å; F67-A71 PolarHBondContact O-N 3.31Å; V68-A71 WeakPolarHBondContact O-CB 3.14Å; V68-A71 PolarHBondContact O-N 3.11Å; A71-I74 PolarHBondContact O-N 3.37Å; A71-T75 WeakPolarHBondContact O-CB 3.41Å; A71-T75 WeakPolarHBondContact O-CG2 3.11Å; A71-T75 PolarHBondContact O-N 3.37Å; A71-T75 PolarHBondContact O-OG1 3.3Å; A71-V102 HydrophobicContact CB-CG1 4.19Å; A71-F318 HydrophobicContact CB-CB 4.35Å; A71-A321 HydrophobicContact CB-CB 4.18Å
72L93.4Very high91.1Very high23 Ų2348 Ų4812%0.1224%0.238CC..Hα-helixtrans-60.2-47.6174.8-71.7176.4000111.6V68 W69 T70 I74 T75 C76 P103V68-L72 HydrophobicContact CG1-CD1 4.11Å; V68-L72 HydrophobicContact CG1-CG 4.42Å; V68-L72 WeakPolarHBondContact O-CB 3.33Å; V68-L72 VanDerWaalsContact O-CG 3.3Å; V68-L72 WeakPolarHBondContact O-CG 3.2Å; V68-L72 PolarHBondContact O-N 3.48Å; W69-L72 HydrophobicContact CE3-CD1 4.26Å; W69-L72 PolarHBondContact O-N 3.03Å; T70-L72 VanDerWaalsContact C-N 3.35Å; T70-L72 PolarHBondContact O-N 2.93Å; L72-I74 PolarHBondContact O-N 3.2Å; L72-T75 WeakPolarHBondContact CA-OG1 3.29Å; L72-T75 PolarHBondContact O-N 3.34Å; L72-T75 PolarHBondContact O-OG1 2.82Å; L72-T75 VanDerWaalsContact O-OG1 3.06Å; L72-C76 WeakPolarHBondContact O-CB 3.24Å; L72-C76 PolarHBondContact O-N 3.49Å; L72-C76 PolarHBondContact O-SG 3.2Å; L72-P103 VanDerWaalsContact CD2-CA 3.49Å; L72-P103 HydrophobicContact CD2-CB 3.38Å
73L94.6Very high90.9Very high120 Ų12043.8 Ų43.863%0.62821%0.212SC*.Hα-helixtrans-62.2-43178.6-72173.9000112.3W69 T70 H77W69-L73 WeakPolarHBondContact O-CG 3.5Å; W69-L73 PolarHBondContact O-N 2.79Å; T70-L73 PolarHBondContact O-N 3.04Å; L73-H77 VanDerWaalsContact O-CB 3.26Å; L73-H77 WeakPolarHBondContact O-CB 3.11Å; L73-H77 PolarHBondContact O-N 3.07Å
74I93.1Very high90.6Very high29 Ų2946.1 Ų46.115%0.14922%0.215CC..Hα-helixtrans-62.2-48178.8-69.4168.7000110.7T70 A71 L72 Q78 F318 A321 V322T70-I74 HydrophobicContact CG2-CD1 4.05Å; T70-I74 VanDerWaalsContact O-CG1 3.3Å; T70-I74 WeakPolarHBondContact O-CG1 3.5Å; T70-I74 PolarHBondContact O-N 3.19Å; A71-I74 PolarHBondContact O-N 3.37Å; L72-I74 PolarHBondContact O-N 3.2Å; I74-Q78 WeakPolarHBondContact O-CB 3.24Å; I74-Q78 PolarHBondContact O-N 2.87Å; I74-F318 HydrophobicContact CD1-CD2 4.4Å; I74-F318 HydrophobicContact CD1-CE2 3.97Å; I74-A321 HydrophobicContact CB-CB 4.34Å; I74-A321 HydrophobicContact CG2-CB 4.08Å; I74-V322 HydrophobicContact CD1-CG2 4.09Å
75T92.6Very high90.4Very high0 Ų048.1 Ų48.10%022%0.223CC..Hα-helixtrans-71-44-177.650.20000112.2A71 L72 H77 Q78 I79 V102 A321A71-T75 WeakPolarHBondContact O-CB 3.41Å; A71-T75 WeakPolarHBondContact O-CG2 3.11Å; A71-T75 PolarHBondContact O-N 3.37Å; A71-T75 PolarHBondContact O-OG1 3.3Å; L72-T75 WeakPolarHBondContact CA-OG1 3.29Å; L72-T75 PolarHBondContact O-N 3.34Å; L72-T75 PolarHBondContact O-OG1 2.82Å; L72-T75 VanDerWaalsContact O-OG1 3.06Å; T75-H77 VanDerWaalsContact C-N 3.32Å; T75-H77 PolarHBondContact O-N 3.3Å; T75-Q78 WeakPolarHBondContact O-CB 2.99Å; T75-Q78 PolarHBondContact O-N 3.42Å; T75-Q78 VanDerWaalsContact O-N 3.08Å; T75-I79 VanDerWaalsContact O-CG1 3.32Å; T75-I79 WeakPolarHBondContact O-CG1 3.42Å; T75-I79 PolarHBondContact O-N 3.31Å; T75-V102 HydrophobicContact CG2-CB 3.82Å; T75-V102 HydrophobicContact CG2-CG1 3.63Å; T75-V102 HydrophobicContact CG2-CG2 4.46Å; T75-A321 HydrophobicContact CG2-CB 3.84Å
76C91.9Very high89.9Confident71 Ų7150.4 Ų50.448%0.4823%0.229SC..Hα-helixtrans-57.9-44.3173.8-75.10000111.6L72 Q78 I79 Y80L72-C76 WeakPolarHBondContact O-CB 3.24Å; L72-C76 PolarHBondContact O-N 3.49Å; L72-C76 PolarHBondContact O-SG 3.2Å; C76-Q78 VanDerWaalsContact C-N 3.34Å; C76-Q78 PolarHBondContact O-N 3Å; C76-I79 PolarHBondContact O-N 3.35Å; C76-Y80 VanDerWaalsContact O-CB 3.3Å; C76-Y80 WeakPolarHBondContact O-CB 3.22Å; C76-Y80 PolarHBondContact O-N 2.91Å
77H92.4Very high89.2Confident78 Ų7845.8 Ų45.836%0.36121%0.214SC..Hα-helixtrans-60.9-43.4174.1175.3-84.7000111.5L73 T75 Y80 M81L73-H77 VanDerWaalsContact O-CB 3.26Å; L73-H77 WeakPolarHBondContact O-CB 3.11Å; L73-H77 PolarHBondContact O-N 3.07Å; T75-H77 VanDerWaalsContact C-N 3.32Å; T75-H77 PolarHBondContact O-N 3.3Å; H77-Y80 PolarHBondContact O-N 3.42Å; H77-M81 VanDerWaalsContact O-CG 3.29Å; H77-M81 WeakPolarHBondContact O-CG 3.37Å; H77-M81 PolarHBondContact O-N 3.47Å
78Q90.2Very high88.7Confident0 Ų044.7 Ų44.70%021%0.213CC..Hα-helixtrans-64.8-44.5178.7-168.7-175.6-8.800112.3I74 T75 C76 M81 H82 L99 L324 F328I74-Q78 WeakPolarHBondContact O-CB 3.24Å; I74-Q78 PolarHBondContact O-N 2.87Å; T75-Q78 WeakPolarHBondContact O-CB 2.99Å; T75-Q78 PolarHBondContact O-N 3.42Å; T75-Q78 VanDerWaalsContact O-N 3.08Å; C76-Q78 VanDerWaalsContact C-N 3.34Å; C76-Q78 PolarHBondContact O-N 3Å; Q78-M81 PolarHBondContact O-N 2.75Å; Q78-H82 PolarHBondContact O-CD2 3.34Å; Q78-H82 VanDerWaalsContact O-CD2 3.32Å; Q78-H82 PolarHBondContact O-N 3.2Å; Q78-L99 HydrophobicContact CB-CD2 4.03Å; Q78-L99 HydrophobicContact CG-CD2 3.53Å; Q78-L324 PolarHBondContact NE2-O 2.96Å; Q78-F328 PolarHBondContact NE2-O 3.48Å
79I89.9Confident88.1Confident12 Ų1247.6 Ų47.66%0.06223%0.232CC..Hα-helixtrans-61.4-46.3176-68.4165.4000109.9T75 C76 M81 H82 L83 V96 L99 F100T75-I79 VanDerWaalsContact O-CG1 3.32Å; T75-I79 WeakPolarHBondContact O-CG1 3.42Å; T75-I79 PolarHBondContact O-N 3.31Å; C76-I79 PolarHBondContact O-N 3.35Å; I79-M81 VanDerWaalsContact C-N 3.32Å; I79-M81 PolarHBondContact O-N 3.38Å; I79-H82 PolarHBondContact O-N 3.25Å; I79-L83 HydrophobicContact CG2-CD1 3.82Å; I79-L83 HydrophobicContact CG2-CG 4.31Å; I79-L83 WeakPolarHBondContact O-CG 3.43Å; I79-L83 PolarHBondContact O-N 3.46Å; I79-V96 HydrophobicContact CG2-CG1 4.14Å; I79-L99 HydrophobicContact CD1-CB 4.3Å; I79-L99 HydrophobicContact CG1-CB 3.95Å; I79-L99 HydrophobicContact CG1-CD2 3.9Å; I79-F100 HydrophobicContact CD1-CD1 4.05Å; I79-F100 HydrophobicContact CD1-CD2 4.21Å; I79-F100 HydrophobicContact CD1-CE1 3.91Å; I79-F100 HydrophobicContact CD1-CE2 4.07Å; I79-F100 HydrophobicContact CD1-CG 4.18Å; I79-F100 HydrophobicContact CD1-CZ 3.91Å; I79-F100 HydrophobicContact CG2-CE2 4.3Å; I79-F100 HydrophobicContact CG2-CZ 4.25Å
80Y88.6Confident87.6Confident99 Ų9945.7 Ų45.739%0.38823%0.232SC..Hα-helixtrans-57.1-44.6176.4172.7-98.3000112C76 H77 L83 R84 I359C76-Y80 VanDerWaalsContact O-CB 3.3Å; C76-Y80 WeakPolarHBondContact O-CB 3.22Å; C76-Y80 PolarHBondContact O-N 2.91Å; H77-Y80 PolarHBondContact O-N 3.42Å; Y80-L83 PolarHBondContact O-N 3.27Å; Y80-R84 VanDerWaalsContact O-CB 3.29Å; Y80-R84 WeakPolarHBondContact O-CB 3.4Å; Y80-R84 PolarHBondContact O-N 2.99Å; Y80-I359 HydrophobicContact CD2-CD1 4.45Å; Y80-I359 HydrophobicContact CE2-CD1 3.86Å
81M85.8Confident87.1Confident22 Ų2245.1 Ų45.111%0.10823%0.227CC..Hα-helixtrans-64.5-42.2177.8-69.4-65.1-78.800112H77 Q78 I79 L83 R84 Y85 Y330H77-M81 VanDerWaalsContact O-CG 3.29Å; H77-M81 WeakPolarHBondContact O-CG 3.37Å; H77-M81 PolarHBondContact O-N 3.47Å; Q78-M81 PolarHBondContact O-N 2.75Å; I79-M81 VanDerWaalsContact C-N 3.32Å; I79-M81 PolarHBondContact O-N 3.38Å; M81-L83 PolarHBondContact O-N 3.17Å; M81-R84 PolarHBondContact O-N 3.31Å; M81-Y85 HydrophobicContact CE-CD2 4.31Å; M81-Y85 HydrophobicContact CE-CE2 3.6Å; M81-Y85 VanDerWaalsContact O-CD2 3.27Å; M81-Y85 WeakPolarHBondContact O-CD2 3.39Å; M81-Y85 PolarHBondContact O-N 3.06Å; M81-Y85 HydrophobicContact SD-CE2 4.15Å; M81-Y330 HydrophobicContact CB-CD1 3.89Å; M81-Y330 HydrophobicContact CB-CD2 4.09Å; M81-Y330 HydrophobicContact CB-CE1 4.38Å; M81-Y330 HydrophobicContact CB-CG 3.73Å; M81-Y330 HydrophobicContact CE-CD2 3.66Å; M81-Y330 HydrophobicContact CE-CE1 4.34Å; M81-Y330 HydrophobicContact CE-CE2 3.17Å; M81-Y330 HydrophobicContact CE-CG 4.41Å; M81-Y330 HydrophobicContact CG-CD1 4.35Å; M81-Y330 HydrophobicContact CG-CE1 4.34Å; M81-Y330 HydrophobicContact CG-CG 4.46Å
82H86.4Confident86.8Confident0 Ų045.1 Ų45.10%023%0.227CC..Hα-helixtrans-62.1-40.3174.5-83.6-66.8000112.7Q78 I79 Y85 Y86 Q92 V96 F328 Y333Q78-H82 PolarHBondContact O-CD2 3.34Å; Q78-H82 VanDerWaalsContact O-CD2 3.32Å; Q78-H82 PolarHBondContact O-N 3.2Å; I79-H82 PolarHBondContact O-N 3.25Å; H82-Y85 CarbonylContact O-C 3.36Å; H82-Y86 PolarHBondContact O-N 2.96Å; H82-Q92 PolarHBondContact O-NE2 3.05Å; H82-V96 HydrophobicContact CB-CG2 3.91Å; H82-F328 PolarHBondContact NE2-O 2.75Å; H82-Y333 AromaticContact CE1-CD2 3.82Å; H82-Y333 AromaticContact CE1-CE2 3.92Å; H82-Y333 AromaticContact ND1-CD2 3.83Å
83L84.8Confident86.5Confident13 Ų1346.1 Ų46.17%0.06823%0.229CC..Hα-helixtrans-71.2-32.2176-67.1172.7000112.7I79 Y80 M81 I359 L363I79-L83 HydrophobicContact CG2-CD1 3.82Å; I79-L83 HydrophobicContact CG2-CG 4.31Å; I79-L83 WeakPolarHBondContact O-CG 3.43Å; I79-L83 PolarHBondContact O-N 3.46Å; Y80-L83 PolarHBondContact O-N 3.27Å; M81-L83 PolarHBondContact O-N 3.17Å; L83-I359 HydrophobicContact CB-CG2 4.06Å; L83-I359 HydrophobicContact CD1-CG2 3.84Å; L83-L363 HydrophobicContact CD1-CB 4.23Å; L83-L363 HydrophobicContact CD1-CD1 4.21Å
84R83.1Confident86.2Confident127 Ų12741.1 Ų41.148%0.47920%0.202SC..Hα-helixtrans-70.3-36.8177-176.8173.2-178.7167.2-1.9111.9Y80 M81 R337Y80-R84 VanDerWaalsContact O-CB 3.29Å; Y80-R84 WeakPolarHBondContact O-CB 3.4Å; Y80-R84 PolarHBondContact O-N 2.99Å; M81-R84 PolarHBondContact O-N 3.31Å; R84-R337 PolarHBondContact O-NH1 3.42Å
85Y82Confident86Confident43 Ų4339.8 Ų39.817%0.16920%0.195CC..THydrogen-bonded Turntrans-107.951.9177.8-59-78000111M81 H82 S87 Q92 M334M81-Y85 HydrophobicContact CE-CD2 4.31Å; M81-Y85 HydrophobicContact CE-CE2 3.6Å; M81-Y85 VanDerWaalsContact O-CD2 3.27Å; M81-Y85 WeakPolarHBondContact O-CD2 3.39Å; M81-Y85 PolarHBondContact O-N 3.06Å; M81-Y85 HydrophobicContact SD-CE2 4.15Å; H82-Y85 CarbonylContact O-C 3.36Å; Y85-S87 VanDerWaalsContact C-N 3.26Å; Y85-S87 PolarHBondContact O-N 3.41Å; Y85-Q92 PolarHBondContact O-NE2 3.47Å; Y85-Q92 PolarHBondContact O-OE1 3.1Å; Y85-M334 HydrophobicContact CD1-CB 4.13Å; Y85-M334 HydrophobicContact CD1-CG 3.86Å; Y85-M334 HydrophobicContact CD2-CB 4.47Å; Y85-M334 HydrophobicContact CE1-CB 4.38Å; Y85-M334 HydrophobicContact CE1-CG 3.64Å; Y85-M334 HydrophobicContact CE1-SD 4.43Å; Y85-M334 HydrophobicContact CE2-CG 4.37Å; Y85-M334 HydrophobicContact CG-CB 4.19Å; Y85-M334 HydrophobicContact CG-CG 4.32Å
86Y80.1Confident85.9Confident55 Ų5539.8 Ų39.822%0.21620%0.195CC..  trans-78.968.8-177.5-157-112.8000111.9H82 P89 Q92 T366H82-Y86 PolarHBondContact O-N 2.96Å; Y86-P89 HydrophobicContact CD1-CB 4.23Å; Y86-P89 HydrophobicContact CE1-CB 3.45Å; Y86-P89 VanDerWaalsContact CE1-CB 3.45Å; Y86-P89 PolarHBondContact OH-O 2.99Å; Y86-Q92 VanDerWaalsContact C-OE1 3.32Å; Y86-Q92 VanDerWaalsContact CA-OE1 3.26Å; Y86-Q92 HydrophobicContact CD2-CB 3.95Å; Y86-Q92 HydrophobicContact CE2-CB 3.73Å; Y86-T366 PolarHBondContact OH-OG1 3.47Å
87S78.6Confident85.8Confident42 Ų4236.4 Ų36.429%0.29417%0.173SC..SBendtrans-88.4-29-177.3-62.10000113.7Y85 Y333 R337Y85-S87 VanDerWaalsContact C-N 3.26Å; Y85-S87 PolarHBondContact O-N 3.41Å; S87-Y333 PolarHBondContact OG-O 3.35Å; S87-R337 WeakPolarHBondContact OG-CB 3.38Å
88S80.8Confident85.7Confident28 Ų2832.8 Ų32.820%0.19616%0.156CC..  trans-127.783.1-176.8-59.40000109.2N90 E91 Q92S88-N90 VanDerWaalsContact C-N 3.3Å; S88-N90 PolarHBondContact O-N 3.47Å; S88-E91 PolarHBondContact O-N 3.11Å; S88-Q92 WeakPolarHBondContact O-CB 3.4Å; S88-Q92 WeakPolarHBondContact O-CG 3.29Å; S88-Q92 PolarHBondContact O-N 2.93Å; S88-Q92 PolarHBondContact O-OE1 2.7Å
89P80.8Confident85.6Confident60 Ų6032.8 Ų32.839%0.3916%0.156SC..Hα-helixtrans-61.2-35.9-169.124.1-34.7000113.2Y86 R93Y86-P89 HydrophobicContact CD1-CB 4.23Å; Y86-P89 HydrophobicContact CE1-CB 3.45Å; Y86-P89 VanDerWaalsContact CE1-CB 3.45Å; Y86-P89 PolarHBondContact OH-O 2.99Å; P89-R93 WeakPolarHBondContact O-CB 3.44Å; P89-R93 PolarHBondContact O-N 2.68Å
90N82.5Confident85.6Confident99 Ų9934.4 Ų34.453%0.52916%0.162SC..Hα-helixtrans-63.1-46.6-177.8-60.8-10.1000112S88 H94 E146S88-N90 VanDerWaalsContact C-N 3.3Å; S88-N90 PolarHBondContact O-N 3.47Å; N90-H94 PolarHBondContact O-ND1 3.43Å; N90-E146 HydrophobicContact CB-CG 4.38Å; N90-E146 WeakPolarHBondContact CB-OE2 3.34Å
91E85.5Confident85.6Confident27 Ų2730 Ų3013%0.12615%0.145CC..Hα-helixtrans-74.5-49.2177.5-60.2173.2-165.500111.5S88 R93 H94 I95 L143 E146 Y147 Y333S88-E91 PolarHBondContact O-N 3.11Å; E91-R93 VanDerWaalsContact C-N 3.29Å; E91-R93 PolarHBondContact O-N 2.82Å; E91-H94 PolarHBondContact O-N 3.24Å; E91-I95 WeakPolarHBondContact O-CG1 3.48Å; E91-I95 PolarHBondContact O-N 3.22Å; E91-I95 VanDerWaalsContact O-N 3.09Å; E91-L143 HydrophobicContact CB-CD1 4.11Å; E91-L143 WeakPolarHBondContact O-CD1 3.13Å; E91-E146 HydrophobicContact CG-CB 4.43Å; E91-Y147 HydrophobicContact CB-CE1 4.11Å; E91-Y147 HydrophobicContact CG-CD1 3.9Å; E91-Y147 HydrophobicContact CG-CE1 3.91Å; E91-Y147 WeakPolarHBondContact OE2-CE1 3.48Å; E91-Y333 VanDerWaalsContact OE2-CE1 3.23Å; E91-Y333 WeakPolarHBondContact OE2-CE1 3.46Å; E91-Y333 PolarHBondContact OE2-OH 3.17Å
92Q85.1Confident85.8Confident0 Ų028.9 Ų28.90%014%0.14CC..Hα-helixtrans-67.2-30.5-171.3-69.3-179.3-70.500112.5H82 Y85 Y86 S88 H94 I95 V96 Y333H82-Q92 PolarHBondContact O-NE2 3.05Å; Y85-Q92 PolarHBondContact O-NE2 3.47Å; Y85-Q92 PolarHBondContact O-OE1 3.1Å; Y86-Q92 VanDerWaalsContact C-OE1 3.32Å; Y86-Q92 VanDerWaalsContact CA-OE1 3.26Å; Y86-Q92 HydrophobicContact CD2-CB 3.95Å; Y86-Q92 HydrophobicContact CE2-CB 3.73Å; S88-Q92 WeakPolarHBondContact O-CB 3.4Å; S88-Q92 WeakPolarHBondContact O-CG 3.29Å; S88-Q92 PolarHBondContact O-N 2.93Å; S88-Q92 PolarHBondContact O-OE1 2.7Å; Q92-H94 PolarHBondContact O-N 3.25Å; Q92-I95 PolarHBondContact O-N 3.46Å; Q92-V96 WeakPolarHBondContact O-CB 3.42Å; Q92-V96 VanDerWaalsContact O-CG2 3.26Å; Q92-V96 WeakPolarHBondContact O-CG2 3.22Å; Q92-V96 PolarHBondContact O-N 3.27Å; Q92-Y333 HydrophobicContact CG-CD1 3.77Å; Q92-Y333 HydrophobicContact CG-CD2 4.14Å; Q92-Y333 HydrophobicContact CG-CE1 3.67Å; Q92-Y333 HydrophobicContact CG-CE2 4.04Å; Q92-Y333 HydrophobicContact CG-CG 4.01Å; Q92-Y333 VanDerWaalsContact NE2-CG 3.25Å
93R88.3Confident86Confident44 Ų4429.7 Ų29.717%0.16615%0.145CC..Hα-helixtrans-56.6-48.8172.8175.4165.4-167.3-154.6-4.5111.8P89 E91 R97 E365 T366 N368 D371P89-R93 WeakPolarHBondContact O-CB 3.44Å; P89-R93 PolarHBondContact O-N 2.68Å; E91-R93 VanDerWaalsContact C-N 3.29Å; E91-R93 PolarHBondContact O-N 2.82Å; R93-R97 VanDerWaalsContact O-CG 3.26Å; R93-R97 WeakPolarHBondContact O-CG 3.39Å; R93-R97 PolarHBondContact O-N 3.28Å; R93-R97 VanDerWaalsContact O-N 3.15Å; R93-E365 PolarHBondContact NE-O 3.32Å; R93-E365 VanDerWaalsContact NE-O 3.14Å; R93-E365 PolarHBondContact NH2-O 2.89Å; R93-T366 HydrophobicContact CB-CG2 4.33Å; R93-T366 HydrophobicContact CG-CG2 4.07Å; R93-T366 WeakPolarHBondContact O-CG2 3.28Å; R93-N368 PolarHBondContact NH2-O 3.32Å; R93-N368 VanDerWaalsContact NH2-O 3.13Å; R93-D371 IonicContact CZ-OD1 2.96Å; R93-D371 IonicContact CZ-OD2 3Å; R93-D371 IonicContact NE-OD2 2.75Å; R93-D371 PolarHBondContact NE-OD2 3.12Å; R93-D371 IonicContact NH1-OD1 2.85Å; R93-D371 PolarHBondContact NH1-OD1 3.32Å; R93-D371 IonicContact NH1-OD2 2.78Å; R93-D371 PolarHBondContact NH1-OD2 3.05Å; R93-D371 IonicContact NH2-OD1 2.98Å; R93-D371 PolarHBondContact NH2-OD1 3.32Å; R93-D371 IonicContact NH2-OD2 3.16Å; R93-D371 PolarHBondContact NH2-OD2 3.04Å
94H88.3Confident86.2Confident14 Ų1431.2 Ų31.27%0.06515%0.153CC..Hα-helixtrans-69-40179.1-63.796.2000111.9N90 E91 Q92 R97 I98 N139 S142 L143N90-H94 PolarHBondContact O-ND1 3.43Å; E91-H94 PolarHBondContact O-N 3.24Å; Q92-H94 PolarHBondContact O-N 3.25Å; H94-R97 WeakPolarHBondContact O-CB 2.98Å; H94-R97 PolarHBondContact O-N 3Å; H94-I98 VanDerWaalsContact O-CG1 3.3Å; H94-I98 WeakPolarHBondContact O-CG1 3.09Å; H94-I98 PolarHBondContact O-N 3.31Å; H94-N139 HydrophobicContact CB-CB 4.5Å; H94-N139 PolarHBondContact CD2-OD1 3.48Å; H94-S142 VanDerWaalsContact CD2-CB 3.5Å; H94-S142 WeakPolarHBondContact CD2-CB 3.33Å; H94-S142 VanDerWaalsContact NE2-CB 3.3Å; H94-S142 WeakPolarHBondContact NE2-CB 3.38Å; H94-L143 HydrophobicContact CB-CB 3.83Å; H94-L143 HydrophobicContact CB-CD1 4.19Å
95I88.4Confident86.4Confident1 Ų125.4 Ų25.41%0.00513%0.131CC..Hα-helixtrans-58.8-52.3175.4-67.6168.6000110.4E91 Q92 R97 I98 L99 L143 Y147 F328 Y333E91-I95 WeakPolarHBondContact O-CG1 3.48Å; E91-I95 PolarHBondContact O-N 3.22Å; E91-I95 VanDerWaalsContact O-N 3.09Å; Q92-I95 PolarHBondContact O-N 3.46Å; I95-R97 VanDerWaalsContact C-N 3.28Å; I95-R97 PolarHBondContact O-N 3.07Å; I95-I98 WeakPolarHBondContact O-CB 3.26Å; I95-I98 PolarHBondContact O-N 3.05Å; I95-L99 HydrophobicContact CG2-CD1 3.54Å; I95-L99 WeakPolarHBondContact O-CD1 3.37Å; I95-L99 PolarHBondContact O-N 2.89Å; I95-L143 HydrophobicContact CD1-CD1 4.21Å; I95-L143 HydrophobicContact CG1-CD1 3.81Å; I95-L143 HydrophobicContact CG1-CD2 3.65Å; I95-L143 HydrophobicContact CG1-CG 4.41Å; I95-Y147 WeakPolarHBondContact CD1-OH 3.47Å; I95-F328 HydrophobicContact CD1-CD1 4.32Å; I95-F328 HydrophobicContact CG1-CD1 4.05Å; I95-F328 HydrophobicContact CG1-CE1 4.32Å; I95-F328 HydrophobicContact CG2-CB 3.86Å; I95-F328 HydrophobicContact CG2-CD1 4.18Å; I95-F328 HydrophobicContact CG2-CG 4.01Å; I95-Y333 HydrophobicContact CD1-CE2 3.9Å; I95-Y333 WeakPolarHBondContact CD1-OH 3.43Å
96V90Very high86.8Confident0 Ų023.4 Ų23.40%012%0.123CC..Hα-helixtrans-58-42.3-179.8168.20000111I79 H82 Q92 I98 L99 F100 T366I79-V96 HydrophobicContact CG2-CG1 4.14Å; H82-V96 HydrophobicContact CB-CG2 3.91Å; Q92-V96 WeakPolarHBondContact O-CB 3.42Å; Q92-V96 VanDerWaalsContact O-CG2 3.26Å; Q92-V96 WeakPolarHBondContact O-CG2 3.22Å; Q92-V96 PolarHBondContact O-N 3.27Å; V96-I98 PolarHBondContact O-N 3.45Å; V96-L99 WeakPolarHBondContact O-CB 3.11Å; V96-L99 PolarHBondContact O-N 2.9Å; V96-F100 HydrophobicContact CG1-CD2 3.94Å; V96-F100 HydrophobicContact CG1-CE2 3.6Å; V96-F100 WeakPolarHBondContact O-CD2 3.41Å; V96-F100 PolarHBondContact O-N 2.95Å; V96-T366 HydrophobicContact CB-CG2 3.73Å; V96-T366 HydrophobicContact CG1-CG2 3.61Å
97R90.8Very high87.2Confident1 Ų125.4 Ų25.40%0.00413%0.133CC..Hα-helixtrans-59.6-43.3173.3-70.1167.8175.1173.4-1.5112.4R93 H94 I95 L99 F100 Y132 F135 N139 T366 M367 N368 D371R93-R97 VanDerWaalsContact O-CG 3.26Å; R93-R97 WeakPolarHBondContact O-CG 3.39Å; R93-R97 PolarHBondContact O-N 3.28Å; R93-R97 VanDerWaalsContact O-N 3.15Å; H94-R97 WeakPolarHBondContact O-CB 2.98Å; H94-R97 PolarHBondContact O-N 3Å; I95-R97 VanDerWaalsContact C-N 3.28Å; I95-R97 PolarHBondContact O-N 3.07Å; R97-L99 VanDerWaalsContact C-N 3.33Å; R97-L99 PolarHBondContact O-N 2.91Å; R97-F100 PolarHBondContact O-N 3.21Å; R97-Y132 PolarHBondContact O-OH 3.45Å; R97-F135 HydrophobicContact CB-CE1 3.91Å; R97-F135 HydrophobicContact CB-CZ 4.43Å; R97-F135 HydrophobicContact CG-CE1 3.84Å; R97-F135 HydrophobicContact CG-CZ 3.99Å; R97-N139 HydrophobicContact CB-CB 4.29Å; R97-N139 VanDerWaalsContact CD-CG 3.4Å; R97-N139 WeakPolarHBondContact CD-OD1 3.42Å; R97-N139 PolarHBondContact NH1-OD1 3.05Å; R97-T366 HydrophobicContact CG-CG2 4.42Å; R97-T366 PolarHBondContact NE-O 2.79Å; R97-T366 PolarHBondContact NH2-O 3.01Å; R97-M367 HydrophobicContact CB-CE 4.1Å; R97-M367 HydrophobicContact CG-CE 3.39Å; R97-N368 PolarHBondContact NH2-O 3.36Å; R97-D371 IonicContact CZ-OD2 2.89Å; R97-D371 IonicContact NH1-OD2 2.79Å; R97-D371 PolarHBondContact NH1-OD2 2.82Å; R97-D371 IonicContact NH2-OD2 3.44Å; R97-D371 PolarHBondContact NH2-OD2 3.31Å
98I89Confident87.6Confident2 Ų223.9 Ų23.91%0.0112%0.122CC..Hα-helixtrans-63.9-40.3176.2-65160.2000110.8H94 I95 V96 F100 I101 V136 N139 F140 L143 V266 L324 F328H94-I98 VanDerWaalsContact O-CG1 3.3Å; H94-I98 WeakPolarHBondContact O-CG1 3.09Å; H94-I98 PolarHBondContact O-N 3.31Å; I95-I98 WeakPolarHBondContact O-CB 3.26Å; I95-I98 PolarHBondContact O-N 3.05Å; V96-I98 PolarHBondContact O-N 3.45Å; I98-F100 PolarHBondContact O-N 3.01Å; I98-I101 WeakPolarHBondContact O-CB 3.44Å; I98-I101 WeakPolarHBondContact O-CG2 3.33Å; I98-I101 PolarHBondContact O-N 3.32Å; I98-I101 VanDerWaalsContact O-N 3.15Å; I98-V136 HydrophobicContact CG1-CG1 4.42Å; I98-V136 HydrophobicContact CG2-CG1 4.33Å; I98-N139 HydrophobicContact CG1-CB 4.05Å; I98-F140 HydrophobicContact CD1-CB 4.06Å; I98-F140 HydrophobicContact CD1-CD2 4.23Å; I98-L143 HydrophobicContact CD1-CD2 3.93Å; I98-V266 HydrophobicContact CG2-CG2 3.98Å; I98-L324 HydrophobicContact CG2-CD2 4.21Å; I98-F328 HydrophobicContact CD1-CZ 4.4Å; I98-F328 HydrophobicContact CG2-CE2 4.04Å
99L89.8Confident87.8Confident0 Ų022.6 Ų22.60%011%0.113CC..Hα-helixtrans-62-28.5180-90.867.4000113.1Q78 I79 I95 V96 R97 I101 P103 F328Q78-L99 HydrophobicContact CB-CD2 4.03Å; Q78-L99 HydrophobicContact CG-CD2 3.53Å; I79-L99 HydrophobicContact CD1-CB 4.3Å; I79-L99 HydrophobicContact CG1-CB 3.95Å; I79-L99 HydrophobicContact CG1-CD2 3.9Å; I95-L99 HydrophobicContact CG2-CD1 3.54Å; I95-L99 WeakPolarHBondContact O-CD1 3.37Å; I95-L99 PolarHBondContact O-N 2.89Å; V96-L99 WeakPolarHBondContact O-CB 3.11Å; V96-L99 PolarHBondContact O-N 2.9Å; R97-L99 VanDerWaalsContact C-N 3.33Å; R97-L99 PolarHBondContact O-N 2.91Å; L99-I101 PolarHBondContact O-N 3.35Å; L99-P103 WeakPolarHBondContact O-CD 3.36Å; L99-F328 HydrophobicContact CD1-CB 4.18Å; L99-F328 HydrophobicContact CD1-CD2 3.96Å; L99-F328 HydrophobicContact CD1-CG 4.34Å
100F90.1Very high88.1Confident45 Ų4522 Ų2220%0.19710%0.103CC..THydrogen-bonded Turntrans-70.7-8.6178.8-89.2-69.7000113.9I79 V96 R97 I98 V102 P103 I104 Y132 L363 M367I79-F100 HydrophobicContact CD1-CD1 4.05Å; I79-F100 HydrophobicContact CD1-CD2 4.21Å; I79-F100 HydrophobicContact CD1-CE1 3.91Å; I79-F100 HydrophobicContact CD1-CE2 4.07Å; I79-F100 HydrophobicContact CD1-CG 4.18Å; I79-F100 HydrophobicContact CD1-CZ 3.91Å; I79-F100 HydrophobicContact CG2-CE2 4.3Å; I79-F100 HydrophobicContact CG2-CZ 4.25Å; V96-F100 HydrophobicContact CG1-CD2 3.94Å; V96-F100 HydrophobicContact CG1-CE2 3.6Å; V96-F100 WeakPolarHBondContact O-CD2 3.41Å; V96-F100 PolarHBondContact O-N 2.95Å; R97-F100 PolarHBondContact O-N 3.21Å; I98-F100 PolarHBondContact O-N 3.01Å; F100-V102 VanDerWaalsContact C-N 3.34Å; F100-V102 PolarHBondContact O-N 2.92Å; F100-P103 VanDerWaalsContact C-CD 3.5Å; F100-P103 HydrophobicContact CB-CG 4.5Å; F100-P103 HydrophobicContact CD1-CG 3.94Å; F100-P103 VanDerWaalsContact O-CD 3.28Å; F100-P103 WeakPolarHBondContact O-CD 3.45Å; F100-P103 VanDerWaalsContact O-CG 3.29Å; F100-P103 WeakPolarHBondContact O-CG 3.18Å; F100-I104 HydrophobicContact CB-CD1 4.49Å; F100-I104 WeakPolarHBondContact O-CB 3.18Å; F100-I104 WeakPolarHBondContact O-CD1 3.49Å; F100-I104 VanDerWaalsContact O-CG1 3.28Å; F100-I104 WeakPolarHBondContact O-CG1 3.25Å; F100-I104 PolarHBondContact O-N 3.38Å; F100-Y132 HydrophobicContact CB-CE1 4.35Å; F100-Y132 WeakPolarHBondContact CB-OH 3.15Å; F100-L363 HydrophobicContact CE2-CD1 3.68Å; F100-L363 HydrophobicContact CZ-CD1 3.7Å; F100-M367 HydrophobicContact CD2-CE 3.83Å; F100-M367 HydrophobicContact CD2-SD 3.59Å; F100-M367 VanDerWaalsContact CD2-SD 3.59Å; F100-M367 HydrophobicContact CE2-CE 4.26Å; F100-M367 HydrophobicContact CE2-CG 4.39Å; F100-M367 HydrophobicContact CE2-SD 3.59Å; F100-M367 VanDerWaalsContact CE2-SD 3.59Å; F100-M367 HydrophobicContact CG-SD 4.23Å; F100-M367 HydrophobicContact CZ-SD 4.23Å
101I88.2Confident88.3Confident6 Ų618.7 Ų18.73%0.0319%0.085CC..Hα-helixtrans-60.2-44.5174.5-165.9174.7000111.8I98 L99 I104 Y105 Y132 V136 V269 I270 L324I98-I101 WeakPolarHBondContact O-CB 3.44Å; I98-I101 WeakPolarHBondContact O-CG2 3.33Å; I98-I101 PolarHBondContact O-N 3.32Å; I98-I101 VanDerWaalsContact O-N 3.15Å; L99-I101 PolarHBondContact O-N 3.35Å; I101-I104 PolarHBondContact O-N 2.91Å; I101-Y105 HydrophobicContact CD1-CE2 4.22Å; I101-Y105 HydrophobicContact CG1-CD2 3.68Å; I101-Y105 HydrophobicContact CG1-CE2 3.69Å; I101-Y105 HydrophobicContact CG1-CG 4.47Å; I101-Y105 WeakPolarHBondContact O-CB 3.3Å; I101-Y105 VanDerWaalsContact O-CD2 3.26Å; I101-Y105 WeakPolarHBondContact O-CD2 3.29Å; I101-Y105 PolarHBondContact O-N 3.49Å; I101-Y132 HydrophobicContact CB-CD1 4.23Å; I101-Y132 HydrophobicContact CB-CE1 4.01Å; I101-Y132 HydrophobicContact CG1-CD1 4.24Å; I101-V136 HydrophobicContact CB-CG2 3.91Å; I101-V136 HydrophobicContact CD1-CB 4.36Å; I101-V136 HydrophobicContact CD1-CG1 4.15Å; I101-V136 HydrophobicContact CD1-CG2 4.04Å; I101-V136 HydrophobicContact CG1-CG2 4.13Å; I101-V269 HydrophobicContact CD1-CG1 4.05Å; I101-I270 HydrophobicContact CD1-CG1 4.48Å; I101-L324 HydrophobicContact CG2-CD1 4.34Å
102V89.7Confident88Confident0 Ų017.7 Ų17.70%08%0.081CC..Hα-helixtrans-63.4-52.8-177.4170.80000112.4A71 T75 F100 I104 Y105 A106 M317 A320 A321 L324A71-V102 HydrophobicContact CB-CG1 4.19Å; T75-V102 HydrophobicContact CG2-CB 3.82Å; T75-V102 HydrophobicContact CG2-CG1 3.63Å; T75-V102 HydrophobicContact CG2-CG2 4.46Å; F100-V102 VanDerWaalsContact C-N 3.34Å; F100-V102 PolarHBondContact O-N 2.92Å; V102-I104 VanDerWaalsContact C-N 3.29Å; V102-I104 PolarHBondContact O-N 3.42Å; V102-Y105 PolarHBondContact O-N 3.21Å; V102-A106 WeakPolarHBondContact O-CB 3.36Å; V102-A106 PolarHBondContact O-N 3.22Å; V102-M317 HydrophobicContact CG1-CB 4.23Å; V102-M317 WeakPolarHBondContact CG1-O 3.37Å; V102-M317 HydrophobicContact CG2-SD 4.22Å; V102-A320 HydrophobicContact CG2-CB 4.15Å; V102-A321 HydrophobicContact CG1-CB 4.06Å; V102-L324 HydrophobicContact CB-CD1 4.46Å; V102-L324 HydrophobicContact CG2-CD1 3.23Å
103P90.9Very high87.7Confident17 Ų1717.9 Ų17.911%0.118%0.082CC..Hα-helixtrans-63-36.318022.8-33.5000112.4L72 L99 F100 F107L72-P103 VanDerWaalsContact CD2-CA 3.49Å; L72-P103 HydrophobicContact CD2-CB 3.38Å; L99-P103 WeakPolarHBondContact O-CD 3.36Å; F100-P103 VanDerWaalsContact C-CD 3.5Å; F100-P103 HydrophobicContact CB-CG 4.5Å; F100-P103 HydrophobicContact CD1-CG 3.94Å; F100-P103 VanDerWaalsContact O-CD 3.28Å; F100-P103 WeakPolarHBondContact O-CD 3.45Å; F100-P103 VanDerWaalsContact O-CG 3.29Å; F100-P103 WeakPolarHBondContact O-CG 3.18Å; P103-F107 WeakPolarHBondContact O-CB 2.94Å; P103-F107 PolarHBondContact O-N 2.91Å
104I89.2Confident87.3Confident45 Ų4519.2 Ų19.223%0.2319%0.092CC..Hα-helixtrans-64.8-52.8176.6-68.2170000110F100 I101 V102 D108 Y132F100-I104 HydrophobicContact CB-CD1 4.49Å; F100-I104 WeakPolarHBondContact O-CB 3.18Å; F100-I104 WeakPolarHBondContact O-CD1 3.49Å; F100-I104 VanDerWaalsContact O-CG1 3.28Å; F100-I104 WeakPolarHBondContact O-CG1 3.25Å; F100-I104 PolarHBondContact O-N 3.38Å; I101-I104 PolarHBondContact O-N 2.91Å; V102-I104 VanDerWaalsContact C-N 3.29Å; V102-I104 PolarHBondContact O-N 3.42Å; I104-D108 WeakPolarHBondContact O-CB 3.29Å; I104-D108 PolarHBondContact O-N 2.98Å; I104-Y132 HydrophobicContact CD1-CD1 3.89Å; I104-Y132 HydrophobicContact CD1-CD2 3.36Å; I104-Y132 HydrophobicContact CD1-CE1 3.82Å; I104-Y132 HydrophobicContact CD1-CE2 3.27Å; I104-Y132 HydrophobicContact CD1-CG 3.67Å
105Y87.2Confident86.6Confident5 Ų523.4 Ų23.42%0.0211%0.11CC..Hα-helixtrans-66.9-40.9-178-85.9-116.5000112.7I101 V102 S109 R129 E133 I313 M317I101-Y105 HydrophobicContact CD1-CE2 4.22Å; I101-Y105 HydrophobicContact CG1-CD2 3.68Å; I101-Y105 HydrophobicContact CG1-CE2 3.69Å; I101-Y105 HydrophobicContact CG1-CG 4.47Å; I101-Y105 WeakPolarHBondContact O-CB 3.3Å; I101-Y105 VanDerWaalsContact O-CD2 3.26Å; I101-Y105 WeakPolarHBondContact O-CD2 3.29Å; I101-Y105 PolarHBondContact O-N 3.49Å; V102-Y105 PolarHBondContact O-N 3.21Å; Y105-S109 WeakPolarHBondContact O-CB 3.49Å; Y105-S109 PolarHBondContact O-N 3.12Å; Y105-S109 PolarHBondContact O-OG 3.34Å; Y105-R129 HydrophobicContact CD2-CG 4.3Å; Y105-R129 HydrophobicContact CE2-CB 4.23Å; Y105-R129 HydrophobicContact CE2-CG 4.29Å; Y105-R129 HydrophobicContact CG-CG 4.48Å; Y105-R129 PolarHBondContact OH-O 3.29Å; Y105-E133 WeakPolarHBondContact OH-CB 3.47Å; Y105-I313 HydrophobicContact CD1-CG2 4.42Å; Y105-M317 HydrophobicContact CD1-CE 4.36Å; Y105-M317 HydrophobicContact CG-SD 4.44Å
106A89.4Confident85.5Confident0 Ų024.8 Ų24.80%012%0.116CC..Hα-helixtrans-67.2-46.1-179.900000111.4V68 V102 W110 M317V68-A106 HydrophobicContact CB-CB 4.49Å; V68-A106 HydrophobicContact CG1-CB 4.03Å; V68-A106 HydrophobicContact CG2-CB 4.25Å; V102-A106 WeakPolarHBondContact O-CB 3.36Å; V102-A106 PolarHBondContact O-N 3.22Å; A106-W110 VanDerWaalsContact O-CB 3.25Å; A106-W110 WeakPolarHBondContact O-CB 3.38Å; A106-W110 PolarHBondContact O-N 3.24Å; A106-M317 HydrophobicContact CB-CB 3.87Å; A106-M317 HydrophobicContact CB-CG 4.17Å
107F89Confident83.9Confident97 Ų9729.3 Ų29.343%0.42514%0.144SC..Hα-helixtrans-67.3-45.2179.2-175.2-102.7000111.3P103 W110 L111P103-F107 WeakPolarHBondContact O-CB 2.94Å; P103-F107 PolarHBondContact O-N 2.91Å; F107-W110 HydrophobicContact CD2-CE3 4.28Å; F107-W110 HydrophobicContact CE2-CE3 4.33Å; F107-W110 HydrophobicContact CE2-CZ3 4.26Å; F107-W110 PolarHBondContact O-N 3.32Å; F107-L111 HydrophobicContact CE1-CD2 3.9Å; F107-L111 HydrophobicContact CZ-CD2 4.4Å; F107-L111 VanDerWaalsContact O-CB 3.26Å; F107-L111 WeakPolarHBondContact O-CB 3.5Å; F107-L111 PolarHBondContact O-N 3.19Å
108D87Confident82.5Confident11 Ų1133.1 Ų33.16%0.05916%0.164CC..Hα-helixtrans-63.9-46.1-179.8-171.185.9000112.2I104 W110 L111 S112 F125 R129I104-D108 WeakPolarHBondContact O-CB 3.29Å; I104-D108 PolarHBondContact O-N 2.98Å; D108-W110 VanDerWaalsContact C-N 3.34Å; D108-W110 PolarHBondContact O-N 2.77Å; D108-L111 PolarHBondContact O-N 3.2Å; D108-S112 VanDerWaalsContact O-CB 3.28Å; D108-S112 WeakPolarHBondContact O-CB 3.37Å; D108-S112 PolarHBondContact O-N 3.16Å; D108-F125 VanDerWaalsContact OD1-CA 3.3Å; D108-F125 WeakPolarHBondContact OD1-CA 3.18Å; D108-F125 WeakPolarHBondContact OD1-CB 3.17Å; D108-F125 WeakPolarHBondContact OD1-CD1 3.3Å; D108-F125 WeakPolarHBondContact OD1-CG 3.46Å; D108-F125 WeakPolarHBondContact OD2-CB 3.28Å; D108-R129 HydrophobicContact CB-CG 4.12Å; D108-R129 VanDerWaalsContact CG-CD 3.5Å; D108-R129 WeakPolarHBondContact OD2-CD 3.26Å; D108-R129 IonicContact OD2-NH1 3.66Å
109S85.1Confident81Confident0 Ų038.2 Ų38.20%019%0.188CC..Hα-helixtrans-63-40.5176.2-57.30000111.7Y105 S112 L113 R129 I313Y105-S109 WeakPolarHBondContact O-CB 3.49Å; Y105-S109 PolarHBondContact O-N 3.12Å; Y105-S109 PolarHBondContact O-OG 3.34Å; S109-S112 PolarHBondContact O-N 3.1Å; S109-L113 VanDerWaalsContact O-CG 3.26Å; S109-L113 WeakPolarHBondContact O-CG 3.48Å; S109-L113 PolarHBondContact O-N 3.41Å; S109-R129 PolarHBondContact OG-NH1 3.35Å; S109-I313 WeakPolarHBondContact OG-CG2 3.41Å
110W87.4Confident79.6Confident48 Ų4845.6 Ų45.618%0.18222%0.223CC..Hα-helixtrans-65.5-41.1175.7-177.556.8000112.3V68 W69 A106 F107 D108 L113 L114V68-W110 HydrophobicContact CB-CB 4.36Å; V68-W110 HydrophobicContact CB-CG 4.48Å; V68-W110 HydrophobicContact CG1-CB 4.01Å; V68-W110 HydrophobicContact CG1-CG 4.28Å; V68-W110 HydrophobicContact CG2-CB 3.92Å; V68-W110 HydrophobicContact CG2-CG 4.36Å; W69-W110 AromaticContact NE1-CH2 3.78Å; A106-W110 VanDerWaalsContact O-CB 3.25Å; A106-W110 WeakPolarHBondContact O-CB 3.38Å; A106-W110 PolarHBondContact O-N 3.24Å; F107-W110 HydrophobicContact CD2-CE3 4.28Å; F107-W110 HydrophobicContact CE2-CE3 4.33Å; F107-W110 HydrophobicContact CE2-CZ3 4.26Å; F107-W110 PolarHBondContact O-N 3.32Å; D108-W110 VanDerWaalsContact C-N 3.34Å; D108-W110 PolarHBondContact O-N 2.77Å; W110-L113 WeakPolarHBondContact O-CB 3.27Å; W110-L113 PolarHBondContact O-N 3.25Å; W110-L114 HydrophobicContact CD2-CD1 4.05Å; W110-L114 HydrophobicContact CE3-CD1 4.35Å; W110-L114 HydrophobicContact CH2-CD1 4.02Å; W110-L114 HydrophobicContact CZ2-CD1 3.69Å; W110-L114 HydrophobicContact CZ3-CD1 4.34Å; W110-L114 WeakPolarHBondContact O-CG 3.25Å; W110-L114 PolarHBondContact O-N 3.46Å
111L85Confident78.5Confident30 Ų3049.9 Ų49.916%0.15724%0.239CC..Hα-helixtrans-66.2-41.7178-160.162.3000111.2F107 D108 L113 L114 F115 F125F107-L111 HydrophobicContact CE1-CD2 3.9Å; F107-L111 HydrophobicContact CZ-CD2 4.4Å; F107-L111 VanDerWaalsContact O-CB 3.26Å; F107-L111 WeakPolarHBondContact O-CB 3.5Å; F107-L111 PolarHBondContact O-N 3.19Å; D108-L111 PolarHBondContact O-N 3.2Å; L111-L113 VanDerWaalsContact C-N 3.31Å; L111-L113 PolarHBondContact O-N 3.22Å; L111-L114 PolarHBondContact O-N 3.19Å; L111-F115 HydrophobicContact CD1-CD2 3.77Å; L111-F115 HydrophobicContact CD1-CE2 3.42Å; L111-F115 VanDerWaalsContact CD1-CE2 3.42Å; L111-F115 HydrophobicContact CG-CD2 3.82Å; L111-F115 HydrophobicContact CG-CE2 3.92Å; L111-F115 WeakPolarHBondContact O-CD2 3.42Å; L111-F115 PolarHBondContact O-N 3.02Å; L111-F125 HydrophobicContact CD2-CD1 4.39Å; L111-F125 HydrophobicContact CD2-CE1 3.46Å; L111-F125 VanDerWaalsContact CD2-CE1 3.46Å; L111-F125 HydrophobicContact CD2-CE2 4.22Å; L111-F125 HydrophobicContact CD2-CZ 3.36Å; L111-F125 HydrophobicContact CG-CE1 4.37Å; L111-F125 HydrophobicContact CG-CE2 4.33Å; L111-F125 HydrophobicContact CG-CZ 3.92Å
112S79.8Confident77.5Confident5 Ų551.7 Ų51.74%0.03525%0.245CC..Hα-helixtrans-59.8-40.5173.2-172.30000111.6D108 S109 L114 F115 F116 Y122 N310D108-S112 VanDerWaalsContact O-CB 3.28Å; D108-S112 WeakPolarHBondContact O-CB 3.37Å; D108-S112 PolarHBondContact O-N 3.16Å; S109-S112 PolarHBondContact O-N 3.1Å; S112-L114 VanDerWaalsContact C-N 3.33Å; S112-L114 PolarHBondContact O-N 2.88Å; S112-F115 PolarHBondContact O-N 3.39Å; S112-F116 PolarHBondContact O-N 3.22Å; S112-Y122 VanDerWaalsContact OG-CD2 3.27Å; S112-Y122 WeakPolarHBondContact OG-CD2 3.39Å; S112-N310 WeakPolarHBondContact CB-ND2 3.4Å; S112-N310 PolarHBondContact OG-ND2 3.3Å
113L79.7Confident76.5Confident5 Ų552.5 Ų52.53%0.02625%0.25CS..Hα-helixtrans-67.8-26.3172.9-68.2172.6000114.1L55 S109 W110 L111 F116 G307 N310 F311L55-L113 HydrophobicContact CD2-CD2 4.4Å; S109-L113 VanDerWaalsContact O-CG 3.26Å; S109-L113 WeakPolarHBondContact O-CG 3.48Å; S109-L113 PolarHBondContact O-N 3.41Å; W110-L113 WeakPolarHBondContact O-CB 3.27Å; W110-L113 PolarHBondContact O-N 3.25Å; L111-L113 VanDerWaalsContact C-N 3.31Å; L111-L113 PolarHBondContact O-N 3.22Å; L113-F116 VanDerWaalsContact CA-CE2 3.49Å; L113-F116 HydrophobicContact CB-CE2 4.03Å; L113-F116 HydrophobicContact CD2-CE2 3.4Å; L113-F116 HydrophobicContact CD2-CZ 3.44Å; L113-F116 VanDerWaalsContact CD2-CZ 3.44Å; L113-F116 HydrophobicContact CG-CE2 4.29Å; L113-F116 WeakPolarHBondContact O-CD2 3.11Å; L113-F116 WeakPolarHBondContact O-CE2 3.44Å; L113-G307 VanDerWaalsContact CD2-O 3.29Å; L113-G307 WeakPolarHBondContact CD2-O 3.38Å; L113-N310 HydrophobicContact CD2-CB 4.04Å; L113-N310 HydrophobicContact CG-CB 4.06Å; L113-F311 HydrophobicContact CD1-CB 4.25Å; L113-F311 HydrophobicContact CD1-CD2 4.39Å; L113-F311 HydrophobicContact CD2-CB 4.21Å
114L79.2Confident75.7Confident71 Ų7158.6 Ų58.637%0.37227%0.272SS..Hα-helixtrans-83.1-31.1177.5-72.8177.4000112.3W110 L111 S112W110-L114 HydrophobicContact CD2-CD1 4.05Å; W110-L114 HydrophobicContact CE3-CD1 4.35Å; W110-L114 HydrophobicContact CH2-CD1 4.02Å; W110-L114 HydrophobicContact CZ2-CD1 3.69Å; W110-L114 HydrophobicContact CZ3-CD1 4.34Å; W110-L114 WeakPolarHBondContact O-CG 3.25Å; W110-L114 PolarHBondContact O-N 3.46Å; L111-L114 PolarHBondContact O-N 3.19Å; S112-L114 VanDerWaalsContact C-N 3.33Å; S112-L114 PolarHBondContact O-N 2.88Å
115F74.1Confident75.1Confident103 Ų10358.6 Ų58.645%0.45227%0.271SS..  trans-105.329.1-176.4-68.9-67.7000114.2L111 S112 T117 N118L111-F115 HydrophobicContact CD1-CD2 3.77Å; L111-F115 HydrophobicContact CD1-CE2 3.42Å; L111-F115 VanDerWaalsContact CD1-CE2 3.42Å; L111-F115 HydrophobicContact CG-CD2 3.82Å; L111-F115 HydrophobicContact CG-CE2 3.92Å; L111-F115 WeakPolarHBondContact O-CD2 3.42Å; L111-F115 PolarHBondContact O-N 3.02Å; S112-F115 PolarHBondContact O-N 3.39Å; F115-T117 PolarHBondContact O-N 3.48Å; F115-N118 PolarHBondContact O-N 3.35Å; F115-N118 VanDerWaalsContact O-N 3.15Å
116F64.3Low74.4Confident29 Ų2960.2 Ų60.213%0.12728%0.279CS..THydrogen-bonded Turntrans-48.2-26.3176.3-91.6-66.6000115.2L55 M56 S112 L113 N118L55-F116 HydrophobicContact CB-CE2 4.27Å; L55-F116 HydrophobicContact CB-CZ 4.33Å; L55-F116 HydrophobicContact CD1-CZ 4.18Å; M56-F116 HydrophobicContact CE-CB 3.45Å; M56-F116 VanDerWaalsContact CE-CB 3.45Å; M56-F116 HydrophobicContact CE-CD2 4.3Å; M56-F116 HydrophobicContact CE-CG 4.09Å; S112-F116 PolarHBondContact O-N 3.22Å; L113-F116 VanDerWaalsContact CA-CE2 3.49Å; L113-F116 HydrophobicContact CB-CE2 4.03Å; L113-F116 HydrophobicContact CD2-CE2 3.4Å; L113-F116 HydrophobicContact CD2-CZ 3.44Å; L113-F116 VanDerWaalsContact CD2-CZ 3.44Å; L113-F116 HydrophobicContact CG-CE2 4.29Å; L113-F116 WeakPolarHBondContact O-CD2 3.11Å; L113-F116 WeakPolarHBondContact O-CE2 3.44Å; F116-N118 VanDerWaalsContact C-N 3.34Å; F116-N118 PolarHBondContact O-N 3.32Å
117T56.6Low73.9Confident96 Ų9661.8 Ų61.859%0.58929%0.289SS*.THydrogen-bonded Turntrans-78.3-14.7-173.1-420000113.8F115F115-T117 PolarHBondContact O-N 3.48Å
118N61.2Low73.5Confident80 Ų8061.1 Ų61.143%0.42829%0.293SS..  trans-116.493.4-176.6-60.4-42.8000110.6F115 F116 E120 Y121F115-N118 PolarHBondContact O-N 3.35Å; F115-N118 VanDerWaalsContact O-N 3.15Å; F116-N118 VanDerWaalsContact C-N 3.34Å; F116-N118 PolarHBondContact O-N 3.32Å; N118-E120 PolarHBondContact O-N 3.37Å; N118-Y121 HydrophobicContact CB-CD2 3.6Å; N118-Y121 HydrophobicContact CB-CE2 4.15Å; N118-Y121 PolarHBondContact O-N 2.95Å
119E58.5Low73.2Confident109 Ų10961.2 Ų61.251%0.50929%0.292SS..Hα-helixtrans-55.5-25.2-174.7-62.5-176.3167.600114.1
120E59.9Low72.9Confident155 Ų15564.1 Ų64.172%0.72431%0.308SS*.Hα-helixtrans-76.3-28.2-178.6-63.1-161.3163.500114.4N118 Y124N118-E120 PolarHBondContact O-N 3.37Å; E120-Y124 WeakPolarHBondContact O-CD2 3.32Å; E120-Y124 WeakPolarHBondContact O-CE2 3.12Å
121Y66.4Low72.7Confident136 Ų13664 Ų6453%0.53331%0.314SS..Hα-helixtrans-78.2-28-175.5-72.9-75.1000113.3N118 V123 Y124 F125N118-Y121 HydrophobicContact CB-CD2 3.6Å; N118-Y121 HydrophobicContact CB-CE2 4.15Å; N118-Y121 PolarHBondContact O-N 2.95Å; Y121-V123 VanDerWaalsContact C-N 3.27Å; Y121-V123 PolarHBondContact O-N 3.41Å; Y121-Y124 PolarHBondContact O-N 2.91Å; Y121-F125 WeakPolarHBondContact O-CD2 3.36Å; Y121-F125 PolarHBondContact O-N 3.27Å
122Y67.9Low72.8Confident43 Ų4364 Ų6417%0.16931%0.312CS..Hα-helixtrans-54.4-43.4-179.4176.7-89.6000112.3S112 Y124 F125 D126 A306S112-Y122 VanDerWaalsContact OG-CD2 3.27Å; S112-Y122 WeakPolarHBondContact OG-CD2 3.39Å; Y122-Y124 VanDerWaalsContact C-N 3.33Å; Y122-Y124 PolarHBondContact O-N 2.86Å; Y122-F125 PolarHBondContact O-N 2.92Å; Y122-D126 WeakPolarHBondContact CE1-OD2 2.99Å; Y122-D126 PolarHBondContact O-N 2.95Å; Y122-D126 PolarHBondContact OH-OD1 2.86Å; Y122-D126 PolarHBondContact OH-OD2 3.04Å; Y122-A306 HydrophobicContact CE1-CB 4.39Å; Y122-A306 HydrophobicContact CE2-CB 3.63Å; Y122-A306 WeakPolarHBondContact OH-CB 3.31Å
123V68.9Low73Confident18 Ų1864.1 Ų64.111%0.10931%0.312CS..Hα-helixtrans-62.7-38.7-178178.80000112.3Y121 T127Y121-V123 VanDerWaalsContact C-N 3.27Å; Y121-V123 PolarHBondContact O-N 3.41Å; V123-T127 WeakPolarHBondContact O-CB 3.12Å; V123-T127 PolarHBondContact O-N 3.48Å; V123-T127 PolarHBondContact O-OG1 3.39Å
124Y73.2Confident73.2Confident144 Ų14464 Ų6457%0.56531%0.311SS*.Hα-helixtrans-68.8-40.4-179.9-68.8-78.5000111.5E120 Y121 Y122 T127 V128E120-Y124 WeakPolarHBondContact O-CD2 3.32Å; E120-Y124 WeakPolarHBondContact O-CE2 3.12Å; Y121-Y124 PolarHBondContact O-N 2.91Å; Y122-Y124 VanDerWaalsContact C-N 3.33Å; Y122-Y124 PolarHBondContact O-N 2.86Å; Y124-T127 PolarHBondContact O-N 2.99Å; Y124-V128 WeakPolarHBondContact O-CG2 3.42Å; Y124-V128 PolarHBondContact O-N 3.36Å
125F76.4Confident73.6Confident46 Ų4661.7 Ų61.720%0.20230%0.298CS..Hα-helixtrans-63.4-46.8176.8-72.1-44.9000111.6D108 L111 Y121 Y122 T127 V128 R129D108-F125 VanDerWaalsContact OD1-CA 3.3Å; D108-F125 WeakPolarHBondContact OD1-CA 3.18Å; D108-F125 WeakPolarHBondContact OD1-CB 3.17Å; D108-F125 WeakPolarHBondContact OD1-CD1 3.3Å; D108-F125 WeakPolarHBondContact OD1-CG 3.46Å; D108-F125 WeakPolarHBondContact OD2-CB 3.28Å; L111-F125 HydrophobicContact CD2-CD1 4.39Å; L111-F125 HydrophobicContact CD2-CE1 3.46Å; L111-F125 VanDerWaalsContact CD2-CE1 3.46Å; L111-F125 HydrophobicContact CD2-CE2 4.22Å; L111-F125 HydrophobicContact CD2-CZ 3.36Å; L111-F125 HydrophobicContact CG-CE1 4.37Å; L111-F125 HydrophobicContact CG-CE2 4.33Å; L111-F125 HydrophobicContact CG-CZ 3.92Å; Y121-F125 WeakPolarHBondContact O-CD2 3.36Å; Y121-F125 PolarHBondContact O-N 3.27Å; Y122-F125 PolarHBondContact O-N 2.92Å; F125-T127 VanDerWaalsContact C-N 3.34Å; F125-T127 PolarHBondContact O-N 3.46Å; F125-V128 PolarHBondContact O-N 2.87Å; F125-R129 PolarHBondContact O-N 3.4Å; F125-R129 VanDerWaalsContact O-N 3.16Å
126D73.9Confident74.1Confident38 Ų3856.8 Ų56.820%0.20328%0.277CS..Hα-helixtrans-60.9-41.7174.9-88.210.8000112.4Y122 V128 R129 D130Y122-D126 WeakPolarHBondContact CE1-OD2 2.99Å; Y122-D126 PolarHBondContact O-N 2.95Å; Y122-D126 PolarHBondContact OH-OD1 2.86Å; Y122-D126 PolarHBondContact OH-OD2 3.04Å; D126-V128 VanDerWaalsContact C-N 3.32Å; D126-V128 PolarHBondContact O-N 2.77Å; D126-R129 PolarHBondContact O-N 3.05Å; D126-R129 IonicContact OD1-NH1 3.97Å; D126-D130 WeakPolarHBondContact O-CB 3.04Å; D126-D130 PolarHBondContact O-N 3.23Å
127T78.1Confident75.1Confident33 Ų3355.5 Ų55.520%0.20227%0.272CS..Hα-helixtrans-59-41177.2-63.90000112.6V123 Y124 F125 D130 C131 A202V123-T127 WeakPolarHBondContact O-CB 3.12Å; V123-T127 PolarHBondContact O-N 3.48Å; V123-T127 PolarHBondContact O-OG1 3.39Å; Y124-T127 PolarHBondContact O-N 2.99Å; F125-T127 VanDerWaalsContact C-N 3.34Å; F125-T127 PolarHBondContact O-N 3.46Å; T127-D130 PolarHBondContact O-N 2.86Å; T127-C131 PolarHBondContact O-N 3.41Å; T127-C131 VanDerWaalsContact O-N 3.12Å; T127-C131 PolarHBondContact O-SG 3.35Å; T127-A202 HydrophobicContact CG2-CB 3.83Å
128V80.9Confident76.6Confident83 Ų8351.1 Ų51.150%0.50324%0.244SC..Hα-helixtrans-66.5-45.1178.7171.70000110.8Y124 F125 D126 D130 C131 Y132Y124-V128 WeakPolarHBondContact O-CG2 3.42Å; Y124-V128 PolarHBondContact O-N 3.36Å; F125-V128 PolarHBondContact O-N 2.87Å; D126-V128 VanDerWaalsContact C-N 3.32Å; D126-V128 PolarHBondContact O-N 2.77Å; V128-D130 VanDerWaalsContact C-N 3.32Å; V128-D130 PolarHBondContact O-N 2.82Å; V128-C131 PolarHBondContact O-N 3.47Å; V128-Y132 PolarHBondContact O-N 3.48Å; V128-Y132 VanDerWaalsContact O-N 3.09Å
129R81.3Confident77.9Confident13 Ų1347.3 Ų47.35%0.04922%0.224CC..Hα-helixtrans-59.3-45.1176.2-77.6169.653.4-179.7-8.8111.7Y105 D108 S109 F125 D126 C131 Y132 E133 N310Y105-R129 HydrophobicContact CD2-CG 4.3Å; Y105-R129 HydrophobicContact CE2-CB 4.23Å; Y105-R129 HydrophobicContact CE2-CG 4.29Å; Y105-R129 HydrophobicContact CG-CG 4.48Å; Y105-R129 PolarHBondContact OH-O 3.29Å; D108-R129 HydrophobicContact CB-CG 4.12Å; D108-R129 VanDerWaalsContact CG-CD 3.5Å; D108-R129 WeakPolarHBondContact OD2-CD 3.26Å; D108-R129 IonicContact OD2-NH1 3.66Å; S109-R129 PolarHBondContact OG-NH1 3.35Å; F125-R129 PolarHBondContact O-N 3.4Å; F125-R129 VanDerWaalsContact O-N 3.16Å; D126-R129 PolarHBondContact O-N 3.05Å; D126-R129 IonicContact OD1-NH1 3.97Å; R129-C131 PolarHBondContact O-N 2.71Å; R129-Y132 WeakPolarHBondContact O-CB 3.24Å; R129-Y132 PolarHBondContact O-N 3.2Å; R129-Y132 VanDerWaalsContact O-N 3.1Å; R129-E133 PolarHBondContact O-N 2.93Å; R129-N310 PolarHBondContact NH1-OD1 2.86Å
130D79.1Confident79.2Confident62 Ų6242.5 Ų42.533%0.33220%0.201SC..Hα-helixtrans-61-43.7179.8-84-20.4000112.7D126 T127 V128 Y132 E133 K198D126-D130 WeakPolarHBondContact O-CB 3.04Å; D126-D130 PolarHBondContact O-N 3.23Å; T127-D130 PolarHBondContact O-N 2.86Å; V128-D130 VanDerWaalsContact C-N 3.32Å; V128-D130 PolarHBondContact O-N 2.82Å; D130-Y132 VanDerWaalsContact C-N 3.27Å; D130-Y132 PolarHBondContact O-N 2.82Å; D130-E133 PolarHBondContact O-N 2.84Å; D130-K198 HydrophobicContact CB-CG 4.38Å; D130-K198 VanDerWaalsContact O-CD 3.31Å; D130-K198 WeakPolarHBondContact O-CD 3.46Å; D130-K198 WeakPolarHBondContact O-CE 3.34Å; D130-K198 WeakPolarHBondContact O-CG 3.27Å; D130-K198 WeakPolarHBondContact OD1-CE 3.43Å; D130-K198 IonicContact OD1-NZ 3.45Å; D130-K198 PolarHBondContact OD1-NZ 2.97Å
131C83.2Confident80.3Confident45 Ų4535.3 Ų35.330%0.30417%0.168SC..Hα-helixtrans-63.3-38.2175.9-67.70000111.5T127 V128 R129 F135T127-C131 PolarHBondContact O-N 3.41Å; T127-C131 VanDerWaalsContact O-N 3.12Å; T127-C131 PolarHBondContact O-SG 3.35Å; V128-C131 PolarHBondContact O-N 3.47Å; R129-C131 PolarHBondContact O-N 2.71Å; C131-F135 PolarHBondContact O-N 2.68Å
132Y86.4Confident81.3Confident30 Ų3029.4 Ų29.412%0.11815%0.146CC..Hα-helixtrans-69.7-35.7-179.6-154.1-95.9000113R97 F100 I101 I104 V128 R129 D130 A134 F135 V136R97-Y132 PolarHBondContact O-OH 3.45Å; F100-Y132 HydrophobicContact CB-CE1 4.35Å; F100-Y132 WeakPolarHBondContact CB-OH 3.15Å; I101-Y132 HydrophobicContact CB-CD1 4.23Å; I101-Y132 HydrophobicContact CB-CE1 4.01Å; I101-Y132 HydrophobicContact CG1-CD1 4.24Å; I104-Y132 HydrophobicContact CD1-CD1 3.89Å; I104-Y132 HydrophobicContact CD1-CD2 3.36Å; I104-Y132 HydrophobicContact CD1-CE1 3.82Å; I104-Y132 HydrophobicContact CD1-CE2 3.27Å; I104-Y132 HydrophobicContact CD1-CG 3.67Å; V128-Y132 PolarHBondContact O-N 3.48Å; V128-Y132 VanDerWaalsContact O-N 3.09Å; R129-Y132 WeakPolarHBondContact O-CB 3.24Å; R129-Y132 PolarHBondContact O-N 3.2Å; R129-Y132 VanDerWaalsContact O-N 3.1Å; D130-Y132 VanDerWaalsContact C-N 3.27Å; D130-Y132 PolarHBondContact O-N 2.82Å; Y132-A134 VanDerWaalsContact C-N 3.3Å; Y132-A134 PolarHBondContact O-N 2.96Å; Y132-F135 HydrophobicContact CD2-CD1 4.34Å; Y132-F135 AromaticContact CE2-CD1 3.82Å; Y132-F135 HydrophobicContact CE2-CD1 3.82Å; Y132-F135 HydrophobicContact CE2-CE1 4.34Å; Y132-F135 WeakPolarHBondContact O-CB 2.99Å; Y132-F135 PolarHBondContact O-N 2.73Å; Y132-V136 HydrophobicContact CD1-CG2 3.53Å; Y132-V136 HydrophobicContact CE1-CG2 3.35Å; Y132-V136 WeakPolarHBondContact O-CG2 3.33Å; Y132-V136 PolarHBondContact O-N 3.18Å
133E83.1Confident82.1Confident7 Ų727.4 Ų27.43%0.03314%0.139CC..Hα-helixtrans-55.8-47.2176.3-161.3-171.1110.900111.5Y105 R129 D130 F135 V136 I137 K198 Y232 I270Y105-E133 WeakPolarHBondContact OH-CB 3.47Å; R129-E133 PolarHBondContact O-N 2.93Å; D130-E133 PolarHBondContact O-N 2.84Å; E133-F135 VanDerWaalsContact C-N 3.34Å; E133-F135 PolarHBondContact O-N 3.34Å; E133-V136 PolarHBondContact O-N 3.04Å; E133-I137 WeakPolarHBondContact O-CG1 3.42Å; E133-I137 PolarHBondContact O-N 3.04Å; E133-I137 VanDerWaalsContact O-N 3.16Å; E133-K198 IonicContact OE1-NZ 2.86Å; E133-K198 PolarHBondContact OE1-NZ 3.4Å; E133-K198 IonicContact OE2-NZ 2.75Å; E133-K198 PolarHBondContact OE2-NZ 3.44Å; E133-Y232 PolarHBondContact OE1-OH 3.43Å; E133-I270 HydrophobicContact CG-CG1 4.28Å; E133-I270 HydrophobicContact CG-CG2 3.86Å
134A85.3Confident82.7Confident2 Ų227 Ų272%0.01714%0.137CC..Hα-helixtrans-65-41.5178.900000111.5Y132 V136 I137 Y138 F194 C195 K198Y132-A134 VanDerWaalsContact C-N 3.3Å; Y132-A134 PolarHBondContact O-N 2.96Å; A134-V136 VanDerWaalsContact C-N 3.29Å; A134-V136 PolarHBondContact O-N 3.15Å; A134-I137 PolarHBondContact O-N 3.37Å; A134-Y138 PolarHBondContact O-N 3.48Å; A134-Y138 VanDerWaalsContact O-N 3.13Å; A134-F194 HydrophobicContact CB-CD1 3.84Å; A134-F194 HydrophobicContact CB-CE1 3.71Å; A134-C195 PolarHBondContact O-SG 3.33Å; A134-K198 HydrophobicContact CB-CB 4.02Å; A134-K198 HydrophobicContact CB-CD 4.28Å; A134-K198 HydrophobicContact CB-CG 4.47Å
135F86.6Confident83.2Confident23 Ų2320.8 Ų20.810%0.10111%0.112CC..Hα-helixtrans-58.9-39.3174.7-174.2-116.3000112.3R97 C131 Y132 E133 Y138 N139 M367 P369 M372R97-F135 HydrophobicContact CB-CE1 3.91Å; R97-F135 HydrophobicContact CB-CZ 4.43Å; R97-F135 HydrophobicContact CG-CE1 3.84Å; R97-F135 HydrophobicContact CG-CZ 3.99Å; C131-F135 PolarHBondContact O-N 2.68Å; Y132-F135 HydrophobicContact CD2-CD1 4.34Å; Y132-F135 AromaticContact CE2-CD1 3.82Å; Y132-F135 HydrophobicContact CE2-CD1 3.82Å; Y132-F135 HydrophobicContact CE2-CE1 4.34Å; Y132-F135 WeakPolarHBondContact O-CB 2.99Å; Y132-F135 PolarHBondContact O-N 2.73Å; E133-F135 VanDerWaalsContact C-N 3.34Å; E133-F135 PolarHBondContact O-N 3.34Å; F135-Y138 PolarHBondContact O-N 2.83Å; F135-N139 WeakPolarHBondContact CD1-ND2 3.19Å; F135-N139 WeakPolarHBondContact CD2-ND2 3.31Å; F135-N139 WeakPolarHBondContact CE1-ND2 3.42Å; F135-N139 VanDerWaalsContact CE2-ND2 3.28Å; F135-N139 WeakPolarHBondContact CE2-ND2 3.38Å; F135-N139 WeakPolarHBondContact CZ-ND2 3.24Å; F135-N139 PolarHBondContact O-N 3.25Å; F135-N139 PolarHBondContact O-ND2 2.98Å; F135-M367 HydrophobicContact CE1-CE 4.41Å; F135-P369 HydrophobicContact CE2-CB 4.36Å; F135-M372 HydrophobicContact CD2-CE 4.43Å; F135-M372 HydrophobicContact CD2-SD 3.94Å
136V85.8Confident83.6Confident1 Ų121.9 Ų21.91%0.00612%0.118CC..Hα-helixtrans-67.2-42.5179171.10000111.7I98 I101 Y132 E133 A134 Y138 N139 F140 V266 I270I98-V136 HydrophobicContact CG1-CG1 4.42Å; I98-V136 HydrophobicContact CG2-CG1 4.33Å; I101-V136 HydrophobicContact CB-CG2 3.91Å; I101-V136 HydrophobicContact CD1-CB 4.36Å; I101-V136 HydrophobicContact CD1-CG1 4.15Å; I101-V136 HydrophobicContact CD1-CG2 4.04Å; I101-V136 HydrophobicContact CG1-CG2 4.13Å; Y132-V136 HydrophobicContact CD1-CG2 3.53Å; Y132-V136 HydrophobicContact CE1-CG2 3.35Å; Y132-V136 WeakPolarHBondContact O-CG2 3.33Å; Y132-V136 PolarHBondContact O-N 3.18Å; E133-V136 PolarHBondContact O-N 3.04Å; A134-V136 VanDerWaalsContact C-N 3.29Å; A134-V136 PolarHBondContact O-N 3.15Å; V136-Y138 VanDerWaalsContact C-N 3.33Å; V136-Y138 PolarHBondContact O-N 3.08Å; V136-N139 PolarHBondContact O-N 2.66Å; V136-F140 WeakPolarHBondContact O-CB 3.32Å; V136-F140 PolarHBondContact O-N 3.44Å; V136-V266 HydrophobicContact CG1-CG1 4.16Å; V136-I270 HydrophobicContact CG1-CD1 4.32Å
137I85.1Confident83.8Confident2 Ų221.2 Ų21.21%0.0111%0.113CC..Hα-helixtrans-61.3-44.2177.6-60.1-177.4000110.4E133 A134 F140 L141 T191 F194 L240 L243 I270E133-I137 WeakPolarHBondContact O-CG1 3.42Å; E133-I137 PolarHBondContact O-N 3.04Å; E133-I137 VanDerWaalsContact O-N 3.16Å; A134-I137 PolarHBondContact O-N 3.37Å; I137-F140 PolarHBondContact O-N 3.22Å; I137-L141 PolarHBondContact O-N 3.24Å; I137-T191 HydrophobicContact CG2-CG2 3.77Å; I137-F194 HydrophobicContact CD1-CD1 3.91Å; I137-F194 HydrophobicContact CD1-CE1 3.52Å; I137-F194 HydrophobicContact CD1-CZ 4.39Å; I137-F194 HydrophobicContact CG1-CE1 4.49Å; I137-L240 HydrophobicContact CD1-CD2 4.13Å; I137-L243 HydrophobicContact CG2-CD1 4.39Å; I137-I270 HydrophobicContact CD1-CD1 4.19Å; I137-I270 HydrophobicContact CG1-CD1 3.6Å
138Y87.4Confident83.7Confident4 Ų420.7 Ų20.72%0.01611%0.109CC..Hα-helixtrans-57.9-51174.2166.8-97.9000111.9A134 F135 V136 F140 L141 S142 L192 C195 M372 D375A134-Y138 PolarHBondContact O-N 3.48Å; A134-Y138 VanDerWaalsContact O-N 3.13Å; F135-Y138 PolarHBondContact O-N 2.83Å; V136-Y138 VanDerWaalsContact C-N 3.33Å; V136-Y138 PolarHBondContact O-N 3.08Å; Y138-F140 PolarHBondContact O-N 2.71Å; Y138-L141 PolarHBondContact O-N 2.93Å; Y138-L141 VanDerWaalsContact O-N 3.12Å; Y138-S142 WeakPolarHBondContact CE2-OG 3.48Å; Y138-S142 PolarHBondContact O-N 3Å; Y138-S142 PolarHBondContact O-OG 3.16Å; Y138-L192 HydrophobicContact CD2-CD2 3.71Å; Y138-L192 HydrophobicContact CD2-CG 4.49Å; Y138-L192 HydrophobicContact CE2-CD2 3.76Å; Y138-C195 VanDerWaalsContact CB-SG 3.56Å; Y138-M372 HydrophobicContact CD1-CB 3.97Å; Y138-M372 HydrophobicContact CD1-CG 3.84Å; Y138-M372 HydrophobicContact CD1-SD 4.1Å; Y138-M372 HydrophobicContact CD2-CG 4.02Å; Y138-M372 HydrophobicContact CE1-CB 3.58Å; Y138-M372 HydrophobicContact CE1-CG 3.9Å; Y138-M372 HydrophobicContact CE2-CB 4.32Å; Y138-M372 HydrophobicContact CE2-CG 4.06Å; Y138-M372 HydrophobicContact CG-CG 3.92Å; Y138-M372 HydrophobicContact CG-SD 4.16Å; Y138-M372 WeakPolarHBondContact OH-CA 3.21Å; Y138-D375 HydrophobicContact CE2-CB 4.34Å; Y138-D375 PolarHBondContact OH-OD2 2.85Å; Y138-D375 VanDerWaalsContact OH-OD2 3.06Å
139N87.9Confident83.4Confident0 Ų019.2 Ų19.20%011%0.11CC..Hα-helixtrans-64.1-33.3-178-78.4-72.3000112.7H94 R97 I98 F135 V136 L143H94-N139 HydrophobicContact CB-CB 4.5Å; H94-N139 PolarHBondContact CD2-OD1 3.48Å; R97-N139 HydrophobicContact CB-CB 4.29Å; R97-N139 VanDerWaalsContact CD-CG 3.4Å; R97-N139 WeakPolarHBondContact CD-OD1 3.42Å; R97-N139 PolarHBondContact NH1-OD1 3.05Å; I98-N139 HydrophobicContact CG1-CB 4.05Å; F135-N139 WeakPolarHBondContact CD1-ND2 3.19Å; F135-N139 WeakPolarHBondContact CD2-ND2 3.31Å; F135-N139 WeakPolarHBondContact CE1-ND2 3.42Å; F135-N139 VanDerWaalsContact CE2-ND2 3.28Å; F135-N139 WeakPolarHBondContact CE2-ND2 3.38Å; F135-N139 WeakPolarHBondContact CZ-ND2 3.24Å; F135-N139 PolarHBondContact O-N 3.25Å; F135-N139 PolarHBondContact O-ND2 2.98Å; V136-N139 PolarHBondContact O-N 2.66Å; N139-L143 VanDerWaalsContact O-CB 3.23Å; N139-L143 WeakPolarHBondContact O-CB 3.48Å; N139-L143 PolarHBondContact O-N 3.49Å
140F85.4Confident83.3Confident8 Ų819.3 Ų19.34%0.03512%0.115CC..Hα-helixtrans-66.8-42.8174.3-179.6-100.5000112I98 V136 I137 Y138 L143 C144 L243 F263 V266I98-F140 HydrophobicContact CD1-CB 4.06Å; I98-F140 HydrophobicContact CD1-CD2 4.23Å; V136-F140 WeakPolarHBondContact O-CB 3.32Å; V136-F140 PolarHBondContact O-N 3.44Å; I137-F140 PolarHBondContact O-N 3.22Å; Y138-F140 PolarHBondContact O-N 2.71Å; F140-L143 PolarHBondContact O-N 2.78Å; F140-C144 PolarHBondContact O-N 2.74Å; F140-C144 VanDerWaalsContact O-N 3.17Å; F140-C144 PolarHBondContact O-SG 3.43Å; F140-L243 HydrophobicContact CD1-CD1 3.67Å; F140-L243 HydrophobicContact CD1-CD2 3.77Å; F140-L243 HydrophobicContact CD1-CG 4.14Å; F140-L243 HydrophobicContact CE1-CD1 4.11Å; F140-L243 HydrophobicContact CE1-CD2 3.74Å; F140-L243 HydrophobicContact CE1-CG 4.15Å; F140-F263 AromaticContact CE1-CD2 3.48Å; F140-F263 HydrophobicContact CE1-CD2 3.48Å; F140-F263 VanDerWaalsContact CE1-CD2 3.48Å; F140-F263 AromaticContact CE1-CE2 3.97Å; F140-F263 HydrophobicContact CE1-CE2 3.97Å; F140-F263 HydrophobicContact CE1-CG 4.41Å; F140-F263 HydrophobicContact CZ-CB 3.97Å; F140-F263 AromaticContact CZ-CD2 3.59Å; F140-F263 HydrophobicContact CZ-CD2 3.59Å; F140-F263 HydrophobicContact CZ-CG 4.18Å; F140-V266 HydrophobicContact CB-CG1 4.2Å; F140-V266 HydrophobicContact CD2-CB 4.1Å; F140-V266 HydrophobicContact CD2-CG1 4.21Å; F140-V266 HydrophobicContact CD2-CG2 3.76Å; F140-V266 HydrophobicContact CE2-CB 4.36Å; F140-V266 HydrophobicContact CE2-CG2 4.11Å; F140-V266 HydrophobicContact CG-CB 4.39Å; F140-V266 HydrophobicContact CG-CG1 4.06Å; F140-V266 HydrophobicContact CG-CG2 4.43Å
141L84.8Confident82.9Confident3 Ų318.8 Ų18.82%0.01611%0.111CC..Hα-helixtrans-61.9-51.1174.2-178.464.3000110.8I137 Y138 L143 C144 Y145 K188 T191 L243 F246I137-L141 PolarHBondContact O-N 3.24Å; Y138-L141 PolarHBondContact O-N 2.93Å; Y138-L141 VanDerWaalsContact O-N 3.12Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 3.42Å; L141-C144 WeakPolarHBondContact O-CB 3.47Å; L141-C144 PolarHBondContact O-N 2.92Å; L141-Y145 HydrophobicContact CD1-CD2 4.13Å; L141-Y145 HydrophobicContact CD1-CE2 3.68Å; L141-Y145 HydrophobicContact CD2-CE2 4.12Å; L141-Y145 HydrophobicContact CG-CD2 3.96Å; L141-Y145 HydrophobicContact CG-CE2 3.68Å; L141-Y145 WeakPolarHBondContact O-CD2 3.27Å; L141-Y145 PolarHBondContact O-N 3.48Å; L141-Y145 VanDerWaalsContact O-N 3.08Å; L141-K188 HydrophobicContact CD2-CB 4.44Å; L141-T191 HydrophobicContact CB-CG2 4.29Å; L141-T191 HydrophobicContact CD2-CG2 3.91Å; L141-T191 WeakPolarHBondContact CD2-OG1 3.26Å; L141-L243 HydrophobicContact CB-CD1 3.93Å; L141-L243 HydrophobicContact CD1-CD1 4.11Å; L141-F246 HydrophobicContact CD1-CB 4.4Å; L141-F246 HydrophobicContact CD1-CD1 3.96Å; L141-F246 HydrophobicContact CD1-CD2 4.31Å; L141-F246 HydrophobicContact CD1-CE1 4.35Å; L141-F246 HydrophobicContact CD1-CG 3.95Å
142S85.6Confident82.3Confident12 Ų1220.8 Ų20.88%0.08413%0.125CC..Hα-helixtrans-61.3-37.4-179.7-61.20000112.4H94 Y138 C144 Y145 E146H94-S142 VanDerWaalsContact CD2-CB 3.5Å; H94-S142 WeakPolarHBondContact CD2-CB 3.33Å; H94-S142 VanDerWaalsContact NE2-CB 3.3Å; H94-S142 WeakPolarHBondContact NE2-CB 3.38Å; Y138-S142 WeakPolarHBondContact CE2-OG 3.48Å; Y138-S142 PolarHBondContact O-N 3Å; Y138-S142 PolarHBondContact O-OG 3.16Å; S142-C144 VanDerWaalsContact C-N 3.29Å; S142-C144 PolarHBondContact O-N 3.4Å; S142-Y145 WeakPolarHBondContact O-CB 3.16Å; S142-Y145 PolarHBondContact O-N 3.28Å; S142-E146 WeakPolarHBondContact O-CG 3.36Å; S142-E146 PolarHBondContact O-N 3.09Å
143L85.3Confident81.6Confident1 Ų121.2 Ų21.21%0.00514%0.135CC..Hα-helixtrans-58.9-41.1171.9179.660.8000112E91 H94 I95 I98 N139 F140 L141 Y145 E146 Y147 F328E91-L143 HydrophobicContact CB-CD1 4.11Å; E91-L143 WeakPolarHBondContact O-CD1 3.13Å; H94-L143 HydrophobicContact CB-CB 3.83Å; H94-L143 HydrophobicContact CB-CD1 4.19Å; I95-L143 HydrophobicContact CD1-CD1 4.21Å; I95-L143 HydrophobicContact CG1-CD1 3.81Å; I95-L143 HydrophobicContact CG1-CD2 3.65Å; I95-L143 HydrophobicContact CG1-CG 4.41Å; I98-L143 HydrophobicContact CD1-CD2 3.93Å; N139-L143 VanDerWaalsContact O-CB 3.23Å; N139-L143 WeakPolarHBondContact O-CB 3.48Å; N139-L143 PolarHBondContact O-N 3.49Å; F140-L143 PolarHBondContact O-N 2.78Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 3.42Å; L143-Y145 VanDerWaalsContact C-N 3.34Å; L143-E146 PolarHBondContact O-N 3.32Å; L143-Y147 HydrophobicContact CD1-CD1 4.2Å; L143-Y147 HydrophobicContact CD1-CD2 4.39Å; L143-Y147 HydrophobicContact CD1-CE1 3.75Å; L143-Y147 HydrophobicContact CD1-CE2 3.96Å; L143-Y147 HydrophobicContact CD2-CE2 3.94Å; L143-Y147 HydrophobicContact CG-CD2 4.09Å; L143-Y147 HydrophobicContact CG-CE1 4.4Å; L143-Y147 HydrophobicContact CG-CE2 3.7Å; L143-Y147 PolarHBondContact O-N 2.94Å; L143-F328 HydrophobicContact CD2-CE1 3.7Å; L143-F328 HydrophobicContact CD2-CZ 4.16Å
144C81.9Confident81Confident11 Ų1121 Ų217%0.07413%0.134CC..Hα-helixtrans-67.8-36.4178.2-60.50000111.7F140 L141 S142 Y147 L148 F246F140-C144 PolarHBondContact O-N 2.74Å; F140-C144 VanDerWaalsContact O-N 3.17Å; F140-C144 PolarHBondContact O-SG 3.43Å; L141-C144 WeakPolarHBondContact O-CB 3.47Å; L141-C144 PolarHBondContact O-N 2.92Å; S142-C144 VanDerWaalsContact C-N 3.29Å; S142-C144 PolarHBondContact O-N 3.4Å; C144-Y147 PolarHBondContact O-N 3.39Å; C144-L148 WeakPolarHBondContact O-CD1 3.08Å; C144-L148 WeakPolarHBondContact O-CG 3.28Å; C144-L148 PolarHBondContact O-N 3.34Å; C144-F246 HydrophobicContact CB-CD1 4.38Å; C144-F246 HydrophobicContact CB-CE1 3.54Å; C144-F246 HydrophobicContact CB-CZ 4.28Å
145Y82.8Confident80.2Confident13 Ų1324.2 Ų24.25%0.05115%0.15CC..Hα-helixtrans-60.8-45.3171.6-84-87.5000112L141 S142 L143 L148 G149 G150 E151 I154 L184 F246L141-Y145 HydrophobicContact CD1-CD2 4.13Å; L141-Y145 HydrophobicContact CD1-CE2 3.68Å; L141-Y145 HydrophobicContact CD2-CE2 4.12Å; L141-Y145 HydrophobicContact CG-CD2 3.96Å; L141-Y145 HydrophobicContact CG-CE2 3.68Å; L141-Y145 WeakPolarHBondContact O-CD2 3.27Å; L141-Y145 PolarHBondContact O-N 3.48Å; L141-Y145 VanDerWaalsContact O-N 3.08Å; S142-Y145 WeakPolarHBondContact O-CB 3.16Å; S142-Y145 PolarHBondContact O-N 3.28Å; L143-Y145 VanDerWaalsContact C-N 3.34Å; Y145-L148 PolarHBondContact O-N 3.15Å; Y145-G149 PolarHBondContact O-N 2.94Å; Y145-G150 WeakPolarHBondContact O-CA 2.97Å; Y145-G150 PolarHBondContact O-N 3.45Å; Y145-E151 HydrophobicContact CD1-CG 3.9Å; Y145-E151 HydrophobicContact CE1-CG 4Å; Y145-I154 HydrophobicContact CD1-CD1 3.42Å; Y145-I154 VanDerWaalsContact CD1-CD1 3.42Å; Y145-I154 HydrophobicContact CE1-CD1 3.92Å; Y145-I154 HydrophobicContact CG-CD1 4.21Å; Y145-L184 HydrophobicContact CE1-CD2 4.16Å; Y145-L184 PolarHBondContact OH-O 3.37Å; Y145-F246 HydrophobicContact CD1-CE2 4.36Å; Y145-F246 HydrophobicContact CD1-CZ 4.49Å; Y145-F246 HydrophobicContact CD2-CE2 4.15Å; Y145-F246 HydrophobicContact CD2-CZ 4.07Å; Y145-F246 AromaticContact CE1-CE2 3.85Å; Y145-F246 HydrophobicContact CE1-CE2 3.85Å; Y145-F246 HydrophobicContact CE1-CZ 4.41Å; Y145-F246 HydrophobicContact CE2-CD2 4.16Å; Y145-F246 AromaticContact CE2-CE2 3.61Å; Y145-F246 HydrophobicContact CE2-CE2 3.61Å; Y145-F246 AromaticContact CE2-CZ 3.97Å; Y145-F246 HydrophobicContact CE2-CZ 3.97Å; Y145-F246 HydrophobicContact CG-CE2 4.49Å; Y145-F246 HydrophobicContact CG-CZ 4.31Å; Y145-F246 AromaticContact CZ-CE2 3.42Å; Y145-F246 VanDerWaalsContact CZ-CE2 3.42Å
146E84.8Confident79.2Confident68 Ų6826.8 Ų26.832%0.31818%0.175SC..Hα-helixtrans-64.5-41.9178.1-70.8-62.5150.800112.4N90 E91 S142 L143 L148 G149N90-E146 HydrophobicContact CB-CG 4.38Å; N90-E146 WeakPolarHBondContact CB-OE2 3.34Å; E91-E146 HydrophobicContact CG-CB 4.43Å; S142-E146 WeakPolarHBondContact O-CG 3.36Å; S142-E146 PolarHBondContact O-N 3.09Å; L143-E146 PolarHBondContact O-N 3.32Å; E146-L148 PolarHBondContact O-N 3.29Å; E146-L148 VanDerWaalsContact O-N 3.15Å; E146-G149 PolarHBondContact O-N 3.28Å
147Y79.6Confident78.5Confident24 Ų2432 Ų329%0.09420%0.2CC..Hα-helixtrans-60.3-25.6176.1-76.9-22.7000114.1E91 I95 L143 C144 G149 L254E91-Y147 HydrophobicContact CB-CE1 4.11Å; E91-Y147 HydrophobicContact CG-CD1 3.9Å; E91-Y147 HydrophobicContact CG-CE1 3.91Å; E91-Y147 WeakPolarHBondContact OE2-CE1 3.48Å; I95-Y147 WeakPolarHBondContact CD1-OH 3.47Å; L143-Y147 HydrophobicContact CD1-CD1 4.2Å; L143-Y147 HydrophobicContact CD1-CD2 4.39Å; L143-Y147 HydrophobicContact CD1-CE1 3.75Å; L143-Y147 HydrophobicContact CD1-CE2 3.96Å; L143-Y147 HydrophobicContact CD2-CE2 3.94Å; L143-Y147 HydrophobicContact CG-CD2 4.09Å; L143-Y147 HydrophobicContact CG-CE1 4.4Å; L143-Y147 HydrophobicContact CG-CE2 3.7Å; L143-Y147 PolarHBondContact O-N 2.94Å; C144-Y147 PolarHBondContact O-N 3.39Å; Y147-G149 VanDerWaalsContact C-N 3.33Å; Y147-L254 HydrophobicContact CD2-CD2 4.34Å
148L76.6Confident77.6Confident22 Ų2232.5 Ų32.512%0.11520%0.202CC..THydrogen-bonded Turntrans-90.52.9177.2-66156.3000112.9C144 Y145 E146 A153 I154 F246 T250 L253 L254C144-L148 WeakPolarHBondContact O-CD1 3.08Å; C144-L148 WeakPolarHBondContact O-CG 3.28Å; C144-L148 PolarHBondContact O-N 3.34Å; Y145-L148 PolarHBondContact O-N 3.15Å; E146-L148 PolarHBondContact O-N 3.29Å; E146-L148 VanDerWaalsContact O-N 3.15Å; L148-A153 WeakPolarHBondContact O-CB 3.2Å; L148-I154 HydrophobicContact CB-CD1 3.68Å; L148-I154 HydrophobicContact CB-CG1 3.28Å; L148-I154 HydrophobicContact CD1-CD1 3.66Å; L148-I154 HydrophobicContact CD1-CG1 3.8Å; L148-I154 HydrophobicContact CG-CD1 4.3Å; L148-I154 HydrophobicContact CG-CG1 4.07Å; L148-F246 HydrophobicContact CD1-CE1 4.13Å; L148-F246 HydrophobicContact CD1-CZ 3.68Å; L148-T250 HydrophobicContact CD1-CG2 3.64Å; L148-L253 HydrophobicContact CD2-CB 3.33Å; L148-L253 HydrophobicContact CD2-CD1 3.91Å; L148-L253 HydrophobicContact CD2-CG 4.26Å; L148-L254 HydrophobicContact CD2-CG 4.14Å; L148-L254 HydrophobicContact CG-CD2 4.37Å; L148-L254 HydrophobicContact CG-CG 4.37Å
149G73.6Confident76.3Confident52 Ų5240.3 Ų40.354%0.53623%0.232SC..THydrogen-bonded Turntrans82.320.5-178.300000114.4Y145 E146 Y147 A153Y145-G149 PolarHBondContact O-N 2.94Å; E146-G149 PolarHBondContact O-N 3.28Å; Y147-G149 VanDerWaalsContact C-N 3.33Å; G149-A153 WeakPolarHBondContact O-CB 3.36Å
150G78.9Confident74.7Confident15 Ų1543.4 Ų43.416%0.15526%0.264CS..Hα-helixtrans88.3177.6176.400000114.8Y145 S152 A153 I154Y145-G150 WeakPolarHBondContact O-CA 2.97Å; Y145-G150 PolarHBondContact O-N 3.45Å; G150-S152 VanDerWaalsContact C-N 3.28Å; G150-S152 PolarHBondContact O-N 3Å; G150-A153 PolarHBondContact O-N 3.1Å; G150-I154 WeakPolarHBondContact O-CD1 3.07Å; G150-I154 WeakPolarHBondContact O-CG1 3.11Å; G150-I154 PolarHBondContact O-N 3.06Å
151E71.6Confident73.4Confident51 Ų5147.2 Ų47.224%0.23828%0.28CS..Hα-helixtrans-60.2-34-172.3-64.4-175-174.300113.2Y145 M155 K188Y145-E151 HydrophobicContact CD1-CG 3.9Å; Y145-E151 HydrophobicContact CE1-CG 4Å; E151-M155 WeakPolarHBondContact O-CB 3.41Å; E151-M155 WeakPolarHBondContact O-CE 3.23Å; E151-M155 VanDerWaalsContact O-CG 3.28Å; E151-M155 WeakPolarHBondContact O-CG 3.26Å; E151-M155 PolarHBondContact O-N 2.79Å; E151-M155 VanDerWaalsContact O-N 3.11Å; E151-K188 IonicContact OE1-NZ 3.49Å; E151-K188 PolarHBondContact OE1-NZ 3.45Å
152S69.4Low72.1Confident87 Ų8752.2 Ų52.261%0.60831%0.312SS*.Hα-helixtrans-74.6-42.2-178.551.50000113.5G150 M155 A156G150-S152 VanDerWaalsContact C-N 3.28Å; G150-S152 PolarHBondContact O-N 3Å; S152-M155 PolarHBondContact O-N 3.41Å; S152-A156 PolarHBondContact O-N 2.99Å
153A71.7Confident70.8Confident40 Ų4052.5 Ų52.533%0.33131%0.313SS..Hα-helixtrans-67.6-42.8177.700000111.3L148 G149 G150 M155 A156 E157L148-A153 WeakPolarHBondContact O-CB 3.2Å; G149-A153 WeakPolarHBondContact O-CB 3.36Å; G150-A153 PolarHBondContact O-N 3.1Å; A153-M155 VanDerWaalsContact C-N 3.3Å; A153-M155 PolarHBondContact O-N 3.35Å; A153-A156 PolarHBondContact O-N 3.02Å; A153-A156 VanDerWaalsContact O-N 3.15Å; A153-E157 WeakPolarHBondContact O-CB 3.03Å; A153-E157 PolarHBondContact O-N 3.01Å
154I71.5Confident69.1Low1 Ų158.6 Ų58.61%0.00534%0.342CS..Hα-helixtrans-55.4-48.7171.8-66167.9000109.9Y145 L148 G150 A156 E157 I158 L184 F246Y145-I154 HydrophobicContact CD1-CD1 3.42Å; Y145-I154 VanDerWaalsContact CD1-CD1 3.42Å; Y145-I154 HydrophobicContact CE1-CD1 3.92Å; Y145-I154 HydrophobicContact CG-CD1 4.21Å; L148-I154 HydrophobicContact CB-CD1 3.68Å; L148-I154 HydrophobicContact CB-CG1 3.28Å; L148-I154 HydrophobicContact CD1-CD1 3.66Å; L148-I154 HydrophobicContact CD1-CG1 3.8Å; L148-I154 HydrophobicContact CG-CD1 4.3Å; L148-I154 HydrophobicContact CG-CG1 4.07Å; G150-I154 WeakPolarHBondContact O-CD1 3.07Å; G150-I154 WeakPolarHBondContact O-CG1 3.11Å; G150-I154 PolarHBondContact O-N 3.06Å; I154-A156 VanDerWaalsContact C-N 3.32Å; I154-A156 PolarHBondContact O-N 3.45Å; I154-E157 PolarHBondContact O-N 3.41Å; I154-I158 HydrophobicContact CG2-CD1 3.4Å; I154-I158 VanDerWaalsContact CG2-CD1 3.4Å; I154-I158 HydrophobicContact CG2-CG1 4.2Å; I154-I158 WeakPolarHBondContact O-CB 3.26Å; I154-I158 VanDerWaalsContact O-CG1 3.27Å; I154-I158 WeakPolarHBondContact O-CG1 3.48Å; I154-I158 PolarHBondContact O-N 2.83Å; I154-L184 HydrophobicContact CB-CD1 4.46Å; I154-L184 HydrophobicContact CG2-CD1 3.55Å; I154-L184 HydrophobicContact CG2-CD2 3.81Å; I154-L184 HydrophobicContact CG2-CG 4.34Å; I154-F246 HydrophobicContact CD1-CZ 4.48Å
155M67.2Low67.4Low70 Ų7059.4 Ų59.435%0.34535%0.347SS..Hα-helixtrans-63.4-36179-81.9-167.4-72.900113.4E151 S152 A153 R159 I181 L184E151-M155 WeakPolarHBondContact O-CB 3.41Å; E151-M155 WeakPolarHBondContact O-CE 3.23Å; E151-M155 VanDerWaalsContact O-CG 3.28Å; E151-M155 WeakPolarHBondContact O-CG 3.26Å; E151-M155 PolarHBondContact O-N 2.79Å; E151-M155 VanDerWaalsContact O-N 3.11Å; S152-M155 PolarHBondContact O-N 3.41Å; A153-M155 VanDerWaalsContact C-N 3.3Å; A153-M155 PolarHBondContact O-N 3.35Å; M155-R159 WeakPolarHBondContact O-CB 3.4Å; M155-R159 PolarHBondContact O-N 2.92Å; M155-I181 HydrophobicContact CE-CD1 3.88Å; M155-I181 HydrophobicContact CG-CD1 4.34Å; M155-I181 HydrophobicContact SD-CB 3.76Å; M155-I181 HydrophobicContact SD-CD1 3.42Å; M155-I181 WeakPolarHBondContact SD-CD1 3.44Å; M155-I181 HydrophobicContact SD-CG1 3.92Å; M155-L184 HydrophobicContact CG-CD1 4.18Å
156A67.5Low65.9Low77 Ų7761.1 Ų61.164%0.63636%0.361SS*.Hα-helixtrans-66-42.3177.700000111.5S152 A153 I154S152-A156 PolarHBondContact O-N 2.99Å; A153-A156 PolarHBondContact O-N 3.02Å; A153-A156 VanDerWaalsContact O-N 3.15Å; I154-A156 VanDerWaalsContact C-N 3.32Å; I154-A156 PolarHBondContact O-N 3.45Å
157E69.3Low64Low112 Ų11262.8 Ų62.852%0.52338%0.379SS..Hα-helixtrans-81.2-31.2-173.7-166.659.9-151.400113.3A153 I154 L253A153-E157 WeakPolarHBondContact O-CB 3.03Å; A153-E157 PolarHBondContact O-N 3.01Å; I154-E157 PolarHBondContact O-N 3.41Å; E157-L253 HydrophobicContact CB-CD1 4.05Å; E157-L253 HydrophobicContact CG-CD1 3.65Å; E157-L253 HydrophobicContact CG-CD2 3.4Å; E157-L253 HydrophobicContact CG-CG 4.16Å
158I66.3Low62.3Low12 Ų1269.7 Ų69.76%0.06241%0.414CS..Hα-helixtrans-91.4-15.9-175.1-68.2-173.6000112.2I154 G160 K161 Y179 T250 L253I154-I158 HydrophobicContact CG2-CD1 3.4Å; I154-I158 VanDerWaalsContact CG2-CD1 3.4Å; I154-I158 HydrophobicContact CG2-CG1 4.2Å; I154-I158 WeakPolarHBondContact O-CB 3.26Å; I154-I158 VanDerWaalsContact O-CG1 3.27Å; I154-I158 WeakPolarHBondContact O-CG1 3.48Å; I154-I158 PolarHBondContact O-N 2.83Å; I158-G160 PolarHBondContact O-N 3.22Å; I158-K161 PolarHBondContact O-N 2.81Å; I158-Y179 HydrophobicContact CG2-CD1 4.02Å; I158-Y179 HydrophobicContact CG2-CD2 3.55Å; I158-Y179 HydrophobicContact CG2-CG 3.25Å; I158-T250 HydrophobicContact CD1-CG2 3.79Å; I158-L253 HydrophobicContact CD1-CD1 4.09Å; I158-L253 HydrophobicContact CG1-CD1 3.78Å
159R60.2Low61Low168 Ų16873.7 Ų73.763%0.63443%0.429SS*.THydrogen-bonded Turntrans-69.4105.5-178.9-175.4175-169.3-140.4-4.4111.3M155 R395M155-R159 WeakPolarHBondContact O-CB 3.4Å; M155-R159 PolarHBondContact O-N 2.92Å; R159-R395 VanDerWaalsContact NH2-CZ 3.3Å
160G54.3Low60Low65 Ų6573.2 Ų73.267%0.6742%0.423SS*.THydrogen-bonded Turntrans117.8-11.7173.500000114.7I158I158-G160 PolarHBondContact O-N 3.22Å
161K59.7Low58.8Low88 Ų8873 Ų7338%0.38342%0.419SS..PPolyproline II helixtrans-77.5125.4170.6-70-173.3175.6-176.50109.8I158 Y179 E252I158-K161 PolarHBondContact O-N 2.81Å; K161-Y179 HydrophobicContact CB-CD2 4.36Å; K161-Y179 WeakPolarHBondContact O-CD2 3.48Å; K161-E252 IonicContact NZ-OE2 2.77Å; K161-E252 PolarHBondContact NZ-OE2 3.15Å
162P56.1Low57.9Low107 Ų10773.7 Ų73.770%0.69543%0.429SS*.BIsolated β-bridgetrans-68145.3173.127.9-32.3000110.3E164P162-E164 PolarHBondContact O-N 3.38Å
163I57.7Low56.9Low19 Ų1975.6 Ų75.610%0.09744%0.441CS..PPolyproline II helixtrans-66.6119.8171.6-65.3172.5000107.7S165 K177 Y179I163-S165 VanDerWaalsContact C-N 3.28Å; I163-S165 PolarHBondContact O-N 3.38Å; I163-K177 HydrophobicContact CD1-CB 4.29Å; I163-K177 WeakPolarHBondContact CD1-O 3.48Å; I163-K177 WeakPolarHBondContact CG1-O 3.35Å; I163-Y179 HydrophobicContact CG1-CD1 4.13Å; I163-Y179 HydrophobicContact CG1-CD2 4.29Å; I163-Y179 HydrophobicContact CG1-CE1 3.93Å; I163-Y179 HydrophobicContact CG1-CE2 4.16Å; I163-Y179 HydrophobicContact CG1-CG 4.27Å
164E51.3Low55.9Low129 Ų12975.6 Ų75.660%0.60344%0.435SS*.  trans-67.393.2164.4-74.7-161.4151.700108.5P162 R251P162-E164 PolarHBondContact O-N 3.38Å; E164-R251 IonicContact OE2-NH2 3.65Å
165S45.4Very low54.3Low28 Ų2884.4 Ų84.420%0.19647%0.468CS..  trans-73.8128.4176.947.40000109.8I163 W175I163-S165 VanDerWaalsContact C-N 3.28Å; I163-S165 PolarHBondContact O-N 3.38Å; S165-W175 VanDerWaalsContact CB-CE3 3.41Å; S165-W175 WeakPolarHBondContact OG-CZ3 2.81Å
166S52.4Low53.3Low49 Ų4984.4 Ų84.434%0.34349%0.486SS..  trans-134.6117.9175.9-840000109.1M168 Y169 T171S166-M168 PolarHBondContact O-N 3.44Å; S166-M168 VanDerWaalsContact O-N 3.12Å; S166-Y169 VanDerWaalsContact CB-CD2 3.48Å; S166-Y169 PolarHBondContact O-N 2.81Å; S166-T171 PolarHBondContact N-OG1 2.82Å; S166-T171 VanDerWaalsContact N-OG1 3.16Å; S166-T171 PolarHBondContact O-OG1 3Å; S166-T171 VanDerWaalsContact O-OG1 3.05Å
167C44Very low52.7Low103 Ų10387.7 Ų87.770%0.69649%0.486SS*.G310 helixtrans-56.2-29.8-176.4-175.80000112.8Y169 G170C167-Y169 PolarHBondContact O-N 3.33Å; C167-G170 PolarHBondContact O-N 3.42Å
168M43.1Very low52Low169 Ų16985.2 Ų85.283%0.83349%0.485SS*.G310 helixtrans-64.2-21.1176.3-119-171.676.900114.7S166S166-M168 PolarHBondContact O-N 3.44Å; S166-M168 VanDerWaalsContact O-N 3.12Å
169Y50.9Low51.7Low106 Ų10686.3 Ų86.342%0.41649%0.489SS..G310 helixtrans-107.612.7-174.5-60-77.6000113.4S166 C167 T171 F244S166-Y169 VanDerWaalsContact CB-CD2 3.48Å; S166-Y169 PolarHBondContact O-N 2.81Å; C167-Y169 PolarHBondContact O-N 3.33Å; Y169-T171 PolarHBondContact O-N 3.12Å; Y169-F244 HydrophobicContact CD1-CE1 4.14Å; Y169-F244 AromaticContact CD1-CZ 3.89Å; Y169-F244 HydrophobicContact CD1-CZ 3.89Å; Y169-F244 HydrophobicContact CE1-CZ 4.36Å
170G50.9Low51.9Low41 Ų4181.5 Ų81.542%0.42348%0.481SS..THydrogen-bonded Turntrans71.87.917900000114.6C167 C172 Y241C167-G170 PolarHBondContact O-N 3.42Å; G170-C172 PolarHBondContact O-N 3.44Å; G170-Y241 PolarHBondContact O-OH 3.27Å
171T53.9Low52.6Low11 Ų1180.4 Ų80.47%0.06746%0.459CS..G310 helixtrans-82.213.2177.551.90000113.4S166 Y169 C173 L174 L245S166-T171 PolarHBondContact N-OG1 2.82Å; S166-T171 VanDerWaalsContact N-OG1 3.16Å; S166-T171 PolarHBondContact O-OG1 3Å; S166-T171 VanDerWaalsContact O-OG1 3.05Å; Y169-T171 PolarHBondContact O-N 3.12Å; T171-C173 PolarHBondContact O-N 3.44Å; T171-C173 VanDerWaalsContact O-N 3.17Å; T171-L174 HydrophobicContact CG2-CD1 4.15Å; T171-L174 WeakPolarHBondContact O-CA 3.44Å; T171-L174 WeakPolarHBondContact O-CB 3.43Å; T171-L174 PolarHBondContact O-N 2.92Å; T171-L245 HydrophobicContact CG2-CD2 3.55Å
172C53Low53.1Low65 Ų6578.2 Ų78.244%0.43946%0.461SS..G310 helixtrans-53.9-36.5178.5-320000112G170 L174G170-C172 PolarHBondContact O-N 3.44Å; C172-L174 VanDerWaalsContact C-N 3.31Å; C172-L174 PolarHBondContact O-N 2.93Å
173C48.2Very low54.1Low127 Ų12774.3 Ų74.386%0.85843%0.433SS*.G310 helixtrans-81-6.6178.8-58.70000114.1T171T171-C173 PolarHBondContact O-N 3.44Å; T171-C173 VanDerWaalsContact O-N 3.17Å
174L50.6Low55Low41 Ų4173.9 Ų73.922%0.21543%0.431CS..G310 helixtrans-104.98.6179.1-72.8157.7000112.2T171 C172 G176 K177 L245T171-L174 HydrophobicContact CG2-CD1 4.15Å; T171-L174 WeakPolarHBondContact O-CA 3.44Å; T171-L174 WeakPolarHBondContact O-CB 3.43Å; T171-L174 PolarHBondContact O-N 2.92Å; C172-L174 VanDerWaalsContact C-N 3.31Å; C172-L174 PolarHBondContact O-N 2.93Å; L174-G176 PolarHBondContact O-N 3.26Å; L174-K177 PolarHBondContact O-N 2.92Å; L174-L245 HydrophobicContact CD1-CD1 4.29Å; L174-L245 HydrophobicContact CD1-CD2 4.35Å
175W38.5Very low56.3Low185 Ų18569.8 Ų69.870%0.70141%0.41SS*.THydrogen-bonded Turntrans-56.1121.7178.4-165.1-79.2000111.4S165 K177S165-W175 VanDerWaalsContact CB-CE3 3.41Å; S165-W175 WeakPolarHBondContact OG-CZ3 2.81Å; W175-K177 PolarHBondContact O-N 3.33Å
176G47Very low58.1Low70 Ų7072.8 Ų72.872%0.72242%0.42SS*.THydrogen-bonded Turntrans78.26.4173.200000116.5L174L174-G176 PolarHBondContact O-N 3.26Å
177K53.5Low59.5Low146 Ų14670.4 Ų70.464%0.63540%0.404SS*.  trans-84.2133.1168.8-68.6-152.6176.91710110.2I163 L174 W175I163-K177 HydrophobicContact CD1-CB 4.29Å; I163-K177 WeakPolarHBondContact CD1-O 3.48Å; I163-K177 WeakPolarHBondContact CG1-O 3.35Å; L174-K177 PolarHBondContact O-N 2.92Å; W175-K177 PolarHBondContact O-N 3.33Å
178A54.5Low61.5Low61 Ų6166.2 Ų66.250%0.50437%0.374SS..BIsolated β-bridgetrans-67.8148.7165.700000108.9S180A178-S180 PolarHBondContact O-N 3.43Å
179Y60.8Low63.5Low35 Ų3561.5 Ų61.514%0.13735%0.349CS..  trans-56.5114.5167.5-71.2-71.7000109.4I158 K161 I163 F183 A249I158-Y179 HydrophobicContact CG2-CD1 4.02Å; I158-Y179 HydrophobicContact CG2-CD2 3.55Å; I158-Y179 HydrophobicContact CG2-CG 3.25Å; K161-Y179 HydrophobicContact CB-CD2 4.36Å; K161-Y179 WeakPolarHBondContact O-CD2 3.48Å; I163-Y179 HydrophobicContact CG1-CD1 4.13Å; I163-Y179 HydrophobicContact CG1-CD2 4.29Å; I163-Y179 HydrophobicContact CG1-CE1 3.93Å; I163-Y179 HydrophobicContact CG1-CE2 4.16Å; I163-Y179 HydrophobicContact CG1-CG 4.27Å; Y179-F183 HydrophobicContact CD1-CD1 4.06Å; Y179-F183 HydrophobicContact CD1-CE1 4.11Å; Y179-F183 HydrophobicContact CE1-CE1 4.16Å; Y179-A249 HydrophobicContact CD1-CB 3.94Å; Y179-A249 HydrophobicContact CE1-CB 3.16Å; Y179-A249 WeakPolarHBondContact OH-CA 3.05Å
180S64.4Low65.2Low66 Ų6656.8 Ų56.846%0.46233%0.332SS..  trans-119.6156.8-175.2176.70000109.4A178 G182 F183A178-S180 PolarHBondContact O-N 3.43Å; S180-G182 PolarHBondContact O-N 2.94Å; S180-F183 WeakPolarHBondContact O-CB 3.37Å; S180-F183 PolarHBondContact O-N 3.1Å
181I68.5Low66.9Low43 Ų4354.8 Ų54.822%0.22131%0.312CS..Hα-helixtrans-48.6-33.6171.8-178.862000111.9M155 F183 L184 R185M155-I181 HydrophobicContact CE-CD1 3.88Å; M155-I181 HydrophobicContact CG-CD1 4.34Å; M155-I181 HydrophobicContact SD-CB 3.76Å; M155-I181 HydrophobicContact SD-CD1 3.42Å; M155-I181 WeakPolarHBondContact SD-CD1 3.44Å; M155-I181 HydrophobicContact SD-CG1 3.92Å; I181-F183 VanDerWaalsContact C-N 3.33Å; I181-F183 PolarHBondContact O-N 3.24Å; I181-L184 PolarHBondContact O-N 3.34Å; I181-R185 HydrophobicContact CD1-CG 4.27Å; I181-R185 HydrophobicContact CG1-CG 4.32Å; I181-R185 WeakPolarHBondContact O-CB 3.08Å; I181-R185 VanDerWaalsContact O-CG 3.28Å; I181-R185 WeakPolarHBondContact O-CG 3.3Å; I181-R185 PolarHBondContact O-N 3.3Å
182G70.1Confident68.4Low41 Ų4154.3 Ų54.342%0.42331%0.309SS..Hα-helixtrans-63.5-32.4176.800000114.2S180 F186S180-G182 PolarHBondContact O-N 2.94Å; G182-F186 VanDerWaalsContact O-CB 3.32Å; G182-F186 WeakPolarHBondContact O-CB 3.06Å; G182-F186 PolarHBondContact O-N 3.16Å
183F76.8Confident70.2Confident25 Ų2554 Ų5411%0.1130%0.301CS..Hα-helixtrans-72.4-45.6178.2170.8-97.3000111.6Y179 S180 I181 R185 F186 C187 L245 A249Y179-F183 HydrophobicContact CD1-CD1 4.06Å; Y179-F183 HydrophobicContact CD1-CE1 4.11Å; Y179-F183 HydrophobicContact CE1-CE1 4.16Å; S180-F183 WeakPolarHBondContact O-CB 3.37Å; S180-F183 PolarHBondContact O-N 3.1Å; I181-F183 VanDerWaalsContact C-N 3.33Å; I181-F183 PolarHBondContact O-N 3.24Å; F183-R185 VanDerWaalsContact C-N 3.31Å; F183-R185 PolarHBondContact O-N 3.21Å; F183-F186 WeakPolarHBondContact O-CB 3.12Å; F183-F186 PolarHBondContact O-N 3.39Å; F183-C187 PolarHBondContact O-N 3.28Å; F183-C187 PolarHBondContact O-SG 2.93Å; F183-L245 HydrophobicContact CE2-CB 4.04Å; F183-L245 HydrophobicContact CE2-CD1 4.29Å; F183-L245 HydrophobicContact CZ-CB 3.81Å; F183-A249 HydrophobicContact CE1-CB 3.75Å; F183-A249 HydrophobicContact CZ-CB 4.23Å
184L77.6Confident72.1Confident11 Ų1148 Ų486%0.05826%0.26CS..Hα-helixtrans-60.4-44.5174.4-70.5163.7000110.4Y145 I154 M155 I181 F186 C187 K188 F246Y145-L184 HydrophobicContact CE1-CD2 4.16Å; Y145-L184 PolarHBondContact OH-O 3.37Å; I154-L184 HydrophobicContact CB-CD1 4.46Å; I154-L184 HydrophobicContact CG2-CD1 3.55Å; I154-L184 HydrophobicContact CG2-CD2 3.81Å; I154-L184 HydrophobicContact CG2-CG 4.34Å; M155-L184 HydrophobicContact CG-CD1 4.18Å; I181-L184 PolarHBondContact O-N 3.34Å; L184-F186 PolarHBondContact O-N 3.2Å; L184-C187 PolarHBondContact O-N 3.33Å; L184-K188 PolarHBondContact O-N 2.75Å; L184-F246 HydrophobicContact CD2-CD2 3.74Å; L184-F246 HydrophobicContact CD2-CE2 3.47Å; L184-F246 VanDerWaalsContact CD2-CE2 3.47Å
185R77.9Confident73.8Confident42 Ų4246.4 Ų46.416%0.15825%0.253CS..Hα-helixtrans-61.8-43.3175-74.6-179-174.2-178.46.3112.6I181 F183 C187 K188 Q189 Y384 T388I181-R185 HydrophobicContact CD1-CG 4.27Å; I181-R185 HydrophobicContact CG1-CG 4.32Å; I181-R185 WeakPolarHBondContact O-CB 3.08Å; I181-R185 VanDerWaalsContact O-CG 3.28Å; I181-R185 WeakPolarHBondContact O-CG 3.3Å; I181-R185 PolarHBondContact O-N 3.3Å; F183-R185 VanDerWaalsContact C-N 3.31Å; F183-R185 PolarHBondContact O-N 3.21Å; R185-C187 VanDerWaalsContact C-N 3.28Å; R185-C187 PolarHBondContact O-N 3.44Å; R185-K188 PolarHBondContact O-N 2.86Å; R185-Q189 VanDerWaalsContact O-CB 3.28Å; R185-Q189 WeakPolarHBondContact O-CB 3.49Å; R185-Q189 VanDerWaalsContact O-CG 3.26Å; R185-Q189 WeakPolarHBondContact O-CG 3.41Å; R185-Q189 PolarHBondContact O-N 2.93Å; R185-Y384 VanDerWaalsContact NH2-CZ 3.28Å; R185-Y384 PolarHBondContact NH2-OH 3.02Å; R185-T388 PolarHBondContact NH1-OG1 3.36Å
186F83.5Confident76.1Confident91 Ų9141.6 Ų41.640%0.39924%0.243SC..Hα-helixtrans-57.5-43.3175.2172.7-98.6000111.2G182 F183 L184 K188 Q189 A190 L238G182-F186 VanDerWaalsContact O-CB 3.32Å; G182-F186 WeakPolarHBondContact O-CB 3.06Å; G182-F186 PolarHBondContact O-N 3.16Å; F183-F186 WeakPolarHBondContact O-CB 3.12Å; F183-F186 PolarHBondContact O-N 3.39Å; L184-F186 PolarHBondContact O-N 3.2Å; F186-K188 PolarHBondContact O-N 3.01Å; F186-Q189 PolarHBondContact O-N 3.49Å; F186-A190 VanDerWaalsContact O-CB 3.27Å; F186-A190 WeakPolarHBondContact O-CB 3.22Å; F186-A190 PolarHBondContact O-N 3.38Å; F186-L238 HydrophobicContact CZ-CD1 4.35Å
187C82.6Confident78Confident0 Ų039.6 Ų39.60%022%0.217CC..Hα-helixtrans-63.6-43.2178.4-62.60000112.3F183 L184 R185 T191 A242 F246F183-C187 PolarHBondContact O-N 3.28Å; F183-C187 PolarHBondContact O-SG 2.93Å; L184-C187 PolarHBondContact O-N 3.33Å; R185-C187 VanDerWaalsContact C-N 3.28Å; R185-C187 PolarHBondContact O-N 3.44Å; C187-T191 PolarHBondContact O-N 3.21Å; C187-T191 VanDerWaalsContact O-N 3.15Å; C187-T191 PolarHBondContact O-OG1 2.9Å; C187-A242 HydrophobicContact CB-CB 4.4Å; C187-F246 HydrophobicContact CB-CB 4.17Å; C187-F246 HydrophobicContact CB-CD2 4.48Å
188K84.9Confident79.6Confident15 Ų1533.1 Ų33.17%0.06519%0.189CC..Hα-helixtrans-65.9-45.2176.2-167168.4178175.40111.8L141 E151 L184 R185 F186 T191 L192 D375 N379L141-K188 HydrophobicContact CD2-CB 4.44Å; E151-K188 IonicContact OE1-NZ 3.49Å; E151-K188 PolarHBondContact OE1-NZ 3.45Å; L184-K188 PolarHBondContact O-N 2.75Å; R185-K188 PolarHBondContact O-N 2.86Å; F186-K188 PolarHBondContact O-N 3.01Å; K188-T191 PolarHBondContact O-N 3.01Å; K188-L192 HydrophobicContact CG-CD1 3.94Å; K188-L192 WeakPolarHBondContact O-CB 3.12Å; K188-L192 VanDerWaalsContact O-CG 3.31Å; K188-L192 WeakPolarHBondContact O-CG 3.47Å; K188-L192 PolarHBondContact O-N 3.27Å; K188-D375 VanDerWaalsContact CE-CG 3.41Å; K188-D375 WeakPolarHBondContact CE-OD2 3.45Å; K188-D375 IonicContact NZ-OD1 3.21Å; K188-D375 PolarHBondContact NZ-OD1 3.3Å; K188-D375 IonicContact NZ-OD2 2.91Å; K188-D375 PolarHBondContact NZ-OD2 2.9Å; K188-N379 VanDerWaalsContact CE-ND2 3.29Å; K188-N379 WeakPolarHBondContact CE-ND2 3.3Å
189Q85.3Confident81.1Confident70 Ų7032.4 Ų32.433%0.32718%0.179SC..Hα-helixtrans-63.1-44.1177.2-75.8175.5-21.500112.6R185 F186 T191 L192 Q193 N379 F380R185-Q189 VanDerWaalsContact O-CB 3.28Å; R185-Q189 WeakPolarHBondContact O-CB 3.49Å; R185-Q189 VanDerWaalsContact O-CG 3.26Å; R185-Q189 WeakPolarHBondContact O-CG 3.41Å; R185-Q189 PolarHBondContact O-N 2.93Å; F186-Q189 PolarHBondContact O-N 3.49Å; Q189-T191 VanDerWaalsContact C-N 3.31Å; Q189-T191 PolarHBondContact O-N 3.19Å; Q189-L192 PolarHBondContact O-N 3.33Å; Q189-Q193 VanDerWaalsContact O-CB 3.27Å; Q189-Q193 WeakPolarHBondContact O-CB 3.43Å; Q189-Q193 PolarHBondContact O-N 3.47Å; Q189-N379 HydrophobicContact CG-CB 4.18Å; Q189-N379 PolarHBondContact NE2-O 3.33Å; Q189-F380 HydrophobicContact CB-CZ 4.47Å
190A86.9Confident82.3Confident6 Ų634.8 Ų34.85%0.0519%0.194CC..Hα-helixtrans-62.8-38.917700000112F186 Q193 F194 L238 A242F186-A190 VanDerWaalsContact O-CB 3.27Å; F186-A190 WeakPolarHBondContact O-CB 3.22Å; F186-A190 PolarHBondContact O-N 3.38Å; A190-Q193 PolarHBondContact O-OE1 2.82Å; A190-F194 PolarHBondContact O-N 3.4Å; A190-L238 HydrophobicContact CB-CG 4.28Å; A190-A242 HydrophobicContact CB-CB 3.55Å
191T86.1Confident83.3Confident0 Ų032.8 Ų32.80%018%0.178CC..Hα-helixtrans-71.6-42.7177-57.10000112I137 L141 C187 K188 Q189 Q193 F194 C195I137-T191 HydrophobicContact CG2-CG2 3.77Å; L141-T191 HydrophobicContact CB-CG2 4.29Å; L141-T191 HydrophobicContact CD2-CG2 3.91Å; L141-T191 WeakPolarHBondContact CD2-OG1 3.26Å; C187-T191 PolarHBondContact O-N 3.21Å; C187-T191 VanDerWaalsContact O-N 3.15Å; C187-T191 PolarHBondContact O-OG1 2.9Å; K188-T191 PolarHBondContact O-N 3.01Å; Q189-T191 VanDerWaalsContact C-N 3.31Å; Q189-T191 PolarHBondContact O-N 3.19Å; T191-Q193 VanDerWaalsContact C-N 3.31Å; T191-Q193 PolarHBondContact O-N 3.41Å; T191-F194 PolarHBondContact O-N 3Å; T191-C195 PolarHBondContact O-N 3.02Å; T191-C195 PolarHBondContact O-SG 2.86Å
192L85.8Confident84Confident1 Ų131.1 Ų31.11%0.00517%0.17CC..Hα-helixtrans-64.6-35.3175.2-75.2167.1000112.1Y138 K188 Q189 F194 C195 V196 M372 D375 A376 N379 F380Y138-L192 HydrophobicContact CD2-CD2 3.71Å; Y138-L192 HydrophobicContact CD2-CG 4.49Å; Y138-L192 HydrophobicContact CE2-CD2 3.76Å; K188-L192 HydrophobicContact CG-CD1 3.94Å; K188-L192 WeakPolarHBondContact O-CB 3.12Å; K188-L192 VanDerWaalsContact O-CG 3.31Å; K188-L192 WeakPolarHBondContact O-CG 3.47Å; K188-L192 PolarHBondContact O-N 3.27Å; Q189-L192 PolarHBondContact O-N 3.33Å; L192-F194 VanDerWaalsContact C-N 3.32Å; L192-F194 PolarHBondContact O-N 3.43Å; L192-C195 WeakPolarHBondContact O-CB 3.38Å; L192-C195 PolarHBondContact O-N 3.01Å; L192-C195 VanDerWaalsContact O-N 3.14Å; L192-V196 PolarHBondContact O-N 2.87Å; L192-V196 VanDerWaalsContact O-N 3.1Å; L192-M372 HydrophobicContact CD2-CG 4.29Å; L192-D375 HydrophobicContact CD1-CB 4.48Å; L192-A376 HydrophobicContact CD2-CB 4.28Å; L192-N379 HydrophobicContact CD1-CB 3.97Å; L192-F380 HydrophobicContact CB-CE2 3.87Å; L192-F380 HydrophobicContact CB-CZ 4.46Å
193Q90.5Very high84.8Confident57 Ų5733.3 Ų33.327%0.26618%0.175SC..Hα-helixtrans-58.1-45174.1174.1-84.5-18.900110.8Q189 A190 T191 C195 V196 V197 S235 F380Q189-Q193 VanDerWaalsContact O-CB 3.27Å; Q189-Q193 WeakPolarHBondContact O-CB 3.43Å; Q189-Q193 PolarHBondContact O-N 3.47Å; A190-Q193 PolarHBondContact O-OE1 2.82Å; T191-Q193 VanDerWaalsContact C-N 3.31Å; T191-Q193 PolarHBondContact O-N 3.41Å; Q193-C195 VanDerWaalsContact C-N 3.31Å; Q193-C195 PolarHBondContact O-N 3.47Å; Q193-V196 PolarHBondContact O-N 3.26Å; Q193-V197 HydrophobicContact CG-CG2 4.26Å; Q193-V197 VanDerWaalsContact NE2-CG2 3.32Å; Q193-V197 WeakPolarHBondContact O-CB 3.2Å; Q193-V197 VanDerWaalsContact O-CG2 3.32Å; Q193-V197 WeakPolarHBondContact O-CG2 3.5Å; Q193-V197 PolarHBondContact O-N 2.92Å; Q193-S235 PolarHBondContact NE2-OG 3.42Å; Q193-S235 PolarHBondContact OE1-OG 3.09Å; Q193-F380 HydrophobicContact CB-CZ 4.47Å
194F87.6Confident85.2Confident1 Ų135 Ų350%0.00419%0.185CC..Hα-helixtrans-62.4-38.7175.8179.1-110.6000112.5A134 I137 A190 T191 L192 V196 V197 K198 Y232 V236A134-F194 HydrophobicContact CB-CD1 3.84Å; A134-F194 HydrophobicContact CB-CE1 3.71Å; I137-F194 HydrophobicContact CD1-CD1 3.91Å; I137-F194 HydrophobicContact CD1-CE1 3.52Å; I137-F194 HydrophobicContact CD1-CZ 4.39Å; I137-F194 HydrophobicContact CG1-CE1 4.49Å; A190-F194 PolarHBondContact O-N 3.4Å; T191-F194 PolarHBondContact O-N 3Å; L192-F194 VanDerWaalsContact C-N 3.32Å; L192-F194 PolarHBondContact O-N 3.43Å; F194-V196 VanDerWaalsContact C-N 3.27Å; F194-V196 PolarHBondContact O-N 3.09Å; F194-V197 PolarHBondContact O-N 3.41Å; F194-K198 HydrophobicContact CE1-CD 4.06Å; F194-K198 HydrophobicContact CE2-CB 4.42Å; F194-K198 HydrophobicContact CE2-CD 3.81Å; F194-K198 HydrophobicContact CZ-CD 3.38Å; F194-K198 WeakPolarHBondContact O-CB 3.17Å; F194-K198 PolarHBondContact O-N 3.22Å; F194-Y232 HydrophobicContact CE2-CD2 4.17Å; F194-Y232 AromaticContact CE2-CE2 3.86Å; F194-Y232 HydrophobicContact CE2-CE2 3.86Å; F194-Y232 HydrophobicContact CZ-CE2 4.05Å; F194-V236 HydrophobicContact CD2-CB 4.17Å; F194-V236 HydrophobicContact CE1-CG2 4.4Å; F194-V236 HydrophobicContact CE2-CB 3.54Å; F194-V236 HydrophobicContact CE2-CG2 3.76Å; F194-V236 HydrophobicContact CZ-CB 3.99Å; F194-V236 HydrophobicContact CZ-CG2 3.65Å
195C86.2Confident85.5Confident9 Ų935.2 Ų35.26%0.06119%0.186CC..Hα-helixtrans-64.4-28.1177.8-60.60000114.1A134 Y138 T191 L192 Q193 P199 M372A134-C195 PolarHBondContact O-SG 3.33Å; Y138-C195 VanDerWaalsContact CB-SG 3.56Å; T191-C195 PolarHBondContact O-N 3.02Å; T191-C195 PolarHBondContact O-SG 2.86Å; L192-C195 WeakPolarHBondContact O-CB 3.38Å; L192-C195 PolarHBondContact O-N 3.01Å; L192-C195 VanDerWaalsContact O-N 3.14Å; Q193-C195 VanDerWaalsContact C-N 3.31Å; Q193-C195 PolarHBondContact O-N 3.47Å; C195-P199 WeakPolarHBondContact O-CD 3.5Å; C195-P199 WeakPolarHBondContact O-CG 3.43Å; C195-M372 HydrophobicContact CB-SD 4.08Å
196V87.6Confident85.7Confident83 Ų8335.8 Ų35.850%0.50320%0.195SC..Hα-helixtrans-88.1-42.2175.3176.50000111L192 Q193 F194 K198 L200L192-V196 PolarHBondContact O-N 2.87Å; L192-V196 VanDerWaalsContact O-N 3.1Å; Q193-V196 PolarHBondContact O-N 3.26Å; F194-V196 VanDerWaalsContact C-N 3.27Å; F194-V196 PolarHBondContact O-N 3.09Å; V196-K198 PolarHBondContact O-N 3.41Å; V196-L200 WeakPolarHBondContact O-CB 3.41Å; V196-L200 PolarHBondContact O-N 2.89Å
197V87.7Confident85.8Confident29 Ų2935.3 Ų35.318%0.17620%0.195CC..Hα-helixtrans-66.1-38.2-177.1168.10000111.6Q193 F194 L200 M201 I231Q193-V197 HydrophobicContact CG-CG2 4.26Å; Q193-V197 VanDerWaalsContact NE2-CG2 3.32Å; Q193-V197 WeakPolarHBondContact O-CB 3.2Å; Q193-V197 VanDerWaalsContact O-CG2 3.32Å; Q193-V197 WeakPolarHBondContact O-CG2 3.5Å; Q193-V197 PolarHBondContact O-N 2.92Å; F194-V197 PolarHBondContact O-N 3.41Å; V197-L200 PolarHBondContact O-N 3.37Å; V197-M201 HydrophobicContact CG1-CE 4.12Å; V197-M201 HydrophobicContact CG1-CG 3.85Å; V197-M201 WeakPolarHBondContact O-CB 3.45Å; V197-M201 VanDerWaalsContact O-CG 3.23Å; V197-M201 WeakPolarHBondContact O-CG 3.36Å; V197-M201 PolarHBondContact O-N 3.17Å; V197-I231 HydrophobicContact CG1-CG2 4.32Å
198K85.3Confident85.8Confident9 Ų937.4 Ų37.44%0.03921%0.206CC..Hα-helixtrans-65.7-50.6-174.8-168.5149-177.9174.80113.5D130 E133 A134 F194 V196 L200 M201 A202 Y232D130-K198 HydrophobicContact CB-CG 4.38Å; D130-K198 VanDerWaalsContact O-CD 3.31Å; D130-K198 WeakPolarHBondContact O-CD 3.46Å; D130-K198 WeakPolarHBondContact O-CE 3.34Å; D130-K198 WeakPolarHBondContact O-CG 3.27Å; D130-K198 WeakPolarHBondContact OD1-CE 3.43Å; D130-K198 IonicContact OD1-NZ 3.45Å; D130-K198 PolarHBondContact OD1-NZ 2.97Å; E133-K198 IonicContact OE1-NZ 2.86Å; E133-K198 PolarHBondContact OE1-NZ 3.4Å; E133-K198 IonicContact OE2-NZ 2.75Å; E133-K198 PolarHBondContact OE2-NZ 3.44Å; A134-K198 HydrophobicContact CB-CB 4.02Å; A134-K198 HydrophobicContact CB-CD 4.28Å; A134-K198 HydrophobicContact CB-CG 4.47Å; F194-K198 HydrophobicContact CE1-CD 4.06Å; F194-K198 HydrophobicContact CE2-CB 4.42Å; F194-K198 HydrophobicContact CE2-CD 3.81Å; F194-K198 HydrophobicContact CZ-CD 3.38Å; F194-K198 WeakPolarHBondContact O-CB 3.17Å; F194-K198 PolarHBondContact O-N 3.22Å; V196-K198 PolarHBondContact O-N 3.41Å; K198-L200 VanDerWaalsContact C-N 3.28Å; K198-L200 PolarHBondContact O-N 2.97Å; K198-M201 PolarHBondContact O-N 3.2Å; K198-A202 PolarHBondContact O-N 2.86Å; K198-Y232 HydrophobicContact CD-CD2 4.32Å; K198-Y232 HydrophobicContact CD-CE2 3.82Å; K198-Y232 PolarHBondContact NZ-OH 2.89Å
199P86Confident85.5Confident46 Ų4639.8 Ų39.830%0.29922%0.218SC..Hα-helixtrans-59.7-37.3172.3-24.234.4000113.2C195 A202 V203C195-P199 WeakPolarHBondContact O-CD 3.5Å; C195-P199 WeakPolarHBondContact O-CG 3.43Å; P199-A202 PolarHBondContact O-N 3.2Å; P199-V203 WeakPolarHBondContact O-CG2 3.41Å; P199-V203 PolarHBondContact O-N 3.45Å
200L87.9Confident85.4Confident85 Ų8540.7 Ų40.745%0.44524%0.237SC..Hα-helixtrans-64.5-42.1177-176.3148.4000111.4V196 V197 K198 A202 V203 I204V196-L200 WeakPolarHBondContact O-CB 3.41Å; V196-L200 PolarHBondContact O-N 2.89Å; V197-L200 PolarHBondContact O-N 3.37Å; K198-L200 VanDerWaalsContact C-N 3.28Å; K198-L200 PolarHBondContact O-N 2.97Å; L200-A202 VanDerWaalsContact C-N 3.33Å; L200-V203 PolarHBondContact O-N 3.42Å; L200-I204 HydrophobicContact CD2-CD1 3.47Å; L200-I204 VanDerWaalsContact CD2-CD1 3.47Å; L200-I204 HydrophobicContact CD2-CG1 4.33Å; L200-I204 HydrophobicContact CG-CD1 4.45Å; L200-I204 VanDerWaalsContact O-CG1 3.3Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 2.78Å
201M85.1Confident85.2Confident25 Ų2547.9 Ų47.912%0.12327%0.267CS..Hα-helixtrans-65-36.2174.2-70.1-62.9138.800112V197 K198 I204 T205 V228 I231V197-M201 HydrophobicContact CG1-CE 4.12Å; V197-M201 HydrophobicContact CG1-CG 3.85Å; V197-M201 WeakPolarHBondContact O-CB 3.45Å; V197-M201 VanDerWaalsContact O-CG 3.23Å; V197-M201 WeakPolarHBondContact O-CG 3.36Å; V197-M201 PolarHBondContact O-N 3.17Å; K198-M201 PolarHBondContact O-N 3.2Å; M201-I204 HydrophobicContact CE-CD1 4.24Å; M201-I204 PolarHBondContact O-N 3.41Å; M201-I204 HydrophobicContact SD-CD1 4.41Å; M201-T205 WeakPolarHBondContact O-CB 3.37Å; M201-T205 PolarHBondContact O-N 3.35Å; M201-T205 PolarHBondContact O-OG1 3.5Å; M201-V228 HydrophobicContact CB-CG1 4.5Å; M201-I231 HydrophobicContact CE-CB 4.4Å; M201-I231 HydrophobicContact CE-CD1 4.21Å; M201-I231 HydrophobicContact CE-CG2 3.57Å; M201-I231 HydrophobicContact SD-CB 4.27Å; M201-I231 HydrophobicContact SD-CD1 4.37Å; M201-I231 HydrophobicContact SD-CG2 3.94Å
202A83.4Confident84.8Confident8 Ų850.5 Ų50.57%0.06629%0.294CS..Hα-helixtrans-64.5-44.3174.600000111.9T127 K198 P199 L200 I204 T205 V206T127-A202 HydrophobicContact CG2-CB 3.83Å; K198-A202 PolarHBondContact O-N 2.86Å; P199-A202 PolarHBondContact O-N 3.2Å; L200-A202 VanDerWaalsContact C-N 3.33Å; A202-I204 PolarHBondContact O-N 2.97Å; A202-T205 WeakPolarHBondContact O-CB 3.39Å; A202-T205 PolarHBondContact O-N 2.87Å; A202-T205 VanDerWaalsContact O-N 3.15Å; A202-V206 WeakPolarHBondContact O-CG2 3.24Å; A202-V206 PolarHBondContact O-N 3.35Å
203V85.8Confident84.5Confident87 Ų8757.2 Ų57.253%0.52732%0.324SS..Hα-helixtrans-61.9-44.1174.7172.80000111.4P199 L200 T205 V206 I207P199-V203 WeakPolarHBondContact O-CG2 3.41Å; P199-V203 PolarHBondContact O-N 3.45Å; L200-V203 PolarHBondContact O-N 3.42Å; V203-T205 VanDerWaalsContact C-N 3.28Å; V203-T205 PolarHBondContact O-N 2.91Å; V203-V206 PolarHBondContact O-N 2.98Å; V203-I207 HydrophobicContact CG1-CD1 3.85Å; V203-I207 VanDerWaalsContact O-CG1 3.27Å; V203-I207 WeakPolarHBondContact O-CG1 3.12Å; V203-I207 PolarHBondContact O-N 3.23Å
204I86.1Confident83.5Confident60 Ų6055.9 Ų55.931%0.30832%0.316SS..Hα-helixtrans-58.2-44.1174.2-71.3174.7000110.1L200 M201 A202 I207 L208 V228L200-I204 HydrophobicContact CD2-CD1 3.47Å; L200-I204 VanDerWaalsContact CD2-CD1 3.47Å; L200-I204 HydrophobicContact CD2-CG1 4.33Å; L200-I204 HydrophobicContact CG-CD1 4.45Å; L200-I204 VanDerWaalsContact O-CG1 3.3Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 2.78Å; M201-I204 HydrophobicContact CE-CD1 4.24Å; M201-I204 PolarHBondContact O-N 3.41Å; M201-I204 HydrophobicContact SD-CD1 4.41Å; A202-I204 PolarHBondContact O-N 2.97Å; I204-I207 PolarHBondContact O-N 2.85Å; I204-L208 HydrophobicContact CG2-CD1 3.76Å; I204-L208 HydrophobicContact CG2-CD2 4.13Å; I204-L208 WeakPolarHBondContact O-CB 3.4Å; I204-L208 VanDerWaalsContact O-CD1 3.27Å; I204-L208 WeakPolarHBondContact O-CD1 3.39Å; I204-L208 PolarHBondContact O-N 3.41Å; I204-V228 HydrophobicContact CG2-CG2 4.46Å
205T82.4Confident82.5Confident15 Ų1562.6 Ų62.69%0.09235%0.345CS..Hα-helixtrans-59.7-48.9179.2-61.50000111.8M201 A202 V203 I207 L208 Q209 Y214M201-T205 WeakPolarHBondContact O-CB 3.37Å; M201-T205 PolarHBondContact O-N 3.35Å; M201-T205 PolarHBondContact O-OG1 3.5Å; A202-T205 WeakPolarHBondContact O-CB 3.39Å; A202-T205 PolarHBondContact O-N 2.87Å; A202-T205 VanDerWaalsContact O-N 3.15Å; V203-T205 VanDerWaalsContact C-N 3.28Å; V203-T205 PolarHBondContact O-N 2.91Å; T205-I207 VanDerWaalsContact C-N 3.3Å; T205-I207 PolarHBondContact O-N 3.25Å; T205-L208 PolarHBondContact O-N 3.47Å; T205-Q209 WeakPolarHBondContact O-CB 3.48Å; T205-Q209 PolarHBondContact O-N 3.4Å; T205-Y214 HydrophobicContact CG2-CD1 4.04Å; T205-Y214 HydrophobicContact CG2-CD2 4.02Å; T205-Y214 HydrophobicContact CG2-CE1 3.59Å; T205-Y214 HydrophobicContact CG2-CE2 3.56Å; T205-Y214 HydrophobicContact CG2-CG 4.23Å
206V83.3Confident81.5Confident55 Ų5565.4 Ų65.433%0.33336%0.36SS..Hα-helixtrans-58.8-41.9176.4173.50000111.5A202 V203 Q209 A210A202-V206 WeakPolarHBondContact O-CG2 3.24Å; A202-V206 PolarHBondContact O-N 3.35Å; V203-V206 PolarHBondContact O-N 2.98Å; V206-Q209 PolarHBondContact O-N 3Å; V206-A210 PolarHBondContact O-N 2.81Å
207I85.2Confident80.3Confident81 Ų8161.6 Ų61.642%0.41534%0.337SS..Hα-helixtrans-65.1-47.7177.4-68.2167.9000110.9V203 I204 T205 Q209 A210 F211V203-I207 HydrophobicContact CG1-CD1 3.85Å; V203-I207 VanDerWaalsContact O-CG1 3.27Å; V203-I207 WeakPolarHBondContact O-CG1 3.12Å; V203-I207 PolarHBondContact O-N 3.23Å; I204-I207 PolarHBondContact O-N 2.85Å; T205-I207 VanDerWaalsContact C-N 3.3Å; T205-I207 PolarHBondContact O-N 3.25Å; I207-Q209 PolarHBondContact O-N 2.97Å; I207-A210 WeakPolarHBondContact O-CB 3.3Å; I207-A210 PolarHBondContact O-N 3.02Å; I207-F211 HydrophobicContact CG2-CD2 3.79Å; I207-F211 HydrophobicContact CG2-CE2 3.56Å; I207-F211 WeakPolarHBondContact O-CD2 3.29Å; I207-F211 PolarHBondContact O-N 3.3Å; I207-F211 VanDerWaalsContact O-N 3.14Å
208L82.9Confident79.4Confident43 Ų4362.9 Ų62.923%0.22534%0.343CS..Hα-helixtrans-63.2-33.6179.2-91.254.4000111.8I204 T205 F211 G212 K213 Y214I204-L208 HydrophobicContact CG2-CD1 3.76Å; I204-L208 HydrophobicContact CG2-CD2 4.13Å; I204-L208 WeakPolarHBondContact O-CB 3.4Å; I204-L208 VanDerWaalsContact O-CD1 3.27Å; I204-L208 WeakPolarHBondContact O-CD1 3.39Å; I204-L208 PolarHBondContact O-N 3.41Å; T205-L208 PolarHBondContact O-N 3.47Å; L208-F211 PolarHBondContact O-N 3Å; L208-G212 PolarHBondContact O-N 3.44Å; L208-K213 PolarHBondContact O-N 3.32Å; L208-Y214 PolarHBondContact O-N 3.08Å
209Q79Confident78.5Confident66 Ų6666.2 Ų66.231%0.30836%0.358SS..Hα-helixtrans-69-41.9174.3-169.8158.317.400112T205 V206 I207 F211 G212 Y214T205-Q209 WeakPolarHBondContact O-CB 3.48Å; T205-Q209 PolarHBondContact O-N 3.4Å; V206-Q209 PolarHBondContact O-N 3Å; I207-Q209 PolarHBondContact O-N 2.97Å; Q209-F211 PolarHBondContact O-N 2.96Å; Q209-G212 PolarHBondContact O-N 3.45Å; Q209-Y214 HydrophobicContact CB-CD1 4.44Å
210A81.5Confident77.9Confident88 Ų8868.3 Ų68.373%0.72737%0.366SS*.Hα-helixtrans-60-31.1173.700000112.9V206 I207 G212V206-A210 PolarHBondContact O-N 2.81Å; I207-A210 WeakPolarHBondContact O-CB 3.3Å; I207-A210 PolarHBondContact O-N 3.02Å; A210-G212 VanDerWaalsContact C-N 3.33Å
211F84.3Confident77.4Confident157 Ų15768.8 Ų68.869%0.68937%0.373SS*.THydrogen-bonded Turntrans-84.60.3173.6-71.4-65.2000114.4I207 L208 Q209 K213I207-F211 HydrophobicContact CG2-CD2 3.79Å; I207-F211 HydrophobicContact CG2-CE2 3.56Å; I207-F211 WeakPolarHBondContact O-CD2 3.29Å; I207-F211 PolarHBondContact O-N 3.3Å; I207-F211 VanDerWaalsContact O-N 3.14Å; L208-F211 PolarHBondContact O-N 3Å; Q209-F211 PolarHBondContact O-N 2.96Å; F211-K213 HydrophobicContact CB-CG 4.37Å; F211-K213 PolarHBondContact O-N 3.48Å
212G76.1Confident76.9Confident55 Ų5571.5 Ų71.557%0.56740%0.399SS*.THydrogen-bonded Turntrans66.718.1-177.600000114.3L208 Q209 A210L208-G212 PolarHBondContact O-N 3.44Å; Q209-G212 PolarHBondContact O-N 3.45Å; A210-G212 VanDerWaalsContact C-N 3.33Å
213K79.8Confident76.5Confident143 Ų14371.5 Ų71.562%0.62240%0.398SS*.  trans-98.90.4179.5-67.3-67.5-172.5175.90113.1L208 F211 G224L208-K213 PolarHBondContact O-N 3.32Å; F211-K213 HydrophobicContact CB-CG 4.37Å; F211-K213 PolarHBondContact O-N 3.48Å; K213-G224 PolarHBondContact O-N 3.22Å; K213-G224 VanDerWaalsContact O-N 3.15Å
214Y70.8Confident76.2Confident28 Ų2867.8 Ų67.811%0.1138%0.378CS..  trans-115.4124.3173.9-168-94.9000109.5T205 L208 Q209 D216 Y225T205-Y214 HydrophobicContact CG2-CD1 4.04Å; T205-Y214 HydrophobicContact CG2-CD2 4.02Å; T205-Y214 HydrophobicContact CG2-CE1 3.59Å; T205-Y214 HydrophobicContact CG2-CE2 3.56Å; T205-Y214 HydrophobicContact CG2-CG 4.23Å; L208-Y214 PolarHBondContact O-N 3.08Å; Q209-Y214 HydrophobicContact CB-CD1 4.44Å; Y214-D216 WeakPolarHBondContact CE1-OD1 3.36Å; Y214-D216 PolarHBondContact OH-OD1 2.89Å; Y214-Y225 HydrophobicContact CE1-CD2 4.29Å; Y214-Y225 AromaticContact CE2-CD2 3.88Å; Y214-Y225 HydrophobicContact CE2-CD2 3.88Å; Y214-Y225 HydrophobicContact CE2-CG 4.42Å; Y214-Y225 AromaticContact CZ-CD2 3.61Å; Y214-Y225 WeakPolarHBondContact OH-CD2 3.32Å
215K66.9Low75.8Confident142 Ų14266.6 Ų66.662%0.61737%0.37SS*.  trans-133.4125.1167.7-71.2-173.8177.1-173.70107.3D218K215-D218 HydrophobicContact CB-CB 4.09Å; K215-D218 PolarHBondContact O-N 2.89Å
216D64.5Low75.7Confident69 Ų6967.4 Ų67.437%0.36937%0.374SS..THydrogen-bonded Turntrans-56.6137174.6-68.5-67000110.3Y214 D218Y214-D216 WeakPolarHBondContact CE1-OD1 3.36Å; Y214-D216 PolarHBondContact OH-OD1 2.89Å; D216-D218 VanDerWaalsContact C-N 3.25Å; D216-D218 PolarHBondContact O-N 3.2Å
217G62.8Low75.7Confident2 Ų270.8 Ų70.82%0.02138%0.381CS..THydrogen-bonded Turntrans78.3-3.2179.800000115.5F219 E284 K285G217-F219 WeakPolarHBondContact O-CD2 2.9Å; G217-F219 PolarHBondContact O-N 2.99Å; G217-E284 VanDerWaalsContact CA-OE2 3.29Å; G217-E284 WeakPolarHBondContact CA-OE2 3.26Å; G217-K285 WeakPolarHBondContact O-CE 3.28Å; G217-K285 PolarHBondContact O-NZ 3.43Å
218D68.7Low75.6Confident56 Ų5667.7 Ų67.730%0.29937%0.366SS..  trans-89.2100.7177.6-1661.4000112.5K215 D216 N220 S223K215-D218 HydrophobicContact CB-CB 4.09Å; K215-D218 PolarHBondContact O-N 2.89Å; D216-D218 VanDerWaalsContact C-N 3.25Å; D216-D218 PolarHBondContact O-N 3.2Å; D218-N220 PolarHBondContact O-N 2.91Å; D218-N220 VanDerWaalsContact OD1-CB 3.29Å; D218-N220 WeakPolarHBondContact OD1-CB 3.03Å; D218-N220 PolarHBondContact OD1-N 3.22Å; D218-N220 VanDerWaalsContact OD1-N 3.1Å; D218-S223 WeakPolarHBondContact O-CB 3.49Å; D218-S223 PolarHBondContact O-OG 2.87Å
219F66.6Low75.3Confident79 Ų7967.2 Ų67.235%0.34637%0.365SS..  trans-84.617.5177.1-70.3-97.9000113.7G217 Y225 L226 A281 K285G217-F219 WeakPolarHBondContact O-CD2 2.9Å; G217-F219 PolarHBondContact O-N 2.99Å; F219-Y225 HydrophobicContact CD2-CE1 4.34Å; F219-Y225 HydrophobicContact CE1-CE1 4.24Å; F219-Y225 HydrophobicContact CE2-CE1 4Å; F219-Y225 AromaticContact CZ-CE1 3.95Å; F219-Y225 HydrophobicContact CZ-CE1 3.95Å; F219-L226 HydrophobicContact CB-CD1 4.48Å; F219-L226 WeakPolarHBondContact O-CD1 3.29Å; F219-A281 HydrophobicContact CE2-CB 4.02Å; F219-A281 HydrophobicContact CZ-CB 3.92Å; F219-K285 HydrophobicContact CD2-CD 4.26Å; F219-K285 HydrophobicContact CD2-CG 4.04Å; F219-K285 HydrophobicContact CE2-CG 4.18Å
220N72.9Confident75.5Confident90 Ų9068.1 Ų68.148%0.48137%0.371SS..  trans-64.9141.8173.2-164.2-18.3000110.8D218 A222 S223D218-N220 PolarHBondContact O-N 2.91Å; D218-N220 VanDerWaalsContact OD1-CB 3.29Å; D218-N220 WeakPolarHBondContact OD1-CB 3.03Å; D218-N220 PolarHBondContact OD1-N 3.22Å; D218-N220 VanDerWaalsContact OD1-N 3.1Å; N220-A222 PolarHBondContact O-N 3.45Å; N220-A222 VanDerWaalsContact O-N 3.16Å; N220-A222 PolarHBondContact OD1-N 3.01Å; N220-S223 WeakPolarHBondContact O-CB 3.49Å; N220-S223 PolarHBondContact O-N 3.31Å
221V76.5Confident75.8Confident96 Ų9667.6 Ų67.658%0.58236%0.355SS*.THydrogen-bonded Turntrans-61.6-22.9176.2-172.50000111.5S223 Y227V221-S223 VanDerWaalsContact C-N 3.34Å; V221-Y227 VanDerWaalsContact O-CE2 3.27Å; V221-Y227 WeakPolarHBondContact O-CE2 3.46Å; V221-Y227 PolarHBondContact O-OH 3.15Å
222A74.4Confident75.7Confident81 Ų8162.1 Ų62.167%0.66933%0.33SS*.THydrogen-bonded Turntrans-80.3-12.217400000114.2N220N220-A222 PolarHBondContact O-N 3.45Å; N220-A222 VanDerWaalsContact O-N 3.16Å; N220-A222 PolarHBondContact OD1-N 3.01Å
223S75.8Confident76Confident8 Ų861.5 Ų61.56%0.05631%0.314CS..SBendtrans-91139.7-179.1-178.80000110.8D218 N220 V221 Y225D218-S223 WeakPolarHBondContact O-CB 3.49Å; D218-S223 PolarHBondContact O-OG 2.87Å; N220-S223 WeakPolarHBondContact O-CB 3.49Å; N220-S223 PolarHBondContact O-N 3.31Å; V221-S223 VanDerWaalsContact C-N 3.34Å; S223-Y225 PolarHBondContact O-N 3.33Å; S223-Y225 PolarHBondContact OG-N 3.28Å
224G79.7Confident76.2Confident10 Ų1060.1 Ų60.110%0.10331%0.312CS..Hα-helixtrans-67.4-22.3175.800000113.9K213 L226 Y227 V228K213-G224 PolarHBondContact O-N 3.22Å; K213-G224 VanDerWaalsContact O-N 3.15Å; G224-L226 VanDerWaalsContact C-N 3.34Å; G224-L226 PolarHBondContact O-N 3.31Å; G224-Y227 PolarHBondContact O-N 2.99Å; G224-V228 WeakPolarHBondContact O-CG2 3.26Å; G224-V228 PolarHBondContact O-N 3.24Å; G224-V228 VanDerWaalsContact O-N 3.09Å
225Y77.1Confident77Confident34 Ų3459 Ų5913%0.13331%0.308CS..Hα-helixtrans-57.6-43.3-178.6179.3-93.3000112.6Y214 F219 S223 Y227 T229Y214-Y225 HydrophobicContact CE1-CD2 4.29Å; Y214-Y225 AromaticContact CE2-CD2 3.88Å; Y214-Y225 HydrophobicContact CE2-CD2 3.88Å; Y214-Y225 HydrophobicContact CE2-CG 4.42Å; Y214-Y225 AromaticContact CZ-CD2 3.61Å; Y214-Y225 WeakPolarHBondContact OH-CD2 3.32Å; F219-Y225 HydrophobicContact CD2-CE1 4.34Å; F219-Y225 HydrophobicContact CE1-CE1 4.24Å; F219-Y225 HydrophobicContact CE2-CE1 4Å; F219-Y225 AromaticContact CZ-CE1 3.95Å; F219-Y225 HydrophobicContact CZ-CE1 3.95Å; S223-Y225 PolarHBondContact O-N 3.33Å; S223-Y225 PolarHBondContact OG-N 3.28Å; Y225-Y227 PolarHBondContact O-N 3.04Å; Y225-T229 VanDerWaalsContact O-CB 3.24Å; Y225-T229 WeakPolarHBondContact O-CB 3.3Å; Y225-T229 PolarHBondContact O-N 2.75Å; Y225-T229 PolarHBondContact O-OG1 3.12Å
226L80.1Confident77.7Confident33 Ų3352.5 Ų52.517%0.17328%0.281CS..Hα-helixtrans-62.3-45179.6-180147.5000112.1F219 G224 T229 I230F219-L226 HydrophobicContact CB-CD1 4.48Å; F219-L226 WeakPolarHBondContact O-CD1 3.29Å; G224-L226 VanDerWaalsContact C-N 3.34Å; G224-L226 PolarHBondContact O-N 3.31Å; L226-T229 PolarHBondContact O-N 2.89Å; L226-I230 HydrophobicContact CD2-CD1 3.49Å; L226-I230 VanDerWaalsContact CD2-CD1 3.49Å; L226-I230 HydrophobicContact CD2-CG1 4.45Å; L226-I230 HydrophobicContact CG-CD1 4.11Å; L226-I230 WeakPolarHBondContact O-CG1 3.42Å; L226-I230 PolarHBondContact O-N 2.82Å
227Y84.2Confident78.6Confident126 Ų12652.6 Ų52.649%0.49429%0.287SS..Hα-helixtrans-67.8-45.1-179.2-66.6-78.2000112.1V221 G224 Y225 T229 I230 I231V221-Y227 VanDerWaalsContact O-CE2 3.27Å; V221-Y227 WeakPolarHBondContact O-CE2 3.46Å; V221-Y227 PolarHBondContact O-OH 3.15Å; G224-Y227 PolarHBondContact O-N 2.99Å; Y225-Y227 PolarHBondContact O-N 3.04Å; Y227-T229 VanDerWaalsContact C-N 3.28Å; Y227-T229 PolarHBondContact O-N 3Å; Y227-I230 PolarHBondContact O-N 2.7Å; Y227-I231 VanDerWaalsContact O-CG1 3.3Å; Y227-I231 WeakPolarHBondContact O-CG1 3.28Å; Y227-I231 PolarHBondContact O-N 3.25Å
228V82.8Confident79.6Confident16 Ų1655.7 Ų55.710%0.09730%0.303CS..Hα-helixtrans-57.9-46.1175.2172.50000109.8M201 I204 G224 I230 I231 Y232M201-V228 HydrophobicContact CB-CG1 4.5Å; I204-V228 HydrophobicContact CG2-CG2 4.46Å; G224-V228 WeakPolarHBondContact O-CG2 3.26Å; G224-V228 PolarHBondContact O-N 3.24Å; G224-V228 VanDerWaalsContact O-N 3.09Å; V228-I230 PolarHBondContact O-N 3.18Å; V228-I231 PolarHBondContact O-N 2.97Å; V228-Y232 WeakPolarHBondContact O-CB 3.5Å; V228-Y232 PolarHBondContact O-N 3.45Å
229T77.6Confident80.3Confident32 Ų3253 Ų5320%0.19629%0.288CS..Hα-helixtrans-61.7-44.9178.9-60.70000112.1Y225 L226 Y227 N233Y225-T229 VanDerWaalsContact O-CB 3.24Å; Y225-T229 WeakPolarHBondContact O-CB 3.3Å; Y225-T229 PolarHBondContact O-N 2.75Å; Y225-T229 PolarHBondContact O-OG1 3.12Å; L226-T229 PolarHBondContact O-N 2.89Å; Y227-T229 VanDerWaalsContact C-N 3.28Å; Y227-T229 PolarHBondContact O-N 3Å; T229-N233 WeakPolarHBondContact CG2-ND2 3.2Å; T229-N233 VanDerWaalsContact O-CB 3.31Å; T229-N233 WeakPolarHBondContact O-CB 3.4Å; T229-N233 PolarHBondContact O-N 2.88Å; T229-N233 PolarHBondContact O-ND2 3.21Å
230I82.6Confident80.9Confident86 Ų8650.1 Ų50.144%0.44128%0.276SS..Hα-helixtrans-64.5-49.1178.6-70.8172.1000111.3L226 Y227 V228 Y232 N233 I234L226-I230 HydrophobicContact CD2-CD1 3.49Å; L226-I230 VanDerWaalsContact CD2-CD1 3.49Å; L226-I230 HydrophobicContact CD2-CG1 4.45Å; L226-I230 HydrophobicContact CG-CD1 4.11Å; L226-I230 WeakPolarHBondContact O-CG1 3.42Å; L226-I230 PolarHBondContact O-N 2.82Å; Y227-I230 PolarHBondContact O-N 2.7Å; V228-I230 PolarHBondContact O-N 3.18Å; I230-Y232 VanDerWaalsContact C-N 3.29Å; I230-Y232 PolarHBondContact O-N 3.29Å; I230-N233 PolarHBondContact O-N 3.35Å; I230-I234 HydrophobicContact CG2-CD1 3.81Å; I230-I234 WeakPolarHBondContact O-CG1 2.97Å; I230-I234 PolarHBondContact O-N 3.16Å
231I86.9Confident81.2Confident77 Ų7749.6 Ų49.640%0.39527%0.268SS..Hα-helixtrans-61.6-43.7-179.1-65.6166.3000110V197 M201 Y227 V228 I234 S235V197-I231 HydrophobicContact CG1-CG2 4.32Å; M201-I231 HydrophobicContact CE-CB 4.4Å; M201-I231 HydrophobicContact CE-CD1 4.21Å; M201-I231 HydrophobicContact CE-CG2 3.57Å; M201-I231 HydrophobicContact SD-CB 4.27Å; M201-I231 HydrophobicContact SD-CD1 4.37Å; M201-I231 HydrophobicContact SD-CG2 3.94Å; Y227-I231 VanDerWaalsContact O-CG1 3.3Å; Y227-I231 WeakPolarHBondContact O-CG1 3.28Å; Y227-I231 PolarHBondContact O-N 3.25Å; V228-I231 PolarHBondContact O-N 2.97Å; I231-I234 PolarHBondContact O-N 2.9Å; I231-S235 VanDerWaalsContact O-CB 3.24Å; I231-S235 WeakPolarHBondContact O-CB 3.39Å; I231-S235 PolarHBondContact O-N 3.18Å
232Y82.9Confident81.5Confident41 Ų4145 Ų4516%0.16124%0.24CC..Hα-helixtrans-56.7-51.1174.6169.4-115.6000111.9E133 F194 K198 V228 I230 I234 S235 V236 F274E133-Y232 PolarHBondContact OE1-OH 3.43Å; F194-Y232 HydrophobicContact CE2-CD2 4.17Å; F194-Y232 AromaticContact CE2-CE2 3.86Å; F194-Y232 HydrophobicContact CE2-CE2 3.86Å; F194-Y232 HydrophobicContact CZ-CE2 4.05Å; K198-Y232 HydrophobicContact CD-CD2 4.32Å; K198-Y232 HydrophobicContact CD-CE2 3.82Å; K198-Y232 PolarHBondContact NZ-OH 2.89Å; V228-Y232 WeakPolarHBondContact O-CB 3.5Å; V228-Y232 PolarHBondContact O-N 3.45Å; I230-Y232 VanDerWaalsContact C-N 3.29Å; I230-Y232 PolarHBondContact O-N 3.29Å; Y232-I234 PolarHBondContact O-N 3.41Å; Y232-S235 PolarHBondContact O-N 3.37Å; Y232-V236 HydrophobicContact CE2-CB 4.21Å; Y232-V236 WeakPolarHBondContact O-CG1 3.32Å; Y232-V236 PolarHBondContact O-N 3.38Å; Y232-F274 AromaticContact CE1-CD2 3.85Å; Y232-F274 HydrophobicContact CE1-CD2 3.85Å; Y232-F274 AromaticContact CE1-CE2 3.97Å; Y232-F274 HydrophobicContact CE1-CE2 3.97Å
233N82.1Confident81.7Confident43 Ų4341.6 Ų41.623%0.2321%0.211CC..Hα-helixtrans-59.2-42.9-179.7-91.1-76.8000113.1T229 I230 V236 S237 F274T229-N233 WeakPolarHBondContact CG2-ND2 3.2Å; T229-N233 VanDerWaalsContact O-CB 3.31Å; T229-N233 WeakPolarHBondContact O-CB 3.4Å; T229-N233 PolarHBondContact O-N 2.88Å; T229-N233 PolarHBondContact O-ND2 3.21Å; I230-N233 PolarHBondContact O-N 3.35Å; N233-V236 WeakPolarHBondContact O-CG1 3.42Å; N233-S237 WeakPolarHBondContact O-CB 3.45Å; N233-S237 PolarHBondContact O-N 3.18Å; N233-S237 PolarHBondContact O-OG 3.33Å; N233-F274 WeakPolarHBondContact OD1-CE2 3.2Å; N233-F274 WeakPolarHBondContact OD1-CZ 3.33Å
234I84.3Confident81.8Confident113 Ų11343.6 Ų43.658%0.57922%0.218SC*.Hα-helixtrans-65.6-46.1177-67.4169.7000110.1I230 I231 Y232 S237 L238I230-I234 HydrophobicContact CG2-CD1 3.81Å; I230-I234 WeakPolarHBondContact O-CG1 2.97Å; I230-I234 PolarHBondContact O-N 3.16Å; I231-I234 PolarHBondContact O-N 2.9Å; Y232-I234 PolarHBondContact O-N 3.41Å; I234-S237 PolarHBondContact O-N 3.09Å; I234-L238 WeakPolarHBondContact O-CB 3.39Å; I234-L238 PolarHBondContact O-N 3.29Å
235S87.7Confident81.6Confident4 Ų443.5 Ų43.53%0.02822%0.216CC..Hα-helixtrans-63-46.8-178-164.40000112.1Q193 I231 Y232 L238 S239Q193-S235 PolarHBondContact NE2-OG 3.42Å; Q193-S235 PolarHBondContact OE1-OG 3.09Å; I231-S235 VanDerWaalsContact O-CB 3.24Å; I231-S235 WeakPolarHBondContact O-CB 3.39Å; I231-S235 PolarHBondContact O-N 3.18Å; Y232-S235 PolarHBondContact O-N 3.37Å; S235-L238 PolarHBondContact O-N 3.02Å; S235-S239 PolarHBondContact O-N 3.5Å; S235-S239 VanDerWaalsContact O-N 3.09Å; S235-S239 PolarHBondContact O-OG 2.91Å
236V82Confident81.7Confident7 Ų742 Ų424%0.04221%0.21CC..Hα-helixtrans-68.5-38.2178.476.90000111.7F194 Y232 N233 L238 S239 L240F194-V236 HydrophobicContact CD2-CB 4.17Å; F194-V236 HydrophobicContact CE1-CG2 4.4Å; F194-V236 HydrophobicContact CE2-CB 3.54Å; F194-V236 HydrophobicContact CE2-CG2 3.76Å; F194-V236 HydrophobicContact CZ-CB 3.99Å; F194-V236 HydrophobicContact CZ-CG2 3.65Å; Y232-V236 HydrophobicContact CE2-CB 4.21Å; Y232-V236 WeakPolarHBondContact O-CG1 3.32Å; Y232-V236 PolarHBondContact O-N 3.38Å; N233-V236 WeakPolarHBondContact O-CG1 3.42Å; V236-L238 VanDerWaalsContact C-N 3.34Å; V236-L238 PolarHBondContact O-N 3.47Å; V236-S239 PolarHBondContact O-N 2.93Å; V236-S239 PolarHBondContact O-OG 3.45Å; V236-L240 HydrophobicContact CG2-CD1 3.76Å; V236-L240 HydrophobicContact CG2-CG 4.35Å; V236-L240 WeakPolarHBondContact O-CB 3.38Å; V236-L240 WeakPolarHBondContact O-CD1 3.49Å; V236-L240 VanDerWaalsContact O-CG 3.22Å; V236-L240 WeakPolarHBondContact O-CG 3.34Å; V236-L240 PolarHBondContact O-N 3.45Å
237S82.1Confident81.6Confident71 Ų7142 Ų4250%0.49721%0.208SC..Hα-helixtrans-64.1-41.2176.6-63.30000111.4N233 I234 Y241N233-S237 WeakPolarHBondContact O-CB 3.45Å; N233-S237 PolarHBondContact O-N 3.18Å; N233-S237 PolarHBondContact O-OG 3.33Å; I234-S237 PolarHBondContact O-N 3.09Å; S237-Y241 WeakPolarHBondContact O-CB 3.44Å; S237-Y241 PolarHBondContact O-N 3.13Å
238L84.4Confident81.1Confident67 Ų6737.8 Ų37.835%0.35119%0.192SC..Hα-helixtrans-64.6-45.7177.6-178.864.1000111.9F186 A190 I234 S235 V236 Y241 A242F186-L238 HydrophobicContact CZ-CD1 4.35Å; A190-L238 HydrophobicContact CB-CG 4.28Å; I234-L238 WeakPolarHBondContact O-CB 3.39Å; I234-L238 PolarHBondContact O-N 3.29Å; S235-L238 PolarHBondContact O-N 3.02Å; V236-L238 VanDerWaalsContact C-N 3.34Å; V236-L238 PolarHBondContact O-N 3.47Å; L238-Y241 PolarHBondContact O-N 3.21Å; L238-A242 WeakPolarHBondContact O-CB 3.48Å; L238-A242 PolarHBondContact O-N 3.23Å
239S84Confident80.7Confident0 Ų037.7 Ų37.70%019%0.193CC..Hα-helixtrans-66.6-42.1-179.967.10000112.1S235 V236 Y241 A242 L243S235-S239 PolarHBondContact O-N 3.5Å; S235-S239 VanDerWaalsContact O-N 3.09Å; S235-S239 PolarHBondContact O-OG 2.91Å; V236-S239 PolarHBondContact O-N 2.93Å; V236-S239 PolarHBondContact O-OG 3.45Å; S239-Y241 VanDerWaalsContact C-N 3.35Å; S239-A242 WeakPolarHBondContact O-CB 3.5Å; S239-A242 PolarHBondContact O-N 3.12Å; S239-L243 WeakPolarHBondContact O-CB 3.31Å; S239-L243 PolarHBondContact O-N 3.23Å
240L78.6Confident80.4Confident17 Ų1736.2 Ų36.29%0.08918%0.184CC..Hα-helixtrans-69.3-33.9177.2-68.3168.5000112.3I137 V236 F244 F271I137-L240 HydrophobicContact CD1-CD2 4.13Å; V236-L240 HydrophobicContact CG2-CD1 3.76Å; V236-L240 HydrophobicContact CG2-CG 4.35Å; V236-L240 WeakPolarHBondContact O-CB 3.38Å; V236-L240 WeakPolarHBondContact O-CD1 3.49Å; V236-L240 VanDerWaalsContact O-CG 3.22Å; V236-L240 WeakPolarHBondContact O-CG 3.34Å; V236-L240 PolarHBondContact O-N 3.45Å; L240-F244 VanDerWaalsContact O-CB 3.3Å; L240-F244 WeakPolarHBondContact O-CB 3.12Å; L240-F244 PolarHBondContact O-N 2.9Å; L240-F271 HydrophobicContact CB-CE2 4.34Å; L240-F271 HydrophobicContact CB-CZ 4.43Å; L240-F271 HydrophobicContact CD1-CD2 4.19Å; L240-F271 HydrophobicContact CD1-CE2 3.48Å; L240-F271 VanDerWaalsContact CD1-CE2 3.48Å; L240-F271 HydrophobicContact CD1-CZ 3.67Å; L240-F271 HydrophobicContact CD2-CE2 4.05Å; L240-F271 HydrophobicContact CG-CE2 4.17Å
241Y79.9Confident80Confident80 Ų8036.1 Ų36.131%0.31418%0.178SC..Hα-helixtrans-65.7-45.2172.2179.8-116.6000111.4G170 S237 L238 S239 L243 F244 L245G170-Y241 PolarHBondContact O-OH 3.27Å; S237-Y241 WeakPolarHBondContact O-CB 3.44Å; S237-Y241 PolarHBondContact O-N 3.13Å; L238-Y241 PolarHBondContact O-N 3.21Å; S239-Y241 VanDerWaalsContact C-N 3.35Å; Y241-L243 PolarHBondContact O-N 3.47Å; Y241-F244 WeakPolarHBondContact O-CB 3.48Å; Y241-F244 PolarHBondContact O-N 3.33Å; Y241-L245 HydrophobicContact CD1-CD1 3.89Å; Y241-L245 HydrophobicContact CD1-CG 4.44Å; Y241-L245 HydrophobicContact CD2-CG 4.42Å; Y241-L245 HydrophobicContact CE1-CD1 3.42Å; Y241-L245 VanDerWaalsContact CE1-CD1 3.42Å; Y241-L245 HydrophobicContact CE1-CG 4.11Å; Y241-L245 HydrophobicContact CE2-CD1 4.27Å; Y241-L245 HydrophobicContact CE2-CD2 4.16Å; Y241-L245 HydrophobicContact CE2-CG 4.05Å; Y241-L245 WeakPolarHBondContact O-CB 3.42Å; Y241-L245 WeakPolarHBondContact O-CG 3.42Å; Y241-L245 PolarHBondContact O-N 2.95Å
242A82.1Confident79.3Confident0 Ų037.9 Ų37.90%018%0.184CC..Hα-helixtrans-58.7-45.3173.700000112.5C187 A190 L238 S239 F244 L245 F246C187-A242 HydrophobicContact CB-CB 4.4Å; A190-A242 HydrophobicContact CB-CB 3.55Å; L238-A242 WeakPolarHBondContact O-CB 3.48Å; L238-A242 PolarHBondContact O-N 3.23Å; S239-A242 WeakPolarHBondContact O-CB 3.5Å; S239-A242 PolarHBondContact O-N 3.12Å; A242-F244 VanDerWaalsContact C-N 3.32Å; A242-F244 PolarHBondContact O-N 2.94Å; A242-L245 PolarHBondContact O-N 3.49Å; A242-F246 WeakPolarHBondContact O-CB 3.4Å; A242-F246 PolarHBondContact O-N 3.35Å
243L79.1Confident78.8Confident8 Ų838 Ų384%0.04219%0.188CC..Hα-helixtrans-60.3-42.1175.3-165.495.4000111.8I137 F140 L141 S239 Y241 F246 Y247 F263I137-L243 HydrophobicContact CG2-CD1 4.39Å; F140-L243 HydrophobicContact CD1-CD1 3.67Å; F140-L243 HydrophobicContact CD1-CD2 3.77Å; F140-L243 HydrophobicContact CD1-CG 4.14Å; F140-L243 HydrophobicContact CE1-CD1 4.11Å; F140-L243 HydrophobicContact CE1-CD2 3.74Å; F140-L243 HydrophobicContact CE1-CG 4.15Å; L141-L243 HydrophobicContact CB-CD1 3.93Å; L141-L243 HydrophobicContact CD1-CD1 4.11Å; S239-L243 WeakPolarHBondContact O-CB 3.31Å; S239-L243 PolarHBondContact O-N 3.23Å; Y241-L243 PolarHBondContact O-N 3.47Å; L243-F246 PolarHBondContact O-N 3.44Å; L243-Y247 WeakPolarHBondContact O-CB 3.38Å; L243-Y247 PolarHBondContact O-N 3.26Å; L243-F263 HydrophobicContact CD2-CD2 4.23Å; L243-F263 HydrophobicContact CD2-CE2 3.41Å; L243-F263 VanDerWaalsContact CD2-CE2 3.41Å; L243-F263 HydrophobicContact CD2-CZ 3.87Å; L243-F263 HydrophobicContact CG-CE2 3.84Å; L243-F263 HydrophobicContact CG-CZ 4.48Å
244F77Confident78.2Confident50 Ų5036.1 Ų36.122%0.21918%0.178CC..Hα-helixtrans-65.2-43.9177175.6-102.9000112.3Y169 L240 Y241 A242 Y247 F248 F263Y169-F244 HydrophobicContact CD1-CE1 4.14Å; Y169-F244 AromaticContact CD1-CZ 3.89Å; Y169-F244 HydrophobicContact CD1-CZ 3.89Å; Y169-F244 HydrophobicContact CE1-CZ 4.36Å; L240-F244 VanDerWaalsContact O-CB 3.3Å; L240-F244 WeakPolarHBondContact O-CB 3.12Å; L240-F244 PolarHBondContact O-N 2.9Å; Y241-F244 WeakPolarHBondContact O-CB 3.48Å; Y241-F244 PolarHBondContact O-N 3.33Å; A242-F244 VanDerWaalsContact C-N 3.32Å; A242-F244 PolarHBondContact O-N 2.94Å; F244-Y247 PolarHBondContact O-N 3.48Å; F244-F248 WeakPolarHBondContact O-CB 3.44Å; F244-F248 PolarHBondContact O-N 3.47Å; F244-F263 HydrophobicContact CB-CZ 4.41Å; F244-F263 HydrophobicContact CD2-CE1 4.47Å; F244-F263 HydrophobicContact CD2-CZ 4.44Å
245L76.7Confident77.4Confident9 Ų935.2 Ų35.25%0.04718%0.177CC..Hα-helixtrans-60.5-45.4174.6-74.9178.8000111.4T171 L174 F183 Y241 A242 Y247 F248 A249T171-L245 HydrophobicContact CG2-CD2 3.55Å; L174-L245 HydrophobicContact CD1-CD1 4.29Å; L174-L245 HydrophobicContact CD1-CD2 4.35Å; F183-L245 HydrophobicContact CE2-CB 4.04Å; F183-L245 HydrophobicContact CE2-CD1 4.29Å; F183-L245 HydrophobicContact CZ-CB 3.81Å; Y241-L245 HydrophobicContact CD1-CD1 3.89Å; Y241-L245 HydrophobicContact CD1-CG 4.44Å; Y241-L245 HydrophobicContact CD2-CG 4.42Å; Y241-L245 HydrophobicContact CE1-CD1 3.42Å; Y241-L245 VanDerWaalsContact CE1-CD1 3.42Å; Y241-L245 HydrophobicContact CE1-CG 4.11Å; Y241-L245 HydrophobicContact CE2-CD1 4.27Å; Y241-L245 HydrophobicContact CE2-CD2 4.16Å; Y241-L245 HydrophobicContact CE2-CG 4.05Å; Y241-L245 WeakPolarHBondContact O-CB 3.42Å; Y241-L245 WeakPolarHBondContact O-CG 3.42Å; Y241-L245 PolarHBondContact O-N 2.95Å; A242-L245 PolarHBondContact O-N 3.49Å; L245-Y247 PolarHBondContact O-N 2.97Å; L245-F248 PolarHBondContact O-N 3.34Å; L245-A249 WeakPolarHBondContact O-CB 3.27Å; L245-A249 PolarHBondContact O-N 3.38Å
246F79.6Confident76.3Confident3 Ų339.8 Ų39.81%0.01321%0.206CC..Hα-helixtrans-60.1-45.6175.9178.2-88.2000111.8L141 C144 Y145 L148 I154 L184 C187 A242 L243 A249 T250L141-F246 HydrophobicContact CD1-CB 4.4Å; L141-F246 HydrophobicContact CD1-CD1 3.96Å; L141-F246 HydrophobicContact CD1-CD2 4.31Å; L141-F246 HydrophobicContact CD1-CE1 4.35Å; L141-F246 HydrophobicContact CD1-CG 3.95Å; C144-F246 HydrophobicContact CB-CD1 4.38Å; C144-F246 HydrophobicContact CB-CE1 3.54Å; C144-F246 HydrophobicContact CB-CZ 4.28Å; Y145-F246 HydrophobicContact CD1-CE2 4.36Å; Y145-F246 HydrophobicContact CD1-CZ 4.49Å; Y145-F246 HydrophobicContact CD2-CE2 4.15Å; Y145-F246 HydrophobicContact CD2-CZ 4.07Å; Y145-F246 AromaticContact CE1-CE2 3.85Å; Y145-F246 HydrophobicContact CE1-CE2 3.85Å; Y145-F246 HydrophobicContact CE1-CZ 4.41Å; Y145-F246 HydrophobicContact CE2-CD2 4.16Å; Y145-F246 AromaticContact CE2-CE2 3.61Å; Y145-F246 HydrophobicContact CE2-CE2 3.61Å; Y145-F246 AromaticContact CE2-CZ 3.97Å; Y145-F246 HydrophobicContact CE2-CZ 3.97Å; Y145-F246 HydrophobicContact CG-CE2 4.49Å; Y145-F246 HydrophobicContact CG-CZ 4.31Å; Y145-F246 AromaticContact CZ-CE2 3.42Å; Y145-F246 VanDerWaalsContact CZ-CE2 3.42Å; L148-F246 HydrophobicContact CD1-CE1 4.13Å; L148-F246 HydrophobicContact CD1-CZ 3.68Å; I154-F246 HydrophobicContact CD1-CZ 4.48Å; L184-F246 HydrophobicContact CD2-CD2 3.74Å; L184-F246 HydrophobicContact CD2-CE2 3.47Å; L184-F246 VanDerWaalsContact CD2-CE2 3.47Å; C187-F246 HydrophobicContact CB-CB 4.17Å; C187-F246 HydrophobicContact CB-CD2 4.48Å; A242-F246 WeakPolarHBondContact O-CB 3.4Å; A242-F246 PolarHBondContact O-N 3.35Å; L243-F246 PolarHBondContact O-N 3.44Å; F246-A249 WeakPolarHBondContact O-CB 3.32Å; F246-A249 PolarHBondContact O-N 3.27Å; F246-T250 HydrophobicContact CE1-CG2 4.15Å; F246-T250 HydrophobicContact CE2-CG2 4.16Å; F246-T250 HydrophobicContact CZ-CG2 3.95Å; F246-T250 WeakPolarHBondContact O-CG2 3.42Å; F246-T250 PolarHBondContact O-N 2.98Å; F246-T250 VanDerWaalsContact O-N 3.09Å; F246-T250 PolarHBondContact O-OG1 3.37Å
247Y76.1Confident75.3Confident33 Ų3343.4 Ų43.413%0.12922%0.22CC..Hα-helixtrans-61.3-46.8177.6173.4-94.9000111.8L243 F244 L245 A249 T250 R251 P259 V260 F263L243-Y247 WeakPolarHBondContact O-CB 3.38Å; L243-Y247 PolarHBondContact O-N 3.26Å; F244-Y247 PolarHBondContact O-N 3.48Å; L245-Y247 PolarHBondContact O-N 2.97Å; Y247-A249 PolarHBondContact O-N 2.97Å; Y247-T250 CarbonylContact O-C 3.59Å; Y247-T250 PolarHBondContact O-N 3.34Å; Y247-R251 HydrophobicContact CE1-CB 4.39Å; Y247-R251 WeakPolarHBondContact O-CA 3.23Å; Y247-R251 WeakPolarHBondContact O-CB 3.46Å; Y247-R251 PolarHBondContact O-N 3.48Å; Y247-P259 HydrophobicContact CE2-CB 3.9Å; Y247-P259 HydrophobicContact CE2-CG 4.1Å; Y247-V260 WeakPolarHBondContact OH-CA 3.34Å; Y247-V260 WeakPolarHBondContact OH-CG2 3.27Å; Y247-V260 PolarHBondContact OH-N 3.14Å; Y247-F263 HydrophobicContact CD2-CB 4.11Å; Y247-F263 AromaticContact CD2-CD2 3.61Å; Y247-F263 HydrophobicContact CD2-CD2 3.61Å; Y247-F263 HydrophobicContact CD2-CE2 4.17Å; Y247-F263 AromaticContact CD2-CG 3.86Å; Y247-F263 HydrophobicContact CD2-CG 3.86Å; Y247-F263 HydrophobicContact CE2-CB 4.01Å; Y247-F263 HydrophobicContact CE2-CD2 4.35Å; Y247-F263 HydrophobicContact CE2-CG 4.16Å; Y247-F263 HydrophobicContact CG-CD1 4.46Å; Y247-F263 AromaticContact CG-CD2 3.77Å; Y247-F263 HydrophobicContact CG-CD2 3.77Å; Y247-F263 AromaticContact CG-CE2 3.87Å; Y247-F263 HydrophobicContact CG-CE2 3.87Å; Y247-F263 HydrophobicContact CG-CG 4.11Å; Y247-F263 HydrophobicContact CG-CZ 4.27Å
248F75.4Confident74.2Confident37 Ų3745.5 Ų45.516%0.16223%0.226CC..Hα-helixtrans-59.9-39.6178.5-172.9-89.2000111.5F244 L245 T250 R251F244-F248 WeakPolarHBondContact O-CB 3.44Å; F244-F248 PolarHBondContact O-N 3.47Å; L245-F248 PolarHBondContact O-N 3.34Å; F248-T250 VanDerWaalsContact C-N 3.32Å; F248-T250 PolarHBondContact O-N 3.2Å; F248-R251 VanDerWaalsContact CZ-NH1 3.26Å; F248-R251 WeakPolarHBondContact O-CG 3.37Å
249A73.3Confident72.8Confident14 Ų1443.1 Ų43.112%0.11621%0.214CC..Hα-helixtrans-63.9-35.2177.800000114.2Y179 F183 L245 F246 Y247Y179-A249 HydrophobicContact CD1-CB 3.94Å; Y179-A249 HydrophobicContact CE1-CB 3.16Å; Y179-A249 WeakPolarHBondContact OH-CA 3.05Å; F183-A249 HydrophobicContact CE1-CB 3.75Å; F183-A249 HydrophobicContact CZ-CB 4.23Å; L245-A249 WeakPolarHBondContact O-CB 3.27Å; L245-A249 PolarHBondContact O-N 3.38Å; F246-A249 WeakPolarHBondContact O-CB 3.32Å; F246-A249 PolarHBondContact O-N 3.27Å; Y247-A249 PolarHBondContact O-N 2.97Å
250T72.4Confident71.6Confident0 Ų047.6 Ų47.60%024%0.241CC..Hα-helixtrans-110.30.2-169.655.50000112.7L148 I158 F246 Y247 F248 E252 L253 L254L148-T250 HydrophobicContact CD1-CG2 3.64Å; I158-T250 HydrophobicContact CD1-CG2 3.79Å; F246-T250 HydrophobicContact CE1-CG2 4.15Å; F246-T250 HydrophobicContact CE2-CG2 4.16Å; F246-T250 HydrophobicContact CZ-CG2 3.95Å; F246-T250 WeakPolarHBondContact O-CG2 3.42Å; F246-T250 PolarHBondContact O-N 2.98Å; F246-T250 VanDerWaalsContact O-N 3.09Å; F246-T250 PolarHBondContact O-OG1 3.37Å; Y247-T250 CarbonylContact O-C 3.59Å; Y247-T250 PolarHBondContact O-N 3.34Å; F248-T250 VanDerWaalsContact C-N 3.32Å; F248-T250 PolarHBondContact O-N 3.2Å; T250-E252 PolarHBondContact O-N 2.98Å; T250-E252 VanDerWaalsContact O-N 3.12Å; T250-L253 PolarHBondContact O-N 3.41Å; T250-L254 PolarHBondContact O-N 3.38Å; T250-L254 WeakPolarHBondContact OG1-CD1 3.27Å
251R74.5Confident70.4Confident85 Ų8552.8 Ų52.832%0.32127%0.269SS..Hα-helixtrans-52.7-40-173.872.4-174.4-175.6-156-5.1113E164 Y247 F248 L254 V255E164-R251 IonicContact OE2-NH2 3.65Å; Y247-R251 HydrophobicContact CE1-CB 4.39Å; Y247-R251 WeakPolarHBondContact O-CA 3.23Å; Y247-R251 WeakPolarHBondContact O-CB 3.46Å; Y247-R251 PolarHBondContact O-N 3.48Å; F248-R251 VanDerWaalsContact CZ-NH1 3.26Å; F248-R251 WeakPolarHBondContact O-CG 3.37Å; R251-L254 PolarHBondContact O-N 3.27Å; R251-V255 VanDerWaalsContact O-CG2 3.26Å; R251-V255 WeakPolarHBondContact O-CG2 3.46Å; R251-V255 PolarHBondContact O-N 3.24Å
252E72.3Confident69.8Low113 Ų11350.4 Ų50.453%0.52826%0.26SS..Hα-helixtrans-66.6-39.1-178.6-65.3-171.2166.600111.8K161 T250 L254 V255K161-E252 IonicContact NZ-OE2 2.77Å; K161-E252 PolarHBondContact NZ-OE2 3.15Å; T250-E252 PolarHBondContact O-N 2.98Å; T250-E252 VanDerWaalsContact O-N 3.12Å; E252-L254 VanDerWaalsContact C-N 3.31Å; E252-V255 WeakPolarHBondContact O-CG2 3.3Å
253L70.9Confident68.8Low44 Ų4451.1 Ų51.123%0.2326%0.263CS..Hα-helixtrans-76-26178.8-55.8-178.7000111.6L148 E157 I158 T250L148-L253 HydrophobicContact CD2-CB 3.33Å; L148-L253 HydrophobicContact CD2-CD1 3.91Å; L148-L253 HydrophobicContact CD2-CG 4.26Å; E157-L253 HydrophobicContact CB-CD1 4.05Å; E157-L253 HydrophobicContact CG-CD1 3.65Å; E157-L253 HydrophobicContact CG-CD2 3.4Å; E157-L253 HydrophobicContact CG-CG 4.16Å; I158-L253 HydrophobicContact CD1-CD1 4.09Å; I158-L253 HydrophobicContact CG1-CD1 3.78Å; T250-L253 PolarHBondContact O-N 3.41Å
254L70.2Confident67.9Low4 Ų457.4 Ų57.42%0.02129%0.29CS..Hα-helixtrans-88.8-11.7179.2-75.8159.8000113.8Y147 L148 T250 R251 E252 P256 Y257 P259Y147-L254 HydrophobicContact CD2-CD2 4.34Å; L148-L254 HydrophobicContact CD2-CG 4.14Å; L148-L254 HydrophobicContact CG-CD2 4.37Å; L148-L254 HydrophobicContact CG-CG 4.37Å; T250-L254 PolarHBondContact O-N 3.38Å; T250-L254 WeakPolarHBondContact OG1-CD1 3.27Å; R251-L254 PolarHBondContact O-N 3.27Å; E252-L254 VanDerWaalsContact C-N 3.31Å; L254-P256 VanDerWaalsContact C-N 3.34Å; L254-Y257 PolarHBondContact O-N 2.82Å; L254-P259 HydrophobicContact CB-CB 3.66Å; L254-P259 HydrophobicContact CB-CG 3.64Å; L254-P259 VanDerWaalsContact O-CD 3.23Å; L254-P259 WeakPolarHBondContact O-CD 3.39Å; L254-P259 WeakPolarHBondContact O-CG 3.49Å
255V67.6Low67.2Low94 Ų9455.9 Ų55.957%0.5728%0.284SS*.G310 helixtrans-43.3-48.1177.9174.20000113.9R251 E252 Y257 N258R251-V255 VanDerWaalsContact O-CG2 3.26Å; R251-V255 WeakPolarHBondContact O-CG2 3.46Å; R251-V255 PolarHBondContact O-N 3.24Å; E252-V255 WeakPolarHBondContact O-CG2 3.3Å; V255-Y257 PolarHBondContact O-N 3.41Å; V255-N258 PolarHBondContact O-N 2.97Å
256P63.6Low66.4Low99 Ų9955.8 Ų55.864%0.64328%0.284SS*.G310 helixtrans-60.8-16.1-179.221.7-33.5000114.1L254L254-P256 VanDerWaalsContact C-N 3.34Å
257Y62.5Low65.7Low83 Ų8358.5 Ų58.533%0.32530%0.295SS..G310 helixtrans-103.811-176.6-62.9-72.2000114.7L254 V255 K262L254-Y257 PolarHBondContact O-N 2.82Å; V255-Y257 PolarHBondContact O-N 3.41Å; Y257-K262 WeakPolarHBondContact O-CE 3.27Å; Y257-K262 PolarHBondContact O-NZ 2.97Å
258N57.7Low64.9Low116 Ų11658.5 Ų58.562%0.6230%0.3SS*.  trans47.962.5-176.6-73.7-54.3000112.9V255V255-N258 PolarHBondContact O-N 2.97Å
259P55.4Low64.3Low16 Ų1657.5 Ų57.510%0.10430%0.297CS..Hα-helixtrans-82.6-24.7-162.438.2-39.5000111.9Y247 L254 L261 K262 F263Y247-P259 HydrophobicContact CE2-CB 3.9Å; Y247-P259 HydrophobicContact CE2-CG 4.1Å; L254-P259 HydrophobicContact CB-CB 3.66Å; L254-P259 HydrophobicContact CB-CG 3.64Å; L254-P259 VanDerWaalsContact O-CD 3.23Å; L254-P259 WeakPolarHBondContact O-CD 3.39Å; L254-P259 WeakPolarHBondContact O-CG 3.49Å; P259-L261 VanDerWaalsContact C-N 3.35Å; P259-L261 PolarHBondContact O-N 3.1Å; P259-K262 PolarHBondContact O-N 3.23Å; P259-F263 WeakPolarHBondContact O-CB 3.13Å; P259-F263 PolarHBondContact O-N 3.03Å
260V58.1Low64Low94 Ų9457.1 Ų57.157%0.5729%0.293SS*.Hα-helixtrans-59-45.6177.9-175.50000110.9Y247 F264Y247-V260 WeakPolarHBondContact OH-CA 3.34Å; Y247-V260 WeakPolarHBondContact OH-CG2 3.27Å; Y247-V260 PolarHBondContact OH-N 3.14Å; V260-F264 WeakPolarHBondContact O-CB 3.29Å; V260-F264 PolarHBondContact O-N 2.95Å
261L55.3Low63.5Low127 Ų12760.4 Ų60.467%0.66531%0.308SS*.Hα-helixtrans-67.4-42.3-179.7-90.7162.4000111.8P259 M265P259-L261 VanDerWaalsContact C-N 3.35Å; P259-L261 PolarHBondContact O-N 3.1Å; L261-M265 WeakPolarHBondContact O-CB 3.3Å; L261-M265 PolarHBondContact O-N 3.32Å
262K67.3Low62.9Low29 Ų2960 Ų6013%0.12631%0.312CS..Hα-helixtrans-66.7-44.2177.6-68.6169.6175.5172.10111.7Y257 P259 M265 V266 A327 F328Y257-K262 WeakPolarHBondContact O-CE 3.27Å; Y257-K262 PolarHBondContact O-NZ 2.97Å; P259-K262 PolarHBondContact O-N 3.23Å; K262-M265 PolarHBondContact O-N 3.23Å; K262-V266 PolarHBondContact O-N 3.07Å; K262-V266 VanDerWaalsContact O-N 3.12Å; K262-A327 WeakPolarHBondContact CE-O 3.18Å; K262-A327 HydrophobicContact CG-CB 4.05Å; K262-F328 HydrophobicContact CB-CE1 4.38Å; K262-F328 HydrophobicContact CB-CZ 4.32Å; K262-F328 HydrophobicContact CD-CD1 4.31Å; K262-F328 HydrophobicContact CD-CE1 3.93Å; K262-F328 HydrophobicContact CG-CD1 4.46Å; K262-F328 HydrophobicContact CG-CE1 4.04Å; K262-F328 HydrophobicContact CG-CZ 4.36Å
263F61.1Low62.5Low16 Ų1655.1 Ų55.17%0.0729%0.29CS..Hα-helixtrans-66.7-48.3178.4-175.1-88.9000111.6F140 L243 F244 Y247 P259 M265 K267F140-F263 AromaticContact CE1-CD2 3.48Å; F140-F263 HydrophobicContact CE1-CD2 3.48Å; F140-F263 VanDerWaalsContact CE1-CD2 3.48Å; F140-F263 AromaticContact CE1-CE2 3.97Å; F140-F263 HydrophobicContact CE1-CE2 3.97Å; F140-F263 HydrophobicContact CE1-CG 4.41Å; F140-F263 HydrophobicContact CZ-CB 3.97Å; F140-F263 AromaticContact CZ-CD2 3.59Å; F140-F263 HydrophobicContact CZ-CD2 3.59Å; F140-F263 HydrophobicContact CZ-CG 4.18Å; L243-F263 HydrophobicContact CD2-CD2 4.23Å; L243-F263 HydrophobicContact CD2-CE2 3.41Å; L243-F263 VanDerWaalsContact CD2-CE2 3.41Å; L243-F263 HydrophobicContact CD2-CZ 3.87Å; L243-F263 HydrophobicContact CG-CE2 3.84Å; L243-F263 HydrophobicContact CG-CZ 4.48Å; F244-F263 HydrophobicContact CB-CZ 4.41Å; F244-F263 HydrophobicContact CD2-CE1 4.47Å; F244-F263 HydrophobicContact CD2-CZ 4.44Å; Y247-F263 HydrophobicContact CD2-CB 4.11Å; Y247-F263 AromaticContact CD2-CD2 3.61Å; Y247-F263 HydrophobicContact CD2-CD2 3.61Å; Y247-F263 HydrophobicContact CD2-CE2 4.17Å; Y247-F263 AromaticContact CD2-CG 3.86Å; Y247-F263 HydrophobicContact CD2-CG 3.86Å; Y247-F263 HydrophobicContact CE2-CB 4.01Å; Y247-F263 HydrophobicContact CE2-CD2 4.35Å; Y247-F263 HydrophobicContact CE2-CG 4.16Å; Y247-F263 HydrophobicContact CG-CD1 4.46Å; Y247-F263 AromaticContact CG-CD2 3.77Å; Y247-F263 HydrophobicContact CG-CD2 3.77Å; Y247-F263 AromaticContact CG-CE2 3.87Å; Y247-F263 HydrophobicContact CG-CE2 3.87Å; Y247-F263 HydrophobicContact CG-CG 4.11Å; Y247-F263 HydrophobicContact CG-CZ 4.27Å; P259-F263 WeakPolarHBondContact O-CB 3.13Å; P259-F263 PolarHBondContact O-N 3.03Å; F263-M265 VanDerWaalsContact C-N 3.27Å; F263-M265 PolarHBondContact O-N 3.09Å; F263-K267 HydrophobicContact CD1-CD 4.29Å; F263-K267 HydrophobicContact CE1-CD 3.62Å; F263-K267 HydrophobicContact CZ-CD 4.26Å; F263-K267 WeakPolarHBondContact O-CB 3.19Å; F263-K267 PolarHBondContact O-N 3.33Å
264F60.3Low62.2Low139 Ų13954.8 Ų54.861%0.6129%0.287SS*.Hα-helixtrans-63.2-36.1177.5-172.2-96000111.4V260 S268V260-F264 WeakPolarHBondContact O-CB 3.29Å; V260-F264 PolarHBondContact O-N 2.95Å; F264-S268 WeakPolarHBondContact O-CA 3.41Å; F264-S268 WeakPolarHBondContact O-CB 3.26Å; F264-S268 PolarHBondContact O-N 3.33Å
265M61.2Low62Low18 Ų1861.9 Ų61.99%0.08931%0.313CS..Hα-helixtrans-70.2-48-179.8177.6-71.2-62.100111.9L261 K262 F263 K267 S268 V269 A323 L324 A327 F328L261-M265 WeakPolarHBondContact O-CB 3.3Å; L261-M265 PolarHBondContact O-N 3.32Å; K262-M265 PolarHBondContact O-N 3.23Å; F263-M265 VanDerWaalsContact C-N 3.27Å; F263-M265 PolarHBondContact O-N 3.09Å; M265-K267 VanDerWaalsContact C-N 3.34Å; M265-K267 PolarHBondContact O-N 3.27Å; M265-S268 PolarHBondContact O-N 3.47Å; M265-V269 VanDerWaalsContact O-CG2 3.32Å; M265-V269 WeakPolarHBondContact O-CG2 3.23Å; M265-V269 PolarHBondContact O-N 3.02Å; M265-V269 HydrophobicContact SD-CG2 4.36Å; M265-A323 HydrophobicContact CG-CB 3.95Å; M265-L324 HydrophobicContact CE-CD2 3.14Å; M265-L324 HydrophobicContact CE-CG 3.73Å; M265-L324 HydrophobicContact SD-CD1 4.31Å; M265-L324 HydrophobicContact SD-CD2 3.48Å; M265-L324 WeakPolarHBondContact SD-CD2 3.5Å; M265-L324 HydrophobicContact SD-CG 3.47Å; M265-L324 WeakPolarHBondContact SD-CG 3.33Å; M265-A327 HydrophobicContact CE-CB 3.98Å; M265-F328 HydrophobicContact CE-CD2 4.11Å; M265-F328 HydrophobicContact CE-CE2 3.56Å; M265-F328 HydrophobicContact CE-CZ 4.43Å
266V60.8Low61.7Low8 Ų858.7 Ų58.75%0.04829%0.292CS..Hα-helixtrans-65-41.5176.2176.70000110.9I98 V136 F140 K262 I270 F328I98-V266 HydrophobicContact CG2-CG2 3.98Å; V136-V266 HydrophobicContact CG1-CG1 4.16Å; F140-V266 HydrophobicContact CB-CG1 4.2Å; F140-V266 HydrophobicContact CD2-CB 4.1Å; F140-V266 HydrophobicContact CD2-CG1 4.21Å; F140-V266 HydrophobicContact CD2-CG2 3.76Å; F140-V266 HydrophobicContact CE2-CB 4.36Å; F140-V266 HydrophobicContact CE2-CG2 4.11Å; F140-V266 HydrophobicContact CG-CB 4.39Å; F140-V266 HydrophobicContact CG-CG1 4.06Å; F140-V266 HydrophobicContact CG-CG2 4.43Å; K262-V266 PolarHBondContact O-N 3.07Å; K262-V266 VanDerWaalsContact O-N 3.12Å; V266-I270 HydrophobicContact CG1-CD1 4.06Å; V266-I270 WeakPolarHBondContact O-CG1 3.35Å; V266-I270 PolarHBondContact O-N 3.21Å; V266-F328 HydrophobicContact CG2-CE2 4.44Å
267K64.3Low61.7Low59 Ų5955 Ų5526%0.25727%0.272SS..Hα-helixtrans-62.2-48.5176.1-171.9173.2-179.71760111.2F263 M265 V269 I270 F271F263-K267 HydrophobicContact CD1-CD 4.29Å; F263-K267 HydrophobicContact CE1-CD 3.62Å; F263-K267 HydrophobicContact CZ-CD 4.26Å; F263-K267 WeakPolarHBondContact O-CB 3.19Å; F263-K267 PolarHBondContact O-N 3.33Å; M265-K267 VanDerWaalsContact C-N 3.34Å; M265-K267 PolarHBondContact O-N 3.27Å; K267-V269 PolarHBondContact O-N 3.37Å; K267-I270 PolarHBondContact O-N 3.3Å; K267-F271 HydrophobicContact CB-CD2 4.45Å; K267-F271 HydrophobicContact CD-CD2 4.28Å; K267-F271 HydrophobicContact CD-CE2 3.97Å; K267-F271 HydrophobicContact CG-CD2 3.33Å; K267-F271 HydrophobicContact CG-CE2 3.43Å; K267-F271 VanDerWaalsContact CG-CE2 3.43Å; K267-F271 HydrophobicContact CG-CG 4.42Å; K267-F271 VanDerWaalsContact O-CB 3.26Å; K267-F271 WeakPolarHBondContact O-CB 3.41Å; K267-F271 VanDerWaalsContact O-CD2 3.24Å; K267-F271 WeakPolarHBondContact O-CD2 3.44Å; K267-F271 PolarHBondContact O-N 2.82Å
268S58.8Low61.8Low33 Ų3353.8 Ų53.823%0.23127%0.27CS..Hα-helixtrans-65.3-37.2-177.2-171.60000111.9F264 M265 L272F264-S268 WeakPolarHBondContact O-CA 3.41Å; F264-S268 WeakPolarHBondContact O-CB 3.26Å; F264-S268 PolarHBondContact O-N 3.33Å; M265-S268 PolarHBondContact O-N 3.47Å; S268-L272 WeakPolarHBondContact O-CB 3.47Å; S268-L272 WeakPolarHBondContact O-CD1 3.26Å; S268-L272 WeakPolarHBondContact O-CG 2.83Å; S268-L272 PolarHBondContact O-N 3.35Å; S268-L272 WeakPolarHBondContact OG-CD1 3.41Å
269V63Low62.2Low17 Ų1753.1 Ų53.110%0.10327%0.266CS..Hα-helixtrans-63.1-45.2177.3168.70000111.1I101 M265 K267 S273 M317 A320I101-V269 HydrophobicContact CD1-CG1 4.05Å; M265-V269 VanDerWaalsContact O-CG2 3.32Å; M265-V269 WeakPolarHBondContact O-CG2 3.23Å; M265-V269 PolarHBondContact O-N 3.02Å; M265-V269 HydrophobicContact SD-CG2 4.36Å; K267-V269 PolarHBondContact O-N 3.37Å; V269-S273 PolarHBondContact O-N 3.09Å; V269-S273 PolarHBondContact O-OG 2.91Å; V269-M317 HydrophobicContact CG1-CE 4.11Å; V269-A320 HydrophobicContact CG2-CB 3.88Å
270I66.6Low62.6Low6 Ų653.6 Ų53.63%0.03127%0.267CS..Hα-helixtrans-74.1-41.2-178.9-61.1170.4000111I101 E133 V136 I137 V266 K267 F274I101-I270 HydrophobicContact CD1-CG1 4.48Å; E133-I270 HydrophobicContact CG-CG1 4.28Å; E133-I270 HydrophobicContact CG-CG2 3.86Å; V136-I270 HydrophobicContact CG1-CD1 4.32Å; I137-I270 HydrophobicContact CD1-CD1 4.19Å; I137-I270 HydrophobicContact CG1-CD1 3.6Å; V266-I270 HydrophobicContact CG1-CD1 4.06Å; V266-I270 WeakPolarHBondContact O-CG1 3.35Å; V266-I270 PolarHBondContact O-N 3.21Å; K267-I270 PolarHBondContact O-N 3.3Å; I270-F274 WeakPolarHBondContact O-CB 3.5Å; I270-F274 PolarHBondContact O-N 2.67Å; I270-F274 VanDerWaalsContact O-N 3.08Å
271F61.7Low62.8Low68 Ų6849.4 Ų49.430%0.29824%0.243SC..Hα-helixtrans-68-39.4179.2-93.7-92.1000113.1L240 K267 F274 W275L240-F271 HydrophobicContact CB-CE2 4.34Å; L240-F271 HydrophobicContact CB-CZ 4.43Å; L240-F271 HydrophobicContact CD1-CD2 4.19Å; L240-F271 HydrophobicContact CD1-CE2 3.48Å; L240-F271 VanDerWaalsContact CD1-CE2 3.48Å; L240-F271 HydrophobicContact CD1-CZ 3.67Å; L240-F271 HydrophobicContact CD2-CE2 4.05Å; L240-F271 HydrophobicContact CG-CE2 4.17Å; K267-F271 HydrophobicContact CB-CD2 4.45Å; K267-F271 HydrophobicContact CD-CD2 4.28Å; K267-F271 HydrophobicContact CD-CE2 3.97Å; K267-F271 HydrophobicContact CG-CD2 3.33Å; K267-F271 HydrophobicContact CG-CE2 3.43Å; K267-F271 VanDerWaalsContact CG-CE2 3.43Å; K267-F271 HydrophobicContact CG-CG 4.42Å; K267-F271 VanDerWaalsContact O-CB 3.26Å; K267-F271 WeakPolarHBondContact O-CB 3.41Å; K267-F271 VanDerWaalsContact O-CD2 3.24Å; K267-F271 WeakPolarHBondContact O-CD2 3.44Å; K267-F271 PolarHBondContact O-N 2.82Å; F271-F274 PolarHBondContact O-N 3.48Å; F271-W275 WeakPolarHBondContact O-CB 3.42Å; F271-W275 PolarHBondContact O-N 3.34Å
272L63.1Low63.4Low78 Ų7847.4 Ų47.441%0.40823%0.231SC..Hα-helixtrans-65.6-45.3177.6-72.1171.4000110.5S268 F274 W275 Q276S268-L272 WeakPolarHBondContact O-CB 3.47Å; S268-L272 WeakPolarHBondContact O-CD1 3.26Å; S268-L272 WeakPolarHBondContact O-CG 2.83Å; S268-L272 PolarHBondContact O-N 3.35Å; S268-L272 WeakPolarHBondContact OG-CD1 3.41Å; L272-F274 VanDerWaalsContact C-N 3.28Å; L272-F274 PolarHBondContact O-N 2.87Å; L272-W275 PolarHBondContact O-N 3.31Å; L272-Q276 WeakPolarHBondContact O-CB 3.18Å; L272-Q276 WeakPolarHBondContact O-CG 3.23Å; L272-Q276 PolarHBondContact O-N 3.18Å
273S63.8Low63.1Low9 Ų949.2 Ų49.26%0.06324%0.242CC..Hα-helixtrans-56.5-42.3175.4-51.10000112.4V269 G277V269-S273 PolarHBondContact O-N 3.09Å; V269-S273 PolarHBondContact O-OG 2.91Å; S273-G277 PolarHBondContact O-N 3.18Å
274F64.1Low63.1Low38 Ų3849.6 Ų49.617%0.16724%0.244CC..Hα-helixtrans-68.5-49.6178168.4-95000112.6Y232 N233 I270 F271 L272 Q276 G277 M278Y232-F274 AromaticContact CE1-CD2 3.85Å; Y232-F274 HydrophobicContact CE1-CD2 3.85Å; Y232-F274 AromaticContact CE1-CE2 3.97Å; Y232-F274 HydrophobicContact CE1-CE2 3.97Å; N233-F274 WeakPolarHBondContact OD1-CE2 3.2Å; N233-F274 WeakPolarHBondContact OD1-CZ 3.33Å; I270-F274 WeakPolarHBondContact O-CB 3.5Å; I270-F274 PolarHBondContact O-N 2.67Å; I270-F274 VanDerWaalsContact O-N 3.08Å; F271-F274 PolarHBondContact O-N 3.48Å; L272-F274 VanDerWaalsContact C-N 3.28Å; L272-F274 PolarHBondContact O-N 2.87Å; F274-Q276 VanDerWaalsContact C-N 3.27Å; F274-Q276 PolarHBondContact O-N 3.34Å; F274-G277 PolarHBondContact O-N 2.99Å; F274-M278 HydrophobicContact CE1-CE 3.94Å; F274-M278 HydrophobicContact CE1-SD 4.3Å; F274-M278 HydrophobicContact CZ-CE 4.37Å; F274-M278 HydrophobicContact CZ-SD 4.14Å; F274-M278 PolarHBondContact O-N 3.48Å
275W66.6Low63.2Low152 Ų15248.4 Ų48.458%0.57624%0.239SC*.Hα-helixtrans-65.8-31.4-179.6-90.893.1000112.3F271 L272 M278 L279F271-W275 WeakPolarHBondContact O-CB 3.42Å; F271-W275 PolarHBondContact O-N 3.34Å; L272-W275 PolarHBondContact O-N 3.31Å; W275-M278 HydrophobicContact CD2-CE 3.54Å; W275-M278 HydrophobicContact CE3-CE 3.23Å; W275-M278 HydrophobicContact CG-CE 4.38Å; W275-M278 HydrophobicContact CH2-CE 3.54Å; W275-M278 HydrophobicContact CZ2-CE 3.81Å; W275-M278 HydrophobicContact CZ3-CE 3.24Å; W275-L279 WeakPolarHBondContact O-CB 3.2Å; W275-L279 PolarHBondContact O-N 2.93Å
276Q59.6Low63.1Low28 Ų2852.1 Ų52.113%0.13127%0.266CS..Hα-helixtrans-62-51.2170.6-73.9156.51000111.5L272 F274 M278 L279 L280 Q309 E316L272-Q276 WeakPolarHBondContact O-CB 3.18Å; L272-Q276 WeakPolarHBondContact O-CG 3.23Å; L272-Q276 PolarHBondContact O-N 3.18Å; F274-Q276 VanDerWaalsContact C-N 3.27Å; F274-Q276 PolarHBondContact O-N 3.34Å; Q276-M278 VanDerWaalsContact C-N 3.28Å; Q276-M278 PolarHBondContact O-N 3.15Å; Q276-L279 PolarHBondContact O-N 3.08Å; Q276-L280 WeakPolarHBondContact O-CB 3.33Å; Q276-L280 PolarHBondContact O-N 3.49Å; Q276-Q309 HydrophobicContact CB-CG 4.36Å; Q276-E316 PolarHBondContact NE2-OE1 3.38Å; Q276-E316 PolarHBondContact NE2-OE2 2.99Å
277G63.7Low62.9Low21 Ų2154.6 Ų54.622%0.21629%0.293CS..Hα-helixtrans-58.8-40.2177.600000112.5S273 F274 A281S273-G277 PolarHBondContact O-N 3.18Å; F274-G277 PolarHBondContact O-N 2.99Å; G277-A281 WeakPolarHBondContact O-CB 3.44Å; G277-A281 PolarHBondContact O-N 2.89Å
278M64.7Low62.2Low58 Ų5854.9 Ų54.929%0.28631%0.306SS..Hα-helixtrans-70.1-45.4176.8-175.6171.559.700112.9F274 W275 Q276 L280 A281 I282F274-M278 HydrophobicContact CE1-CE 3.94Å; F274-M278 HydrophobicContact CE1-SD 4.3Å; F274-M278 HydrophobicContact CZ-CE 4.37Å; F274-M278 HydrophobicContact CZ-SD 4.14Å; F274-M278 PolarHBondContact O-N 3.48Å; W275-M278 HydrophobicContact CD2-CE 3.54Å; W275-M278 HydrophobicContact CE3-CE 3.23Å; W275-M278 HydrophobicContact CG-CE 4.38Å; W275-M278 HydrophobicContact CH2-CE 3.54Å; W275-M278 HydrophobicContact CZ2-CE 3.81Å; W275-M278 HydrophobicContact CZ3-CE 3.24Å; Q276-M278 VanDerWaalsContact C-N 3.28Å; Q276-M278 PolarHBondContact O-N 3.15Å; M278-L280 PolarHBondContact O-N 2.87Å; M278-A281 PolarHBondContact O-N 3.17Å; M278-I282 HydrophobicContact CG-CD1 3.97Å; M278-I282 WeakPolarHBondContact O-CD1 3.12Å; M278-I282 VanDerWaalsContact O-CG1 3.24Å; M278-I282 WeakPolarHBondContact O-CG1 3.27Å; M278-I282 PolarHBondContact O-N 3.38Å
279L65.8Low61.8Low101 Ų10154.4 Ų54.453%0.52930%0.301SS..Hα-helixtrans-59.5-40176.9179.965.7000110.6W275 Q276 I282 L283W275-L279 WeakPolarHBondContact O-CB 3.2Å; W275-L279 PolarHBondContact O-N 2.93Å; Q276-L279 PolarHBondContact O-N 3.08Å; L279-I282 PolarHBondContact O-N 3.36Å; L279-L283 HydrophobicContact CD1-CD1 4.36Å; L279-L283 HydrophobicContact CD2-CD1 4.46Å; L279-L283 HydrophobicContact CG-CD1 3.85Å; L279-L283 WeakPolarHBondContact O-CB 3.42Å; L279-L283 WeakPolarHBondContact O-CD1 3.42Å; L279-L283 WeakPolarHBondContact O-CG 3.5Å; L279-L283 PolarHBondContact O-N 2.92Å
280L65.5Low61.1Low27 Ų2757.6 Ų57.614%0.14132%0.322CS..Hα-helixtrans-65.4-46.9177.9-169.585.5000112Q276 M278 I282 L283 E284 A305 Q309Q276-L280 WeakPolarHBondContact O-CB 3.33Å; Q276-L280 PolarHBondContact O-N 3.49Å; M278-L280 PolarHBondContact O-N 2.87Å; L280-I282 PolarHBondContact O-N 3Å; L280-L283 WeakPolarHBondContact O-CB 3.4Å; L280-L283 PolarHBondContact O-N 3.18Å; L280-L283 VanDerWaalsContact O-N 3.16Å; L280-E284 PolarHBondContact O-N 3Å; L280-A305 HydrophobicContact CD1-CB 3.68Å; L280-A305 WeakPolarHBondContact CD1-O 3.28Å; L280-A305 HydrophobicContact CD2-CB 3.55Å; L280-A305 VanDerWaalsContact CD2-O 3.24Å; L280-A305 WeakPolarHBondContact CD2-O 3.25Å; L280-A305 HydrophobicContact CG-CB 3.48Å; L280-A305 VanDerWaalsContact CG-CB 3.48Å; L280-Q309 HydrophobicContact CD2-CB 4.09Å
281A62.6Low60Low6 Ų663.6 Ų63.65%0.0535%0.349CS..Hα-helixtrans-62.5-32.5174.900000112.4F219 G277 M278 K285F219-A281 HydrophobicContact CE2-CB 4.02Å; F219-A281 HydrophobicContact CZ-CB 3.92Å; G277-A281 WeakPolarHBondContact O-CB 3.44Å; G277-A281 PolarHBondContact O-N 2.89Å; M278-A281 PolarHBondContact O-N 3.17Å; A281-K285 WeakPolarHBondContact O-CG 3.39Å; A281-K285 PolarHBondContact O-N 3.12Å
282I66.3Low59.2Low84 Ų8463.5 Ų63.543%0.43135%0.352SS..Hα-helixtrans-71.4-43.7172.9-67164.3000110.9M278 L279 L280 E284 K285 C286M278-I282 HydrophobicContact CG-CD1 3.97Å; M278-I282 WeakPolarHBondContact O-CD1 3.12Å; M278-I282 VanDerWaalsContact O-CG1 3.24Å; M278-I282 WeakPolarHBondContact O-CG1 3.27Å; M278-I282 PolarHBondContact O-N 3.38Å; L279-I282 PolarHBondContact O-N 3.36Å; L280-I282 PolarHBondContact O-N 3Å; I282-E284 VanDerWaalsContact C-N 3.28Å; I282-E284 PolarHBondContact O-N 3.47Å; I282-K285 CarbonylContact O-C 3.57Å; I282-K285 PolarHBondContact O-N 3.29Å; I282-C286 PolarHBondContact O-N 3.36Å; I282-C286 PolarHBondContact O-SG 3.27Å; I282-C286 VanDerWaalsContact O-SG 3.38Å
283L61.5Low58Low67 Ų6765.5 Ų65.535%0.35136%0.362SS..Hα-helixtrans-60.9-37.1177.2-82.9155.6000112.2L279 L280 C286 G287 A288 I289L279-L283 HydrophobicContact CD1-CD1 4.36Å; L279-L283 HydrophobicContact CD2-CD1 4.46Å; L279-L283 HydrophobicContact CG-CD1 3.85Å; L279-L283 WeakPolarHBondContact O-CB 3.42Å; L279-L283 WeakPolarHBondContact O-CD1 3.42Å; L279-L283 WeakPolarHBondContact O-CG 3.5Å; L279-L283 PolarHBondContact O-N 2.92Å; L280-L283 WeakPolarHBondContact O-CB 3.4Å; L280-L283 PolarHBondContact O-N 3.18Å; L280-L283 VanDerWaalsContact O-N 3.16Å; L283-C286 PolarHBondContact O-N 2.74Å; L283-G287 PolarHBondContact O-N 2.9Å; L283-A288 HydrophobicContact CD2-CB 3.89Å; L283-A288 PolarHBondContact O-N 3.47Å; L283-I289 HydrophobicContact CB-CD1 4.35Å
284E61.7Low56.7Low24 Ų2468.5 Ų68.511%0.11238%0.384CS..Hα-helixtrans-59-48.3170.1-172.9-176.8175.100110.6G217 L280 I282 C286 G287 E301G217-E284 VanDerWaalsContact CA-OE2 3.29Å; G217-E284 WeakPolarHBondContact CA-OE2 3.26Å; L280-E284 PolarHBondContact O-N 3Å; I282-E284 VanDerWaalsContact C-N 3.28Å; I282-E284 PolarHBondContact O-N 3.47Å; E284-C286 PolarHBondContact O-N 3.06Å; E284-G287 PolarHBondContact O-N 3.2Å; E284-G287 VanDerWaalsContact O-N 3.15Å; E284-E301 HydrophobicContact CG-CB 4.16Å
285K61.9Low55.4Low114 Ų11473.6 Ų73.650%0.49642%0.418SS..Hα-helixtrans-68.6-29.5178.3-71.7-65172.4-1470114.9G217 F219 A281 I282 G287G217-K285 WeakPolarHBondContact O-CE 3.28Å; G217-K285 PolarHBondContact O-NZ 3.43Å; F219-K285 HydrophobicContact CD2-CD 4.26Å; F219-K285 HydrophobicContact CD2-CG 4.04Å; F219-K285 HydrophobicContact CE2-CG 4.18Å; A281-K285 WeakPolarHBondContact O-CG 3.39Å; A281-K285 PolarHBondContact O-N 3.12Å; I282-K285 CarbonylContact O-C 3.57Å; I282-K285 PolarHBondContact O-N 3.29Å; K285-G287 PolarHBondContact O-N 2.98Å
286C60.1Low54.2Low97 Ų9772.9 Ų72.966%0.65543%0.425SS*.THydrogen-bonded Turntrans-74.9-2.3175.4-70.30000113I282 L283 E284 A288I282-C286 PolarHBondContact O-N 3.36Å; I282-C286 PolarHBondContact O-SG 3.27Å; I282-C286 VanDerWaalsContact O-SG 3.38Å; L283-C286 PolarHBondContact O-N 2.74Å; E284-C286 PolarHBondContact O-N 3.06Å; C286-A288 PolarHBondContact O-N 3.26Å
287G55.9Low53.5Low60 Ų6078.4 Ų78.462%0.61945%0.449SS*.THydrogen-bonded Turntrans66.218.9-178.600000113.1L283 E284 K285 I289L283-G287 PolarHBondContact O-N 2.9Å; E284-G287 PolarHBondContact O-N 3.2Å; E284-G287 VanDerWaalsContact O-N 3.15Å; K285-G287 PolarHBondContact O-N 2.98Å; G287-I289 PolarHBondContact O-N 3.47Å
288A49.3Very low52.5Low64 Ų6481.5 Ų81.553%0.52947%0.467SS..  trans-76.6-11.5179.200000112.3L283 C286L283-A288 HydrophobicContact CD2-CB 3.89Å; L283-A288 PolarHBondContact O-N 3.47Å; C286-A288 PolarHBondContact O-N 3.26Å
289I51.2Low51.9Low24 Ų2481.5 Ų81.512%0.12347%0.471CS..SBendtrans-105.9109.8178.3-52.8-179.6000107.9L283 G287 V304 A305L283-I289 HydrophobicContact CB-CD1 4.35Å; G287-I289 PolarHBondContact O-N 3.47Å; I289-V304 HydrophobicContact CG2-CB 4.2Å; I289-V304 HydrophobicContact CG2-CG1 3.8Å; I289-A305 HydrophobicContact CD1-CB 3.41Å; I289-A305 VanDerWaalsContact CD1-CB 3.41Å
290P46.7Very low51.3Low84 Ų8478.2 Ų78.255%0.54546%0.462SS..  trans-69136.3-175.823.6-30.1000112I292P290-I292 PolarHBondContact O-N 3.01Å
291Q44.4Very low50.9Low131 Ų13180 Ų8061%0.61247%0.469SS*.  trans-62.7121.7166.9-67.6-175.30.900109.6E301Q291-E301 VanDerWaalsContact CD-OE1 3.25Å; Q291-E301 HydrophobicContact CG-CG 3.88Å; Q291-E301 WeakPolarHBondContact CG-OE1 3.37Å; Q291-E301 PolarHBondContact NE2-OE1 2.77Å
292I44.9Very low50.7Low67 Ų6780.5 Ų80.534%0.34448%0.475SS..  trans-110.685.7174.9-61.8165.5000108F53 P290 S294F53-I292 HydrophobicContact CD2-CD1 4.09Å; F53-I292 HydrophobicContact CE1-CD1 4.14Å; F53-I292 HydrophobicContact CE2-CB 4.01Å; F53-I292 HydrophobicContact CE2-CD1 3.21Å; F53-I292 HydrophobicContact CE2-CG1 4.16Å; F53-I292 HydrophobicContact CE2-CG2 4.04Å; F53-I292 HydrophobicContact CZ-CB 4.3Å; F53-I292 HydrophobicContact CZ-CD1 3.25Å; F53-I292 HydrophobicContact CZ-CG1 4.26Å; P290-I292 PolarHBondContact O-N 3.01Å; I292-S294 PolarHBondContact O-N 3.24Å
293N37.2Very low50.7Low119 Ų11978.1 Ų78.164%0.63646%0.464SS*.EExtended strand (participates in β ladder)trans-76.894.2165.7-74.1-36.8000108.3
294S36.6Very low51.1Low73 Ų7375.6 Ų75.651%0.5145%0.452SS..EExtended strand (participates in β ladder)trans-96.5140.8166-67.60000109.3I292 N296 F297I292-S294 PolarHBondContact O-N 3.24Å; S294-N296 PolarHBondContact O-N 3.03Å; S294-F297 PolarHBondContact O-N 3.49Å
295T38.3Very low51.4Low144 Ų14474.5 Ų74.588%0.88345%0.447SS*.THydrogen-bonded Turntrans-58.16.5-168.844.60000117.4
296N40.5Very low51.8Low137 Ų13769.3 Ų69.373%0.73343%0.425SS*.THydrogen-bonded Turntrans-136.5-9.9173.5-70-69.9000114.7S294S294-N296 PolarHBondContact O-N 3.03Å
297F45.7Very low52.5Low145 Ų14564.8 Ų64.864%0.63640%0.395SS*.EExtended strand (participates in β ladder)trans-151.5122.8-178.5-66.5-79.9000110.6S294S294-F297 PolarHBondContact O-N 3.49Å
298S41.5Very low53.6Low85 Ų8566.2 Ų66.259%0.59438%0.382SS*.EExtended strand (participates in β ladder)trans-101.890.9173.6170.50000108.1
299V52.1Low55.1Low58 Ų5864.5 Ų64.535%0.35236%0.363SS..  trans-80.5123173.2-177.10000107.6T303 V304V299-T303 HydrophobicContact CG1-CG2 3.75Å; V299-V304 HydrophobicContact CG1-CG2 4.17Å
300G54.4Low56.5Low33 Ų3363.3 Ų63.334%0.3436%0.357SS..  trans-60.2149.6178.800000112.6G302 T303G300-G302 PolarHBondContact O-N 3.15Å; G300-T303 PolarHBondContact O-N 3.49Å
301E56.9Low58.4Low63 Ų6360.6 Ų60.629%0.29434%0.337SS..Hα-helixtrans-51-41.2178.2-65.6175.7168.600111.9E284 Q291 T303 V304 A305E284-E301 HydrophobicContact CG-CB 4.16Å; Q291-E301 VanDerWaalsContact CD-OE1 3.25Å; Q291-E301 HydrophobicContact CG-CG 3.88Å; Q291-E301 WeakPolarHBondContact CG-OE1 3.37Å; Q291-E301 PolarHBondContact NE2-OE1 2.77Å; E301-T303 PolarHBondContact O-N 3.38Å; E301-V304 PolarHBondContact O-N 3.21Å; E301-A305 PolarHBondContact O-N 3.4Å
302G58.7Low60.3Low17 Ų1757.9 Ų57.918%0.17533%0.325CS..Hα-helixtrans-63.1-32.7177.200000114.9G300 A305 A306G300-G302 PolarHBondContact O-N 3.15Å; G302-A305 PolarHBondContact O-N 3.33Å; G302-A306 VanDerWaalsContact O-CB 3.29Å; G302-A306 WeakPolarHBondContact O-CB 3.43Å; G302-A306 PolarHBondContact O-N 3.45Å
303T66.1Low62.2Low34 Ų3454.7 Ų54.721%0.20931%0.309CS..Hα-helixtrans-72.7-36.8-178.6-50.50000111.9V299 G300 E301 A305 G307V299-T303 HydrophobicContact CG1-CG2 3.75Å; G300-T303 PolarHBondContact O-N 3.49Å; E301-T303 PolarHBondContact O-N 3.38Å; T303-A305 VanDerWaalsContact C-N 3.33Å; T303-G307 PolarHBondContact O-N 3.42Å
304V68.6Low64.6Low15 Ų1549 Ų499%0.09128%0.279CS..Hα-helixtrans-63.9-45.1174.21700000110.4F53 I289 V299 E301 G307 Y308F53-V304 HydrophobicContact CE1-CB 4.2Å; F53-V304 HydrophobicContact CE1-CG1 3.63Å; F53-V304 HydrophobicContact CE1-CG2 3.58Å; F53-V304 HydrophobicContact CZ-CG1 4.31Å; F53-V304 HydrophobicContact CZ-CG2 3.53Å; I289-V304 HydrophobicContact CG2-CB 4.2Å; I289-V304 HydrophobicContact CG2-CG1 3.8Å; V299-V304 HydrophobicContact CG1-CG2 4.17Å; E301-V304 PolarHBondContact O-N 3.21Å; V304-G307 PolarHBondContact O-N 2.87Å; V304-Y308 HydrophobicContact CG1-CD2 4.17Å; V304-Y308 HydrophobicContact CG1-CE2 3.98Å; V304-Y308 WeakPolarHBondContact O-CD2 3.04Å; V304-Y308 PolarHBondContact O-N 3.42Å
305A68.4Low67Low0 Ų047.8 Ų47.80%027%0.266CS..Hα-helixtrans-61.5-50.4-179.800000110.2L280 I289 E301 G302 T303 G307 Y308 Q309L280-A305 HydrophobicContact CD1-CB 3.68Å; L280-A305 WeakPolarHBondContact CD1-O 3.28Å; L280-A305 HydrophobicContact CD2-CB 3.55Å; L280-A305 VanDerWaalsContact CD2-O 3.24Å; L280-A305 WeakPolarHBondContact CD2-O 3.25Å; L280-A305 HydrophobicContact CG-CB 3.48Å; L280-A305 VanDerWaalsContact CG-CB 3.48Å; I289-A305 HydrophobicContact CD1-CB 3.41Å; I289-A305 VanDerWaalsContact CD1-CB 3.41Å; E301-A305 PolarHBondContact O-N 3.4Å; G302-A305 PolarHBondContact O-N 3.33Å; T303-A305 VanDerWaalsContact C-N 3.33Å; A305-G307 PolarHBondContact O-N 3.14Å; A305-Y308 PolarHBondContact O-N 3.46Å; A305-Q309 PolarHBondContact O-N 2.82Å; A305-Q309 VanDerWaalsContact O-N 3.11Å
306A70.3Confident69.3Low6 Ų643.3 Ų43.35%0.0524%0.235CC..Hα-helixtrans-55.9-36.2175.300000112.5Y122 G302 Q309 N310Y122-A306 HydrophobicContact CE1-CB 4.39Å; Y122-A306 HydrophobicContact CE2-CB 3.63Å; Y122-A306 WeakPolarHBondContact OH-CB 3.31Å; G302-A306 VanDerWaalsContact O-CB 3.29Å; G302-A306 WeakPolarHBondContact O-CB 3.43Å; G302-A306 PolarHBondContact O-N 3.45Å; A306-Q309 PolarHBondContact O-N 3.1Å; A306-N310 PolarHBondContact O-N 3.25Å; A306-N310 PolarHBondContact O-ND2 2.88Å
307G75.8Confident71.6Confident1 Ų136.9 Ų36.91%0.0120%0.201CC..Hα-helixtrans-59.4-46.7173.600000114.8L113 T303 V304 A305 Q309 N310 F311L113-G307 VanDerWaalsContact CD2-O 3.29Å; L113-G307 WeakPolarHBondContact CD2-O 3.38Å; T303-G307 PolarHBondContact O-N 3.42Å; V304-G307 PolarHBondContact O-N 2.87Å; A305-G307 PolarHBondContact O-N 3.14Å; G307-Q309 VanDerWaalsContact C-N 3.31Å; G307-Q309 PolarHBondContact O-N 3.37Å; G307-N310 PolarHBondContact O-N 3.22Å; G307-F311 PolarHBondContact O-N 2.87Å
308Y78.1Confident73.7Confident90 Ų9032.1 Ų32.135%0.35318%0.18SC..Hα-helixtrans-64.8-38.7176.1-81.3-72.1000111.8F54 L55 V304 A305 F311 I312F54-Y308 HydrophobicContact CD1-CE1 4.35Å; L55-Y308 HydrophobicContact CD1-CD1 4Å; L55-Y308 HydrophobicContact CD1-CD2 3.59Å; L55-Y308 HydrophobicContact CD1-CE1 4.06Å; L55-Y308 HydrophobicContact CD1-CE2 3.66Å; L55-Y308 HydrophobicContact CD1-CG 3.76Å; L55-Y308 HydrophobicContact CD2-CD1 4Å; L55-Y308 HydrophobicContact CD2-CE1 4.17Å; L55-Y308 HydrophobicContact CD2-CG 4.43Å; L55-Y308 HydrophobicContact CG-CD1 4.09Å; L55-Y308 HydrophobicContact CG-CD2 4.47Å; L55-Y308 HydrophobicContact CG-CE1 3.9Å; L55-Y308 HydrophobicContact CG-CE2 4.3Å; L55-Y308 HydrophobicContact CG-CG 4.37Å; V304-Y308 HydrophobicContact CG1-CD2 4.17Å; V304-Y308 HydrophobicContact CG1-CE2 3.98Å; V304-Y308 WeakPolarHBondContact O-CD2 3.04Å; V304-Y308 PolarHBondContact O-N 3.42Å; A305-Y308 PolarHBondContact O-N 3.46Å; Y308-F311 PolarHBondContact O-N 2.88Å; Y308-I312 WeakPolarHBondContact O-CG1 3.36Å; Y308-I312 PolarHBondContact O-N 3.01Å
309Q80.6Confident75.9Confident28 Ų2834.2 Ų34.213%0.13118%0.179CC..Hα-helixtrans-60.9-48.1174.7178.4176.8-13.200111.4Q276 L280 A305 A306 G307 F311 I312 I313Q276-Q309 HydrophobicContact CB-CG 4.36Å; L280-Q309 HydrophobicContact CD2-CB 4.09Å; A305-Q309 PolarHBondContact O-N 2.82Å; A305-Q309 VanDerWaalsContact O-N 3.11Å; A306-Q309 PolarHBondContact O-N 3.1Å; G307-Q309 VanDerWaalsContact C-N 3.31Å; G307-Q309 PolarHBondContact O-N 3.37Å; Q309-F311 VanDerWaalsContact C-N 3.28Å; Q309-F311 PolarHBondContact O-N 3.04Å; Q309-I312 PolarHBondContact O-N 2.78Å; Q309-I313 HydrophobicContact CG-CD1 3.77Å; Q309-I313 HydrophobicContact CG-CG1 4.4Å; Q309-I313 VanDerWaalsContact O-CG1 3.25Å; Q309-I313 WeakPolarHBondContact O-CG1 3.41Å; Q309-I313 PolarHBondContact O-N 3.09Å
310N81.8Confident77.5Confident0 Ų032 Ų320%017%0.166CC..Hα-helixtrans-63.1-33.9178.3-73.3-30000112.8S112 L113 R129 A306 G307 C314S112-N310 WeakPolarHBondContact CB-ND2 3.4Å; S112-N310 PolarHBondContact OG-ND2 3.3Å; L113-N310 HydrophobicContact CD2-CB 4.04Å; L113-N310 HydrophobicContact CG-CB 4.06Å; R129-N310 PolarHBondContact NH1-OD1 2.86Å; A306-N310 PolarHBondContact O-N 3.25Å; A306-N310 PolarHBondContact O-ND2 2.88Å; G307-N310 PolarHBondContact O-N 3.22Å; N310-C314 PolarHBondContact O-N 3.16Å; N310-C314 PolarHBondContact O-SG 3.13Å
311F84.8Confident79.1Confident27 Ų2730.4 Ų30.412%0.11815%0.15CC..Hα-helixtrans-64.8-45.9173.3-179.8-99.9000112.5F54 L55 A60 L113 G307 Y308 Q309 I313 C314 I315F54-F311 HydrophobicContact CE1-CE1 4.24Å; F54-F311 HydrophobicContact CE1-CZ 4.27Å; L55-F311 HydrophobicContact CD2-CB 3.73Å; L55-F311 HydrophobicContact CD2-CG 4.14Å; A60-F311 HydrophobicContact CB-CE2 4.15Å; L113-F311 HydrophobicContact CD1-CB 4.25Å; L113-F311 HydrophobicContact CD1-CD2 4.39Å; L113-F311 HydrophobicContact CD2-CB 4.21Å; G307-F311 PolarHBondContact O-N 2.87Å; Y308-F311 PolarHBondContact O-N 2.88Å; Q309-F311 VanDerWaalsContact C-N 3.28Å; Q309-F311 PolarHBondContact O-N 3.04Å; F311-I313 VanDerWaalsContact C-N 3.35Å; F311-C314 WeakPolarHBondContact O-CB 3.35Å; F311-C314 PolarHBondContact O-N 3.15Å; F311-I315 HydrophobicContact CD1-CD1 4.34Å; F311-I315 HydrophobicContact CE1-CD1 3.72Å; F311-I315 HydrophobicContact CZ-CD1 3.92Å; F311-I315 PolarHBondContact O-N 3.44Å
312I84.6Confident80.6Confident73 Ų7330.1 Ų30.137%0.37415%0.152SC..Hα-helixtrans-62.5-44.7176.7-68.1167000110.2Y308 Q309 C314 I315 E316Y308-I312 WeakPolarHBondContact O-CG1 3.36Å; Y308-I312 PolarHBondContact O-N 3.01Å; Q309-I312 PolarHBondContact O-N 2.78Å; I312-C314 VanDerWaalsContact C-N 3.3Å; I312-C314 PolarHBondContact O-N 2.78Å; I312-I315 PolarHBondContact O-N 3.32Å; I312-E316 HydrophobicContact CG2-CG 4.12Å; I312-E316 WeakPolarHBondContact CG2-OE1 3.32Å; I312-E316 WeakPolarHBondContact O-CG 3.33Å; I312-E316 PolarHBondContact O-N 2.93Å
313I85.8Confident81.8Confident0 Ų031.3 Ų31.30%016%0.161CC..Hα-helixtrans-58.6-40.9178.1-69.4172.3000111.4Y105 S109 Q309 F311 I315 E316 M317Y105-I313 HydrophobicContact CD1-CG2 4.42Å; S109-I313 WeakPolarHBondContact OG-CG2 3.41Å; Q309-I313 HydrophobicContact CG-CD1 3.77Å; Q309-I313 HydrophobicContact CG-CG1 4.4Å; Q309-I313 VanDerWaalsContact O-CG1 3.25Å; Q309-I313 WeakPolarHBondContact O-CG1 3.41Å; Q309-I313 PolarHBondContact O-N 3.09Å; F311-I313 VanDerWaalsContact C-N 3.35Å; I313-I315 VanDerWaalsContact C-N 3.25Å; I313-I315 PolarHBondContact O-N 3.46Å; I313-E316 PolarHBondContact O-N 3.36Å; I313-M317 HydrophobicContact CG2-CE 4.08Å; I313-M317 HydrophobicContact CG2-CG 3.89Å; I313-M317 WeakPolarHBondContact O-CB 3.36Å; I313-M317 VanDerWaalsContact O-CG 3.22Å; I313-M317 WeakPolarHBondContact O-CG 3.27Å; I313-M317 PolarHBondContact O-N 3Å
314C87.5Confident82.6Confident0 Ų029.8 Ų29.80%015%0.151CC..Hα-helixtrans-55.8-40.5176-70.50000112.6V68 N310 F311 I312V68-C314 HydrophobicContact CG2-CB 3.71Å; N310-C314 PolarHBondContact O-N 3.16Å; N310-C314 PolarHBondContact O-SG 3.13Å; F311-C314 WeakPolarHBondContact O-CB 3.35Å; F311-C314 PolarHBondContact O-N 3.15Å; I312-C314 VanDerWaalsContact C-N 3.3Å; I312-C314 PolarHBondContact O-N 2.78Å
315I86.9Confident83.4Confident47 Ų4733.2 Ų33.224%0.24116%0.162CC..Hα-helixtrans-74.3-42.9178.6-62.3172.5000110.5F67 F311 I312 I313 M317 F318 F319F67-I315 HydrophobicContact CD2-CG1 4.09Å; F67-I315 HydrophobicContact CE2-CG1 4.39Å; F311-I315 HydrophobicContact CD1-CD1 4.34Å; F311-I315 HydrophobicContact CE1-CD1 3.72Å; F311-I315 HydrophobicContact CZ-CD1 3.92Å; F311-I315 PolarHBondContact O-N 3.44Å; I312-I315 PolarHBondContact O-N 3.32Å; I313-I315 VanDerWaalsContact C-N 3.25Å; I313-I315 PolarHBondContact O-N 3.46Å; I315-M317 PolarHBondContact O-N 2.86Å; I315-F318 WeakPolarHBondContact O-CB 3.07Å; I315-F318 PolarHBondContact O-N 3.39Å; I315-F319 HydrophobicContact CG2-CD2 4.3Å; I315-F319 HydrophobicContact CG2-CE2 3.85Å; I315-F319 WeakPolarHBondContact O-CD2 3.47Å
316E87.3Confident84.1Confident51 Ų5140.5 Ų40.524%0.23820%0.196CC..Hα-helixtrans-65.3-37.9-179.4-71.8-174.3170.200113.1Q276 I312 I313 F318 F319 A320Q276-E316 PolarHBondContact NE2-OE1 3.38Å; Q276-E316 PolarHBondContact NE2-OE2 2.99Å; I312-E316 HydrophobicContact CG2-CG 4.12Å; I312-E316 WeakPolarHBondContact CG2-OE1 3.32Å; I312-E316 WeakPolarHBondContact O-CG 3.33Å; I312-E316 PolarHBondContact O-N 2.93Å; I313-E316 PolarHBondContact O-N 3.36Å; E316-F318 PolarHBondContact O-N 3.47Å; E316-F319 PolarHBondContact O-N 3.35Å; E316-F319 VanDerWaalsContact O-N 3.11Å; E316-A320 WeakPolarHBondContact O-CB 3.21Å; E316-A320 PolarHBondContact O-N 2.9Å
317M88.2Confident84.6Confident2 Ų241.1 Ų41.11%0.0120%0.201CC..Hα-helixtrans-61.5-28.4177.4-73.4-53.6121.900112.5V102 Y105 A106 V269 I313 I315 A321V102-M317 HydrophobicContact CG1-CB 4.23Å; V102-M317 WeakPolarHBondContact CG1-O 3.37Å; V102-M317 HydrophobicContact CG2-SD 4.22Å; Y105-M317 HydrophobicContact CD1-CE 4.36Å; Y105-M317 HydrophobicContact CG-SD 4.44Å; A106-M317 HydrophobicContact CB-CB 3.87Å; A106-M317 HydrophobicContact CB-CG 4.17Å; V269-M317 HydrophobicContact CG1-CE 4.11Å; I313-M317 HydrophobicContact CG2-CE 4.08Å; I313-M317 HydrophobicContact CG2-CG 3.89Å; I313-M317 WeakPolarHBondContact O-CB 3.36Å; I313-M317 VanDerWaalsContact O-CG 3.22Å; I313-M317 WeakPolarHBondContact O-CG 3.27Å; I313-M317 PolarHBondContact O-N 3Å; I315-M317 PolarHBondContact O-N 2.86Å; M317-A321 WeakPolarHBondContact O-CB 3.29Å; M317-A321 PolarHBondContact O-N 3.25Å
318F89Confident84.8Confident44 Ų4441.3 Ų41.319%0.19320%0.201CC..Hα-helixtrans-66.3-49.2171.6168.8-101.5000112.2F67 T70 A71 I74 I315 E316 A320 A321 V322F67-F318 HydrophobicContact CB-CB 4.31Å; F67-F318 HydrophobicContact CD1-CB 3.97Å; F67-F318 AromaticContact CD1-CD1 3.87Å; F67-F318 HydrophobicContact CD1-CD1 3.87Å; F67-F318 HydrophobicContact CD1-CD2 4.37Å; F67-F318 HydrophobicContact CD1-CE1 4.49Å; F67-F318 AromaticContact CD1-CG 3.8Å; F67-F318 HydrophobicContact CD1-CG 3.8Å; F67-F318 HydrophobicContact CE1-CD1 4.08Å; F67-F318 HydrophobicContact CE1-CE1 4.39Å; F67-F318 HydrophobicContact CE1-CG 4.46Å; T70-F318 HydrophobicContact CG2-CD2 3.98Å; T70-F318 HydrophobicContact CG2-CE2 3.56Å; A71-F318 HydrophobicContact CB-CB 4.35Å; I74-F318 HydrophobicContact CD1-CD2 4.4Å; I74-F318 HydrophobicContact CD1-CE2 3.97Å; I315-F318 WeakPolarHBondContact O-CB 3.07Å; I315-F318 PolarHBondContact O-N 3.39Å; E316-F318 PolarHBondContact O-N 3.47Å; F318-A320 VanDerWaalsContact C-N 3.31Å; F318-A320 PolarHBondContact O-N 3.34Å; F318-A321 WeakPolarHBondContact O-CB 3.41Å; F318-A321 PolarHBondContact O-N 3.27Å; F318-V322 HydrophobicContact CE2-CG2 4.46Å; F318-V322 HydrophobicContact CZ-CG2 4.39Å; F318-V322 PolarHBondContact O-N 3.49Å
319F87.9Confident85Confident130 Ų13039.3 Ų39.357%0.5720%0.199SC*.Hα-helixtrans-64.6-38.9176.3-67.8-71.7000111.5I315 E316 A321 V322 A323I315-F319 HydrophobicContact CG2-CD2 4.3Å; I315-F319 HydrophobicContact CG2-CE2 3.85Å; I315-F319 WeakPolarHBondContact O-CD2 3.47Å; E316-F319 PolarHBondContact O-N 3.35Å; E316-F319 VanDerWaalsContact O-N 3.11Å; F319-A321 VanDerWaalsContact C-N 3.34Å; F319-A321 PolarHBondContact O-N 2.89Å; F319-V322 PolarHBondContact O-N 3.33Å; F319-A323 WeakPolarHBondContact O-CB 3.48Å; F319-A323 PolarHBondContact O-N 3.47Å
320A85.8Confident84.9Confident10 Ų1039.9 Ų39.98%0.08320%0.2CC..Hα-helixtrans-60.4-41.5173.800000111.6V102 V269 E316 F318 V322 A323 L324V102-A320 HydrophobicContact CG2-CB 4.15Å; V269-A320 HydrophobicContact CG2-CB 3.88Å; E316-A320 WeakPolarHBondContact O-CB 3.21Å; E316-A320 PolarHBondContact O-N 2.9Å; F318-A320 VanDerWaalsContact C-N 3.31Å; F318-A320 PolarHBondContact O-N 3.34Å; A320-V322 VanDerWaalsContact C-N 3.34Å; A320-V322 PolarHBondContact O-N 2.84Å; A320-A323 PolarHBondContact O-N 3.15Å; A320-L324 VanDerWaalsContact O-CB 3.27Å; A320-L324 WeakPolarHBondContact O-CB 3.47Å; A320-L324 WeakPolarHBondContact O-CG 3.16Å; A320-L324 PolarHBondContact O-N 2.68Å
321A88.3Confident84.8Confident0 Ų045.6 Ų45.60%023%0.225CC..Hα-helixtrans-57.8-44.9175.300000112.2A71 I74 T75 V102 M317 F318 F319 R325A71-A321 HydrophobicContact CB-CB 4.18Å; I74-A321 HydrophobicContact CB-CB 4.34Å; I74-A321 HydrophobicContact CG2-CB 4.08Å; T75-A321 HydrophobicContact CG2-CB 3.84Å; V102-A321 HydrophobicContact CG1-CB 4.06Å; M317-A321 WeakPolarHBondContact O-CB 3.29Å; M317-A321 PolarHBondContact O-N 3.25Å; F318-A321 WeakPolarHBondContact O-CB 3.41Å; F318-A321 PolarHBondContact O-N 3.27Å; F319-A321 VanDerWaalsContact C-N 3.34Å; F319-A321 PolarHBondContact O-N 2.89Å; A321-R325 WeakPolarHBondContact O-CB 3.36Å; A321-R325 PolarHBondContact O-N 3.26Å
322V87.6Confident84.7Confident57 Ų5747.8 Ų47.835%0.34524%0.24SC..Hα-helixtrans-68-40.7178.71780000111.2I74 F318 F319 A320 R325 H326I74-V322 HydrophobicContact CD1-CG2 4.09Å; F318-V322 HydrophobicContact CE2-CG2 4.46Å; F318-V322 HydrophobicContact CZ-CG2 4.39Å; F318-V322 PolarHBondContact O-N 3.49Å; F319-V322 PolarHBondContact O-N 3.33Å; A320-V322 VanDerWaalsContact C-N 3.34Å; A320-V322 PolarHBondContact O-N 2.84Å; V322-R325 WeakPolarHBondContact O-CB 3.41Å; V322-R325 PolarHBondContact O-N 3.47Å; V322-H326 PolarHBondContact O-N 2.94Å; V322-H326 PolarHBondContact O-ND1 2.75Å
323A84.7Confident84.4Confident43 Ų4344.7 Ų44.736%0.35522%0.224SC..Hα-helixtrans-66-45.5176.700000111.9M265 F319 A320 R325 H326 A327M265-A323 HydrophobicContact CG-CB 3.95Å; F319-A323 WeakPolarHBondContact O-CB 3.48Å; F319-A323 PolarHBondContact O-N 3.47Å; A320-A323 PolarHBondContact O-N 3.15Å; A323-R325 VanDerWaalsContact C-N 3.25Å; A323-R325 PolarHBondContact O-N 3.33Å; A323-H326 PolarHBondContact O-N 3.49Å; A323-H326 VanDerWaalsContact O-N 3.1Å; A323-A327 WeakPolarHBondContact O-CB 3.37Å; A323-A327 PolarHBondContact O-N 3.2Å
324L83.3Confident84Confident1 Ų147 Ų471%0.00524%0.235CC..Hα-helixtrans-59.7-36174.5-83.9159000112Q78 I98 I101 V102 M265 A320 F328Q78-L324 PolarHBondContact NE2-O 2.96Å; I98-L324 HydrophobicContact CG2-CD2 4.21Å; I101-L324 HydrophobicContact CG2-CD1 4.34Å; V102-L324 HydrophobicContact CB-CD1 4.46Å; V102-L324 HydrophobicContact CG2-CD1 3.23Å; M265-L324 HydrophobicContact CE-CD2 3.14Å; M265-L324 HydrophobicContact CE-CG 3.73Å; M265-L324 HydrophobicContact SD-CD1 4.31Å; M265-L324 HydrophobicContact SD-CD2 3.48Å; M265-L324 WeakPolarHBondContact SD-CD2 3.5Å; M265-L324 HydrophobicContact SD-CG 3.47Å; M265-L324 WeakPolarHBondContact SD-CG 3.33Å; A320-L324 VanDerWaalsContact O-CB 3.27Å; A320-L324 WeakPolarHBondContact O-CB 3.47Å; A320-L324 WeakPolarHBondContact O-CG 3.16Å; A320-L324 PolarHBondContact O-N 2.68Å; L324-F328 HydrophobicContact CD2-CD2 3.78Å; L324-F328 HydrophobicContact CD2-CE2 3.86Å; L324-F328 PolarHBondContact O-N 2.7Å
325R85.4Confident83.6Confident88 Ų8850.8 Ų50.833%0.33226%0.256SS..Hα-helixtrans-63.6-39.3174-175.4172.1177.5152-0.3113A321 V322 A323A321-R325 WeakPolarHBondContact O-CB 3.36Å; A321-R325 PolarHBondContact O-N 3.26Å; V322-R325 WeakPolarHBondContact O-CB 3.41Å; V322-R325 PolarHBondContact O-N 3.47Å; A323-R325 VanDerWaalsContact C-N 3.25Å; A323-R325 PolarHBondContact O-N 3.33Å
326H83.1Confident83.1Confident153 Ų15352 Ų5271%0.70826%0.259SS*.Hα-helixtrans-76.6-42.9176.3-82.376.2000112.2V322 A323V322-H326 PolarHBondContact O-N 2.94Å; V322-H326 PolarHBondContact O-ND1 2.75Å; A323-H326 PolarHBondContact O-N 3.49Å; A323-H326 VanDerWaalsContact O-N 3.1Å
327A80.3Confident82.3Confident18 Ų1854.2 Ų54.215%0.14927%0.265CS..Hα-helixtrans-65.4-42.9-178.700000111.9K262 M265 A323K262-A327 WeakPolarHBondContact CE-O 3.18Å; K262-A327 HydrophobicContact CG-CB 4.05Å; M265-A327 HydrophobicContact CE-CB 3.98Å; A323-A327 WeakPolarHBondContact O-CB 3.37Å; A323-A327 PolarHBondContact O-N 3.2Å
328F79.4Confident81.5Confident5 Ų559.1 Ų59.12%0.02229%0.291CS..THydrogen-bonded Turntrans-114.566.4-179.6-61.4-65.9000112Q78 H82 I95 I98 L99 L143 K262 M265 V266 L324Q78-F328 PolarHBondContact NE2-O 3.48Å; H82-F328 PolarHBondContact NE2-O 2.75Å; I95-F328 HydrophobicContact CD1-CD1 4.32Å; I95-F328 HydrophobicContact CG1-CD1 4.05Å; I95-F328 HydrophobicContact CG1-CE1 4.32Å; I95-F328 HydrophobicContact CG2-CB 3.86Å; I95-F328 HydrophobicContact CG2-CD1 4.18Å; I95-F328 HydrophobicContact CG2-CG 4.01Å; I98-F328 HydrophobicContact CD1-CZ 4.4Å; I98-F328 HydrophobicContact CG2-CE2 4.04Å; L99-F328 HydrophobicContact CD1-CB 4.18Å; L99-F328 HydrophobicContact CD1-CD2 3.96Å; L99-F328 HydrophobicContact CD1-CG 4.34Å; L143-F328 HydrophobicContact CD2-CE1 3.7Å; L143-F328 HydrophobicContact CD2-CZ 4.16Å; K262-F328 HydrophobicContact CB-CE1 4.38Å; K262-F328 HydrophobicContact CB-CZ 4.32Å; K262-F328 HydrophobicContact CD-CD1 4.31Å; K262-F328 HydrophobicContact CD-CE1 3.93Å; K262-F328 HydrophobicContact CG-CD1 4.46Å; K262-F328 HydrophobicContact CG-CE1 4.04Å; K262-F328 HydrophobicContact CG-CZ 4.36Å; M265-F328 HydrophobicContact CE-CD2 4.11Å; M265-F328 HydrophobicContact CE-CE2 3.56Å; M265-F328 HydrophobicContact CE-CZ 4.43Å; V266-F328 HydrophobicContact CG2-CE2 4.44Å; L324-F328 HydrophobicContact CD2-CD2 3.78Å; L324-F328 HydrophobicContact CD2-CE2 3.86Å; L324-F328 PolarHBondContact O-N 2.7Å
329T82.8Confident80.5Confident49 Ų4962.6 Ų62.630%0.30131%0.312SS..  trans-65.7133.5178.7-164.90000111.8K331 V332T329-K331 VanDerWaalsContact C-N 3.26Å; T329-K331 HydrophobicContact CG2-CB 4.48Å; T329-K331 PolarHBondContact O-N 3.49Å; T329-V332 HydrophobicContact CG2-CG2 3.74Å
330Y78.7Confident79.3Confident39 Ų3961.3 Ų61.315%0.15332%0.319CS..SBendtrans-75.4-16176.263.7-94.8000112.6M81 V332 Y333 M334M81-Y330 HydrophobicContact CB-CD1 3.89Å; M81-Y330 HydrophobicContact CB-CD2 4.09Å; M81-Y330 HydrophobicContact CB-CE1 4.38Å; M81-Y330 HydrophobicContact CB-CG 3.73Å; M81-Y330 HydrophobicContact CE-CD2 3.66Å; M81-Y330 HydrophobicContact CE-CE1 4.34Å; M81-Y330 HydrophobicContact CE-CE2 3.17Å; M81-Y330 HydrophobicContact CE-CG 4.41Å; M81-Y330 HydrophobicContact CG-CD1 4.35Å; M81-Y330 HydrophobicContact CG-CE1 4.34Å; M81-Y330 HydrophobicContact CG-CG 4.46Å; Y330-V332 VanDerWaalsContact C-N 3.29Å; Y330-V332 PolarHBondContact O-N 3.27Å; Y330-Y333 PolarHBondContact O-N 2.7Å; Y330-Y333 VanDerWaalsContact O-N 3.09Å; Y330-M334 PolarHBondContact O-N 3.15Å; Y330-M334 VanDerWaalsContact O-N 3.07Å
331K80.5Confident78.2Confident121 Ų12169.2 Ų69.253%0.52635%0.348SS..Hα-helixtrans-59.8-38.1-175.6-66.2-175.7179.3-178.60112.5T329 Y333 M334 D335T329-K331 VanDerWaalsContact C-N 3.26Å; T329-K331 HydrophobicContact CG2-CB 4.48Å; T329-K331 PolarHBondContact O-N 3.49Å; K331-Y333 PolarHBondContact O-N 3.14Å; K331-M334 WeakPolarHBondContact O-CB 3.3Å; K331-M334 PolarHBondContact O-N 3.39Å; K331-M334 VanDerWaalsContact O-N 3.1Å; K331-D335 PolarHBondContact O-N 3.05Å
332V80.8Confident76.6Confident72 Ų7271.3 Ų71.344%0.43637%0.369SS..Hα-helixtrans-58.1-36.1177.3177.80000111.7T329 Y330 K336T329-V332 HydrophobicContact CG2-CG2 3.74Å; Y330-V332 VanDerWaalsContact C-N 3.29Å; Y330-V332 PolarHBondContact O-N 3.27Å; V332-K336 WeakPolarHBondContact O-CG 3.43Å; V332-K336 PolarHBondContact O-N 3.48Å
333Y78.9Confident74.6Confident9 Ų973.8 Ų73.84%0.03539%0.389CS..Hα-helixtrans-84.1-28179.1-60.7-74000112.9H82 S87 E91 Q92 I95 Y330 K331 R337H82-Y333 AromaticContact CE1-CD2 3.82Å; H82-Y333 AromaticContact CE1-CE2 3.92Å; H82-Y333 AromaticContact ND1-CD2 3.83Å; S87-Y333 PolarHBondContact OG-O 3.35Å; E91-Y333 VanDerWaalsContact OE2-CE1 3.23Å; E91-Y333 WeakPolarHBondContact OE2-CE1 3.46Å; E91-Y333 PolarHBondContact OE2-OH 3.17Å; Q92-Y333 HydrophobicContact CG-CD1 3.77Å; Q92-Y333 HydrophobicContact CG-CD2 4.14Å; Q92-Y333 HydrophobicContact CG-CE1 3.67Å; Q92-Y333 HydrophobicContact CG-CE2 4.04Å; Q92-Y333 HydrophobicContact CG-CG 4.01Å; Q92-Y333 VanDerWaalsContact NE2-CG 3.25Å; I95-Y333 HydrophobicContact CD1-CE2 3.9Å; I95-Y333 WeakPolarHBondContact CD1-OH 3.43Å; Y330-Y333 PolarHBondContact O-N 2.7Å; Y330-Y333 VanDerWaalsContact O-N 3.09Å; K331-Y333 PolarHBondContact O-N 3.14Å; Y333-R337 PolarHBondContact O-N 2.97Å; Y333-R337 VanDerWaalsContact O-N 3.13Å
334M78.5Confident72.5Confident49 Ų4980.6 Ų80.624%0.24141%0.411CS..Hα-helixtrans-63.7-48.3171.6-172.6-174.78100110.9Y85 Y330 K331 R337 L338Y85-M334 HydrophobicContact CD1-CB 4.13Å; Y85-M334 HydrophobicContact CD1-CG 3.86Å; Y85-M334 HydrophobicContact CD2-CB 4.47Å; Y85-M334 HydrophobicContact CE1-CB 4.38Å; Y85-M334 HydrophobicContact CE1-CG 3.64Å; Y85-M334 HydrophobicContact CE1-SD 4.43Å; Y85-M334 HydrophobicContact CE2-CG 4.37Å; Y85-M334 HydrophobicContact CG-CB 4.19Å; Y85-M334 HydrophobicContact CG-CG 4.32Å; Y330-M334 PolarHBondContact O-N 3.15Å; Y330-M334 VanDerWaalsContact O-N 3.07Å; K331-M334 WeakPolarHBondContact O-CB 3.3Å; K331-M334 PolarHBondContact O-N 3.39Å; K331-M334 VanDerWaalsContact O-N 3.1Å; M334-R337 WeakPolarHBondContact O-CB 3.09Å; M334-R337 PolarHBondContact O-N 3.21Å; M334-R337 VanDerWaalsContact O-N 3.15Å; M334-L338 HydrophobicContact CE-CD1 4.4Å; M334-L338 HydrophobicContact CG-CD1 4.28Å; M334-L338 WeakPolarHBondContact O-CG 3.28Å; M334-L338 PolarHBondContact O-N 3Å
335D78.9Confident70.6Confident79 Ų7986.3 Ų86.342%0.42245%0.448SS..Hα-helixtrans-64.6-46.3-179.5-64.4-17.1000110.8K331 R337 L338 D339K331-D335 PolarHBondContact O-N 3.05Å; D335-R337 PolarHBondContact O-N 3.23Å; D335-R337 VanDerWaalsContact O-N 3.16Å; D335-L338 PolarHBondContact O-N 3.27Å; D335-D339 PolarHBondContact O-N 2.92Å
336K76Confident68.5Low73 Ų7389.3 Ų89.332%0.31747%0.469SS..Hα-helixtrans-53.3-37.8172.2-77.2179.6178.8-1760113.1V332 S340V332-K336 WeakPolarHBondContact O-CG 3.43Å; V332-K336 PolarHBondContact O-N 3.48Å; K336-S340 WeakPolarHBondContact O-CB 3.5Å; K336-S340 PolarHBondContact O-N 3.4Å; K336-S340 VanDerWaalsContact O-N 3.09Å; K336-S340 PolarHBondContact O-OG 2.91Å
337R71.4Confident66.6Low97 Ų9792.9 Ų92.937%0.36648%0.478SS..Hα-helixtrans-69.1-42.4177.3-163.5-176.6174.81774.1111.9R84 S87 Y333 M334 D335 S340 Y341R84-R337 PolarHBondContact O-NH1 3.42Å; S87-R337 WeakPolarHBondContact OG-CB 3.38Å; Y333-R337 PolarHBondContact O-N 2.97Å; Y333-R337 VanDerWaalsContact O-N 3.13Å; M334-R337 WeakPolarHBondContact O-CB 3.09Å; M334-R337 PolarHBondContact O-N 3.21Å; M334-R337 VanDerWaalsContact O-N 3.15Å; D335-R337 PolarHBondContact O-N 3.23Å; D335-R337 VanDerWaalsContact O-N 3.16Å; R337-S340 PolarHBondContact O-N 3.13Å; R337-Y341 PolarHBondContact O-N 3.33Å
338L71Confident64.5Low104 Ų10494.6 Ų94.655%0.54550%0.497SS..Hα-helixtrans-67.1-42.1-179.9-69.8170.6000110.7M334 D335 S340 Y341 G342M334-L338 HydrophobicContact CE-CD1 4.4Å; M334-L338 HydrophobicContact CG-CD1 4.28Å; M334-L338 WeakPolarHBondContact O-CG 3.28Å; M334-L338 PolarHBondContact O-N 3Å; D335-L338 PolarHBondContact O-N 3.27Å; L338-S340 VanDerWaalsContact C-N 3.35Å; L338-S340 PolarHBondContact O-N 3.28Å; L338-Y341 CarbonylContact O-C 3.45Å; L338-Y341 PolarHBondContact O-N 3.41Å; L338-Y341 VanDerWaalsContact O-N 3.12Å; L338-G342 PolarHBondContact O-N 3.31Å
339D68.3Low62.7Low118 Ų118102.9 Ų102.963%0.63154%0.536SS*.Hα-helixtrans-63.6-40.2175.1-67.1-23.1000111.6D335 Y341 G342D335-D339 PolarHBondContact O-N 2.92Å; D339-Y341 PolarHBondContact O-N 2.97Å; D339-G342 CarbonylContact O-C 3.58Å; D339-G342 PolarHBondContact O-N 3.11Å
340S62.3Low61Low103 Ų103111.8 Ų111.872%0.7257%0.566SS**Hα-helixtrans-65-24.5175-60.20000113.2K336 R337 L338K336-S340 WeakPolarHBondContact O-CB 3.5Å; K336-S340 PolarHBondContact O-N 3.4Å; K336-S340 VanDerWaalsContact O-N 3.09Å; K336-S340 PolarHBondContact O-OG 2.91Å; R337-S340 PolarHBondContact O-N 3.13Å; L338-S340 VanDerWaalsContact C-N 3.35Å; L338-S340 PolarHBondContact O-N 3.28Å
341Y62.8Low59.1Low175 Ų175113 Ų11369%0.68659%0.591SS**THydrogen-bonded Turntrans-92.7-3.7172.8-96.6-100.6000112.9R337 L338 D339R337-Y341 PolarHBondContact O-N 3.33Å; L338-Y341 CarbonylContact O-C 3.45Å; L338-Y341 PolarHBondContact O-N 3.41Å; L338-Y341 VanDerWaalsContact O-N 3.12Å; D339-Y341 PolarHBondContact O-N 2.97Å
342G55.2Low56.9Low44 Ų44119.2 Ų119.245%0.45461%0.611SS.*  trans-124.371.8-164.800000114.2L338 D339L338-G342 PolarHBondContact O-N 3.31Å; D339-G342 CarbonylContact O-C 3.58Å; D339-G342 PolarHBondContact O-N 3.11Å
343S44.9Very low55Low110 Ų110121 Ų12177%0.76963%0.625SS**SBendtrans-156101.5147.1-82.50000108.1
344F39.5Very low53.4Low186 Ų186124.2 Ų124.282%0.81665%0.653SS**  trans69.4107.5-176.8-63.6-85.2000117.5I346F344-I346 PolarHBondContact O-N 2.91Å
345P43.6Very low51.7Low121 Ų121127.4 Ų127.479%0.78668%0.678SS**  trans-82.186.3157.233.4-25.6000107.9Y347P345-Y347 PolarHBondContact O-N 2.96Å
346I40.9Very low50.2Low150 Ų150132.1 Ų132.177%0.76970%0.699SS**  trans-71.9113.5153.1-65.1-169.3000105F344 G348F344-I346 PolarHBondContact O-N 2.91Å; I346-G348 PolarHBondContact O-N 3.06Å
347Y44.3Very low49.3Very low229 Ų229134.7 Ų134.790%0.89871%0.71SS**  trans-58.482.9166.9-102.4-94.3000108.7P345 Q349P345-Y347 PolarHBondContact O-N 2.96Å; Y347-Q349 PolarHBondContact O-N 3Å
348G36.9Very low49.3Very low53 Ų53133.2 Ų133.255%0.54672%0.715SS.*  trans-84.2102.4165.400000108.1I346 Y350I346-G348 PolarHBondContact O-N 3.06Å; G348-Y350 PolarHBondContact O-N 3.47Å
349Q40.3Very low49.5Very low180 Ų180131.3 Ų131.384%0.84171%0.705SS**SBendtrans-52.3115.9165.9-167.9167-3.800108.2Y347Y347-Q349 PolarHBondContact O-N 3Å
350Y46.9Very low49.8Very low236 Ų236129.4 Ų129.493%0.92570%0.701SS**  trans80.775.7-166.9-67-94.1000116.5G348G348-Y350 PolarHBondContact O-N 3.47Å
351G39.8Very low50.4Low65 Ų65126.7 Ų126.767%0.6768%0.682SS**  trans-127.3101.2162.800000110.2C353G351-C353 PolarHBondContact O-N 3.23Å; G351-C353 VanDerWaalsContact O-N 3.12Å
352R34.7Very low51Low251 Ų251118.8 Ų118.895%0.94765%0.652SS**PPolyproline II helixtrans-48.8116.5175.7-82.4172.7163.8164.4-5.7110.1A354R352-A354 PolarHBondContact O-N 3.5Å; R352-A354 VanDerWaalsContact O-N 3.13Å
353C40.6Very low52.1Low110 Ų110119.4 Ų119.474%0.74364%0.644SS**PPolyproline II helixtrans-51.8121.8152.7-76.80000106.4G351G351-C353 PolarHBondContact O-N 3.23Å; G351-C353 VanDerWaalsContact O-N 3.12Å
354A44.3Very low53.8Low75 Ų75122.4 Ų122.462%0.6264%0.644SS**PPolyproline II helixtrans-46.3129.9167.700000107.3R352 M356R352-A354 PolarHBondContact O-N 3.5Å; R352-A354 VanDerWaalsContact O-N 3.13Å; A354-M356 PolarHBondContact O-N 2.89Å; A354-M356 VanDerWaalsContact O-N 3.11Å
355P44.3Very low55.5Low117 Ų117117.9 Ų117.976%0.7663%0.625SS**PPolyproline II helixtrans-54.5129.1-175.922.9-31.5000106.6K357P355-K357 PolarHBondContact O-N 3.38Å
356M45.7Very low56.8Low177 Ų177112.1 Ų112.187%0.87259%0.588SS**  trans-56.697169-74.6-175.669.900106A354 S358A354-M356 PolarHBondContact O-N 2.89Å; A354-M356 VanDerWaalsContact O-N 3.11Å; M356-S358 PolarHBondContact O-N 3.04Å; M356-S358 VanDerWaalsContact O-N 3.07Å
357K58.4Low58.5Low127 Ų127107.8 Ų107.855%0.55257%0.565SS**  trans-50.1122.9162.9-90.2-171.7171.7-170.50104P355 I359 E365P355-K357 PolarHBondContact O-N 3.38Å; K357-I359 PolarHBondContact O-N 2.81Å; K357-E365 IonicContact NZ-OE1 3.66Å; K357-E365 IonicContact NZ-OE2 3.04Å; K357-E365 PolarHBondContact NZ-OE2 2.74Å
358S71.6Confident60.2Low66 Ų66101 Ų10146%0.46254%0.544SS..  trans-51.8137.8-178.5177.60000108.3M356 S360 S361 S362M356-S358 PolarHBondContact O-N 3.04Å; M356-S358 VanDerWaalsContact O-N 3.07Å; S358-S360 PolarHBondContact O-N 2.98Å; S358-S360 PolarHBondContact OG-N 2.97Å; S358-S360 PolarHBondContact OG-OG 3.4Å; S358-S361 PolarHBondContact N-OG 2.88Å; S358-S361 VanDerWaalsContact N-OG 3.14Å; S358-S361 WeakPolarHBondContact O-CA 3.09Å; S358-S361 PolarHBondContact O-N 3.12Å; S358-S361 PolarHBondContact O-OG 3.18Å; S358-S362 PolarHBondContact O-N 3.49Å
359I73.5Confident62.2Low64 Ų64101.4 Ų101.433%0.32854%0.537SS..Hα-helixtrans-52.2-32.2176.8-65.4171.8000110.1Y80 L83 K357 S362 L363Y80-I359 HydrophobicContact CD2-CD1 4.45Å; Y80-I359 HydrophobicContact CE2-CD1 3.86Å; L83-I359 HydrophobicContact CB-CG2 4.06Å; L83-I359 HydrophobicContact CD1-CG2 3.84Å; K357-I359 PolarHBondContact O-N 2.81Å; I359-S362 PolarHBondContact O-N 3.27Å; I359-L363 WeakPolarHBondContact O-CB 3.43Å; I359-L363 PolarHBondContact O-N 3.05Å
360S76.3Confident64Low79 Ų7994.1 Ų94.155%0.55251%0.511SS*.Hα-helixtrans-65.7-38.417363.70000114.1S358 L363 K364S358-S360 PolarHBondContact O-N 2.98Å; S358-S360 PolarHBondContact OG-N 2.97Å; S358-S360 PolarHBondContact OG-OG 3.4Å; S360-L363 PolarHBondContact O-N 3Å; S360-K364 WeakPolarHBondContact O-CB 3.43Å; S360-K364 PolarHBondContact O-N 3.28Å
361S74.1Confident65.5Low45 Ų4584.9 Ų84.932%0.31548%0.477SS..Hα-helixtrans-68.9-41.1175.360.10000111.1S358 L363 K364 E365S358-S361 PolarHBondContact N-OG 2.88Å; S358-S361 VanDerWaalsContact N-OG 3.14Å; S358-S361 WeakPolarHBondContact O-CA 3.09Å; S358-S361 PolarHBondContact O-N 3.12Å; S358-S361 PolarHBondContact O-OG 3.18Å; S361-L363 VanDerWaalsContact C-N 3.33Å; S361-L363 PolarHBondContact O-N 3.45Å; S361-K364 PolarHBondContact O-N 3.07Å; S361-E365 VanDerWaalsContact O-CB 3.26Å; S361-E365 WeakPolarHBondContact O-CB 3.43Å; S361-E365 PolarHBondContact O-N 3.14Å
362S75.8Confident67.4Low9 Ų983.6 Ų83.66%0.06345%0.454CS..Hα-helixtrans-64.1-38.9175.3-56.70000111.6S358 I359 T366S358-S362 PolarHBondContact O-N 3.49Å; I359-S362 PolarHBondContact O-N 3.27Å; S362-T366 WeakPolarHBondContact O-CB 3.34Å; S362-T366 PolarHBondContact O-N 3.44Å; S362-T366 PolarHBondContact O-OG1 2.98Å
363L78.4Confident69.6Low57 Ų5775.3 Ų75.330%0.29843%0.431SS..Hα-helixtrans-66.6-44.2174.9-17964.8000112L83 F100 I359 S360 S361 T366 M367L83-L363 HydrophobicContact CD1-CB 4.23Å; L83-L363 HydrophobicContact CD1-CD1 4.21Å; F100-L363 HydrophobicContact CE2-CD1 3.68Å; F100-L363 HydrophobicContact CZ-CD1 3.7Å; I359-L363 WeakPolarHBondContact O-CB 3.43Å; I359-L363 PolarHBondContact O-N 3.05Å; S360-L363 PolarHBondContact O-N 3Å; S361-L363 VanDerWaalsContact C-N 3.33Å; S361-L363 PolarHBondContact O-N 3.45Å; L363-T366 WeakPolarHBondContact O-CB 3.41Å; L363-T366 PolarHBondContact O-N 3.05Å; L363-M367 HydrophobicContact CD1-CG 3.92Å; L363-M367 HydrophobicContact CG-CG 4.34Å; L363-M367 WeakPolarHBondContact O-CB 3.32Å; L363-M367 VanDerWaalsContact O-CG 3.29Å; L363-M367 WeakPolarHBondContact O-CG 3.29Å; L363-M367 PolarHBondContact O-N 3.33Å
364K80.1Confident71.4Confident173 Ų17376.7 Ų76.775%0.75243%0.427SS*.Hα-helixtrans-62.5-45.5177.6-176.6-178.9178.9-176.10111.6S360 S361 T366 M367 N368S360-K364 WeakPolarHBondContact O-CB 3.43Å; S360-K364 PolarHBondContact O-N 3.28Å; S361-K364 PolarHBondContact O-N 3.07Å; K364-T366 VanDerWaalsContact C-N 3.29Å; K364-T366 PolarHBondContact O-N 2.76Å; K364-M367 PolarHBondContact O-N 2.9Å; K364-N368 PolarHBondContact O-N 2.77Å
365E74.6Confident72.9Confident92 Ų9274.9 Ų74.943%0.4341%0.407SS..Hα-helixtrans-61.2-42.3175.5-168.6171.9178.700110.2R93 K357 S361 M367R93-E365 PolarHBondContact NE-O 3.32Å; R93-E365 VanDerWaalsContact NE-O 3.14Å; R93-E365 PolarHBondContact NH2-O 2.89Å; K357-E365 IonicContact NZ-OE1 3.66Å; K357-E365 IonicContact NZ-OE2 3.04Å; K357-E365 PolarHBondContact NZ-OE2 2.74Å; S361-E365 VanDerWaalsContact O-CB 3.26Å; S361-E365 WeakPolarHBondContact O-CB 3.43Å; S361-E365 PolarHBondContact O-N 3.14Å; E365-M367 PolarHBondContact O-N 2.78Å
366T72.1Confident74.4Confident0 Ų070.1 Ų70.10%038%0.378CS..Hα-helixtrans-64.3-41.1177.2-65.30000112.6Y86 R93 V96 R97 S362 L363 K364 N368Y86-T366 PolarHBondContact OH-OG1 3.47Å; R93-T366 HydrophobicContact CB-CG2 4.33Å; R93-T366 HydrophobicContact CG-CG2 4.07Å; R93-T366 WeakPolarHBondContact O-CG2 3.28Å; V96-T366 HydrophobicContact CB-CG2 3.73Å; V96-T366 HydrophobicContact CG1-CG2 3.61Å; R97-T366 HydrophobicContact CG-CG2 4.42Å; R97-T366 PolarHBondContact NE-O 2.79Å; R97-T366 PolarHBondContact NH2-O 3.01Å; S362-T366 WeakPolarHBondContact O-CB 3.34Å; S362-T366 PolarHBondContact O-N 3.44Å; S362-T366 PolarHBondContact O-OG1 2.98Å; L363-T366 WeakPolarHBondContact O-CB 3.41Å; L363-T366 PolarHBondContact O-N 3.05Å; K364-T366 VanDerWaalsContact C-N 3.29Å; K364-T366 PolarHBondContact O-N 2.76Å; T366-N368 PolarHBondContact O-N 2.91Å
367M76.9Confident76.1Confident58 Ų5867 Ų6729%0.28636%0.363SS..Hα-helixtrans-84.3-5.2-174.1-68.3-89.270.900114.7R97 F100 F135 L363 K364 E365 P369R97-M367 HydrophobicContact CB-CE 4.1Å; R97-M367 HydrophobicContact CG-CE 3.39Å; F100-M367 HydrophobicContact CD2-CE 3.83Å; F100-M367 HydrophobicContact CD2-SD 3.59Å; F100-M367 VanDerWaalsContact CD2-SD 3.59Å; F100-M367 HydrophobicContact CE2-CE 4.26Å; F100-M367 HydrophobicContact CE2-CG 4.39Å; F100-M367 HydrophobicContact CE2-SD 3.59Å; F100-M367 VanDerWaalsContact CE2-SD 3.59Å; F100-M367 HydrophobicContact CG-SD 4.23Å; F100-M367 HydrophobicContact CZ-SD 4.23Å; F135-M367 HydrophobicContact CE1-CE 4.41Å; L363-M367 HydrophobicContact CD1-CG 3.92Å; L363-M367 HydrophobicContact CG-CG 4.34Å; L363-M367 WeakPolarHBondContact O-CB 3.32Å; L363-M367 VanDerWaalsContact O-CG 3.29Å; L363-M367 WeakPolarHBondContact O-CG 3.29Å; L363-M367 PolarHBondContact O-N 3.33Å; K364-M367 PolarHBondContact O-N 2.9Å; E365-M367 PolarHBondContact O-N 2.78Å; M367-P369 WeakPolarHBondContact O-CD 3.34Å
368N79.6Confident77Confident86 Ų8664.1 Ų64.146%0.4635%0.352SS..  trans-66.6119.6-179.7-176.3-0.5000111.1R93 R97 K364 T366 G370R93-N368 PolarHBondContact NH2-O 3.32Å; R93-N368 VanDerWaalsContact NH2-O 3.13Å; R97-N368 PolarHBondContact NH2-O 3.36Å; K364-N368 PolarHBondContact O-N 2.77Å; T366-N368 PolarHBondContact O-N 2.91Å; N368-G370 PolarHBondContact O-N 3.13Å; N368-G370 PolarHBondContact OD1-N 2.96Å
369P78.8Confident77Confident63 Ų6361.5 Ų61.541%0.40933%0.332SS..THydrogen-bonded Turntrans-75.4-0.5178.432.4-36.7000113.9F135 M367 D371 M372 V373F135-P369 HydrophobicContact CE2-CB 4.36Å; M367-P369 WeakPolarHBondContact O-CD 3.34Å; P369-D371 PolarHBondContact O-N 3.3Å; P369-D371 VanDerWaalsContact O-N 3.13Å; P369-M372 WeakPolarHBondContact O-CB 3.45Å; P369-M372 PolarHBondContact O-N 2.79Å; P369-V373 PolarHBondContact O-N 3.04Å
370G77.2Confident77.1Confident27 Ų2763.7 Ų63.728%0.27834%0.34SS..Hα-helixtrans-50.7-37.2-176.400000114.7N368 M372 V373 Q374N368-G370 PolarHBondContact O-N 3.13Å; N368-G370 PolarHBondContact OD1-N 2.96Å; G370-M372 VanDerWaalsContact C-N 3.31Å; G370-M372 PolarHBondContact O-N 3.35Å; G370-V373 PolarHBondContact O-N 2.94Å; G370-Q374 WeakPolarHBondContact O-CB 3.26Å; G370-Q374 PolarHBondContact O-N 3.39Å
371D78.3Confident77Confident41 Ų4161.6 Ų61.622%0.21933%0.325CS..Hα-helixtrans-65.2-37.1179.9-23.6-54.5000111.7R93 R97 P369 V373 Q374 D375R93-D371 IonicContact CZ-OD1 2.96Å; R93-D371 IonicContact CZ-OD2 3Å; R93-D371 IonicContact NE-OD2 2.75Å; R93-D371 PolarHBondContact NE-OD2 3.12Å; R93-D371 IonicContact NH1-OD1 2.85Å; R93-D371 PolarHBondContact NH1-OD1 3.32Å; R93-D371 IonicContact NH1-OD2 2.78Å; R93-D371 PolarHBondContact NH1-OD2 3.05Å; R93-D371 IonicContact NH2-OD1 2.98Å; R93-D371 PolarHBondContact NH2-OD1 3.32Å; R93-D371 IonicContact NH2-OD2 3.16Å; R93-D371 PolarHBondContact NH2-OD2 3.04Å; R97-D371 IonicContact CZ-OD2 2.89Å; R97-D371 IonicContact NH1-OD2 2.79Å; R97-D371 PolarHBondContact NH1-OD2 2.82Å; R97-D371 IonicContact NH2-OD2 3.44Å; R97-D371 PolarHBondContact NH2-OD2 3.31Å; P369-D371 PolarHBondContact O-N 3.3Å; P369-D371 VanDerWaalsContact O-N 3.13Å; D371-V373 VanDerWaalsContact C-N 3.32Å; D371-V373 PolarHBondContact O-N 3.46Å; D371-Q374 PolarHBondContact O-N 3.47Å; D371-D375 VanDerWaalsContact O-CB 3.32Å; D371-D375 WeakPolarHBondContact O-CB 3.39Å; D371-D375 PolarHBondContact O-N 3.43Å
372M79.7Confident76.1Confident38 Ų3864.3 Ų64.319%0.18734%0.341CS..Hα-helixtrans-64-40.9177.9-175.6-177.369.800111.1F135 Y138 L192 C195 P369 G370 D375 A376F135-M372 HydrophobicContact CD2-CE 4.43Å; F135-M372 HydrophobicContact CD2-SD 3.94Å; Y138-M372 HydrophobicContact CD1-CB 3.97Å; Y138-M372 HydrophobicContact CD1-CG 3.84Å; Y138-M372 HydrophobicContact CD1-SD 4.1Å; Y138-M372 HydrophobicContact CD2-CG 4.02Å; Y138-M372 HydrophobicContact CE1-CB 3.58Å; Y138-M372 HydrophobicContact CE1-CG 3.9Å; Y138-M372 HydrophobicContact CE2-CB 4.32Å; Y138-M372 HydrophobicContact CE2-CG 4.06Å; Y138-M372 HydrophobicContact CG-CG 3.92Å; Y138-M372 HydrophobicContact CG-SD 4.16Å; Y138-M372 WeakPolarHBondContact OH-CA 3.21Å; L192-M372 HydrophobicContact CD2-CG 4.29Å; C195-M372 HydrophobicContact CB-SD 4.08Å; P369-M372 WeakPolarHBondContact O-CB 3.45Å; P369-M372 PolarHBondContact O-N 2.79Å; G370-M372 VanDerWaalsContact C-N 3.31Å; G370-M372 PolarHBondContact O-N 3.35Å; M372-D375 PolarHBondContact O-N 2.92Å; M372-A376 WeakPolarHBondContact O-CB 3.37Å; M372-A376 PolarHBondContact O-N 3.02Å
373V80.8Confident75.1Confident78 Ų7866.4 Ų66.447%0.47336%0.36SS..Hα-helixtrans-68-43.2177.7178.50000110.3P369 G370 D371 D375 A376 I377P369-V373 PolarHBondContact O-N 3.04Å; G370-V373 PolarHBondContact O-N 2.94Å; D371-V373 VanDerWaalsContact C-N 3.32Å; D371-V373 PolarHBondContact O-N 3.46Å; V373-D375 VanDerWaalsContact C-N 3.35Å; V373-A376 PolarHBondContact O-N 3.38Å; V373-I377 HydrophobicContact CG1-CD1 3.9Å; V373-I377 HydrophobicContact CG1-CG1 4.49Å; V373-I377 VanDerWaalsContact O-CG1 3.29Å; V373-I377 WeakPolarHBondContact O-CG1 3.29Å; V373-I377 PolarHBondContact O-N 2.96Å
374Q79.6Confident73.9Confident138 Ų13866.4 Ų66.465%0.64536%0.356SS*.Hα-helixtrans-62.9-42.3176.8-170.1171.6-1.900111.5G370 D371 I377 H378G370-Q374 WeakPolarHBondContact O-CB 3.26Å; G370-Q374 PolarHBondContact O-N 3.39Å; D371-Q374 PolarHBondContact O-N 3.47Å; Q374-I377 PolarHBondContact O-N 2.89Å; Q374-H378 WeakPolarHBondContact O-CB 3.25Å; Q374-H378 PolarHBondContact O-N 3.36Å
375D75.8Confident72.7Confident37 Ų3764.2 Ų64.220%0.19835%0.348CS..Hα-helixtrans-65.3-38.5174.6-98.9-13.4000112.3Y138 K188 L192 D371 M372 V373 H378 N379Y138-D375 HydrophobicContact CE2-CB 4.34Å; Y138-D375 PolarHBondContact OH-OD2 2.85Å; Y138-D375 VanDerWaalsContact OH-OD2 3.06Å; K188-D375 VanDerWaalsContact CE-CG 3.41Å; K188-D375 WeakPolarHBondContact CE-OD2 3.45Å; K188-D375 IonicContact NZ-OD1 3.21Å; K188-D375 PolarHBondContact NZ-OD1 3.3Å; K188-D375 IonicContact NZ-OD2 2.91Å; K188-D375 PolarHBondContact NZ-OD2 2.9Å; L192-D375 HydrophobicContact CD1-CB 4.48Å; D371-D375 VanDerWaalsContact O-CB 3.32Å; D371-D375 WeakPolarHBondContact O-CB 3.39Å; D371-D375 PolarHBondContact O-N 3.43Å; M372-D375 PolarHBondContact O-N 2.92Å; V373-D375 VanDerWaalsContact C-N 3.35Å; D375-H378 PolarHBondContact O-N 3.33Å; D375-N379 WeakPolarHBondContact O-CB 3Å; D375-N379 PolarHBondContact O-N 3.16Å; D375-N379 PolarHBondContact O-ND2 3.27Å
376A76.4Confident71.5Confident18 Ų1865.9 Ų65.915%0.14936%0.356CS..Hα-helixtrans-62.6-49.2173.900000110.9L192 M372 V373 H378 N379 F380L192-A376 HydrophobicContact CD2-CB 4.28Å; M372-A376 WeakPolarHBondContact O-CB 3.37Å; M372-A376 PolarHBondContact O-N 3.02Å; V373-A376 PolarHBondContact O-N 3.38Å; A376-H378 VanDerWaalsContact C-N 3.33Å; A376-H378 PolarHBondContact O-N 2.76Å; A376-N379 PolarHBondContact O-N 3.25Å; A376-F380 WeakPolarHBondContact O-CB 3.42Å; A376-F380 VanDerWaalsContact O-CD2 3.25Å; A376-F380 WeakPolarHBondContact O-CD2 3.44Å; A376-F380 PolarHBondContact O-N 2.89Å
377I80.6Confident70.5Confident111 Ų11173.7 Ų73.757%0.56939%0.387SS*.Hα-helixtrans-60-46.6177.4-67.4166.2000109.7V373 Q374 N379 F380 S381V373-I377 HydrophobicContact CG1-CD1 3.9Å; V373-I377 HydrophobicContact CG1-CG1 4.49Å; V373-I377 VanDerWaalsContact O-CG1 3.29Å; V373-I377 WeakPolarHBondContact O-CG1 3.29Å; V373-I377 PolarHBondContact O-N 2.96Å; Q374-I377 PolarHBondContact O-N 2.89Å; I377-N379 PolarHBondContact O-N 2.69Å; I377-F380 PolarHBondContact O-N 3.19Å; I377-S381 WeakPolarHBondContact O-CA 3.47Å; I377-S381 WeakPolarHBondContact O-CB 3.32Å; I377-S381 PolarHBondContact O-N 3.13Å; I377-S381 PolarHBondContact O-OG 2.86Å
378H77Confident69.3Low67 Ų6772.4 Ų72.431%0.3138%0.382SS..Hα-helixtrans-60.6-47.9-179.8-178.1-97.1000112.3Q374 D375 A376 S381 Y384Q374-H378 WeakPolarHBondContact O-CB 3.25Å; Q374-H378 PolarHBondContact O-N 3.36Å; D375-H378 PolarHBondContact O-N 3.33Å; A376-H378 VanDerWaalsContact C-N 3.33Å; A376-H378 PolarHBondContact O-N 2.76Å; H378-S381 PolarHBondContact O-OG 3.49Å; H378-Y384 AromaticContact CE1-CD2 3.91Å; H378-Y384 AromaticContact CE1-CE1 3.74Å; H378-Y384 AromaticContact CE1-CE2 3.44Å; H378-Y384 VanDerWaalsContact CE1-CE2 3.44Å; H378-Y384 WeakPolarHBondContact CE1-CE2 3.37Å; H378-Y384 AromaticContact CE1-CZ 3.35Å; H378-Y384 AromaticContact NE2-CD2 3.49Å; H378-Y384 WeakPolarHBondContact NE2-CD2 3.34Å; H378-Y384 AromaticContact NE2-CE2 3.17Å; H378-Y384 WeakPolarHBondContact NE2-CE2 3.49Å; H378-Y384 AromaticContact NE2-CZ 3.63Å
379N71.5Confident67.8Low11 Ų1174.5 Ų74.56%0.05939%0.389CS..Hα-helixtrans-76.5-22.3-175.7-76.4-75.1000114.7K188 Q189 L192 D375 A376 I377K188-N379 VanDerWaalsContact CE-ND2 3.29Å; K188-N379 WeakPolarHBondContact CE-ND2 3.3Å; Q189-N379 HydrophobicContact CG-CB 4.18Å; Q189-N379 PolarHBondContact NE2-O 3.33Å; L192-N379 HydrophobicContact CD1-CB 3.97Å; D375-N379 WeakPolarHBondContact O-CB 3Å; D375-N379 PolarHBondContact O-N 3.16Å; D375-N379 PolarHBondContact O-ND2 3.27Å; A376-N379 PolarHBondContact O-N 3.25Å; I377-N379 PolarHBondContact O-N 2.69Å
380F76.4Confident66.1Low110 Ų11077.1 Ų77.148%0.48240%0.396SS..Hα-helixtrans-105.8-6.4176.8-67.4-69.4000113.6Q189 L192 Q193 A376 I377Q189-F380 HydrophobicContact CB-CZ 4.47Å; L192-F380 HydrophobicContact CB-CE2 3.87Å; L192-F380 HydrophobicContact CB-CZ 4.46Å; Q193-F380 HydrophobicContact CB-CZ 4.47Å; A376-F380 WeakPolarHBondContact O-CB 3.42Å; A376-F380 VanDerWaalsContact O-CD2 3.25Å; A376-F380 WeakPolarHBondContact O-CD2 3.44Å; A376-F380 PolarHBondContact O-N 2.89Å; I377-F380 PolarHBondContact O-N 3.19Å
381S73.3Confident64.3Low34 Ų3478.8 Ų78.824%0.23840%0.403CS..  trans-69.2132.9179.365.80000111.9I377 H378 A383 Y384I377-S381 WeakPolarHBondContact O-CA 3.47Å; I377-S381 WeakPolarHBondContact O-CB 3.32Å; I377-S381 PolarHBondContact O-N 3.13Å; I377-S381 PolarHBondContact O-OG 2.86Å; H378-S381 PolarHBondContact O-OG 3.49Å; S381-A383 VanDerWaalsContact C-N 3.26Å; S381-A383 PolarHBondContact O-N 2.69Å; S381-Y384 PolarHBondContact O-N 3.11Å
382P55.6Low62.5Low102 Ų10281.5 Ų81.566%0.66242%0.422SS*.THydrogen-bonded Turntrans-66.7-25.1178.321.1-28.6000113.3Y384 Q385P382-Y384 PolarHBondContact O-N 2.82Å; P382-Q385 WeakPolarHBondContact O-CB 3.42Å; P382-Q385 PolarHBondContact O-N 3.32Å
383A55.3Low60.7Low54 Ų5486.5 Ų86.545%0.44645%0.448SS..Hα-helixtrans-62.7-26.4178.200000113.3S381 Q386S381-A383 VanDerWaalsContact C-N 3.26Å; S381-A383 PolarHBondContact O-N 2.69Å; A383-Q386 WeakPolarHBondContact O-CB 3.17Å; A383-Q386 PolarHBondContact O-N 3.1Å
384Y53.5Low58.9Low57 Ų5790.2 Ų90.222%0.22446%0.461CS..Hα-helixtrans-77.3-23.3-179.7-162.3-115.5000113.4R185 H378 S381 P382 Q386 Y387 T388R185-Y384 VanDerWaalsContact NH2-CZ 3.28Å; R185-Y384 PolarHBondContact NH2-OH 3.02Å; H378-Y384 AromaticContact CE1-CD2 3.91Å; H378-Y384 AromaticContact CE1-CE1 3.74Å; H378-Y384 AromaticContact CE1-CE2 3.44Å; H378-Y384 VanDerWaalsContact CE1-CE2 3.44Å; H378-Y384 WeakPolarHBondContact CE1-CE2 3.37Å; H378-Y384 AromaticContact CE1-CZ 3.35Å; H378-Y384 AromaticContact NE2-CD2 3.49Å; H378-Y384 WeakPolarHBondContact NE2-CD2 3.34Å; H378-Y384 AromaticContact NE2-CE2 3.17Å; H378-Y384 WeakPolarHBondContact NE2-CE2 3.49Å; H378-Y384 AromaticContact NE2-CZ 3.63Å; S381-Y384 PolarHBondContact O-N 3.11Å; P382-Y384 PolarHBondContact O-N 2.82Å; Y384-Q386 PolarHBondContact O-N 3.5Å; Y384-Y387 PolarHBondContact O-N 3.45Å; Y384-T388 PolarHBondContact O-N 3.27Å; Y384-T388 PolarHBondContact O-OG1 3.26Å
385Q53.1Low57.2Low127 Ų12792.5 Ų92.559%0.59346%0.463SS*.Hα-helixtrans-61.2-31.3172.7-64.1-174.1-12.900111.1P382 T388 Q389P382-Q385 WeakPolarHBondContact O-CB 3.42Å; P382-Q385 PolarHBondContact O-N 3.32Å; Q385-T388 PolarHBondContact O-N 3.36Å; Q385-Q389 WeakPolarHBondContact O-CB 3.44Å; Q385-Q389 VanDerWaalsContact O-CG 3.29Å; Q385-Q389 WeakPolarHBondContact O-CG 3.5Å; Q385-Q389 PolarHBondContact O-N 3.2Å
386Q49.3Very low55.2Low126 Ų12693.9 Ų93.959%0.58949%0.486SS*.Hα-helixtrans-68.3-45.9178.8-64.5175-39.100111.8A383 Y384 T388 Q389 Q390A383-Q386 WeakPolarHBondContact O-CB 3.17Å; A383-Q386 PolarHBondContact O-N 3.1Å; Y384-Q386 PolarHBondContact O-N 3.5Å; Q386-T388 VanDerWaalsContact C-N 3.29Å; Q386-T388 PolarHBondContact O-N 3.28Å; Q386-Q389 PolarHBondContact O-N 3.33Å; Q386-Q390 VanDerWaalsContact O-CB 3.23Å; Q386-Q390 WeakPolarHBondContact O-CB 3.48Å; Q386-Q390 PolarHBondContact O-N 3.49Å
387Y51.8Low53.2Low164 Ų16496 Ų9664%0.64351%0.51SS*.Hα-helixtrans-61.2-36175.4-78-80.2000113.4Y384 S391Y384-Y387 PolarHBondContact O-N 3.45Å; Y387-S391 WeakPolarHBondContact O-CB 3.44Å; Y387-S391 PolarHBondContact O-N 3.33Å; Y387-S391 PolarHBondContact O-OG 3.18Å
388T51Low51.2Low32 Ų3293.5 Ų93.520%0.19651%0.511CS..Hα-helixtrans-75.2-37.4179.9-24.60000111.9R185 Y384 Q385 Q386 S391 T392R185-T388 PolarHBondContact NH1-OG1 3.36Å; Y384-T388 PolarHBondContact O-N 3.27Å; Y384-T388 PolarHBondContact O-OG1 3.26Å; Q385-T388 PolarHBondContact O-N 3.36Å; Q386-T388 VanDerWaalsContact C-N 3.29Å; Q386-T388 PolarHBondContact O-N 3.28Å; T388-S391 WeakPolarHBondContact CA-OG 3.29Å; T388-S391 PolarHBondContact O-OG 3.27Å; T388-S391 VanDerWaalsContact O-OG 3.1Å; T388-T392 WeakPolarHBondContact O-CB 3.45Å; T388-T392 PolarHBondContact O-N 3.34Å; T388-T392 PolarHBondContact O-OG1 3.3Å
389Q48.2Very low49.3Very low130 Ų13096.6 Ų96.661%0.60754%0.538SS*.Hα-helixtrans-68.8-38.3174.2-72.9178.117.200111.3Q385 Q386 T392 L393Q385-Q389 WeakPolarHBondContact O-CB 3.44Å; Q385-Q389 VanDerWaalsContact O-CG 3.29Å; Q385-Q389 WeakPolarHBondContact O-CG 3.5Å; Q385-Q389 PolarHBondContact O-N 3.2Å; Q386-Q389 PolarHBondContact O-N 3.33Å; Q389-T392 PolarHBondContact O-N 3.21Å; Q389-L393 WeakPolarHBondContact O-CB 3.47Å; Q389-L393 PolarHBondContact O-N 3Å
390Q43Very low47.4Very low117 Ų117101.7 Ų101.755%0.54757%0.574SS.*Hα-helixtrans-70.2-42.1-179.4-158.2155.4-4.700112.3Q386 T392 L393 E394Q386-Q390 VanDerWaalsContact O-CB 3.23Å; Q386-Q390 WeakPolarHBondContact O-CB 3.48Å; Q386-Q390 PolarHBondContact O-N 3.49Å; Q390-T392 VanDerWaalsContact C-N 3.26Å; Q390-T392 PolarHBondContact O-N 2.89Å; Q390-L393 PolarHBondContact O-N 3.24Å; Q390-E394 WeakPolarHBondContact O-CB 3.23Å; Q390-E394 WeakPolarHBondContact O-CG 3.46Å; Q390-E394 PolarHBondContact O-N 2.71Å
391S39.7Very low45.5Very low62 Ų62104.7 Ų104.743%0.43459%0.594SS.*Hα-helixtrans-66.1-25.8171.7520000113.7Y387 T388 R395Y387-S391 WeakPolarHBondContact O-CB 3.44Å; Y387-S391 PolarHBondContact O-N 3.33Å; Y387-S391 PolarHBondContact O-OG 3.18Å; T388-S391 WeakPolarHBondContact CA-OG 3.29Å; T388-S391 PolarHBondContact O-OG 3.27Å; T388-S391 VanDerWaalsContact O-OG 3.1Å; S391-R395 WeakPolarHBondContact O-CB 3.39Å; S391-R395 PolarHBondContact O-N 2.86Å
392T41.4Very low43.8Very low99 Ų99108.7 Ų108.761%0.60762%0.622SS**Hα-helixtrans-79-35.3172.5-47.50000111.2T388 Q389 Q390 R395 G396T388-T392 WeakPolarHBondContact O-CB 3.45Å; T388-T392 PolarHBondContact O-N 3.34Å; T388-T392 PolarHBondContact O-OG1 3.3Å; Q389-T392 PolarHBondContact O-N 3.21Å; Q390-T392 VanDerWaalsContact C-N 3.26Å; Q390-T392 PolarHBondContact O-N 2.89Å; T392-R395 PolarHBondContact O-N 3.12Å; T392-G396 PolarHBondContact O-N 2.85Å
393L40.6Very low42.5Very low142 Ų142115.8 Ų115.874%0.74364%0.636SS**Hα-helixtrans-69.1-43176.1-134.190.8000112Q389 Q390 R395 G396Q389-L393 WeakPolarHBondContact O-CB 3.47Å; Q389-L393 PolarHBondContact O-N 3Å; Q390-L393 PolarHBondContact O-N 3.24Å; L393-R395 PolarHBondContact O-N 3.18Å; L393-G396 PolarHBondContact O-N 3.17Å
394E44Very low41.3Very low157 Ų157117.9 Ų117.973%0.73465%0.647SS**Hα-helixtrans-66.4-24.6177.6-74.1-174.9152.400112.7Q390Q390-E394 WeakPolarHBondContact O-CB 3.23Å; Q390-E394 WeakPolarHBondContact O-CG 3.46Å; Q390-E394 PolarHBondContact O-N 2.71Å
395R42.8Very low40.1Very low186 Ų186124.1 Ų124.170%0.70268%0.678SS**Hα-helixtrans-95.1-10179.5-138.7174.7-167.4169.58.6114.1R159 S391 T392 L393R159-R395 VanDerWaalsContact NH2-CZ 3.3Å; S391-R395 WeakPolarHBondContact O-CB 3.39Å; S391-R395 PolarHBondContact O-N 2.86Å; T392-R395 PolarHBondContact O-N 3.12Å; L393-R395 PolarHBondContact O-N 3.18Å
396G35.2Very low38.9Very low65 Ų65123.4 Ų123.467%0.6769%0.687SS**Hα-helixtrans-95.7-5175.100000114.5T392 L393 G398T392-G396 PolarHBondContact O-N 2.85Å; L393-G396 PolarHBondContact O-N 3.17Å; G396-G398 PolarHBondContact O-N 3.49Å
397G34.5Very low38.1Very low63 Ų63124.5 Ų124.565%0.64970%0.697SS**  trans-75.199.3176.100000111.7
398G38Very low37Very low58 Ų58124.6 Ų124.660%0.59871%0.708SS**PPolyproline II helixtrans-57.1161.3160.700000111.5G396 S400G396-G398 PolarHBondContact O-N 3.49Å; G398-S400 PolarHBondContact O-N 3.18Å; G398-S400 VanDerWaalsContact O-N 3.17Å
399P37.1Very low36Very low133 Ų133128.3 Ų128.386%0.86474%0.735SS**PPolyproline II helixtrans-61.8121.1-167.924.8-32.2000111.1L401P399-L401 PolarHBondContact O-N 3.37Å
400S32.2Very low35.1Very low118 Ų118126.5 Ų126.583%0.82574%0.742SS**PPolyproline II helixtrans-72116.817441.80000109.8G398 S402G398-S400 PolarHBondContact O-N 3.18Å; G398-S400 VanDerWaalsContact O-N 3.17Å; S400-S402 PolarHBondContact O-N 3.35Å
401L35.1Very low34.7Very low172 Ų172132.7 Ų132.790%0.90176%0.761SS**PPolyproline II helixtrans-57.9126.4166.7-94.1117.7000110P399 R403P399-L401 PolarHBondContact O-N 3.37Å; L401-R403 PolarHBondContact O-N 3.38Å
402S37.9Very low34.5Very low119 Ų119132.9 Ų132.983%0.83277%0.772SS**PPolyproline II helixtrans-48.5127165.9-72.40000111.9S400S400-S402 PolarHBondContact O-N 3.35Å
403R28.5Very low34.2Very low251 Ų251135.8 Ų135.895%0.94778%0.784SS**  trans-147.2120.9152.9-150.2169.6-176.1162.50.6111.3L401L401-R403 PolarHBondContact O-N 3.38Å
404S29.6Very low33.9Very low98 Ų98136.4 Ų136.469%0.68579%0.788SS**  trans-73.3161.3-177.3-54.30000114.8
405H29.4Very low33.6Very low188 Ų188138 Ų13887%0.8780%0.795SS**  trans73.5138.3165.2-68.8-83.4000115.8
406S28.5Very low33.4Very low111 Ų111138.8 Ų138.878%0.77680%0.804SS**  cis-164.5159.525.343.90000112.2
407N31.4Very low33.5Very low149 Ų149141.9 Ų141.980%0.79781%0.81SS**  trans-37139.4172.4-61.9-24.9000117.4
408L29.6Very low33.6Very low167 Ų167146 Ų14687%0.87482%0.817SS**  -178.4124.7118.9-122.480.4000113.1
409S28.6Very low33.4Very low109 Ų109151.3 Ų151.376%0.76283%0.83SS**  trans51.5126.6138.4-1590000123.7
410A29.6Very low33.4Very low93 Ų93153 Ų15377%0.76983%0.831SS**  trans74.8144.7141.900000118.5
411R34.4Very low33.6Very low247 Ų247152.9 Ų152.993%0.93283%0.83SS**  cis178.9126.8-9.3170.7177.8178.8172.6-0.7103.9
412G35.7Very low33.9Very low66 Ų66149.9 Ų149.968%0.6882%0.823SS**  trans100.498.7165.400000114.7
413D35.4Very low33.8Very low159 Ų159152.2 Ų152.285%0.8583%0.827SS**  trans177.449.1143.6-91.5-14.5000111.5
414N35.1Very low34.4Very low155 Ų155148 Ų14883%0.82982%0.823SS**  trans-103.314.8179.6-922.8000114.6
415E37Very low34.8Very low190 Ų190151.8 Ų151.889%0.88883%0.83SS**SBendtrans-102.1-0.1-174.7-123.3179138.200115.5
416K37.8Very low35Very low204 Ų204156 Ų15689%0.88785%0.846SS**SBendtrans-113.51-177.8-69.7-174.5178.61740116
417T37.9Very low35.3Very low129 Ų129158.3 Ų158.379%0.79185%0.85SS**SBendtrans-1089-176.3-33.80000113.3
418L36.1Very low35.6Very low151 Ų151158.7 Ų158.779%0.79185%0.852SS**SBendtrans-117.322.3-171.7-131.4162.1000114.4
419L33.8Very low35.9Very low168 Ų168158.3 Ų158.388%0.8885%0.851SS**SBendtrans-124.220.3176.8-74.2179.2000114.9
420L37.9Very low36.3Very low170 Ų170161.2 Ų161.289%0.8986%0.856SS**SBendtrans-137.267.1172.9-83.3160.5000110
421S36.4Very low36.7Very low115 Ų115165.4 Ų165.480%0.80486%0.862SS**SBendtrans-152.323.5165.4-165.20000113.3
422S40.6Very low36.9Very low108 Ų108160 Ų16076%0.75586%0.857SS**  trans-149.188.9178.3-53.20000107.8
423D36.3Very low37Very low168 Ų168166.7 Ų166.790%0.89887%0.87SS**  trans-172.336.7150.3-87.6-16.7000110.6
424D41.6Very low37.1Very low163 Ų163167.3 Ų167.387%0.87287%0.871SS**  trans-123.582.2161.2-85.2-40.5000106.9
425E37.8Very low37.3Very low178 Ų178168.3 Ų168.383%0.83288%0.875SS**  trans-168.5119.9150.2-109.1175.7162.400110.5
426F33.7Very low37.3Very low276 Ų276166.4 Ų166.4100%1.21187%0.874SS**  trans111.50167.2-69-76.4000118.8

Retrieved 426 of 426 residues in 202.6 ms (Link to these results)