A0A087XY94_POEFO Loading...

Cholinephosphotransferase 1

AlphaFold DB , UniProt , Accession A0A087XY94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 382 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
1M46.7Very low68.2Low197 Ų197114.9 Ų114.997%0.9761%0.612SS**  0128.90-67177.8178.700106.8H3M1-H3 PolarHBondContact O-N 3.03Å; M1-H3 VanDerWaalsContact O-N 3.16Å
2P40.4Very low70.5Confident131 Ų131113.9 Ų113.985%0.85162%0.617SS**  trans-62121.6167.724.7-24.8000106.5C4P2-C4 PolarHBondContact O-N 3.08Å
3H46.2Very low72.4Confident188 Ų188109.1 Ų109.187%0.8760%0.602SS**  trans-52.3115176.5-82.4-77000108.3M1 L5M1-H3 PolarHBondContact O-N 3.03Å; M1-H3 VanDerWaalsContact O-N 3.16Å; H3-L5 PolarHBondContact O-N 3.01Å
4C50.3Low74.1Confident94 Ų94103.8 Ų103.864%0.63557%0.571SS**  trans-60.6124.8167.4-168.30000106.3P2 W6P2-C4 PolarHBondContact O-N 3.08Å; C4-W6 PolarHBondContact O-N 3.06Å
5L57.2Low75.6Confident163 Ų16397.9 Ų97.985%0.85354%0.538SS*.SBendtrans-62.6-0.2-180-79160.2000113.4H3H3-L5 PolarHBondContact O-N 3.01Å
6W64.3Low76.8Confident146 Ų146100.1 Ų100.155%0.55354%0.541SS*.SBendtrans-126.6144.3-168.2-56.3106.7000110.8C4 E8C4-W6 PolarHBondContact O-N 3.06Å; W6-E8 PolarHBondContact O-N 3Å
7P77Confident77.9Confident104 Ų10498.9 Ų98.968%0.67553%0.527SS*.  trans-56.4138.6176.419-30.6000111.4
8E87.5Confident78.9Confident141 Ų14193.7 Ų93.766%0.65950%0.498SS*.  trans-62.9133.7178.4-69-172.8-178.800110.9W6 Q361W6-E8 PolarHBondContact O-N 3Å; E8-Q361 PolarHBondContact OE2-NE2 3.22Å
9P91.1Very high79.7Confident46 Ų4694.9 Ų94.930%0.29950%0.501SS..SBendtrans-75.7-25.8-174.627.7-33.1000113.7Y354 V358 Q361P9-Y354 HydrophobicContact CB-CD2 4.19Å; P9-Y354 HydrophobicContact CB-CE2 4Å; P9-V358 HydrophobicContact CB-CG2 3.63Å; P9-V358 HydrophobicContact CG-CB 4.34Å; P9-V358 HydrophobicContact CG-CG2 3.58Å; P9-Q361 VanDerWaalsContact CD-OE1 3.27Å
10L94.8Very high80.3Confident5 Ų595.8 Ų95.83%0.02650%0.502CS..SBendtrans-116.3141.7178.7-51.8179.2000111.3Q14 L15 I303 V358 Q361 I362L10-Q14 HydrophobicContact CB-CB 4.35Å; L10-L15 HydrophobicContact CB-CD2 4.27Å; L10-L15 HydrophobicContact CB-CG 4.22Å; L10-L15 HydrophobicContact CD1-CD2 3.8Å; L10-I303 HydrophobicContact CD2-CG2 3.53Å; L10-V358 HydrophobicContact CD1-CG1 4.13Å; L10-V358 HydrophobicContact CG-CG2 4.5Å; L10-Q361 VanDerWaalsContact CB-OE1 3.28Å; L10-Q361 PolarHBondContact O-NE2 3.47Å; L10-I362 HydrophobicContact CD1-CD1 3.92Å; L10-I362 HydrophobicContact CD1-CG1 3.74Å
11S95.2Very high81Confident49 Ų4992.7 Ų92.734%0.34349%0.485SS..  trans-75.3157.6169.764.10000111.7A13 Q14 L15S11-A13 PolarHBondContact O-N 3.2Å; S11-A13 VanDerWaalsContact O-N 3.17Å; S11-Q14 WeakPolarHBondContact O-CB 3.49Å; S11-Q14 PolarHBondContact O-N 3.1Å; S11-Q14 WeakPolarHBondContact OG-CG 3.49Å; S11-Q14 PolarHBondContact OG-N 3.07Å; S11-Q14 PolarHBondContact OG-OE1 2.73Å; S11-L15 PolarHBondContact O-N 3.12Å; S11-L15 VanDerWaalsContact O-N 3.08Å
12P94.9Very high83.2Confident103 Ų10391.7 Ų91.767%0.66948%0.475SS*.Hα-helixtrans-55.8-33.3173.7-27.135.2000113.7L15 K16P12-L15 PolarHBondContact O-N 3.3Å; P12-K16 PolarHBondContact O-N 3.05Å
13A95.6Very high85.7Confident51 Ų5191.1 Ų91.142%0.42146%0.457SS..Hα-helixtrans-69.3-37.2177.300000112.5S11 R17S11-A13 PolarHBondContact O-N 3.2Å; S11-A13 VanDerWaalsContact O-N 3.17Å; A13-R17 WeakPolarHBondContact O-CG 3.02Å; A13-R17 PolarHBondContact O-N 2.83Å; A13-R17 VanDerWaalsContact O-N 3.15Å
14Q96.4Very high87.9Confident35 Ų3584.5 Ų84.516%0.16443%0.432CS..Hα-helixtrans-66.5-43.1174.1-78.1167.1-59.200111.4L10 S11 K16 R17 L18 T307 S309L10-Q14 HydrophobicContact CB-CB 4.35Å; S11-Q14 WeakPolarHBondContact O-CB 3.49Å; S11-Q14 PolarHBondContact O-N 3.1Å; S11-Q14 WeakPolarHBondContact OG-CG 3.49Å; S11-Q14 PolarHBondContact OG-N 3.07Å; S11-Q14 PolarHBondContact OG-OE1 2.73Å; Q14-K16 VanDerWaalsContact C-N 3.35Å; Q14-K16 PolarHBondContact O-N 3.45Å; Q14-R17 PolarHBondContact O-N 2.82Å; Q14-L18 PolarHBondContact O-N 3.48Å; Q14-T307 HydrophobicContact CB-CG2 4.06Å; Q14-S309 PolarHBondContact NE2-OG 3.18Å
15L96.4Very high89.9Confident15 Ų1581.9 Ų81.98%0.07942%0.417CS..Hα-helixtrans-58.9-45.4176-71.5174.2000111.7L10 S11 P12 R17 L18 E19 Q361 I362 H365L10-L15 HydrophobicContact CB-CD2 4.27Å; L10-L15 HydrophobicContact CB-CG 4.22Å; L10-L15 HydrophobicContact CD1-CD2 3.8Å; S11-L15 PolarHBondContact O-N 3.12Å; S11-L15 VanDerWaalsContact O-N 3.08Å; P12-L15 PolarHBondContact O-N 3.3Å; L15-R17 PolarHBondContact O-N 3.45Å; L15-L18 WeakPolarHBondContact O-CB 3.44Å; L15-L18 PolarHBondContact O-N 3.5Å; L15-L18 VanDerWaalsContact O-N 3.13Å; L15-E19 PolarHBondContact O-N 3.42Å; L15-Q361 HydrophobicContact CD1-CG 4.14Å; L15-Q361 HydrophobicContact CD2-CG 4.36Å; L15-I362 HydrophobicContact CD2-CG1 4.14Å; L15-H365 HydrophobicContact CD1-CB 4.41Å; L15-H365 HydrophobicContact CD2-CB 4.12Å; L15-H365 PolarHBondContact O-NE2 3.07Å
16K95.3Very high91.6Very high134 Ų13476.5 Ų76.558%0.58339%0.393SS*.Hα-helixtrans-60.6-43.1176.2-171.5-179.8179.7-176.30112.7P12 Q14 L18 E19P12-K16 PolarHBondContact O-N 3.05Å; Q14-K16 VanDerWaalsContact C-N 3.35Å; Q14-K16 PolarHBondContact O-N 3.45Å; K16-L18 VanDerWaalsContact C-N 3.27Å; K16-L18 PolarHBondContact O-N 3.42Å; K16-E19 WeakPolarHBondContact O-CB 3.41Å; K16-E19 PolarHBondContact O-N 3.19Å
17R95.8Very high92.8Very high80 Ų8072.2 Ų72.230%0.30239%0.394SS..Hα-helixtrans-68.4-27.5177.1-70.4-169.8-57-94.1-1.1112.6A13 Q14 L15 E19 E20 H21 T307A13-R17 WeakPolarHBondContact O-CG 3.02Å; A13-R17 PolarHBondContact O-N 2.83Å; A13-R17 VanDerWaalsContact O-N 3.15Å; Q14-R17 PolarHBondContact O-N 2.82Å; L15-R17 PolarHBondContact O-N 3.45Å; R17-E19 VanDerWaalsContact C-N 3.27Å; R17-E19 PolarHBondContact O-N 3.23Å; R17-E20 WeakPolarHBondContact O-CB 3.39Å; R17-E20 PolarHBondContact O-N 3.16Å; R17-E20 VanDerWaalsContact O-N 3.15Å; R17-H21 PolarHBondContact O-N 2.84Å; R17-T307 WeakPolarHBondContact CB-O 3.39Å; R17-T307 PolarHBondContact NE-O 2.88Å; R17-T307 PolarHBondContact NH2-O 2.84Å
18L95.3Very high93.4Very high4 Ų474 Ų742%0.02139%0.388CS..Hα-helixtrans-62.7-34.4173.6-166.278000112Q14 L15 K16 E20 H21 A115 M306 T307 I362Q14-L18 PolarHBondContact O-N 3.48Å; L15-L18 WeakPolarHBondContact O-CB 3.44Å; L15-L18 PolarHBondContact O-N 3.5Å; L15-L18 VanDerWaalsContact O-N 3.13Å; K16-L18 VanDerWaalsContact C-N 3.27Å; K16-L18 PolarHBondContact O-N 3.42Å; L18-E20 PolarHBondContact O-N 3.42Å; L18-H21 WeakPolarHBondContact O-CB 3.46Å; L18-H21 PolarHBondContact O-N 3.47Å; L18-H21 VanDerWaalsContact O-N 3.09Å; L18-A115 HydrophobicContact CD1-CB 4.2Å; L18-A115 HydrophobicContact CD2-CB 4.43Å; L18-A115 HydrophobicContact CG-CB 4.03Å; L18-M306 HydrophobicContact CD1-CB 3.73Å; L18-M306 HydrophobicContact CD1-CE 4.1Å; L18-T307 HydrophobicContact CB-CG2 4.21Å; L18-T307 HydrophobicContact CD1-CG2 3.78Å; L18-I362 HydrophobicContact CD2-CB 4.2Å; L18-I362 HydrophobicContact CD2-CD1 3.66Å; L18-I362 HydrophobicContact CD2-CG1 3.64Å; L18-I362 HydrophobicContact CD2-CG2 3.53Å
19E93.3Very high93.6Very high118 Ų11867.6 Ų67.655%0.55136%0.358SS*.Hα-helixtrans-63.1-26.3175.8-60.6-177153.800112.3L15 K16 R17 H21 H365 L366L15-E19 PolarHBondContact O-N 3.42Å; K16-E19 WeakPolarHBondContact O-CB 3.41Å; K16-E19 PolarHBondContact O-N 3.19Å; R17-E19 VanDerWaalsContact C-N 3.27Å; R17-E19 PolarHBondContact O-N 3.23Å; E19-H21 VanDerWaalsContact C-N 3.34Å; E19-H365 IonicContact OE1-CD2 3.41Å; E19-H365 IonicContact OE1-CE1 3.13Å; E19-H365 IonicContact OE1-NE2 2.88Å; E19-H365 PolarHBondContact OE1-NE2 2.92Å; E19-H365 VanDerWaalsContact OE1-NE2 3.13Å; E19-L366 HydrophobicContact CG-CD2 4.23Å
20E92.6Very high93.7Very high111 Ų11170.4 Ų70.452%0.51937%0.37SS..THydrogen-bonded Turntrans-85.5-8.9178.4-57.8173.7-17800112.5R17 L18R17-E20 WeakPolarHBondContact O-CB 3.39Å; R17-E20 PolarHBondContact O-N 3.16Å; R17-E20 VanDerWaalsContact O-N 3.15Å; L18-E20 PolarHBondContact O-N 3.42Å
21H95.1Very high93.7Very high31 Ų3174.2 Ų74.214%0.14439%0.387CS..  trans-65.6137.9-179-17761000111.5R17 L18 E19 E118 H305R17-H21 PolarHBondContact O-N 2.84Å; L18-H21 WeakPolarHBondContact O-CB 3.46Å; L18-H21 PolarHBondContact O-N 3.47Å; L18-H21 VanDerWaalsContact O-N 3.09Å; E19-H21 VanDerWaalsContact C-N 3.34Å; H21-E118 IonicContact CD2-OE1 3.24Å; H21-E118 IonicContact CD2-OE2 2.89Å; H21-E118 PolarHBondContact CD2-OE2 3.24Å; H21-E118 IonicContact CE1-OE1 2.64Å; H21-E118 IonicContact NE2-OE1 4Å; H21-E118 PolarHBondContact NE2-OE1 3.32Å; H21-E118 IonicContact NE2-OE2 3.99Å; H21-E118 PolarHBondContact NE2-OE2 2.84Å; H21-H305 AromaticContact CE1-NE2 3.63Å
22K92.6Very high93.6Very high176 Ų17674 Ų7477%0.76538%0.38SS*.  trans-133123.3172.8-66.5-173.6-178.8-178.60108.3S24K22-S24 PolarHBondContact O-N 3.02Å
23Y92.2Very high93.6Very high120 Ų12071 Ų7147%0.47136%0.361SS..  trans-54.6129.9174.6-177.2-116.5000110.8A25 E118Y23-A25 HydrophobicContact CE1-CB 3.86Å; Y23-A25 HydrophobicContact CE2-CB 4.31Å; Y23-A25 WeakPolarHBondContact OH-CB 3.41Å; Y23-E118 WeakPolarHBondContact CB-OE2 3.44Å; Y23-E118 HydrophobicContact CD2-CG 3.92Å; Y23-E118 WeakPolarHBondContact CD2-OE2 3.12Å; Y23-E118 HydrophobicContact CE2-CG 4.27Å
24S93.4Very high93.6Very high49 Ų4972.3 Ų72.334%0.34337%0.365SS..  trans-136.9117.4176.9-175.40000108.6K22 T172 L173K22-S24 PolarHBondContact O-N 3.02Å; S24-T172 WeakPolarHBondContact O-CA 3.33Å; S24-T172 WeakPolarHBondContact OG-CG2 3.5Å; S24-T172 PolarHBondContact OG-OG1 3.31Å; S24-L173 PolarHBondContact O-N 2.93Å
25A93Very high93.6Very high39 Ų3971.8 Ų71.832%0.32237%0.365SS..EExtended strand (participates in β ladder)trans-137.2152.3172.800000111.1Y23 L173 F175Y23-A25 HydrophobicContact CE1-CB 3.86Å; Y23-A25 HydrophobicContact CE2-CB 4.31Å; Y23-A25 WeakPolarHBondContact OH-CB 3.41Å; A25-L173 CarbonylContact C-O 3.59Å; A25-L173 WeakPolarHBondContact CA-O 3.4Å; A25-L173 HydrophobicContact CB-CB 4.22Å; A25-F175 HydrophobicContact CB-CE2 3.76Å
26S92.3Very high93.6Very high50 Ų5072.9 Ų72.935%0.3537%0.37SS..EExtended strand (participates in β ladder)trans-148.1162.8-177.666.20000111.2L173 R174 F175S26-L173 PolarHBondContact N-O 3.05Å; S26-R174 CarbonylContact O-C 3.52Å; S26-R174 WeakPolarHBondContact O-CA 3.42Å; S26-F175 WeakPolarHBondContact O-CD2 3.3Å; S26-F175 PolarHBondContact O-N 2.93Å
27G89.4Confident93.7Very high56 Ų5671.9 Ų71.958%0.57737%0.374SS*.EExtended strand (participates in β ladder)trans88.8176.5-17400000112
28R88.9Confident93.8Very high141 Ų14171.6 Ų71.653%0.53237%0.374SS..  trans-159.2132.8-176-169.5-168-166.8175.99109.1E32 P33R28-E32 HydrophobicContact CG-CB 4.47Å; R28-E32 WeakPolarHBondContact CG-OE2 3.33Å; R28-P33 VanDerWaalsContact NH2-CA 3.32Å
29S92.1Very high93.9Very high6 Ų671.9 Ų71.94%0.04238%0.375CS..  trans-84.2164.8176.3940000111.9E32 P33 G176 E182S29-E32 PolarHBondContact N-OE2 3.45Å; S29-E32 WeakPolarHBondContact OG-CB 3.19Å; S29-E32 PolarHBondContact OG-N 3.08Å; S29-P33 WeakPolarHBondContact O-CD 3.49Å; S29-G176 WeakPolarHBondContact CA-O 3.23Å; S29-E182 WeakPolarHBondContact CB-OE1 3.37Å; S29-E182 VanDerWaalsContact CB-OE2 3.3Å; S29-E182 WeakPolarHBondContact CB-OE2 3.39Å; S29-E182 VanDerWaalsContact OG-CD 3.31Å; S29-E182 PolarHBondContact OG-OE1 3.39Å; S29-E182 PolarHBondContact OG-OE2 3.39Å
30L94.1Very high94.1Very high105 Ų10570 Ų7055%0.5537%0.369SS..SBendtrans-64.6-44.9-173.7-178.865000113.4P33 L177 E182L30-P33 WeakPolarHBondContact O-CD 3.38Å; L30-L177 WeakPolarHBondContact CB-O 3.42Å; L30-L177 PolarHBondContact N-O 3.46Å; L30-E182 HydrophobicContact CB-CG 4.35Å; L30-E182 PolarHBondContact N-OE1 2.92Å
31F94.6Very high94.4Very high85 Ų8571.5 Ų71.537%0.37337%0.369SS..SBendtrans-94.3-6.7-177.9-64.8-24.3000113.3P34 C35 T181 E182 I185F31-P34 WeakPolarHBondContact O-CD 3.41Å; F31-P34 WeakPolarHBondContact O-CG 3.48Å; F31-C35 VanDerWaalsContact O-CB 3.32Å; F31-C35 WeakPolarHBondContact O-CB 3.1Å; F31-C35 PolarHBondContact O-N 3.19Å; F31-C35 VanDerWaalsContact O-N 3.16Å; F31-C35 PolarHBondContact O-SG 3.34Å; F31-T181 HydrophobicContact CB-CG2 4.12Å; F31-E182 HydrophobicContact CB-CG 4.35Å; F31-E182 HydrophobicContact CD2-CB 4.2Å; F31-E182 HydrophobicContact CD2-CG 3.67Å; F31-E182 HydrophobicContact CE2-CG 4.17Å; F31-E182 HydrophobicContact CG-CG 4.1Å; F31-E182 PolarHBondContact N-OE1 3.5Å; F31-I185 HydrophobicContact CB-CD1 4.14Å; F31-I185 HydrophobicContact CD2-CD1 3.91Å; F31-I185 HydrophobicContact CG-CD1 4.43Å
32E92.4Very high94.6Very high45 Ų4571.1 Ų71.121%0.2137%0.368CS..Hα-helixtrans-54.3-53.8169.7-162.6-157.6142.100112.3R28 S29 C35 Q36 W39R28-E32 HydrophobicContact CG-CB 4.47Å; R28-E32 WeakPolarHBondContact CG-OE2 3.33Å; S29-E32 PolarHBondContact N-OE2 3.45Å; S29-E32 WeakPolarHBondContact OG-CB 3.19Å; S29-E32 PolarHBondContact OG-N 3.08Å; E32-C35 PolarHBondContact O-N 2.97Å; E32-C35 VanDerWaalsContact O-N 3.12Å; E32-Q36 HydrophobicContact CG-CG 4.39Å; E32-Q36 VanDerWaalsContact O-CG 3.31Å; E32-Q36 WeakPolarHBondContact O-CG 3.29Å; E32-Q36 PolarHBondContact O-N 2.82Å; E32-Q36 PolarHBondContact OE1-NE2 3.41Å; E32-W39 HydrophobicContact CG-CZ3 3.91Å
33P94.4Very high94.9Very high40 Ų4063.3 Ų63.326%0.2634%0.335SS..Hα-helixtrans-45.7-55.8177.6-9.62.4000116.1R28 S29 L30 Q36R28-P33 VanDerWaalsContact NH2-CA 3.32Å; S29-P33 WeakPolarHBondContact O-CD 3.49Å; L30-P33 WeakPolarHBondContact O-CD 3.38Å; P33-Q36 WeakPolarHBondContact O-CB 3.13Å; P33-Q36 PolarHBondContact O-N 3.24Å
34P95.8Very high95.1Very high78 Ų7862.5 Ų62.551%0.50634%0.339SS..Hα-helixtrans-66.6-38.8179.524.8-33.5000111.9F31 Q36 V37F31-P34 WeakPolarHBondContact O-CD 3.41Å; F31-P34 WeakPolarHBondContact O-CG 3.48Å; P34-Q36 VanDerWaalsContact C-N 3.26Å; P34-Q36 PolarHBondContact O-N 3.16Å; P34-V37 WeakPolarHBondContact O-CB 3.49Å; P34-V37 PolarHBondContact O-N 3.49Å
35C96.4Very high95.4Very high24 Ų2465.4 Ų65.416%0.16235%0.347CS..Hα-helixtrans-64.8-29177.9-70.30000112.8F31 E32 V37 Y38 W39F31-C35 VanDerWaalsContact O-CB 3.32Å; F31-C35 WeakPolarHBondContact O-CB 3.1Å; F31-C35 PolarHBondContact O-N 3.19Å; F31-C35 VanDerWaalsContact O-N 3.16Å; F31-C35 PolarHBondContact O-SG 3.34Å; E32-C35 PolarHBondContact O-N 2.97Å; E32-C35 VanDerWaalsContact O-N 3.12Å; C35-V37 PolarHBondContact O-N 2.92Å; C35-V37 VanDerWaalsContact O-N 3.17Å; C35-Y38 PolarHBondContact O-N 3.38Å; C35-Y38 VanDerWaalsContact O-N 3.08Å; C35-W39 HydrophobicContact CB-CD2 3.9Å; C35-W39 HydrophobicContact CB-CE3 3.89Å; C35-W39 HydrophobicContact CB-CH2 3.46Å; C35-W39 VanDerWaalsContact CB-CH2 3.46Å; C35-W39 HydrophobicContact CB-CZ2 3.45Å; C35-W39 VanDerWaalsContact CB-CZ2 3.45Å; C35-W39 HydrophobicContact CB-CZ3 3.68Å; C35-W39 VanDerWaalsContact O-CG 3.31Å; C35-W39 PolarHBondContact O-N 3.38Å
36Q96.1Very high95.6Very high39 Ų3964.7 Ų64.718%0.18234%0.337CS..Hα-helixtrans-55.8-33.3174.9-70.6-59.1-17.600112.6E32 P33 P34 W39 N40E32-Q36 HydrophobicContact CG-CG 4.39Å; E32-Q36 VanDerWaalsContact O-CG 3.31Å; E32-Q36 WeakPolarHBondContact O-CG 3.29Å; E32-Q36 PolarHBondContact O-N 2.82Å; E32-Q36 PolarHBondContact OE1-NE2 3.41Å; P33-Q36 WeakPolarHBondContact O-CB 3.13Å; P33-Q36 PolarHBondContact O-N 3.24Å; P34-Q36 VanDerWaalsContact C-N 3.26Å; P34-Q36 PolarHBondContact O-N 3.16Å; Q36-W39 HydrophobicContact CG-CE3 4.49Å; Q36-N40 WeakPolarHBondContact O-CB 3.44Å; Q36-N40 PolarHBondContact O-N 3.42Å; Q36-N40 PolarHBondContact O-ND2 2.98Å
37V97.1Very high95.8Very high112 Ų11265.1 Ų65.168%0.67934%0.339SS*.Hα-helixtrans-61.6-48.9177.3-1800000110.4P34 C35 W41P34-V37 WeakPolarHBondContact O-CB 3.49Å; P34-V37 PolarHBondContact O-N 3.49Å; C35-V37 PolarHBondContact O-N 2.92Å; C35-V37 VanDerWaalsContact O-N 3.17Å; V37-W41 PolarHBondContact O-N 2.93Å
38Y97.8Very high96.1Very high75 Ų7566.4 Ų66.429%0.29434%0.336SS..Hα-helixtrans-66.5-46.9177.9165.8-112.5000111.9C35 N40 W41 L42 F94 S98C35-Y38 PolarHBondContact O-N 3.38Å; C35-Y38 VanDerWaalsContact O-N 3.08Å; Y38-N40 PolarHBondContact O-N 2.86Å; Y38-W41 AromaticContact CD2-CE3 3.95Å; Y38-W41 HydrophobicContact CD2-CE3 3.95Å; Y38-W41 HydrophobicContact CD2-CZ3 4.2Å; Y38-W41 HydrophobicContact CE2-CE3 4.01Å; Y38-W41 AromaticContact CE2-CZ3 3.81Å; Y38-W41 HydrophobicContact CE2-CZ3 3.81Å; Y38-W41 WeakPolarHBondContact O-CB 3.24Å; Y38-W41 PolarHBondContact O-N 3.12Å; Y38-W41 VanDerWaalsContact O-N 3.17Å; Y38-L42 HydrophobicContact CE1-CD2 4.16Å; Y38-L42 WeakPolarHBondContact O-CB 3.29Å; Y38-L42 PolarHBondContact O-N 3.09Å; Y38-F94 HydrophobicContact CE1-CE2 4.34Å; Y38-F94 AromaticContact CE1-CZ 3.85Å; Y38-F94 HydrophobicContact CE1-CZ 3.85Å; Y38-F94 AromaticContact CZ-CZ 3.7Å; Y38-F94 WeakPolarHBondContact OH-CE1 3.31Å; Y38-F94 WeakPolarHBondContact OH-CZ 3.27Å; Y38-S98 WeakPolarHBondContact CE1-OG 3.49Å; Y38-S98 PolarHBondContact OH-OG 2.95Å
39W98.4Very high96.4Very high10 Ų1068.9 Ų68.94%0.03835%0.345CS..Hα-helixtrans-66.3-36-178.3-61.6-33.6000113.3E32 C35 Q36 W41 L42 V43 Q97 A101 I102 K105 T181E32-W39 HydrophobicContact CG-CZ3 3.91Å; C35-W39 HydrophobicContact CB-CD2 3.9Å; C35-W39 HydrophobicContact CB-CE3 3.89Å; C35-W39 HydrophobicContact CB-CH2 3.46Å; C35-W39 VanDerWaalsContact CB-CH2 3.46Å; C35-W39 HydrophobicContact CB-CZ2 3.45Å; C35-W39 VanDerWaalsContact CB-CZ2 3.45Å; C35-W39 HydrophobicContact CB-CZ3 3.68Å; C35-W39 VanDerWaalsContact O-CG 3.31Å; C35-W39 PolarHBondContact O-N 3.38Å; Q36-W39 HydrophobicContact CG-CE3 4.49Å; W39-W41 VanDerWaalsContact C-N 3.33Å; W39-L42 PolarHBondContact O-N 3.07Å; W39-V43 PolarHBondContact O-N 3.13Å; W39-Q97 HydrophobicContact CZ2-CG 4.4Å; W39-A101 HydrophobicContact CD2-CB 3.5Å; W39-A101 HydrophobicContact CE3-CB 3.93Å; W39-A101 HydrophobicContact CG-CB 3.92Å; W39-A101 HydrophobicContact CH2-CB 4.03Å; W39-A101 HydrophobicContact CZ2-CB 3.62Å; W39-A101 HydrophobicContact CZ3-CB 4.18Å; W39-I102 HydrophobicContact CB-CG2 3.89Å; W39-I102 HydrophobicContact CG-CG2 4.36Å; W39-I102 WeakPolarHBondContact O-CG2 3.18Å; W39-K105 HydrophobicContact CB-CD 4.24Å; W39-T181 HydrophobicContact CH2-CG2 4.06Å; W39-T181 HydrophobicContact CZ2-CG2 4.41Å
40N98.3Very high96.7Very high79 Ų7969.4 Ų69.442%0.42235%0.348SS..Hα-helixtrans-68.4-32.9174.4-70.9-27.2000112Q36 Y38 V43 L44 K105Q36-N40 WeakPolarHBondContact O-CB 3.44Å; Q36-N40 PolarHBondContact O-N 3.42Å; Q36-N40 PolarHBondContact O-ND2 2.98Å; Y38-N40 PolarHBondContact O-N 2.86Å; N40-V43 WeakPolarHBondContact O-CG1 3.44Å; N40-L44 WeakPolarHBondContact O-CG 3.39Å; N40-K105 PolarHBondContact OD1-NZ 3.25Å
41W98.4Very high96.8Very high141 Ų14164.6 Ų64.653%0.53432%0.324SS..Hα-helixtrans-69.7-44.9169.9166.983.9000111.6V37 Y38 W39 L44 Q45V37-W41 PolarHBondContact O-N 2.93Å; Y38-W41 AromaticContact CD2-CE3 3.95Å; Y38-W41 HydrophobicContact CD2-CE3 3.95Å; Y38-W41 HydrophobicContact CD2-CZ3 4.2Å; Y38-W41 HydrophobicContact CE2-CE3 4.01Å; Y38-W41 AromaticContact CE2-CZ3 3.81Å; Y38-W41 HydrophobicContact CE2-CZ3 3.81Å; Y38-W41 WeakPolarHBondContact O-CB 3.24Å; Y38-W41 PolarHBondContact O-N 3.12Å; Y38-W41 VanDerWaalsContact O-N 3.17Å; W39-W41 VanDerWaalsContact C-N 3.33Å; W41-L44 WeakPolarHBondContact O-CB 3.33Å; W41-L44 PolarHBondContact O-N 3.27Å; W41-Q45 HydrophobicContact CD2-CG 4.34Å; W41-Q45 HydrophobicContact CH2-CG 4.12Å; W41-Q45 HydrophobicContact CZ2-CG 3.82Å; W41-Q45 HydrophobicContact CZ3-CG 4.48Å; W41-Q45 PolarHBondContact O-NE2 3.25Å
42L98.6Very high97Very high23 Ų2361.1 Ų61.112%0.1231%0.309CS..Hα-helixtrans-64.5-44.4-174.2-178.864.1000111.9Y38 W39 L44 Q45 I46 I102Y38-L42 HydrophobicContact CE1-CD2 4.16Å; Y38-L42 WeakPolarHBondContact O-CB 3.29Å; Y38-L42 PolarHBondContact O-N 3.09Å; W39-L42 PolarHBondContact O-N 3.07Å; L42-L44 PolarHBondContact O-N 3.01Å; L42-L44 VanDerWaalsContact O-N 3.16Å; L42-Q45 WeakPolarHBondContact O-CA 3.47Å; L42-Q45 WeakPolarHBondContact O-CB 3.38Å; L42-Q45 PolarHBondContact O-N 2.98Å; L42-I46 PolarHBondContact O-N 3.35Å; L42-I102 HydrophobicContact CB-CG2 4.29Å; L42-I102 HydrophobicContact CD2-CD1 3.85Å; L42-I102 HydrophobicContact CD2-CG2 4.07Å; L42-I102 HydrophobicContact CG-CD1 3.86Å; L42-I102 HydrophobicContact CG-CG2 4.35Å
43V98.6Very high97.3Very high12 Ų1259.6 Ų59.67%0.07330%0.303CS..Hα-helixtrans-58.6-31.1178.470.40000111.9W39 N40 Q45 I46 I102 K105 Q106 R109W39-V43 PolarHBondContact O-N 3.13Å; N40-V43 WeakPolarHBondContact O-CG1 3.44Å; V43-Q45 VanDerWaalsContact C-N 3.27Å; V43-Q45 PolarHBondContact O-N 2.85Å; V43-I46 PolarHBondContact O-N 3.19Å; V43-I102 HydrophobicContact CB-CB 4.15Å; V43-I102 HydrophobicContact CB-CG2 4.27Å; V43-I102 HydrophobicContact CG2-CB 4.44Å; V43-K105 HydrophobicContact CB-CB 4.19Å; V43-K105 HydrophobicContact CG1-CB 4.33Å; V43-K105 HydrophobicContact CG2-CB 3.83Å; V43-Q106 HydrophobicContact CG2-CB 4.05Å; V43-R109 PolarHBondContact O-NH1 3.28Å
44L98.2Very high97.4Very high104 Ų10459.6 Ų59.655%0.54530%0.302SS..Hα-helixtrans-69.9-25177-63.6173.6000112.8N40 W41 L42 I46N40-L44 WeakPolarHBondContact O-CG 3.39Å; W41-L44 WeakPolarHBondContact O-CB 3.33Å; W41-L44 PolarHBondContact O-N 3.27Å; L42-L44 PolarHBondContact O-N 3.01Å; L42-L44 VanDerWaalsContact O-N 3.16Å; L44-I46 VanDerWaalsContact C-N 3.29Å
45Q98.2Very high97.6Very high109 Ų10956.4 Ų56.451%0.50928%0.281SS..Hα-helixtrans-76.6-18.5175.6-50.6-48.8-58.400112.3W41 L42 V43W41-Q45 HydrophobicContact CD2-CG 4.34Å; W41-Q45 HydrophobicContact CH2-CG 4.12Å; W41-Q45 HydrophobicContact CZ2-CG 3.82Å; W41-Q45 HydrophobicContact CZ3-CG 4.48Å; W41-Q45 PolarHBondContact O-NE2 3.25Å; L42-Q45 WeakPolarHBondContact O-CA 3.47Å; L42-Q45 WeakPolarHBondContact O-CB 3.38Å; L42-Q45 PolarHBondContact O-N 2.98Å; V43-Q45 VanDerWaalsContact C-N 3.27Å; V43-Q45 PolarHBondContact O-N 2.85Å
46I97.8Very high97.6Very high24 Ų2455.4 Ų55.412%0.12327%0.274CS..SBendtrans-77.1127.8178-54.3-54.3000109.6L42 V43 L44 V50 L55 I102 R109L42-I46 PolarHBondContact O-N 3.35Å; V43-I46 PolarHBondContact O-N 3.19Å; L44-I46 VanDerWaalsContact C-N 3.29Å; I46-V50 HydrophobicContact CG2-CB 3.83Å; I46-V50 HydrophobicContact CG2-CG1 4.15Å; I46-V50 HydrophobicContact CG2-CG2 4.23Å; I46-L55 HydrophobicContact CD1-CD2 4.25Å; I46-L55 HydrophobicContact CG1-CD2 4.46Å; I46-L55 HydrophobicContact CG2-CD1 4.28Å; I46-L55 HydrophobicContact CG2-CD2 4.05Å; I46-I102 HydrophobicContact CD1-CD1 4.1Å; I46-I102 HydrophobicContact CG1-CD1 3.73Å; I46-R109 PolarHBondContact O-NH1 3.49Å
47P97.1Very high97.8Very high59 Ų5955.7 Ų55.738%0.38328%0.276SS..  trans-60141.8173.2-21.832.2000111.8W49 V50 Q106P47-W49 HydrophobicContact CB-CD2 4.26Å; P47-W49 HydrophobicContact CB-CG 4.21Å; P47-W49 HydrophobicContact CB-CZ2 4.21Å; P47-W49 HydrophobicContact CG-CZ2 4.21Å; P47-W49 PolarHBondContact O-N 2.77Å; P47-W49 VanDerWaalsContact O-N 3.1Å; P47-V50 HydrophobicContact CB-CG2 4.19Å; P47-V50 HydrophobicContact CG-CG2 4.3Å; P47-V50 WeakPolarHBondContact O-CB 3.39Å; P47-V50 PolarHBondContact O-N 3.14Å; P47-V50 VanDerWaalsContact O-N 3.07Å; P47-Q106 PolarHBondContact O-NE2 3.17Å; P47-Q106 VanDerWaalsContact O-NE2 3.12Å
48T95.8Very high97.8Very high83 Ų8353.4 Ų53.451%0.50926%0.262SS..THydrogen-bonded Turntrans-69.4-8-176.351.70000114.5T110 I373T48-T110 WeakPolarHBondContact O-CG2 3.49Å; T48-I373 WeakPolarHBondContact O-CD1 3.47Å
49W95.2Very high97.9Very high193 Ų19349.9 Ų49.973%0.73125%0.249SC*.THydrogen-bonded Turntrans-87-13.3173.458.9-101.1000113P47 A51P47-W49 HydrophobicContact CB-CD2 4.26Å; P47-W49 HydrophobicContact CB-CG 4.21Å; P47-W49 HydrophobicContact CB-CZ2 4.21Å; P47-W49 HydrophobicContact CG-CZ2 4.21Å; P47-W49 PolarHBondContact O-N 2.77Å; P47-W49 VanDerWaalsContact O-N 3.1Å; W49-A51 PolarHBondContact O-N 3.17Å
50V97.4Very high97.9Very high18 Ų1850 Ų5011%0.10925%0.25CC..SBendtrans-76.1120.9177.1-179.90000108.9I46 P47 T54 L55 Q106I46-V50 HydrophobicContact CG2-CB 3.83Å; I46-V50 HydrophobicContact CG2-CG1 4.15Å; I46-V50 HydrophobicContact CG2-CG2 4.23Å; P47-V50 HydrophobicContact CB-CG2 4.19Å; P47-V50 HydrophobicContact CG-CG2 4.3Å; P47-V50 WeakPolarHBondContact O-CB 3.39Å; P47-V50 PolarHBondContact O-N 3.14Å; P47-V50 VanDerWaalsContact O-N 3.07Å; V50-T54 HydrophobicContact CG1-CG2 4.35Å; V50-L55 HydrophobicContact CG1-CD2 3.75Å; V50-L55 HydrophobicContact CG1-CG 4.16Å; V50-Q106 PolarHBondContact O-NE2 3.15Å
51A97.1Very high97.9Very high4 Ų450.4 Ų50.43%0.03325%0.252CS..  trans-69.5143.6177.300000111.3W49 N53 T54 I373W49-A51 PolarHBondContact O-N 3.17Å; A51-N53 PolarHBondContact O-N 3.49Å; A51-T54 VanDerWaalsContact O-CB 3.24Å; A51-T54 WeakPolarHBondContact O-CB 3.43Å; A51-T54 PolarHBondContact O-N 3.38Å; A51-I373 HydrophobicContact CB-CG1 4.3Å
52P97.8Very high97.9Very high11 Ų1146.2 Ų46.27%0.07124%0.239CC..Hα-helixtrans-51.4-50176.9-30.337.3000113.5T54 L55 T56 D103 Q106 A107P52-T54 PolarHBondContact O-N 3.32Å; P52-L55 WeakPolarHBondContact O-CA 3.42Å; P52-L55 VanDerWaalsContact O-CB 3.27Å; P52-L55 WeakPolarHBondContact O-CB 3.22Å; P52-L55 PolarHBondContact O-N 3.17Å; P52-T56 PolarHBondContact O-N 2.8Å; P52-T56 PolarHBondContact O-OG1 3.18Å; P52-D103 HydrophobicContact CB-CB 4.37Å; P52-D103 WeakPolarHBondContact CB-O 3.38Å; P52-Q106 HydrophobicContact CG-CB 4.45Å; P52-Q106 HydrophobicContact CG-CG 4.26Å; P52-A107 HydrophobicContact CB-CB 4.07Å; P52-A107 VanDerWaalsContact CG-CA 3.49Å; P52-A107 HydrophobicContact CG-CB 3.56Å
53N98.3Very high97.9Very high13 Ų1345.1 Ų45.17%0.0723%0.234CC..Hα-helixtrans-60.7-23.3179.8-59.5-5.8000113.1A51 I57 G117 F120 V370 F371A51-N53 PolarHBondContact O-N 3.49Å; N53-I57 WeakPolarHBondContact O-CG2 3.36Å; N53-I57 PolarHBondContact O-N 3.17Å; N53-G117 WeakPolarHBondContact OD1-CA 3.47Å; N53-F120 HydrophobicContact CB-CD1 3.73Å; N53-F120 HydrophobicContact CB-CD2 4.44Å; N53-F120 HydrophobicContact CB-CE1 3.91Å; N53-F120 HydrophobicContact CB-CG 4.03Å; N53-F120 HydrophobicContact CB-CZ 4.34Å; N53-F120 VanDerWaalsContact O-CE1 3.29Å; N53-F120 WeakPolarHBondContact O-CE1 3.44Å; N53-V370 VanDerWaalsContact CB-O 3.31Å; N53-V370 WeakPolarHBondContact CB-O 3.49Å; N53-V370 PolarHBondContact ND2-O 3.29Å; N53-F371 HydrophobicContact CB-CD1 4.14Å; N53-F371 HydrophobicContact CB-CE1 4.19Å
54T98.3Very high97.9Very high40 Ų4046.3 Ų46.325%0.24524%0.239CC..Hα-helixtrans-69.1-37172.9-56.60000111V50 A51 P52 I57 V58V50-T54 HydrophobicContact CG1-CG2 4.35Å; A51-T54 VanDerWaalsContact O-CB 3.24Å; A51-T54 WeakPolarHBondContact O-CB 3.43Å; A51-T54 PolarHBondContact O-N 3.38Å; P52-T54 PolarHBondContact O-N 3.32Å; T54-I57 WeakPolarHBondContact O-CG2 3.49Å; T54-V58 HydrophobicContact CG2-CG2 4.33Å; T54-V58 VanDerWaalsContact O-CB 3.29Å; T54-V58 WeakPolarHBondContact O-CB 3.29Å; T54-V58 WeakPolarHBondContact O-CG2 3.46Å; T54-V58 PolarHBondContact O-N 3.4Å; T54-V58 VanDerWaalsContact O-N 3.09Å
55L98.4Very high97.9Very high12 Ų1246.8 Ų46.86%0.06324%0.241CC..Hα-helixtrans-64.7-48.8174.9-55.9175.4000110.1I46 V50 P52 I57 V58 G59 L99 I102 D103 Q106I46-L55 HydrophobicContact CD1-CD2 4.25Å; I46-L55 HydrophobicContact CG1-CD2 4.46Å; I46-L55 HydrophobicContact CG2-CD1 4.28Å; I46-L55 HydrophobicContact CG2-CD2 4.05Å; V50-L55 HydrophobicContact CG1-CD2 3.75Å; V50-L55 HydrophobicContact CG1-CG 4.16Å; P52-L55 WeakPolarHBondContact O-CA 3.42Å; P52-L55 VanDerWaalsContact O-CB 3.27Å; P52-L55 WeakPolarHBondContact O-CB 3.22Å; P52-L55 PolarHBondContact O-N 3.17Å; L55-I57 PolarHBondContact O-N 2.91Å; L55-V58 PolarHBondContact O-N 3.17Å; L55-G59 PolarHBondContact O-N 3.24Å; L55-L99 HydrophobicContact CB-CB 4.42Å; L55-L99 HydrophobicContact CD2-CD2 4.26Å; L55-I102 HydrophobicContact CD1-CD1 4.19Å; L55-I102 HydrophobicContact CD1-CG1 4.06Å; L55-D103 HydrophobicContact CB-CB 4.35Å; L55-Q106 HydrophobicContact CD1-CB 3.9Å; L55-Q106 HydrophobicContact CD1-CG 4.03Å
56T97.9Very high98Very high2 Ų241.7 Ų41.71%0.01222%0.218CC..Hα-helixtrans-56.4-51.9178.6-35.30000111.7P52 V58 G59 L60 D103 F120 C124P52-T56 PolarHBondContact O-N 2.8Å; P52-T56 PolarHBondContact O-OG1 3.18Å; T56-V58 PolarHBondContact O-N 3.21Å; T56-G59 PolarHBondContact O-N 3.02Å; T56-L60 PolarHBondContact O-N 3.43Å; T56-D103 PolarHBondContact OG1-OD2 3.38Å; T56-F120 HydrophobicContact CG2-CD1 4.02Å; T56-F120 HydrophobicContact CG2-CE1 4.26Å; T56-C124 HydrophobicContact CG2-CB 3.61Å
57I98.4Very high98Very high46 Ų4640.6 Ų40.624%0.23621%0.212CC..Hα-helixtrans-69.4-35.2-177-163.160.3000112.4N53 T54 L55 L60 L61 F120 F371N53-I57 WeakPolarHBondContact O-CG2 3.36Å; N53-I57 PolarHBondContact O-N 3.17Å; T54-I57 WeakPolarHBondContact O-CG2 3.49Å; L55-I57 PolarHBondContact O-N 2.91Å; I57-L60 HydrophobicContact CD1-CD2 4.1Å; I57-L60 PolarHBondContact O-N 2.9Å; I57-L61 HydrophobicContact CG1-CD1 4.38Å; I57-L61 HydrophobicContact CG1-CG 4.49Å; I57-L61 WeakPolarHBondContact O-CB 3.42Å; I57-L61 VanDerWaalsContact O-CG 3.22Å; I57-L61 WeakPolarHBondContact O-CG 3.31Å; I57-L61 PolarHBondContact O-N 3.08Å; I57-F120 HydrophobicContact CB-CE1 3.95Å; I57-F120 HydrophobicContact CB-CZ 3.94Å; I57-F120 HydrophobicContact CD1-CZ 4.21Å; I57-F120 HydrophobicContact CG1-CZ 4.34Å; I57-F371 HydrophobicContact CB-CE1 4.37Å; I57-F371 HydrophobicContact CG2-CE1 3.94Å
58V98.7Very high98.1Very high63 Ų6341.1 Ų41.138%0.38222%0.215SC..Hα-helixtrans-65.8-44.1175.51680000110.2T54 L55 T56 L61 I62 L99T54-V58 HydrophobicContact CG2-CG2 4.33Å; T54-V58 VanDerWaalsContact O-CB 3.29Å; T54-V58 WeakPolarHBondContact O-CB 3.29Å; T54-V58 WeakPolarHBondContact O-CG2 3.46Å; T54-V58 PolarHBondContact O-N 3.4Å; T54-V58 VanDerWaalsContact O-N 3.09Å; L55-V58 PolarHBondContact O-N 3.17Å; T56-V58 PolarHBondContact O-N 3.21Å; V58-L61 PolarHBondContact O-N 3.02Å; V58-I62 HydrophobicContact CG1-CD1 3.94Å; V58-I62 VanDerWaalsContact O-CG1 3.31Å; V58-I62 WeakPolarHBondContact O-CG1 3.29Å; V58-I62 PolarHBondContact O-N 2.84Å; V58-L99 HydrophobicContact CB-CD1 4.36Å; V58-L99 HydrophobicContact CG1-CD1 3.96Å
59G98.6Very high98.2Very high1 Ų139 Ų391%0.0120%0.201CC..Hα-helixtrans-55-53.5172.300000111.1L55 T56 L61 I62 N63 Y96L55-G59 PolarHBondContact O-N 3.24Å; T56-G59 PolarHBondContact O-N 3.02Å; G59-L61 VanDerWaalsContact C-N 3.35Å; G59-L61 PolarHBondContact O-N 2.89Å; G59-I62 PolarHBondContact O-N 2.93Å; G59-N63 PolarHBondContact O-N 3.04Å; G59-Y96 VanDerWaalsContact C-CD2 3.42Å; G59-Y96 WeakPolarHBondContact O-CD2 3.34Å
60L98.6Very high98.4Very high13 Ų1329.8 Ų29.87%0.06817%0.166CC..Hα-helixtrans-56-47.9179.7179.162.5000111.8T56 I57 I62 N63 I64 Y96 C124 V127T56-L60 PolarHBondContact O-N 3.43Å; I57-L60 HydrophobicContact CD1-CD2 4.1Å; I57-L60 PolarHBondContact O-N 2.9Å; L60-I62 VanDerWaalsContact C-N 3.33Å; L60-I62 PolarHBondContact O-N 3.34Å; L60-N63 PolarHBondContact O-N 3.44Å; L60-I64 HydrophobicContact CD1-CD1 3.94Å; L60-I64 HydrophobicContact CD1-CG1 4.1Å; L60-I64 HydrophobicContact CD2-CD1 4.31Å; L60-I64 HydrophobicContact CG-CD1 3.77Å; L60-I64 HydrophobicContact CG-CG1 4.3Å; L60-I64 VanDerWaalsContact O-CG1 3.28Å; L60-I64 WeakPolarHBondContact O-CG1 3.47Å; L60-I64 PolarHBondContact O-N 2.9Å; L60-Y96 HydrophobicContact CB-CE2 4.26Å; L60-Y96 HydrophobicContact CD1-CE2 4.37Å; L60-C124 HydrophobicContact CB-CB 4.39Å; L60-C124 HydrophobicContact CD2-CB 3.94Å; L60-V127 HydrophobicContact CD1-CB 4.14Å; L60-V127 HydrophobicContact CD1-CG1 4.11Å; L60-V127 HydrophobicContact CD2-CB 4.33Å; L60-V127 HydrophobicContact CD2-CG1 4.42Å
61L98.8Very high98.4Very high88 Ų8830.3 Ų30.346%0.46117%0.169SC..Hα-helixtrans-60.4-41.2179.5-73171.9000112.1I57 V58 G59 I64 L65I57-L61 HydrophobicContact CG1-CD1 4.38Å; I57-L61 HydrophobicContact CG1-CG 4.49Å; I57-L61 WeakPolarHBondContact O-CB 3.42Å; I57-L61 VanDerWaalsContact O-CG 3.22Å; I57-L61 WeakPolarHBondContact O-CG 3.31Å; I57-L61 PolarHBondContact O-N 3.08Å; V58-L61 PolarHBondContact O-N 3.02Å; G59-L61 VanDerWaalsContact C-N 3.35Å; G59-L61 PolarHBondContact O-N 2.89Å; L61-I64 PolarHBondContact O-N 3.41Å; L61-L65 WeakPolarHBondContact O-CB 3.25Å; L61-L65 WeakPolarHBondContact O-CG 3.2Å; L61-L65 PolarHBondContact O-N 3.04Å
62I98.7Very high98.5Very high52 Ų5240.1 Ų40.127%0.26721%0.206SC..Hα-helixtrans-62.7-44.9176.4-69.8169000110.7V58 G59 L60 L65 S66 I95V58-I62 HydrophobicContact CG1-CD1 3.94Å; V58-I62 VanDerWaalsContact O-CG1 3.31Å; V58-I62 WeakPolarHBondContact O-CG1 3.29Å; V58-I62 PolarHBondContact O-N 2.84Å; G59-I62 PolarHBondContact O-N 2.93Å; L60-I62 VanDerWaalsContact C-N 3.33Å; L60-I62 PolarHBondContact O-N 3.34Å; I62-L65 PolarHBondContact O-N 3.48Å; I62-S66 WeakPolarHBondContact O-CB 3.42Å; I62-S66 PolarHBondContact O-N 3.39Å; I62-S66 PolarHBondContact O-OG 3.38Å; I62-S66 VanDerWaalsContact O-OG 3.05Å; I62-I95 HydrophobicContact CD1-CG2 3.62Å; I62-I95 HydrophobicContact CG2-CB 4.44Å; I62-I95 HydrophobicContact CG2-CG2 4.5Å
63N98.5Very high98.5Very high1 Ų144.1 Ų44.11%0.00522%0.22CC..Hα-helixtrans-63.1-44.8177.6-170.631.2000112.1G59 L60 S66 T67 Y96 S128 V132G59-N63 PolarHBondContact O-N 3.04Å; L60-N63 PolarHBondContact O-N 3.44Å; N63-S66 PolarHBondContact O-OG 3.36Å; N63-T67 WeakPolarHBondContact O-CB 3.44Å; N63-T67 PolarHBondContact O-N 3.13Å; N63-T67 PolarHBondContact O-OG1 3.46Å; N63-Y96 HydrophobicContact CB-CD2 3.92Å; N63-Y96 HydrophobicContact CB-CG 4.18Å; N63-S128 PolarHBondContact ND2-OG 3.11Å; N63-V132 WeakPolarHBondContact ND2-CG2 3.38Å
64I98.7Very high98.6Very high37 Ų3743.5 Ų43.519%0.1922%0.217CC..Hα-helixtrans-58.3-53.3175.4-69.9176.5000110.4L60 L61 S66 T67 V68 V127 F131L60-I64 HydrophobicContact CD1-CD1 3.94Å; L60-I64 HydrophobicContact CD1-CG1 4.1Å; L60-I64 HydrophobicContact CD2-CD1 4.31Å; L60-I64 HydrophobicContact CG-CD1 3.77Å; L60-I64 HydrophobicContact CG-CG1 4.3Å; L60-I64 VanDerWaalsContact O-CG1 3.28Å; L60-I64 WeakPolarHBondContact O-CG1 3.47Å; L60-I64 PolarHBondContact O-N 2.9Å; L61-I64 PolarHBondContact O-N 3.41Å; I64-S66 PolarHBondContact O-N 2.86Å; I64-T67 PolarHBondContact O-N 3.36Å; I64-V68 HydrophobicContact CG2-CG2 4.16Å; I64-V68 WeakPolarHBondContact O-CB 3.48Å; I64-V68 VanDerWaalsContact O-CG2 3.28Å; I64-V68 WeakPolarHBondContact O-CG2 3.44Å; I64-V68 PolarHBondContact O-N 3.43Å; I64-V127 HydrophobicContact CD1-CG1 4.27Å; I64-F131 HydrophobicContact CB-CE1 4.37Å; I64-F131 HydrophobicContact CB-CZ 4.36Å; I64-F131 HydrophobicContact CD1-CD2 4.39Å; I64-F131 HydrophobicContact CD1-CE2 3.92Å; I64-F131 HydrophobicContact CD1-CZ 4.29Å; I64-F131 HydrophobicContact CG1-CD1 4.36Å; I64-F131 HydrophobicContact CG1-CD2 3.67Å; I64-F131 HydrophobicContact CG1-CE1 4.27Å; I64-F131 HydrophobicContact CG1-CE2 3.57Å; I64-F131 HydrophobicContact CG1-CG 4.07Å; I64-F131 HydrophobicContact CG1-CZ 3.88Å; I64-F131 HydrophobicContact CG2-CD1 4.46Å; I64-F131 HydrophobicContact CG2-CE1 3.88Å; I64-F131 HydrophobicContact CG2-CE2 4.44Å; I64-F131 HydrophobicContact CG2-CZ 3.87Å
65L98.8Very high98.6Very high113 Ų11344.5 Ų44.559%0.59222%0.224SC*.Hα-helixtrans-62.1-44.5-175.7-70.8171000111.7L61 I62 T67 V68 V69L61-L65 WeakPolarHBondContact O-CB 3.25Å; L61-L65 WeakPolarHBondContact O-CG 3.2Å; L61-L65 PolarHBondContact O-N 3.04Å; I62-L65 PolarHBondContact O-N 3.48Å; L65-T67 PolarHBondContact O-N 3.42Å; L65-V68 PolarHBondContact O-N 3.26Å; L65-V69 WeakPolarHBondContact O-CG2 3.22Å; L65-V69 PolarHBondContact O-N 3.32Å; L65-V69 VanDerWaalsContact O-N 3.11Å
66S98.6Very high98.5Very high3 Ų345.5 Ų45.52%0.02123%0.231CC..Hα-helixtrans-63-40.5177.263.60000112.5I62 N63 I64 V69 L70 S89I62-S66 WeakPolarHBondContact O-CB 3.42Å; I62-S66 PolarHBondContact O-N 3.39Å; I62-S66 PolarHBondContact O-OG 3.38Å; I62-S66 VanDerWaalsContact O-OG 3.05Å; N63-S66 PolarHBondContact O-OG 3.36Å; I64-S66 PolarHBondContact O-N 2.86Å; S66-V69 WeakPolarHBondContact O-CB 3Å; S66-V69 PolarHBondContact O-N 2.61Å; S66-L70 PolarHBondContact O-N 2.94Å; S66-S89 PolarHBondContact O-OG 3.33Å
67T98.6Very high98.5Very high0 Ų045.4 Ų45.40%023%0.23CC..Hα-helixtrans-70.6-38.3176.5-58.20000112.2N63 I64 L65 V69 L70 V71 F131 V134N63-T67 WeakPolarHBondContact O-CB 3.44Å; N63-T67 PolarHBondContact O-N 3.13Å; N63-T67 PolarHBondContact O-OG1 3.46Å; I64-T67 PolarHBondContact O-N 3.36Å; L65-T67 PolarHBondContact O-N 3.42Å; T67-V69 VanDerWaalsContact C-N 3.25Å; T67-V69 PolarHBondContact O-N 2.92Å; T67-L70 CarbonylContact O-C 3.22Å; T67-L70 WeakPolarHBondContact O-CA 3.46Å; T67-L70 WeakPolarHBondContact O-CB 3.35Å; T67-L70 PolarHBondContact O-N 3.17Å; T67-V71 HydrophobicContact CG2-CG2 4.38Å; T67-V71 WeakPolarHBondContact O-CG2 3.24Å; T67-V71 PolarHBondContact O-N 3.48Å; T67-F131 HydrophobicContact CG2-CB 3.96Å; T67-F131 HydrophobicContact CG2-CD1 3.84Å; T67-F131 HydrophobicContact CG2-CG 4.41Å; T67-F131 VanDerWaalsContact CG2-O 3.3Å; T67-F131 WeakPolarHBondContact CG2-O 3.4Å; T67-V134 HydrophobicContact CG2-CB 4.41Å; T67-V134 HydrophobicContact CG2-CG1 4.33Å
68V98.6Very high98.4Very high71 Ų7145.5 Ų45.543%0.4323%0.233SC..Hα-helixtrans-61.6-36.3176.2166.10000111I64 L65 L70 V71 W72 F131I64-V68 HydrophobicContact CG2-CG2 4.16Å; I64-V68 WeakPolarHBondContact O-CB 3.48Å; I64-V68 VanDerWaalsContact O-CG2 3.28Å; I64-V68 WeakPolarHBondContact O-CG2 3.44Å; I64-V68 PolarHBondContact O-N 3.43Å; L65-V68 PolarHBondContact O-N 3.26Å; V68-L70 VanDerWaalsContact C-N 3.34Å; V68-V71 PolarHBondContact O-N 2.92Å; V68-W72 WeakPolarHBondContact O-CB 3.17Å; V68-W72 PolarHBondContact O-N 3.27Å; V68-F131 HydrophobicContact CG2-CE1 4.11Å
69V98.8Very high98.3Very high38 Ų3845 Ų4523%0.2323%0.226CC..Hα-helixtrans-60.2-43.9171.2171.80000111L65 S66 T67 W72 Y73 W84 A85 L88L65-V69 WeakPolarHBondContact O-CG2 3.22Å; L65-V69 PolarHBondContact O-N 3.32Å; L65-V69 VanDerWaalsContact O-N 3.11Å; S66-V69 WeakPolarHBondContact O-CB 3Å; S66-V69 PolarHBondContact O-N 2.61Å; T67-V69 VanDerWaalsContact C-N 3.25Å; T67-V69 PolarHBondContact O-N 2.92Å; V69-W72 WeakPolarHBondContact O-CB 3.45Å; V69-W72 PolarHBondContact O-N 3.45Å; V69-Y73 HydrophobicContact CG1-CD2 4.08Å; V69-Y73 HydrophobicContact CG1-CE2 3.96Å; V69-Y73 VanDerWaalsContact O-CD2 3.25Å; V69-Y73 WeakPolarHBondContact O-CD2 3.42Å; V69-Y73 PolarHBondContact O-N 3.31Å; V69-W84 HydrophobicContact CG1-CH2 3.53Å; V69-W84 HydrophobicContact CG1-CZ3 3.76Å; V69-A85 HydrophobicContact CG1-CB 4Å; V69-L88 HydrophobicContact CG2-CD2 4.29Å
70L98.6Very high98.3Very high0 Ų049.5 Ų49.50%025%0.247CC..Hα-helixtrans-62.1-44.8174.2-72.4180000112.2S66 T67 V68 W72 Y73 C74 A81 A85 F86 S89 I138 Y191S66-L70 PolarHBondContact O-N 2.94Å; T67-L70 CarbonylContact O-C 3.22Å; T67-L70 WeakPolarHBondContact O-CA 3.46Å; T67-L70 WeakPolarHBondContact O-CB 3.35Å; T67-L70 PolarHBondContact O-N 3.17Å; V68-L70 VanDerWaalsContact C-N 3.34Å; L70-W72 VanDerWaalsContact C-N 3.27Å; L70-W72 PolarHBondContact O-N 3.05Å; L70-Y73 PolarHBondContact O-N 3.01Å; L70-C74 WeakPolarHBondContact O-CB 3.27Å; L70-C74 PolarHBondContact O-N 3.46Å; L70-A81 HydrophobicContact CD2-CB 3.96Å; L70-A85 HydrophobicContact CD2-CB 3.91Å; L70-F86 HydrophobicContact CD1-CD1 4.49Å; L70-F86 HydrophobicContact CD2-CD1 3.7Å; L70-F86 HydrophobicContact CD2-CE1 3.76Å; L70-F86 HydrophobicContact CD2-CG 4.42Å; L70-S89 WeakPolarHBondContact CD1-OG 3.3Å; L70-S89 WeakPolarHBondContact CG-OG 3.48Å; L70-I138 HydrophobicContact CB-CD1 3.97Å; L70-I138 HydrophobicContact CB-CG2 4.22Å; L70-I138 HydrophobicContact CD2-CG2 4.48Å; L70-Y191 HydrophobicContact CD1-CD1 4.46Å; L70-Y191 HydrophobicContact CD1-CE1 3.82Å
71V98.6Very high98.2Very high28 Ų2849 Ų4917%0.1725%0.245CC..Hα-helixtrans-62.9-35.4178.4173.60000111.6T67 V68 C74 P75 V134 I138 C284T67-V71 HydrophobicContact CG2-CG2 4.38Å; T67-V71 WeakPolarHBondContact O-CG2 3.24Å; T67-V71 PolarHBondContact O-N 3.48Å; V68-V71 PolarHBondContact O-N 2.92Å; V71-C74 CarbonylContact O-C 3.6Å; V71-P75 VanDerWaalsContact O-CA 3.31Å; V71-P75 WeakPolarHBondContact O-CA 3.28Å; V71-P75 WeakPolarHBondContact O-CD 3.38Å; V71-P75 VanDerWaalsContact O-N 3.11Å; V71-V134 HydrophobicContact CG2-CG1 3.56Å; V71-I138 HydrophobicContact CB-CD1 4.5Å; V71-I138 HydrophobicContact CG2-CD1 3.83Å; V71-C284 HydrophobicContact CG1-CB 4.01Å; V71-C284 HydrophobicContact CG2-CB 4.28Å
72W98.6Very high98.2Very high211 Ų21146.9 Ų46.980%0.79924%0.236SC*.Hα-helixtrans-61.8-42.4175.7174.4-93.5000112.3V68 V69 L70V68-W72 WeakPolarHBondContact O-CB 3.17Å; V68-W72 PolarHBondContact O-N 3.27Å; V69-W72 WeakPolarHBondContact O-CB 3.45Å; V69-W72 PolarHBondContact O-N 3.45Å; L70-W72 VanDerWaalsContact C-N 3.27Å; L70-W72 PolarHBondContact O-N 3.05Å
73Y98.6Very high98.1Very high94 Ų9447.4 Ų47.437%0.36925%0.245SC..Hα-helixtrans-79.6-34.3177.4-75.3-67.7000113.4V69 L70 P75 A81 P82 W84 A85V69-Y73 HydrophobicContact CG1-CD2 4.08Å; V69-Y73 HydrophobicContact CG1-CE2 3.96Å; V69-Y73 VanDerWaalsContact O-CD2 3.25Å; V69-Y73 WeakPolarHBondContact O-CD2 3.42Å; V69-Y73 PolarHBondContact O-N 3.31Å; L70-Y73 PolarHBondContact O-N 3.01Å; Y73-P75 VanDerWaalsContact C-CD 3.47Å; Y73-P75 WeakPolarHBondContact O-CD 3.32Å; Y73-A81 HydrophobicContact CG-CB 4.44Å; Y73-P82 HydrophobicContact CD1-CG 4.49Å; Y73-P82 HydrophobicContact CD2-CG 4.16Å; Y73-P82 HydrophobicContact CE1-CG 4.18Å; Y73-P82 HydrophobicContact CE2-CG 3.83Å; Y73-P82 HydrophobicContact CG-CG 4.49Å; Y73-W84 HydrophobicContact CE2-CH2 4.02Å; Y73-W84 AromaticContact CE2-CZ2 3.73Å; Y73-W84 HydrophobicContact CE2-CZ2 3.73Å; Y73-A85 HydrophobicContact CD2-CB 4.43Å
74C98.4Very high98.2Very high0 Ų053.5 Ų53.50%027%0.268CS..  trans-128.761.8-171.5-59.10000112.1L70 V71 T76 A77 E79 A81 I138L70-C74 WeakPolarHBondContact O-CB 3.27Å; L70-C74 PolarHBondContact O-N 3.46Å; V71-C74 CarbonylContact O-C 3.6Å; C74-T76 PolarHBondContact O-N 3.28Å; C74-A77 PolarHBondContact O-N 3.38Å; C74-A77 VanDerWaalsContact O-N 3.09Å; C74-E79 VanDerWaalsContact C-OE2 3.28Å; C74-E79 WeakPolarHBondContact CA-OE2 3.34Å; C74-E79 HydrophobicContact CB-CB 4.22Å; C74-E79 PolarHBondContact SG-O 3.09Å; C74-E79 VanDerWaalsContact SG-O 3.37Å; C74-A81 PolarHBondContact SG-N 3.47Å; C74-A81 VanDerWaalsContact SG-N 3.43Å; C74-I138 HydrophobicContact CB-CB 4.47Å; C74-I138 HydrophobicContact CB-CD1 4.4Å; C74-I138 HydrophobicContact CB-CG1 4.23Å; C74-I138 HydrophobicContact CB-CG2 3.5Å; C74-I138 VanDerWaalsContact CB-CG2 3.5Å
75P98.2Very high98.1Very high62 Ų6251.8 Ų51.840%0.40326%0.259SS..THydrogen-bonded Turntrans-63.9-24.8-175.926.6-35.7000113.1V71 Y73 E79 C284V71-P75 VanDerWaalsContact O-CA 3.31Å; V71-P75 WeakPolarHBondContact O-CA 3.28Å; V71-P75 WeakPolarHBondContact O-CD 3.38Å; V71-P75 VanDerWaalsContact O-N 3.11Å; Y73-P75 VanDerWaalsContact C-CD 3.47Å; Y73-P75 WeakPolarHBondContact O-CD 3.32Å; P75-E79 WeakPolarHBondContact CD-OE1 3.31Å; P75-C284 VanDerWaalsContact O-CB 3.27Å; P75-C284 WeakPolarHBondContact O-CB 3.38Å; P75-C284 PolarHBondContact O-SG 2.95Å
76T98Very high98.1Very high32 Ų3246.4 Ų46.420%0.19623%0.231CC..THydrogen-bonded Turntrans-100.4-0.9176.670.40000113.8C74 T78 E79 G143 P283C74-T76 PolarHBondContact O-N 3.28Å; T76-T78 PolarHBondContact O-N 3.44Å; T76-T78 PolarHBondContact OG1-OG1 2.73Å; T76-E79 WeakPolarHBondContact CB-OE1 3.49Å; T76-E79 PolarHBondContact N-OE1 3.15Å; T76-E79 VanDerWaalsContact N-OE1 3.12Å; T76-E79 PolarHBondContact N-OE2 2.9Å; T76-E79 PolarHBondContact OG1-OE1 2.94Å; T76-E79 PolarHBondContact OG1-OE2 3.11Å; T76-E79 VanDerWaalsContact OG1-OE2 3.04Å; T76-G143 WeakPolarHBondContact O-CA 3.24Å; T76-P283 WeakPolarHBondContact O-CG 3.16Å
77A97.6Very high98.2Very high0 Ų049.5 Ų49.50%025%0.247CC..SBendtrans54.329.8-171.900000113C74 E79 I138 G141 G143 I149C74-A77 PolarHBondContact O-N 3.38Å; C74-A77 VanDerWaalsContact O-N 3.09Å; A77-E79 PolarHBondContact N-OE2 2.92Å; A77-E79 VanDerWaalsContact N-OE2 3.13Å; A77-I138 HydrophobicContact CB-CB 4.47Å; A77-I138 HydrophobicContact CB-CG1 3.83Å; A77-G141 CarbonylContact O-C 3.58Å; A77-G141 VanDerWaalsContact O-C 3.22Å; A77-G141 WeakPolarHBondContact O-CA 3.23Å; A77-G143 WeakPolarHBondContact O-CA 3.17Å; A77-G143 PolarHBondContact O-N 2.87Å; A77-I149 HydrophobicContact CB-CD1 3.73Å
78T96.5Very high98.2Very high48 Ų4852.8 Ų52.829%0.29426%0.264SS..  trans-115.8-18.8174.270.10000112.8T76 R144T76-T78 PolarHBondContact O-N 3.44Å; T76-T78 PolarHBondContact OG1-OG1 2.73Å; T78-R144 HydrophobicContact CG2-CG 3.86Å; T78-R144 PolarHBondContact O-NH2 3.16Å
79E97.1Very high98.2Very high53 Ų5349.4 Ų49.425%0.24824%0.244CC..SBendtrans-80.6170-178-48.685165.800111.8C74 P75 T76 A77C74-E79 VanDerWaalsContact C-OE2 3.28Å; C74-E79 WeakPolarHBondContact CA-OE2 3.34Å; C74-E79 HydrophobicContact CB-CB 4.22Å; C74-E79 PolarHBondContact SG-O 3.09Å; C74-E79 VanDerWaalsContact SG-O 3.37Å; P75-E79 WeakPolarHBondContact CD-OE1 3.31Å; T76-E79 WeakPolarHBondContact CB-OE1 3.49Å; T76-E79 PolarHBondContact N-OE1 3.15Å; T76-E79 VanDerWaalsContact N-OE1 3.12Å; T76-E79 PolarHBondContact N-OE2 2.9Å; T76-E79 PolarHBondContact OG1-OE1 2.94Å; T76-E79 PolarHBondContact OG1-OE2 3.11Å; T76-E79 VanDerWaalsContact OG1-OE2 3.04Å; A77-E79 PolarHBondContact N-OE2 2.92Å; A77-E79 VanDerWaalsContact N-OE2 3.13Å
80E96.6Very high98.2Very high96 Ų9647.8 Ų47.845%0.44923%0.234SC..  trans-106.8121.2174.9-174.573.3-135.700109.5G198 V199E80-G198 WeakPolarHBondContact OE1-CA 3.23Å; E80-V199 VanDerWaalsContact CD-N 3.28Å; E80-V199 PolarHBondContact OE1-N 3.48Å; E80-V199 WeakPolarHBondContact OE2-CA 3.37Å; E80-V199 WeakPolarHBondContact OE2-CB 3.31Å; E80-V199 PolarHBondContact OE2-N 3.04Å
81A97.6Very high98.2Very high3 Ų352.6 Ų52.63%0.02526%0.259CS..  trans-84.3153.2171.500000110.3L70 Y73 C74 A85 F86L70-A81 HydrophobicContact CD2-CB 3.96Å; Y73-A81 HydrophobicContact CG-CB 4.44Å; C74-A81 PolarHBondContact SG-N 3.47Å; C74-A81 VanDerWaalsContact SG-N 3.43Å; A81-A85 HydrophobicContact CB-CB 4.26Å; A81-F86 HydrophobicContact CB-CE1 4.35Å; A81-F86 HydrophobicContact CB-CE2 3.87Å; A81-F86 HydrophobicContact CB-CZ 3.77Å; A81-F86 WeakPolarHBondContact O-CE2 3.43Å
82P98.1Very high98.2Very high42 Ų4251.3 Ų51.327%0.27325%0.252SS..  trans-62.7144173.127.9-35.3000110.9Y73 W84 A85Y73-P82 HydrophobicContact CD1-CG 4.49Å; Y73-P82 HydrophobicContact CD2-CG 4.16Å; Y73-P82 HydrophobicContact CE1-CG 4.18Å; Y73-P82 HydrophobicContact CE2-CG 3.83Å; Y73-P82 HydrophobicContact CG-CG 4.49Å; P82-W84 HydrophobicContact CG-CD2 4.48Å; P82-W84 HydrophobicContact CG-CZ2 4.04Å; P82-W84 VanDerWaalsContact CG-NE1 3.33Å; P82-W84 PolarHBondContact O-N 3.03Å; P82-A85 HydrophobicContact CG-CB 4.17Å; P82-A85 VanDerWaalsContact O-CB 3.31Å; P82-A85 WeakPolarHBondContact O-CB 3.48Å; P82-A85 PolarHBondContact O-N 3.2Å
83S98.2Very high98.2Very high64 Ų6441.3 Ų41.345%0.44821%0.214SC..Hα-helixtrans-49.7-36.6-176.1-60.80000114.6A85 F86 L87 A195S83-A85 PolarHBondContact O-N 3.4Å; S83-F86 PolarHBondContact O-N 3.41Å; S83-L87 PolarHBondContact O-N 3.21Å; S83-A195 WeakPolarHBondContact CB-O 3.45Å; S83-A195 PolarHBondContact OG-O 3.5Å
84W98.6Very high98.2Very high129 Ų12940.6 Ų40.649%0.48921%0.213SC..Hα-helixtrans-64.4-28.3179.170.4-102.2000112.8V69 Y73 P82 L87 L88V69-W84 HydrophobicContact CG1-CH2 3.53Å; V69-W84 HydrophobicContact CG1-CZ3 3.76Å; Y73-W84 HydrophobicContact CE2-CH2 4.02Å; Y73-W84 AromaticContact CE2-CZ2 3.73Å; Y73-W84 HydrophobicContact CE2-CZ2 3.73Å; P82-W84 HydrophobicContact CG-CD2 4.48Å; P82-W84 HydrophobicContact CG-CZ2 4.04Å; P82-W84 VanDerWaalsContact CG-NE1 3.33Å; P82-W84 PolarHBondContact O-N 3.03Å; W84-L87 PolarHBondContact O-N 3Å; W84-L88 HydrophobicContact CE3-CB 4.46Å; W84-L88 HydrophobicContact CE3-CD2 4.45Å; W84-L88 HydrophobicContact CZ3-CD2 3.9Å; W84-L88 VanDerWaalsContact O-CB 3.3Å; W84-L88 WeakPolarHBondContact O-CB 3.42Å; W84-L88 PolarHBondContact O-N 3.24Å
85A98.6Very high98.2Very high0 Ų043.1 Ų43.10%023%0.226CC..Hα-helixtrans-69.9-39.1177.800000110.8V69 L70 Y73 A81 P82 S83 L88 S89V69-A85 HydrophobicContact CG1-CB 4Å; L70-A85 HydrophobicContact CD2-CB 3.91Å; Y73-A85 HydrophobicContact CD2-CB 4.43Å; A81-A85 HydrophobicContact CB-CB 4.26Å; P82-A85 HydrophobicContact CG-CB 4.17Å; P82-A85 VanDerWaalsContact O-CB 3.31Å; P82-A85 WeakPolarHBondContact O-CB 3.48Å; P82-A85 PolarHBondContact O-N 3.2Å; S83-A85 PolarHBondContact O-N 3.4Å; A85-L88 WeakPolarHBondContact O-CB 3.28Å; A85-L88 PolarHBondContact O-N 3.16Å; A85-S89 PolarHBondContact O-N 2.89Å; A85-S89 PolarHBondContact O-OG 2.88Å
86F98.7Very high98.2Very high0 Ų040.3 Ų40.30%021%0.207CC..Hα-helixtrans-66.7-40.6171.7-64.6-60000112.2L70 A81 S83 L88 S89 A90 I138 Y191 A195 V199L70-F86 HydrophobicContact CD1-CD1 4.49Å; L70-F86 HydrophobicContact CD2-CD1 3.7Å; L70-F86 HydrophobicContact CD2-CE1 3.76Å; L70-F86 HydrophobicContact CD2-CG 4.42Å; A81-F86 HydrophobicContact CB-CE1 4.35Å; A81-F86 HydrophobicContact CB-CE2 3.87Å; A81-F86 HydrophobicContact CB-CZ 3.77Å; A81-F86 WeakPolarHBondContact O-CE2 3.43Å; S83-F86 PolarHBondContact O-N 3.41Å; F86-L88 VanDerWaalsContact C-N 3.32Å; F86-L88 PolarHBondContact O-N 3.12Å; F86-S89 PolarHBondContact O-N 2.9Å; F86-A90 WeakPolarHBondContact O-CB 3.5Å; F86-A90 PolarHBondContact O-N 3.34Å; F86-I138 HydrophobicContact CE1-CG2 4.39Å; F86-Y191 HydrophobicContact CD1-CD1 4.41Å; F86-A195 HydrophobicContact CB-CB 3.73Å; F86-V199 HydrophobicContact CE2-CG2 4.27Å; F86-V199 HydrophobicContact CZ-CG2 3.69Å
87L98.8Very high98.3Very high69 Ų6939.1 Ų39.136%0.36120%0.2SC..Hα-helixtrans-62.2-39.8173-67.2176.3000111.9S83 W84 S89 A90 L91 L192 A195 F196S83-L87 PolarHBondContact O-N 3.21Å; W84-L87 PolarHBondContact O-N 3Å; L87-S89 VanDerWaalsContact C-N 3.35Å; L87-A90 PolarHBondContact O-N 3.38Å; L87-L91 WeakPolarHBondContact O-CB 3.35Å; L87-L91 PolarHBondContact O-N 2.87Å; L87-L192 HydrophobicContact CD2-CD2 3.87Å; L87-A195 HydrophobicContact CD2-CB 3.64Å; L87-A195 HydrophobicContact CG-CB 3.77Å; L87-F196 HydrophobicContact CD2-CE2 4.35Å; L87-F196 HydrophobicContact CD2-CZ 4.19Å
88L98.7Very high98.3Very high68 Ų6839.3 Ų39.336%0.35620%0.201SC..Hα-helixtrans-62-42.1175.7179.464.1000111.1V69 W84 A85 F86 G92V69-L88 HydrophobicContact CG2-CD2 4.29Å; W84-L88 HydrophobicContact CE3-CB 4.46Å; W84-L88 HydrophobicContact CE3-CD2 4.45Å; W84-L88 HydrophobicContact CZ3-CD2 3.9Å; W84-L88 VanDerWaalsContact O-CB 3.3Å; W84-L88 WeakPolarHBondContact O-CB 3.42Å; W84-L88 PolarHBondContact O-N 3.24Å; A85-L88 WeakPolarHBondContact O-CB 3.28Å; A85-L88 PolarHBondContact O-N 3.16Å; F86-L88 VanDerWaalsContact C-N 3.32Å; F86-L88 PolarHBondContact O-N 3.12Å; L88-G92 WeakPolarHBondContact O-CA 3.5Å; L88-G92 PolarHBondContact O-N 2.97Å
89S98.8Very high98.4Very high1 Ų138.2 Ų38.21%0.00719%0.193CC..Hα-helixtrans-70.7-36.3175.9-61.40000113.2S66 L70 A85 F86 L87 G92 L93S66-S89 PolarHBondContact O-OG 3.33Å; L70-S89 WeakPolarHBondContact CD1-OG 3.3Å; L70-S89 WeakPolarHBondContact CG-OG 3.48Å; A85-S89 PolarHBondContact O-N 2.89Å; A85-S89 PolarHBondContact O-OG 2.88Å; F86-S89 PolarHBondContact O-N 2.9Å; L87-S89 VanDerWaalsContact C-N 3.35Å; S89-G92 PolarHBondContact O-N 2.91Å; S89-L93 VanDerWaalsContact O-CB 3.31Å; S89-L93 WeakPolarHBondContact O-CB 3.37Å; S89-L93 PolarHBondContact O-N 3.47Å
90A98.9Very high98.4Very high3 Ų336.9 Ų36.93%0.02519%0.187CC..Hα-helixtrans-60.8-49.8172.400000111.2F86 L87 F94 I188 L192F86-A90 WeakPolarHBondContact O-CB 3.5Å; F86-A90 PolarHBondContact O-N 3.34Å; L87-A90 PolarHBondContact O-N 3.38Å; A90-F94 WeakPolarHBondContact O-CB 3.43Å; A90-F94 PolarHBondContact O-N 2.73Å; A90-I188 HydrophobicContact CB-CG2 4.31Å; A90-L192 HydrophobicContact CB-CD2 3.86Å; A90-L192 HydrophobicContact CB-CG 4.09Å
91L98.8Very high98.5Very high101 Ų10133.6 Ų33.653%0.52918%0.177SC..Hα-helixtrans-65.6-42.2177179.361.1000111.4L87 F94 I95L87-L91 WeakPolarHBondContact O-CB 3.35Å; L87-L91 PolarHBondContact O-N 2.87Å; L91-F94 PolarHBondContact O-N 2.94Å; L91-I95 HydrophobicContact CD1-CD1 3.98Å; L91-I95 HydrophobicContact CD1-CG1 4.22Å; L91-I95 HydrophobicContact CG-CD1 3.84Å; L91-I95 HydrophobicContact CG-CG1 4.47Å; L91-I95 VanDerWaalsContact O-CG1 3.27Å; L91-I95 WeakPolarHBondContact O-CG1 3.42Å; L91-I95 PolarHBondContact O-N 2.96Å
92G98.8Very high98.5Very high2 Ų233.4 Ų33.42%0.02118%0.176CC..Hα-helixtrans-62.5-45.5-179.300000112.4L88 S89 I95 Y96L88-G92 WeakPolarHBondContact O-CA 3.5Å; L88-G92 PolarHBondContact O-N 2.97Å; S89-G92 PolarHBondContact O-N 2.91Å; G92-I95 PolarHBondContact O-N 3.32Å; G92-Y96 WeakPolarHBondContact O-CB 3.15Å; G92-Y96 PolarHBondContact O-N 3.41Å
93L98.8Very high98.5Very high0 Ų032 Ų320%017%0.166CC..Hα-helixtrans-68.3-36.5175.8-175.955.7000112.2S89 Y96 Q97 V132 Q184 I187 I188 Y191S89-L93 VanDerWaalsContact O-CB 3.31Å; S89-L93 WeakPolarHBondContact O-CB 3.37Å; S89-L93 PolarHBondContact O-N 3.47Å; L93-Y96 HydrophobicContact CD1-CD1 4.3Å; L93-Y96 WeakPolarHBondContact O-CB 3.49Å; L93-Y96 PolarHBondContact O-N 3.11Å; L93-Q97 WeakPolarHBondContact O-CB 3.46Å; L93-Q97 PolarHBondContact O-N 3.49Å; L93-V132 HydrophobicContact CD1-CG2 3.66Å; L93-V132 HydrophobicContact CD2-CG2 4.49Å; L93-Q184 HydrophobicContact CD1-CG 4.21Å; L93-I187 HydrophobicContact CD2-CB 3.96Å; L93-I187 HydrophobicContact CD2-CG2 3.57Å; L93-I188 HydrophobicContact CB-CG1 4.03Å; L93-I188 HydrophobicContact CD2-CG1 3.95Å; L93-I188 HydrophobicContact CG-CD1 4.27Å; L93-I188 HydrophobicContact CG-CG1 3.93Å; L93-Y191 HydrophobicContact CB-CE2 4.42Å; L93-Y191 HydrophobicContact CD2-CE2 3.97Å
94F98.7Very high98.4Very high79 Ų7930 Ų3035%0.34616%0.155SC..Hα-helixtrans-62.5-42.6172.6175.8-100.6000112.1Y38 A90 L91 S98 I188Y38-F94 HydrophobicContact CE1-CE2 4.34Å; Y38-F94 AromaticContact CE1-CZ 3.85Å; Y38-F94 HydrophobicContact CE1-CZ 3.85Å; Y38-F94 AromaticContact CZ-CZ 3.7Å; Y38-F94 WeakPolarHBondContact OH-CE1 3.31Å; Y38-F94 WeakPolarHBondContact OH-CZ 3.27Å; A90-F94 WeakPolarHBondContact O-CB 3.43Å; A90-F94 PolarHBondContact O-N 2.73Å; L91-F94 PolarHBondContact O-N 2.94Å; F94-S98 VanDerWaalsContact O-CB 3.28Å; F94-S98 WeakPolarHBondContact O-CB 3.49Å; F94-S98 PolarHBondContact O-N 2.99Å; F94-S98 PolarHBondContact O-OG 2.82Å; F94-I188 HydrophobicContact CB-CD1 3.93Å; F94-I188 HydrophobicContact CD2-CD1 4.46Å
95I98.7Very high98.4Very high54 Ų5425.2 Ų25.228%0.27714%0.137SC..Hα-helixtrans-65.4-45.1175.6-68.1166000110.2I62 L91 G92 S98 L99I62-I95 HydrophobicContact CD1-CG2 3.62Å; I62-I95 HydrophobicContact CG2-CB 4.44Å; I62-I95 HydrophobicContact CG2-CG2 4.5Å; L91-I95 HydrophobicContact CD1-CD1 3.98Å; L91-I95 HydrophobicContact CD1-CG1 4.22Å; L91-I95 HydrophobicContact CG-CD1 3.84Å; L91-I95 HydrophobicContact CG-CG1 4.47Å; L91-I95 VanDerWaalsContact O-CG1 3.27Å; L91-I95 WeakPolarHBondContact O-CG1 3.42Å; L91-I95 PolarHBondContact O-N 2.96Å; G92-I95 PolarHBondContact O-N 3.32Å; I95-S98 PolarHBondContact O-N 3.04Å; I95-L99 HydrophobicContact CG2-CD1 3.8Å; I95-L99 HydrophobicContact CG2-CG 4.12Å; I95-L99 WeakPolarHBondContact O-CG 3.31Å; I95-L99 PolarHBondContact O-N 3.48Å
96Y98.7Very high98.4Very high2 Ų225.2 Ų25.21%0.00814%0.137CC..Hα-helixtrans-51.6-59.3174176.1-88.2000110.7G59 L60 N63 G92 L93 S98 L99 D100 D125 S128G59-Y96 VanDerWaalsContact C-CD2 3.42Å; G59-Y96 WeakPolarHBondContact O-CD2 3.34Å; L60-Y96 HydrophobicContact CB-CE2 4.26Å; L60-Y96 HydrophobicContact CD1-CE2 4.37Å; N63-Y96 HydrophobicContact CB-CD2 3.92Å; N63-Y96 HydrophobicContact CB-CG 4.18Å; G92-Y96 WeakPolarHBondContact O-CB 3.15Å; G92-Y96 PolarHBondContact O-N 3.41Å; L93-Y96 HydrophobicContact CD1-CD1 4.3Å; L93-Y96 WeakPolarHBondContact O-CB 3.49Å; L93-Y96 PolarHBondContact O-N 3.11Å; Y96-S98 PolarHBondContact O-N 3.17Å; Y96-L99 PolarHBondContact O-N 3.44Å; Y96-L99 VanDerWaalsContact O-N 3.11Å; Y96-D100 HydrophobicContact CE1-CB 4.23Å; Y96-D100 WeakPolarHBondContact O-CB 3.45Å; Y96-D100 PolarHBondContact O-N 2.98Å; Y96-D100 PolarHBondContact OH-OD1 3.45Å; Y96-D125 WeakPolarHBondContact OH-CA 3.3Å; Y96-D125 PolarHBondContact OH-OD1 2.95Å; Y96-S128 VanDerWaalsContact CE1-OG 3.31Å; Y96-S128 WeakPolarHBondContact CE1-OG 3.34Å; Y96-S128 VanDerWaalsContact CE2-CB 3.5Å; Y96-S128 WeakPolarHBondContact CE2-OG 3.17Å; Y96-S128 WeakPolarHBondContact OH-CB 3.46Å; Y96-S128 PolarHBondContact OH-OG 3.46Å
97Q98.4Very high98.3Very high8 Ų825.6 Ų25.64%0.03714%0.141CC..Hα-helixtrans-55.2-40.3179.8178.6176.583.200112W39 L93 A101 T181 Q184W39-Q97 HydrophobicContact CZ2-CG 4.4Å; L93-Q97 WeakPolarHBondContact O-CB 3.46Å; L93-Q97 PolarHBondContact O-N 3.49Å; Q97-A101 VanDerWaalsContact O-CB 3.24Å; Q97-A101 WeakPolarHBondContact O-CB 3.38Å; Q97-A101 PolarHBondContact O-N 2.94Å; Q97-T181 PolarHBondContact NE2-O 3.08Å; Q97-Q184 VanDerWaalsContact CB-OE1 3.26Å
98S98.5Very high98.2Very high4 Ų429.7 Ų29.73%0.02815%0.151CC..Hα-helixtrans-66.7-42.6-179.5-63.60000112.3Y38 F94 I95 Y96 I102Y38-S98 WeakPolarHBondContact CE1-OG 3.49Å; Y38-S98 PolarHBondContact OH-OG 2.95Å; F94-S98 VanDerWaalsContact O-CB 3.28Å; F94-S98 WeakPolarHBondContact O-CB 3.49Å; F94-S98 PolarHBondContact O-N 2.99Å; F94-S98 PolarHBondContact O-OG 2.82Å; I95-S98 PolarHBondContact O-N 3.04Å; Y96-S98 PolarHBondContact O-N 3.17Å; S98-I102 WeakPolarHBondContact O-CG1 3.26Å; S98-I102 WeakPolarHBondContact O-CG2 3.39Å; S98-I102 PolarHBondContact O-N 3.06Å
99L98.6Very high98.1Very high24 Ų2431.4 Ų31.413%0.12615%0.153CC..Hα-helixtrans-74.9-39.6-178.2-67.7-177.4000112L55 V58 I95 Y96 I102 D103L55-L99 HydrophobicContact CB-CB 4.42Å; L55-L99 HydrophobicContact CD2-CD2 4.26Å; V58-L99 HydrophobicContact CB-CD1 4.36Å; V58-L99 HydrophobicContact CG1-CD1 3.96Å; I95-L99 HydrophobicContact CG2-CD1 3.8Å; I95-L99 HydrophobicContact CG2-CG 4.12Å; I95-L99 WeakPolarHBondContact O-CG 3.31Å; I95-L99 PolarHBondContact O-N 3.48Å; Y96-L99 PolarHBondContact O-N 3.44Å; Y96-L99 VanDerWaalsContact O-N 3.11Å; L99-I102 HydrophobicContact CD2-CD1 4.11Å; L99-I102 VanDerWaalsContact O-CG1 3.29Å; L99-I102 WeakPolarHBondContact O-CG1 3.36Å; L99-I102 PolarHBondContact O-N 3.44Å; L99-D103 PolarHBondContact O-N 3.19Å
100D97.9Very high97.9Very high25 Ų2532.5 Ų32.513%0.13416%0.16CC..Hα-helixtrans-57-55.8172.7-170.885.4000110.8Y96 I102 D103Y96-D100 HydrophobicContact CE1-CB 4.23Å; Y96-D100 WeakPolarHBondContact O-CB 3.45Å; Y96-D100 PolarHBondContact O-N 2.98Å; Y96-D100 PolarHBondContact OH-OD1 3.45Å; D100-I102 PolarHBondContact O-N 2.89Å; D100-D103 VanDerWaalsContact O-CG 3.24Å; D100-D103 PolarHBondContact O-N 3.4Å; D100-D103 VanDerWaalsContact O-N 3.14Å
101A97.3Very high97.7Very high27 Ų2737.6 Ų37.622%0.22319%0.187CC..Hα-helixtrans-63.2-19.9-178.400000115.2W39 Q97W39-A101 HydrophobicContact CD2-CB 3.5Å; W39-A101 HydrophobicContact CE3-CB 3.93Å; W39-A101 HydrophobicContact CG-CB 3.92Å; W39-A101 HydrophobicContact CH2-CB 4.03Å; W39-A101 HydrophobicContact CZ2-CB 3.62Å; W39-A101 HydrophobicContact CZ3-CB 4.18Å; Q97-A101 VanDerWaalsContact O-CB 3.24Å; Q97-A101 WeakPolarHBondContact O-CB 3.38Å; Q97-A101 PolarHBondContact O-N 2.94Å
102I98.4Very high97.6Very high0 Ų034.5 Ų34.50%017%0.173CC..Hα-helixtrans-100.8-9.2179.670.2175.6000114W39 L42 V43 I46 L55 S98 L99 D100 G104 K105 Q106W39-I102 HydrophobicContact CB-CG2 3.89Å; W39-I102 HydrophobicContact CG-CG2 4.36Å; W39-I102 WeakPolarHBondContact O-CG2 3.18Å; L42-I102 HydrophobicContact CB-CG2 4.29Å; L42-I102 HydrophobicContact CD2-CD1 3.85Å; L42-I102 HydrophobicContact CD2-CG2 4.07Å; L42-I102 HydrophobicContact CG-CD1 3.86Å; L42-I102 HydrophobicContact CG-CG2 4.35Å; V43-I102 HydrophobicContact CB-CB 4.15Å; V43-I102 HydrophobicContact CB-CG2 4.27Å; V43-I102 HydrophobicContact CG2-CB 4.44Å; I46-I102 HydrophobicContact CD1-CD1 4.1Å; I46-I102 HydrophobicContact CG1-CD1 3.73Å; L55-I102 HydrophobicContact CD1-CD1 4.19Å; L55-I102 HydrophobicContact CD1-CG1 4.06Å; S98-I102 WeakPolarHBondContact O-CG1 3.26Å; S98-I102 WeakPolarHBondContact O-CG2 3.39Å; S98-I102 PolarHBondContact O-N 3.06Å; L99-I102 HydrophobicContact CD2-CD1 4.11Å; L99-I102 VanDerWaalsContact O-CG1 3.29Å; L99-I102 WeakPolarHBondContact O-CG1 3.36Å; L99-I102 PolarHBondContact O-N 3.44Å; D100-I102 PolarHBondContact O-N 2.89Å; I102-G104 PolarHBondContact O-N 3.43Å; I102-K105 HydrophobicContact CG2-CD 4.34Å; I102-K105 CarbonylContact O-C 3.58Å; I102-K105 WeakPolarHBondContact O-CB 3.41Å; I102-K105 PolarHBondContact O-N 2.88Å; I102-K105 VanDerWaalsContact O-N 3.17Å; I102-Q106 WeakPolarHBondContact O-CB 3.44Å; I102-Q106 PolarHBondContact O-N 3.05Å
103D98Very high97.4Very high13 Ų1338 Ų387%0.0720%0.197CC..Hα-helixtrans-65.3-44.3-174.770.44.3000111.9P52 L55 T56 L99 D100 K105 Q106 A107P52-D103 HydrophobicContact CB-CB 4.37Å; P52-D103 WeakPolarHBondContact CB-O 3.38Å; L55-D103 HydrophobicContact CB-CB 4.35Å; T56-D103 PolarHBondContact OG1-OD2 3.38Å; L99-D103 PolarHBondContact O-N 3.19Å; D100-D103 VanDerWaalsContact O-CG 3.24Å; D100-D103 PolarHBondContact O-N 3.4Å; D100-D103 VanDerWaalsContact O-N 3.14Å; D103-K105 VanDerWaalsContact C-N 3.28Å; D103-K105 PolarHBondContact O-N 2.93Å; D103-Q106 CarbonylContact O-C 3.47Å; D103-Q106 WeakPolarHBondContact O-CB 3.32Å; D103-Q106 PolarHBondContact O-N 3.47Å; D103-A107 WeakPolarHBondContact O-CB 3.15Å; D103-A107 PolarHBondContact O-N 2.82Å
104G96.4Very high97.2Very high21 Ų2139.8 Ų39.822%0.21621%0.21CC..Hα-helixtrans-70.3-28.6175.500000111.5I102 R108I102-G104 PolarHBondContact O-N 3.43Å; G104-R108 WeakPolarHBondContact O-CG 3.38Å; G104-R108 PolarHBondContact O-N 3.47Å; G104-R108 PolarHBondContact O-NE 3.21Å; G104-R108 PolarHBondContact O-NH1 3.18Å
105K97.5Very high97.1Very high28 Ų2836.7 Ų36.712%0.12220%0.199CC..Hα-helixtrans-67.8-43.8171.8-64.1176.8177.8-71.10110.6W39 N40 V43 I102 D103 A107 R108 R109W39-K105 HydrophobicContact CB-CD 4.24Å; N40-K105 PolarHBondContact OD1-NZ 3.25Å; V43-K105 HydrophobicContact CB-CB 4.19Å; V43-K105 HydrophobicContact CG1-CB 4.33Å; V43-K105 HydrophobicContact CG2-CB 3.83Å; I102-K105 HydrophobicContact CG2-CD 4.34Å; I102-K105 CarbonylContact O-C 3.58Å; I102-K105 WeakPolarHBondContact O-CB 3.41Å; I102-K105 PolarHBondContact O-N 2.88Å; I102-K105 VanDerWaalsContact O-N 3.17Å; D103-K105 VanDerWaalsContact C-N 3.28Å; D103-K105 PolarHBondContact O-N 2.93Å; K105-A107 VanDerWaalsContact C-N 3.34Å; K105-R108 PolarHBondContact O-N 3.4Å; K105-R109 WeakPolarHBondContact O-CB 3.43Å; K105-R109 PolarHBondContact O-N 3.44Å
106Q98.1Very high97Very high0 Ų034.1 Ų34.10%019%0.186CC..Hα-helixtrans-62.1-45.8174.9-17869.2-7.300109.6V43 P47 V50 P52 L55 I102 D103 R108 R109 T110V43-Q106 HydrophobicContact CG2-CB 4.05Å; P47-Q106 PolarHBondContact O-NE2 3.17Å; P47-Q106 VanDerWaalsContact O-NE2 3.12Å; V50-Q106 PolarHBondContact O-NE2 3.15Å; P52-Q106 HydrophobicContact CG-CB 4.45Å; P52-Q106 HydrophobicContact CG-CG 4.26Å; L55-Q106 HydrophobicContact CD1-CB 3.9Å; L55-Q106 HydrophobicContact CD1-CG 4.03Å; I102-Q106 WeakPolarHBondContact O-CB 3.44Å; I102-Q106 PolarHBondContact O-N 3.05Å; D103-Q106 CarbonylContact O-C 3.47Å; D103-Q106 WeakPolarHBondContact O-CB 3.32Å; D103-Q106 PolarHBondContact O-N 3.47Å; Q106-R108 VanDerWaalsContact C-N 3.31Å; Q106-R108 PolarHBondContact O-N 2.76Å; Q106-R109 CarbonylContact O-C 3.6Å; Q106-R109 WeakPolarHBondContact O-CA 3.21Å; Q106-R109 WeakPolarHBondContact O-CB 3.43Å; Q106-R109 PolarHBondContact O-N 3Å; Q106-T110 HydrophobicContact CG-CG2 4.42Å; Q106-T110 PolarHBondContact O-N 2.86Å; Q106-T110 PolarHBondContact O-OG1 2.61Å
107A97.1Very high96.9Very high9 Ų934.8 Ų34.87%0.07419%0.194CC..Hα-helixtrans-57.2-42.4178.100000112.6P52 D103 K105 N111 S112 S113P52-A107 HydrophobicContact CB-CB 4.07Å; P52-A107 VanDerWaalsContact CG-CA 3.49Å; P52-A107 HydrophobicContact CG-CB 3.56Å; D103-A107 WeakPolarHBondContact O-CB 3.15Å; D103-A107 PolarHBondContact O-N 2.82Å; K105-A107 VanDerWaalsContact C-N 3.34Å; A107-N111 PolarHBondContact O-N 3.4Å; A107-N111 VanDerWaalsContact O-N 3.08Å; A107-S112 PolarHBondContact O-N 2.91Å; A107-S113 PolarHBondContact O-N 3.36Å
108R96.6Very high96.8Very high154 Ų15435.7 Ų35.758%0.58120%0.198SC*.Hα-helixtrans-67.1-41.6173.5-72-178.7-67.6-90.31.4112.1G104 K105 Q106 T110 N111G104-R108 WeakPolarHBondContact O-CG 3.38Å; G104-R108 PolarHBondContact O-N 3.47Å; G104-R108 PolarHBondContact O-NE 3.21Å; G104-R108 PolarHBondContact O-NH1 3.18Å; K105-R108 PolarHBondContact O-N 3.4Å; Q106-R108 VanDerWaalsContact C-N 3.31Å; Q106-R108 PolarHBondContact O-N 2.76Å; R108-T110 VanDerWaalsContact C-N 3.34Å; R108-T110 PolarHBondContact O-N 3.34Å; R108-N111 PolarHBondContact O-N 3.44Å
109R96.3Very high96.7Very high104 Ų10436 Ų3639%0.39220%0.199SC..Hα-helixtrans-64-36.6178.8-177.2-176.9177.7-153.50.7112.4V43 I46 K105 Q106V43-R109 PolarHBondContact O-NH1 3.28Å; I46-R109 PolarHBondContact O-NH1 3.49Å; K105-R109 WeakPolarHBondContact O-CB 3.43Å; K105-R109 PolarHBondContact O-N 3.44Å; Q106-R109 CarbonylContact O-C 3.6Å; Q106-R109 WeakPolarHBondContact O-CA 3.21Å; Q106-R109 WeakPolarHBondContact O-CB 3.43Å; Q106-R109 PolarHBondContact O-N 3Å
110T95.9Very high96.7Very high24 Ų2435.8 Ų35.815%0.14720%0.197CC..THydrogen-bonded Turntrans-96.84.8-178.655.40000113.4T48 Q106 R108 S112 I373T48-T110 WeakPolarHBondContact O-CG2 3.49Å; Q106-T110 HydrophobicContact CG-CG2 4.42Å; Q106-T110 PolarHBondContact O-N 2.86Å; Q106-T110 PolarHBondContact O-OG1 2.61Å; R108-T110 VanDerWaalsContact C-N 3.34Å; R108-T110 PolarHBondContact O-N 3.34Å; T110-S112 PolarHBondContact O-N 3.03Å; T110-S112 PolarHBondContact OG1-OG 2.97Å; T110-I373 HydrophobicContact CG2-CD1 3.78Å
111N95.1Very high96.7Very high111 Ų11135.7 Ų35.759%0.59420%0.197SC*.THydrogen-bonded Turntrans51.243-176.1-160.726.3000113A107 R108 Q376A107-N111 PolarHBondContact O-N 3.4Å; A107-N111 VanDerWaalsContact O-N 3.08Å; R108-N111 PolarHBondContact O-N 3.44Å; N111-Q376 PolarHBondContact ND2-NE2 3.21Å; N111-Q376 PolarHBondContact O-NE2 2.85Å
112S95Very high96.7Very high35 Ų3535 Ų3525%0.24519%0.189CC..  trans-123.119.9-176.968.70000113.1A107 T110 S114A107-S112 PolarHBondContact O-N 2.91Å; T110-S112 PolarHBondContact O-N 3.03Å; T110-S112 PolarHBondContact OG1-OG 2.97Å; S112-S114 PolarHBondContact O-N 3.11Å
113S94.9Very high96.6Very high75 Ų7535.5 Ų35.552%0.52419%0.194SC..  trans-60.2133172.3-600000110.8A107A107-S113 PolarHBondContact O-N 3.36Å
114S95.4Very high96.7Very high38 Ų3835.3 Ų35.327%0.26619%0.193SC..  trans-154.8159.8-179.863.90000111.2S112 L116 G117 E118S112-S114 PolarHBondContact O-N 3.11Å; S114-L116 PolarHBondContact O-N 3.1Å; S114-G117 PolarHBondContact O-N 3.37Å; S114-G117 PolarHBondContact OG-N 3.45Å; S114-E118 PolarHBondContact O-N 2.91Å
115A95.8Very high96.8Very high15 Ų1535.2 Ų35.212%0.12419%0.188CC..Hα-helixtrans-57.1-35.1170.700000111.7L18 G117 E118 L119 M306L18-A115 HydrophobicContact CD1-CB 4.2Å; L18-A115 HydrophobicContact CD2-CB 4.43Å; L18-A115 HydrophobicContact CG-CB 4.03Å; A115-G117 VanDerWaalsContact C-N 3.33Å; A115-G117 PolarHBondContact O-N 2.92Å; A115-E118 PolarHBondContact O-N 2.89Å; A115-L119 WeakPolarHBondContact O-CB 3.33Å; A115-L119 PolarHBondContact O-N 2.88Å; A115-M306 HydrophobicContact CB-CE 3.6Å; A115-M306 WeakPolarHBondContact O-CE 3.47Å
116L96.9Very high96.8Very high0 Ų034 Ų340%018%0.184CC..Hα-helixtrans-60.8-42.2174178.460000112.2S114 L119 F120 C359 I362 A363 I368 V370S114-L116 PolarHBondContact O-N 3.1Å; L116-L119 PolarHBondContact O-N 2.92Å; L116-F120 VanDerWaalsContact O-CB 3.25Å; L116-F120 WeakPolarHBondContact O-CB 3.27Å; L116-F120 PolarHBondContact O-N 3.45Å; L116-C359 HydrophobicContact CD1-CB 4.13Å; L116-I362 HydrophobicContact CB-CG2 3.8Å; L116-I362 HydrophobicContact CD1-CB 4.18Å; L116-I362 HydrophobicContact CD1-CG2 4.11Å; L116-I362 HydrophobicContact CG-CG2 4.4Å; L116-A363 HydrophobicContact CD2-CB 3.79Å; L116-I368 HydrophobicContact CB-CD1 3.87Å; L116-I368 HydrophobicContact CD2-CD1 3.67Å; L116-I368 HydrophobicContact CD2-CG1 4.06Å; L116-I368 HydrophobicContact CG-CD1 4.4Å; L116-V370 HydrophobicContact CD2-CG2 4.3Å
117G97Very high96.8Very high16 Ų1634.8 Ų34.817%0.16519%0.188CC..Hα-helixtrans-62.4-47.3179.900000112N53 S114 A115 L119 F120 D121N53-G117 WeakPolarHBondContact OD1-CA 3.47Å; S114-G117 PolarHBondContact O-N 3.37Å; S114-G117 PolarHBondContact OG-N 3.45Å; A115-G117 VanDerWaalsContact C-N 3.33Å; A115-G117 PolarHBondContact O-N 2.92Å; G117-L119 PolarHBondContact O-N 3.31Å; G117-F120 PolarHBondContact O-N 3.06Å; G117-D121 WeakPolarHBondContact O-CB 3.14Å; G117-D121 PolarHBondContact O-N 2.9Å
118E95.9Very high96.9Very high27 Ų2734.5 Ų34.513%0.12619%0.185CC..Hα-helixtrans-58.7-45.1174.6177.1-172.8157.800112.3H21 Y23 S114 A115 F120 H122 M306H21-E118 IonicContact CD2-OE1 3.24Å; H21-E118 IonicContact CD2-OE2 2.89Å; H21-E118 PolarHBondContact CD2-OE2 3.24Å; H21-E118 IonicContact CE1-OE1 2.64Å; H21-E118 IonicContact NE2-OE1 4Å; H21-E118 PolarHBondContact NE2-OE1 3.32Å; H21-E118 IonicContact NE2-OE2 3.99Å; H21-E118 PolarHBondContact NE2-OE2 2.84Å; Y23-E118 WeakPolarHBondContact CB-OE2 3.44Å; Y23-E118 HydrophobicContact CD2-CG 3.92Å; Y23-E118 WeakPolarHBondContact CD2-OE2 3.12Å; Y23-E118 HydrophobicContact CE2-CG 4.27Å; S114-E118 PolarHBondContact O-N 2.91Å; A115-E118 PolarHBondContact O-N 2.89Å; E118-F120 VanDerWaalsContact C-N 3.31Å; E118-F120 PolarHBondContact O-N 2.96Å; E118-H122 PolarHBondContact O-N 3.24Å; E118-H122 VanDerWaalsContact O-N 3.1Å; E118-M306 HydrophobicContact CB-CE 4.29Å; E118-M306 HydrophobicContact CG-CE 4.34Å
119L96.7Very high97Very high9 Ų928.6 Ų28.65%0.04717%0.167CC..Hα-helixtrans-63.2-39.3176.117562.2000112.3A115 L116 G117 G123 V302 I303 M306 V358 I362A115-L119 WeakPolarHBondContact O-CB 3.33Å; A115-L119 PolarHBondContact O-N 2.88Å; L116-L119 PolarHBondContact O-N 2.92Å; G117-L119 PolarHBondContact O-N 3.31Å; L119-G123 WeakPolarHBondContact O-CA 3.28Å; L119-G123 PolarHBondContact O-N 2.61Å; L119-V302 HydrophobicContact CD1-CB 4.17Å; L119-V302 HydrophobicContact CD1-CG1 3.66Å; L119-I303 HydrophobicContact CD1-CD1 3.94Å; L119-I303 HydrophobicContact CD1-CG1 3.4Å; L119-I303 VanDerWaalsContact CD1-CG1 3.4Å; L119-I303 HydrophobicContact CD2-CD1 4.12Å; L119-I303 HydrophobicContact CD2-CG1 3.85Å; L119-I303 HydrophobicContact CG-CG1 4.29Å; L119-M306 HydrophobicContact CB-CE 4.23Å; L119-M306 HydrophobicContact CB-SD 3.91Å; L119-M306 HydrophobicContact CD1-SD 4.38Å; L119-V358 HydrophobicContact CD2-CG1 3.45Å; L119-V358 VanDerWaalsContact CD2-CG1 3.45Å; L119-I362 HydrophobicContact CD2-CD1 3.46Å; L119-I362 VanDerWaalsContact CD2-CD1 3.46Å
120F97.9Very high97.1Very high20 Ų2023.7 Ų23.79%0.08815%0.148CC..Hα-helixtrans-67.1-44.1-178.3-166.4-84.5000111N53 T56 I57 L116 G117 E118 G123 C124 V370 F371N53-F120 HydrophobicContact CB-CD1 3.73Å; N53-F120 HydrophobicContact CB-CD2 4.44Å; N53-F120 HydrophobicContact CB-CE1 3.91Å; N53-F120 HydrophobicContact CB-CG 4.03Å; N53-F120 HydrophobicContact CB-CZ 4.34Å; N53-F120 VanDerWaalsContact O-CE1 3.29Å; N53-F120 WeakPolarHBondContact O-CE1 3.44Å; T56-F120 HydrophobicContact CG2-CD1 4.02Å; T56-F120 HydrophobicContact CG2-CE1 4.26Å; I57-F120 HydrophobicContact CB-CE1 3.95Å; I57-F120 HydrophobicContact CB-CZ 3.94Å; I57-F120 HydrophobicContact CD1-CZ 4.21Å; I57-F120 HydrophobicContact CG1-CZ 4.34Å; L116-F120 VanDerWaalsContact O-CB 3.25Å; L116-F120 WeakPolarHBondContact O-CB 3.27Å; L116-F120 PolarHBondContact O-N 3.45Å; G117-F120 PolarHBondContact O-N 3.06Å; E118-F120 VanDerWaalsContact C-N 3.31Å; E118-F120 PolarHBondContact O-N 2.96Å; F120-G123 PolarHBondContact O-N 3.47Å; F120-C124 VanDerWaalsContact CE1-SG 3.6Å; F120-C124 WeakPolarHBondContact O-CB 3.39Å; F120-C124 PolarHBondContact O-N 3.02Å; F120-C124 PolarHBondContact O-SG 3.4Å; F120-V370 HydrophobicContact CD2-CG1 4.35Å; F120-V370 HydrophobicContact CE2-CG1 4.14Å; F120-F371 HydrophobicContact CE1-CE1 4.33Å; F120-F371 AromaticContact CE2-CE1 3.99Å; F120-F371 HydrophobicContact CE2-CE1 3.99Å; F120-F371 AromaticContact CE2-CZ 3.95Å; F120-F371 HydrophobicContact CE2-CZ 3.95Å; F120-F371 AromaticContact CZ-CE1 3.58Å; F120-F371 HydrophobicContact CZ-CE1 3.58Å; F120-F371 AromaticContact CZ-CZ 3.82Å; F120-F371 HydrophobicContact CZ-CZ 3.82Å
121D97.8Very high97.3Very high24 Ų2423.1 Ų23.113%0.12814%0.144CC..Hα-helixtrans-56.1-65.1174.4178.931.5000111.6G117 G123 C124 D125G117-D121 WeakPolarHBondContact O-CB 3.14Å; G117-D121 PolarHBondContact O-N 2.9Å; D121-G123 PolarHBondContact O-N 2.84Å; D121-G123 VanDerWaalsContact O-N 3.11Å; D121-C124 WeakPolarHBondContact O-CA 3.04Å; D121-C124 WeakPolarHBondContact O-CB 3.48Å; D121-C124 PolarHBondContact O-N 3.37Å; D121-D125 PolarHBondContact O-N 3.36Å
122H97.3Very high97.4Very high13 Ų1318.5 Ų18.56%0.0612%0.12CC..Hα-helixtrans-61-30.3179.2-62.4-19.1000113E118 D125 A126 F160 H164 V302E118-H122 PolarHBondContact O-N 3.24Å; E118-H122 VanDerWaalsContact O-N 3.1Å; H122-D125 IonicContact ND1-OD2 3.61Å; H122-D125 PolarHBondContact O-N 2.88Å; H122-A126 PolarHBondContact O-N 3.17Å; H122-A126 VanDerWaalsContact O-N 3.07Å; H122-F160 WeakPolarHBondContact O-CZ 3.38Å; H122-H164 AromaticContact CD2-NE2 3.68Å; H122-H164 AromaticContact CG-NE2 3.62Å; H122-V302 HydrophobicContact CB-CG1 4.32Å; H122-V302 HydrophobicContact CB-CG2 4.09Å
123G97.8Very high97.6Very high10 Ų1017.3 Ų17.310%0.10311%0.111CC..Hα-helixtrans-63.6-40.1173.400000113.4L119 F120 D121 N299L119-G123 WeakPolarHBondContact O-CA 3.28Å; L119-G123 PolarHBondContact O-N 2.61Å; F120-G123 PolarHBondContact O-N 3.47Å; D121-G123 PolarHBondContact O-N 2.84Å; D121-G123 VanDerWaalsContact O-N 3.11Å; G123-N299 WeakPolarHBondContact CA-OD1 3.33Å; G123-N299 PolarHBondContact O-ND2 2.98Å
124C98.6Very high97.8Very high8 Ų813.7 Ų13.75%0.0549%0.086CC..Hα-helixtrans-73.2-40.5174.9-69.60000111.4T56 L60 F120 D121 A126 V127 S128T56-C124 HydrophobicContact CG2-CB 3.61Å; L60-C124 HydrophobicContact CB-CB 4.39Å; L60-C124 HydrophobicContact CD2-CB 3.94Å; F120-C124 VanDerWaalsContact CE1-SG 3.6Å; F120-C124 WeakPolarHBondContact O-CB 3.39Å; F120-C124 PolarHBondContact O-N 3.02Å; F120-C124 PolarHBondContact O-SG 3.4Å; D121-C124 WeakPolarHBondContact O-CA 3.04Å; D121-C124 WeakPolarHBondContact O-CB 3.48Å; D121-C124 PolarHBondContact O-N 3.37Å; C124-A126 VanDerWaalsContact C-N 3.29Å; C124-A126 PolarHBondContact O-N 2.87Å; C124-V127 PolarHBondContact O-N 3.38Å; C124-V127 VanDerWaalsContact O-N 3.1Å; C124-S128 WeakPolarHBondContact O-CB 3.38Å; C124-S128 PolarHBondContact O-N 2.9Å
125D98.5Very high97.9Very high19 Ų1911.9 Ų11.910%0.1027%0.074CC..Hα-helixtrans-56.7-41.6174.8-85.2-27.8000113.2Y96 D121 H122 V127 S128 T129 F160Y96-D125 WeakPolarHBondContact OH-CA 3.3Å; Y96-D125 PolarHBondContact OH-OD1 2.95Å; D121-D125 PolarHBondContact O-N 3.36Å; H122-D125 IonicContact ND1-OD2 3.61Å; H122-D125 PolarHBondContact O-N 2.88Å; D125-V127 PolarHBondContact O-N 3.47Å; D125-S128 PolarHBondContact O-N 3.28Å; D125-T129 WeakPolarHBondContact O-CB 3.4Å; D125-T129 PolarHBondContact O-N 3.36Å; D125-T129 PolarHBondContact O-OG1 2.95Å; D125-F160 HydrophobicContact CB-CD2 4.47Å; D125-F160 HydrophobicContact CB-CE2 3.45Å; D125-F160 VanDerWaalsContact CB-CE2 3.45Å; D125-F160 HydrophobicContact CB-CZ 3.67Å
126A98.5Very high98Very high4 Ų412 Ų123%0.0337%0.073CC..Hα-helixtrans-58.3-40.3177.500000111.6H122 C124 F160 A295 N299H122-A126 PolarHBondContact O-N 3.17Å; H122-A126 VanDerWaalsContact O-N 3.07Å; C124-A126 VanDerWaalsContact C-N 3.29Å; C124-A126 PolarHBondContact O-N 2.87Å; A126-F160 HydrophobicContact CB-CD1 4.18Å; A126-F160 HydrophobicContact CB-CE1 3.51Å; A126-F160 HydrophobicContact CB-CZ 4.05Å; A126-A295 HydrophobicContact CB-CB 4.11Å; A126-N299 VanDerWaalsContact CB-OD1 3.25Å; A126-N299 WeakPolarHBondContact CB-OD1 3.35Å
127V98.8Very high98.1Very high16 Ų1612 Ų1210%0.0977%0.073CC..Hα-helixtrans-75.7-45.2177.1-178.40000110.8L60 I64 C124 D125 T129 V130 F131 A295 L351L60-V127 HydrophobicContact CD1-CB 4.14Å; L60-V127 HydrophobicContact CD1-CG1 4.11Å; L60-V127 HydrophobicContact CD2-CB 4.33Å; L60-V127 HydrophobicContact CD2-CG1 4.42Å; I64-V127 HydrophobicContact CD1-CG1 4.27Å; C124-V127 PolarHBondContact O-N 3.38Å; C124-V127 VanDerWaalsContact O-N 3.1Å; D125-V127 PolarHBondContact O-N 3.47Å; V127-T129 VanDerWaalsContact C-N 3.25Å; V127-T129 PolarHBondContact O-N 3.31Å; V127-V130 VanDerWaalsContact O-CB 3.29Å; V127-V130 WeakPolarHBondContact O-CB 3.4Å; V127-V130 PolarHBondContact O-N 2.89Å; V127-F131 HydrophobicContact CG1-CD2 4.15Å; V127-F131 HydrophobicContact CG1-CE2 3.8Å; V127-F131 WeakPolarHBondContact O-CD2 3.38Å; V127-A295 HydrophobicContact CG2-CB 4.15Å; V127-L351 HydrophobicContact CG2-CD2 3.93Å
128S98.6Very high98.2Very high2 Ų211.2 Ų11.21%0.0147%0.065CC..Hα-helixtrans-55.8-42.8179.1-171.70000111.5N63 Y96 C124 D125 V130 F131 V132N63-S128 PolarHBondContact ND2-OG 3.11Å; Y96-S128 VanDerWaalsContact CE1-OG 3.31Å; Y96-S128 WeakPolarHBondContact CE1-OG 3.34Å; Y96-S128 VanDerWaalsContact CE2-CB 3.5Å; Y96-S128 WeakPolarHBondContact CE2-OG 3.17Å; Y96-S128 WeakPolarHBondContact OH-CB 3.46Å; Y96-S128 PolarHBondContact OH-OG 3.46Å; C124-S128 WeakPolarHBondContact O-CB 3.38Å; C124-S128 PolarHBondContact O-N 2.9Å; D125-S128 PolarHBondContact O-N 3.28Å; S128-V130 PolarHBondContact O-N 3.3Å; S128-V130 VanDerWaalsContact O-N 3.16Å; S128-F131 PolarHBondContact O-N 3.02Å; S128-V132 WeakPolarHBondContact O-CG2 3.29Å; S128-V132 PolarHBondContact O-N 3.41Å
129T98.6Very high98.2Very high31 Ų3110 Ų1019%0.196%0.059CC..Hα-helixtrans-54.9-35.5177.2-610000112.4D125 V127 A133 M157 F160D125-T129 WeakPolarHBondContact O-CB 3.4Å; D125-T129 PolarHBondContact O-N 3.36Å; D125-T129 PolarHBondContact O-OG1 2.95Å; V127-T129 VanDerWaalsContact C-N 3.25Å; V127-T129 PolarHBondContact O-N 3.31Å; T129-A133 VanDerWaalsContact O-CB 3.32Å; T129-A133 WeakPolarHBondContact O-CB 3.25Å; T129-A133 PolarHBondContact O-N 2.82Å; T129-M157 HydrophobicContact CG2-CG 4.23Å; T129-F160 HydrophobicContact CG2-CB 4.36Å
130V98.8Very high98.2Very high1 Ų19.8 Ų9.81%0.0066%0.059CC..Hα-helixtrans-63.9-49.7176.7175.70000111V127 S128 A133 V134 M157 L288 G291 A295V127-V130 VanDerWaalsContact O-CB 3.29Å; V127-V130 WeakPolarHBondContact O-CB 3.4Å; V127-V130 PolarHBondContact O-N 2.89Å; S128-V130 PolarHBondContact O-N 3.3Å; S128-V130 VanDerWaalsContact O-N 3.16Å; V130-A133 PolarHBondContact O-N 3.48Å; V130-V134 WeakPolarHBondContact O-CG2 3.45Å; V130-V134 PolarHBondContact O-N 3.34Å; V130-M157 HydrophobicContact CB-CE 4.13Å; V130-M157 HydrophobicContact CG1-CE 3.98Å; V130-M157 HydrophobicContact CG2-CE 4.11Å; V130-M157 HydrophobicContact CG2-CG 4.45Å; V130-M157 HydrophobicContact CG2-SD 4.37Å; V130-L288 HydrophobicContact CG1-CD2 4.07Å; V130-G291 VanDerWaalsContact CG2-C 3.47Å; V130-G291 WeakPolarHBondContact CG2-O 3.13Å; V130-A295 HydrophobicContact CG2-CB 4.45Å
131F98.8Very high98.1Very high12 Ų128.9 Ų8.95%0.0536%0.055CC..Hα-helixtrans-69.2-40-178.8-71.6-86.9000111.6I64 T67 V68 V127 S128 A133 V134 G135 L288 M292I64-F131 HydrophobicContact CB-CE1 4.37Å; I64-F131 HydrophobicContact CB-CZ 4.36Å; I64-F131 HydrophobicContact CD1-CD2 4.39Å; I64-F131 HydrophobicContact CD1-CE2 3.92Å; I64-F131 HydrophobicContact CD1-CZ 4.29Å; I64-F131 HydrophobicContact CG1-CD1 4.36Å; I64-F131 HydrophobicContact CG1-CD2 3.67Å; I64-F131 HydrophobicContact CG1-CE1 4.27Å; I64-F131 HydrophobicContact CG1-CE2 3.57Å; I64-F131 HydrophobicContact CG1-CG 4.07Å; I64-F131 HydrophobicContact CG1-CZ 3.88Å; I64-F131 HydrophobicContact CG2-CD1 4.46Å; I64-F131 HydrophobicContact CG2-CE1 3.88Å; I64-F131 HydrophobicContact CG2-CE2 4.44Å; I64-F131 HydrophobicContact CG2-CZ 3.87Å; T67-F131 HydrophobicContact CG2-CB 3.96Å; T67-F131 HydrophobicContact CG2-CD1 3.84Å; T67-F131 HydrophobicContact CG2-CG 4.41Å; T67-F131 VanDerWaalsContact CG2-O 3.3Å; T67-F131 WeakPolarHBondContact CG2-O 3.4Å; V68-F131 HydrophobicContact CG2-CE1 4.11Å; V127-F131 HydrophobicContact CG1-CD2 4.15Å; V127-F131 HydrophobicContact CG1-CE2 3.8Å; V127-F131 WeakPolarHBondContact O-CD2 3.38Å; S128-F131 PolarHBondContact O-N 3.02Å; F131-A133 VanDerWaalsContact C-N 3.31Å; F131-A133 PolarHBondContact O-N 3.36Å; F131-V134 PolarHBondContact O-N 2.95Å; F131-G135 PolarHBondContact O-N 3.3Å; F131-L288 HydrophobicContact CD1-CD2 4.02Å; F131-L288 HydrophobicContact CE1-CD2 3.65Å; F131-L288 HydrophobicContact CZ-CD2 3.96Å; F131-M292 HydrophobicContact CE2-CE 3.62Å; F131-M292 HydrophobicContact CZ-CE 3.68Å
132V98.6Very high98Very high14 Ų148 Ų89%0.0855%0.05CC..Hα-helixtrans-58.5-44.2173.5172.90000111N63 L93 S128 T136 I187N63-V132 WeakPolarHBondContact ND2-CG2 3.38Å; L93-V132 HydrophobicContact CD1-CG2 3.66Å; L93-V132 HydrophobicContact CD2-CG2 4.49Å; S128-V132 WeakPolarHBondContact O-CG2 3.29Å; S128-V132 PolarHBondContact O-N 3.41Å; V132-T136 VanDerWaalsContact O-CB 3.3Å; V132-T136 WeakPolarHBondContact O-CB 3.13Å; V132-T136 PolarHBondContact O-N 3.45Å; V132-T136 PolarHBondContact O-OG1 3.4Å; V132-I187 HydrophobicContact CG1-CD1 3.41Å; V132-I187 VanDerWaalsContact CG1-CD1 3.41Å; V132-I187 HydrophobicContact CG1-CG2 4.41Å
133A98.4Very high97.9Very high9 Ų98 Ų87%0.0745%0.053CC..Hα-helixtrans-63.3-46.3178.300000112.2T129 V130 F131 T136 C137 G153 M157T129-A133 VanDerWaalsContact O-CB 3.32Å; T129-A133 WeakPolarHBondContact O-CB 3.25Å; T129-A133 PolarHBondContact O-N 2.82Å; V130-A133 PolarHBondContact O-N 3.48Å; F131-A133 VanDerWaalsContact C-N 3.31Å; F131-A133 PolarHBondContact O-N 3.36Å; A133-T136 PolarHBondContact O-N 3.26Å; A133-C137 PolarHBondContact O-N 3.02Å; A133-C137 VanDerWaalsContact O-N 3.07Å; A133-C137 PolarHBondContact O-SG 2.99Å; A133-G153 WeakPolarHBondContact CB-O 3.14Å; A133-M157 HydrophobicContact CB-CE 4.13Å
134V98.8Very high97.6Very high0 Ų013.1 Ų13.10%07%0.069CC..Hα-helixtrans-61.4-51177.1171.60000111.2T67 V71 V130 F131 T136 C137 I138 C284 L287 L288T67-V134 HydrophobicContact CG2-CB 4.41Å; T67-V134 HydrophobicContact CG2-CG1 4.33Å; V71-V134 HydrophobicContact CG2-CG1 3.56Å; V130-V134 WeakPolarHBondContact O-CG2 3.45Å; V130-V134 PolarHBondContact O-N 3.34Å; F131-V134 PolarHBondContact O-N 2.95Å; V134-T136 VanDerWaalsContact C-N 3.31Å; V134-T136 PolarHBondContact O-N 2.97Å; V134-C137 WeakPolarHBondContact O-CB 3.41Å; V134-C137 PolarHBondContact O-N 3.03Å; V134-C137 VanDerWaalsContact O-N 3.17Å; V134-I138 HydrophobicContact CG1-CD1 3.96Å; V134-I138 WeakPolarHBondContact O-CG1 3.37Å; V134-I138 PolarHBondContact O-N 3.04Å; V134-C284 HydrophobicContact CG1-CB 4.19Å; V134-L287 HydrophobicContact CG2-CB 3.72Å; V134-L287 HydrophobicContact CG2-CD1 4.2Å; V134-L288 HydrophobicContact CG2-CD2 4.33Å; V134-L288 HydrophobicContact CG2-CG 4.31Å
135G98.5Very high97.4Very high0 Ų016.1 Ų16.10%08%0.08CC..Hα-helixtrans-62.3-37.2-179.800000112.7F131 I138 S139 Y191F131-G135 PolarHBondContact O-N 3.3Å; G135-I138 PolarHBondContact O-N 3.21Å; G135-S139 WeakPolarHBondContact O-CB 3.34Å; G135-S139 PolarHBondContact O-N 3.47Å; G135-Y191 VanDerWaalsContact C-OH 3.24Å; G135-Y191 VanDerWaalsContact CA-OH 3.26Å; G135-Y191 WeakPolarHBondContact CA-OH 3.36Å; G135-Y191 WeakPolarHBondContact O-CE1 3.31Å
136T98.1Very high97.3Very high16 Ų1617.2 Ų17.210%0.0989%0.088CC..Hα-helixtrans-63.2-43.2174.5-56.90000111.6V132 A133 V134 I138 S139 C140 I187 M190 Y191V132-T136 VanDerWaalsContact O-CB 3.3Å; V132-T136 WeakPolarHBondContact O-CB 3.13Å; V132-T136 PolarHBondContact O-N 3.45Å; V132-T136 PolarHBondContact O-OG1 3.4Å; A133-T136 PolarHBondContact O-N 3.26Å; V134-T136 VanDerWaalsContact C-N 3.31Å; V134-T136 PolarHBondContact O-N 2.97Å; T136-I138 VanDerWaalsContact C-N 3.35Å; T136-I138 PolarHBondContact O-N 2.69Å; T136-S139 WeakPolarHBondContact O-CB 3.41Å; T136-S139 PolarHBondContact O-N 3.01Å; T136-C140 PolarHBondContact O-N 3.22Å; T136-I187 HydrophobicContact CG2-CG1 4.28Å; T136-I187 VanDerWaalsContact OG1-CG2 3.32Å; T136-I187 WeakPolarHBondContact OG1-CG2 3.41Å; T136-M190 HydrophobicContact CG2-CE 3.56Å; T136-M190 HydrophobicContact CG2-SD 4.3Å; T136-Y191 PolarHBondContact N-OH 3.36Å
137C98.3Very high97.3Very high1 Ų121.9 Ų21.91%0.00711%0.112CC..Hα-helixtrans-63-41.2176.9-65.80000112A133 V134 G141 I142 I149A133-C137 PolarHBondContact O-N 3.02Å; A133-C137 VanDerWaalsContact O-N 3.07Å; A133-C137 PolarHBondContact O-SG 2.99Å; V134-C137 WeakPolarHBondContact O-CB 3.41Å; V134-C137 PolarHBondContact O-N 3.03Å; V134-C137 VanDerWaalsContact O-N 3.17Å; C137-G141 PolarHBondContact O-N 2.87Å; C137-I142 HydrophobicContact CB-CD1 4.14Å; C137-I142 HydrophobicContact CB-CG1 4.01Å; C137-I142 WeakPolarHBondContact O-CG1 3.31Å; C137-I142 PolarHBondContact O-N 3.07Å; C137-I149 HydrophobicContact CB-CD1 3.99Å; C137-I149 HydrophobicContact CB-CG1 3.97Å
138I98.4Very high97.2Very high0 Ų025.8 Ų25.80%013%0.125CC..Hα-helixtrans-62.4-48.4174.3-68.7168.9000110.6L70 V71 C74 A77 F86 V134 G135 T136 C140 G141L70-I138 HydrophobicContact CB-CD1 3.97Å; L70-I138 HydrophobicContact CB-CG2 4.22Å; L70-I138 HydrophobicContact CD2-CG2 4.48Å; V71-I138 HydrophobicContact CB-CD1 4.5Å; V71-I138 HydrophobicContact CG2-CD1 3.83Å; C74-I138 HydrophobicContact CB-CB 4.47Å; C74-I138 HydrophobicContact CB-CD1 4.4Å; C74-I138 HydrophobicContact CB-CG1 4.23Å; C74-I138 HydrophobicContact CB-CG2 3.5Å; C74-I138 VanDerWaalsContact CB-CG2 3.5Å; A77-I138 HydrophobicContact CB-CB 4.47Å; A77-I138 HydrophobicContact CB-CG1 3.83Å; F86-I138 HydrophobicContact CE1-CG2 4.39Å; V134-I138 HydrophobicContact CG1-CD1 3.96Å; V134-I138 WeakPolarHBondContact O-CG1 3.37Å; V134-I138 PolarHBondContact O-N 3.04Å; G135-I138 PolarHBondContact O-N 3.21Å; T136-I138 VanDerWaalsContact C-N 3.35Å; T136-I138 PolarHBondContact O-N 2.69Å; I138-C140 VanDerWaalsContact C-N 3.25Å; I138-C140 PolarHBondContact O-N 3.37Å; I138-G141 PolarHBondContact O-N 2.71Å
139S97.4Very high97.2Very high0 Ų025.8 Ų25.80%013%0.125CC..Hα-helixtrans-53.5-42.7-178.2-169.60000112.3G135 T136 M190 S194 W202G135-S139 WeakPolarHBondContact O-CB 3.34Å; G135-S139 PolarHBondContact O-N 3.47Å; T136-S139 WeakPolarHBondContact O-CB 3.41Å; T136-S139 PolarHBondContact O-N 3.01Å; S139-M190 PolarHBondContact OG-O 3.26Å; S139-S194 PolarHBondContact O-OG 2.87Å; S139-S194 WeakPolarHBondContact OG-CB 3.25Å; S139-S194 PolarHBondContact OG-OG 3.25Å; S139-W202 PolarHBondContact O-NE1 2.84Å
140C95.8Very high97.2Very high6 Ų625.6 Ų25.64%0.04112%0.122CC..THydrogen-bonded Turntrans-86.6-4.3179.5-64.90000115T136 I138 I142 M190 W202T136-C140 PolarHBondContact O-N 3.22Å; I138-C140 VanDerWaalsContact C-N 3.25Å; I138-C140 PolarHBondContact O-N 3.37Å; C140-I142 HydrophobicContact CB-CG2 3.77Å; C140-I142 PolarHBondContact O-N 3.32Å; C140-M190 WeakPolarHBondContact SG-CE 3.29Å; C140-W202 HydrophobicContact CB-CD2 4.37Å; C140-W202 HydrophobicContact CB-CG 4.39Å
141G95.6Very high97.1Very high0 Ų028.8 Ų28.80%014%0.135CC..THydrogen-bonded Turntrans6130.9-177.700000114.3A77 C137 I138 G143A77-G141 CarbonylContact O-C 3.58Å; A77-G141 VanDerWaalsContact O-C 3.22Å; A77-G141 WeakPolarHBondContact O-CA 3.23Å; C137-G141 PolarHBondContact O-N 2.87Å; I138-G141 PolarHBondContact O-N 2.71Å; G141-G143 PolarHBondContact O-N 3.05Å
142I95.4Very high97.1Very high7 Ų728.8 Ų28.84%0.03614%0.137CC..G310 helixtrans-82.74.1-173.359.5166.3000113.5C137 C140 R144 Y145 I149 C152 Y214C137-I142 HydrophobicContact CB-CD1 4.14Å; C137-I142 HydrophobicContact CB-CG1 4.01Å; C137-I142 WeakPolarHBondContact O-CG1 3.31Å; C137-I142 PolarHBondContact O-N 3.07Å; C140-I142 HydrophobicContact CB-CG2 3.77Å; C140-I142 PolarHBondContact O-N 3.32Å; I142-R144 PolarHBondContact O-N 2.83Å; I142-R144 VanDerWaalsContact O-N 3.16Å; I142-Y145 PolarHBondContact O-N 2.87Å; I142-I149 HydrophobicContact CD1-CB 4.41Å; I142-I149 HydrophobicContact CG1-CB 4.29Å; I142-C152 HydrophobicContact CD1-CB 3.78Å; I142-Y214 HydrophobicContact CG2-CD2 4.46Å
143G95.5Very high97.1Very high11 Ų1128.1 Ų28.111%0.11313%0.133CC..G310 helixtrans-58.2-25.1172.800000113.4T76 A77 G141 Y145T76-G143 WeakPolarHBondContact O-CA 3.24Å; A77-G143 WeakPolarHBondContact O-CA 3.17Å; A77-G143 PolarHBondContact O-N 2.87Å; G141-G143 PolarHBondContact O-N 3.05Å; G143-Y145 PolarHBondContact O-N 3.29Å; G143-Y145 VanDerWaalsContact O-N 3.12Å
144R91.2Very high97.1Very high119 Ų11928 Ų2845%0.44913%0.131SC..G310 helixtrans-64.9-13.9174.3-56.8-176.4-172.5116.45.8113.3T78 I142 P146T78-R144 HydrophobicContact CG2-CG 3.86Å; T78-R144 PolarHBondContact O-NH2 3.16Å; I142-R144 PolarHBondContact O-N 2.83Å; I142-R144 VanDerWaalsContact O-N 3.16Å; R144-P146 WeakPolarHBondContact O-CD 3.36Å
145Y95.9Very high97Very high71 Ų7129.3 Ų29.328%0.27814%0.137SC..SBendtrans-122.883.1-179.1-52.1-74000110.1I142 G143 N147 W148 I149 Q203 Y214I142-Y145 PolarHBondContact O-N 2.87Å; G143-Y145 PolarHBondContact O-N 3.29Å; G143-Y145 VanDerWaalsContact O-N 3.12Å; Y145-N147 VanDerWaalsContact C-N 3.27Å; Y145-N147 PolarHBondContact O-N 3.1Å; Y145-N147 VanDerWaalsContact O-N 3.08Å; Y145-W148 WeakPolarHBondContact O-CA 3.4Å; Y145-W148 PolarHBondContact O-N 3.07Å; Y145-I149 PolarHBondContact O-N 2.95Å; Y145-Q203 PolarHBondContact OH-OE1 2.8Å; Y145-Y214 HydrophobicContact CD2-CE2 4.46Å; Y145-Y214 HydrophobicContact CE2-CE1 4.02Å; Y145-Y214 HydrophobicContact CE2-CE2 4.11Å; Y145-Y214 AromaticContact CE2-CZ 3.8Å; Y145-Y214 AromaticContact CZ-CZ 3.83Å
146P96.3Very high97Very high41 Ų4130.7 Ų30.727%0.26615%0.151SC..Hα-helixtrans-48.8-42.7-173.4-33.237.1000114.7R144 W148 I149 F150 F271 F279 E280R144-P146 WeakPolarHBondContact O-CD 3.36Å; P146-W148 VanDerWaalsContact C-N 3.34Å; P146-W148 PolarHBondContact O-N 3.32Å; P146-I149 VanDerWaalsContact O-CG2 3.25Å; P146-I149 WeakPolarHBondContact O-CG2 3.16Å; P146-F150 VanDerWaalsContact O-CB 3.28Å; P146-F150 WeakPolarHBondContact O-CB 3.45Å; P146-F150 PolarHBondContact O-N 2.97Å; P146-F271 HydrophobicContact CB-CE2 4.17Å; P146-F271 HydrophobicContact CB-CZ 3.81Å; P146-F279 WeakPolarHBondContact O-CE1 3.33Å; P146-E280 HydrophobicContact CB-CG 3.88Å; P146-E280 HydrophobicContact CG-CB 4.47Å; P146-E280 HydrophobicContact CG-CG 3.68Å
147N97.4Very high97Very high102 Ų10230.1 Ų30.155%0.54515%0.148SC..Hα-helixtrans-66.3-35.4178.4-63.7-36.4000112.8Y145 F151 K272Y145-N147 VanDerWaalsContact C-N 3.27Å; Y145-N147 PolarHBondContact O-N 3.1Å; Y145-N147 VanDerWaalsContact O-N 3.08Å; N147-F151 WeakPolarHBondContact O-CB 3.35Å; N147-F151 PolarHBondContact O-N 3.2Å; N147-K272 PolarHBondContact OD1-NZ 3.36Å
148W97Very high97Very high99 Ų9932 Ų3238%0.37516%0.156SC..Hα-helixtrans-74.8-43.3179.1-72.7131.4000112.2Y145 P146 F150 F151 C152 I218 I222Y145-W148 WeakPolarHBondContact O-CA 3.4Å; Y145-W148 PolarHBondContact O-N 3.07Å; P146-W148 VanDerWaalsContact C-N 3.34Å; P146-W148 PolarHBondContact O-N 3.32Å; W148-F150 VanDerWaalsContact C-N 3.31Å; W148-F150 PolarHBondContact O-N 3.37Å; W148-F151 HydrophobicContact CE3-CD1 4.28Å; W148-F151 HydrophobicContact CZ3-CD1 4.3Å; W148-F151 PolarHBondContact O-N 2.77Å; W148-C152 VanDerWaalsContact O-CB 3.3Å; W148-C152 WeakPolarHBondContact O-CB 3.38Å; W148-C152 PolarHBondContact O-N 3.47Å; W148-C152 PolarHBondContact O-SG 2.96Å; W148-I218 HydrophobicContact CB-CD1 4.2Å; W148-I218 HydrophobicContact CD2-CD1 3.99Å; W148-I218 HydrophobicContact CD2-CG2 4.28Å; W148-I218 HydrophobicContact CE3-CD1 4.27Å; W148-I218 HydrophobicContact CE3-CG2 3.7Å; W148-I218 HydrophobicContact CG-CD1 3.96Å; W148-I218 HydrophobicContact CH2-CG2 3.94Å; W148-I218 HydrophobicContact CZ2-CG2 4.47Å; W148-I218 HydrophobicContact CZ3-CG2 3.52Å; W148-I222 HydrophobicContact CH2-CD1 4.12Å; W148-I222 HydrophobicContact CZ3-CD1 4.02Å
149I97.9Very high96.9Very high2 Ų233 Ų331%0.0116%0.161CC..Hα-helixtrans-65-35.7174.1-176.5162.3000111.6A77 C137 I142 Y145 P146 G153 F279 P283 L287A77-I149 HydrophobicContact CB-CD1 3.73Å; C137-I149 HydrophobicContact CB-CD1 3.99Å; C137-I149 HydrophobicContact CB-CG1 3.97Å; I142-I149 HydrophobicContact CD1-CB 4.41Å; I142-I149 HydrophobicContact CG1-CB 4.29Å; Y145-I149 PolarHBondContact O-N 2.95Å; P146-I149 VanDerWaalsContact O-CG2 3.25Å; P146-I149 WeakPolarHBondContact O-CG2 3.16Å; I149-G153 WeakPolarHBondContact O-CA 3.3Å; I149-G153 PolarHBondContact O-N 3.31Å; I149-F279 HydrophobicContact CG1-CZ 4.49Å; I149-F279 HydrophobicContact CG2-CE1 3.84Å; I149-F279 HydrophobicContact CG2-CZ 3.83Å; I149-P283 HydrophobicContact CD1-CB 3.84Å; I149-P283 HydrophobicContact CD1-CG 4.27Å; I149-L287 HydrophobicContact CD1-CD1 4.48Å; I149-L287 HydrophobicContact CG1-CD1 4.07Å
150F98.6Very high96.9Very high27 Ų2734 Ų3412%0.11817%0.166CC..Hα-helixtrans-60.7-53.3172-172.8-86.6000110.8P146 W148 F154 A267 F268 F271 F279P146-F150 VanDerWaalsContact O-CB 3.28Å; P146-F150 WeakPolarHBondContact O-CB 3.45Å; P146-F150 PolarHBondContact O-N 2.97Å; W148-F150 VanDerWaalsContact C-N 3.31Å; W148-F150 PolarHBondContact O-N 3.37Å; F150-F154 HydrophobicContact CD1-CD2 4.22Å; F150-F154 HydrophobicContact CD2-CD2 4.02Å; F150-F154 AromaticContact CD2-CE2 3.83Å; F150-F154 HydrophobicContact CD2-CE2 3.83Å; F150-F154 HydrophobicContact CE1-CD2 4.1Å; F150-F154 AromaticContact CE2-CD2 3.91Å; F150-F154 HydrophobicContact CE2-CD2 3.91Å; F150-F154 AromaticContact CE2-CE2 3.59Å; F150-F154 HydrophobicContact CE2-CE2 3.59Å; F150-F154 HydrophobicContact CG-CD2 4.18Å; F150-F154 HydrophobicContact CG-CE2 4.43Å; F150-F154 AromaticContact CZ-CD2 3.93Å; F150-F154 HydrophobicContact CZ-CD2 3.93Å; F150-F154 AromaticContact CZ-CE2 3.99Å; F150-F154 HydrophobicContact CZ-CE2 3.99Å; F150-F154 VanDerWaalsContact O-CD2 3.27Å; F150-F154 WeakPolarHBondContact O-CD2 3.43Å; F150-F154 PolarHBondContact O-N 3.31Å; F150-A267 HydrophobicContact CE2-CB 4.22Å; F150-A267 HydrophobicContact CZ-CB 4.15Å; F150-F268 HydrophobicContact CE1-CB 4.38Å; F150-F268 AromaticContact CE1-CD2 4Å; F150-F268 HydrophobicContact CE1-CD2 4Å; F150-F268 HydrophobicContact CZ-CB 3.87Å; F150-F268 HydrophobicContact CZ-CD2 4.12Å; F150-F271 HydrophobicContact CB-CD1 4.32Å; F150-F271 HydrophobicContact CB-CE1 4.05Å; F150-F271 HydrophobicContact CD2-CB 4.27Å; F150-F271 AromaticContact CD2-CD1 3.46Å; F150-F271 HydrophobicContact CD2-CD1 3.46Å; F150-F271 VanDerWaalsContact CD2-CD1 3.46Å; F150-F271 HydrophobicContact CD2-CE1 4.07Å; F150-F271 HydrophobicContact CD2-CG 4.13Å; F150-F271 HydrophobicContact CE2-CB 4.08Å; F150-F271 AromaticContact CE2-CD1 3.88Å; F150-F271 HydrophobicContact CE2-CD1 3.88Å; F150-F271 HydrophobicContact CE2-CG 4.39Å; F150-F271 AromaticContact CG-CD1 3.89Å; F150-F271 HydrophobicContact CG-CD1 3.89Å; F150-F271 HydrophobicContact CG-CE1 4.08Å; F150-F279 HydrophobicContact CB-CE1 3.76Å; F150-F279 HydrophobicContact CB-CZ 3.84Å; F150-F279 HydrophobicContact CD2-CE1 4.13Å; F150-F279 HydrophobicContact CD2-CE2 4.42Å; F150-F279 HydrophobicContact CD2-CZ 4.07Å; F150-F279 HydrophobicContact CG-CE1 4.47Å; F150-F279 HydrophobicContact CG-CZ 4.46Å
151F98.3Very high97.1Very high67 Ų6733.8 Ų33.829%0.29416%0.164SC..Hα-helixtrans-60.3-53.1179.6174.5-102.5000112.4N147 W148 G153 F154 I155 I221 I222N147-F151 WeakPolarHBondContact O-CB 3.35Å; N147-F151 PolarHBondContact O-N 3.2Å; W148-F151 HydrophobicContact CE3-CD1 4.28Å; W148-F151 HydrophobicContact CZ3-CD1 4.3Å; W148-F151 PolarHBondContact O-N 2.77Å; F151-G153 VanDerWaalsContact C-N 3.32Å; F151-G153 PolarHBondContact O-N 3.44Å; F151-F154 PolarHBondContact O-N 2.84Å; F151-I155 HydrophobicContact CE2-CB 4.35Å; F151-I155 HydrophobicContact CE2-CD1 4.04Å; F151-I155 HydrophobicContact CE2-CG1 4.21Å; F151-I155 HydrophobicContact CZ-CB 4.33Å; F151-I155 HydrophobicContact CZ-CD1 4.27Å; F151-I155 HydrophobicContact CZ-CG1 4.04Å; F151-I155 VanDerWaalsContact O-CB 3.26Å; F151-I155 WeakPolarHBondContact O-CB 3.28Å; F151-I155 WeakPolarHBondContact O-CG2 3.43Å; F151-I155 PolarHBondContact O-N 3.48Å; F151-I221 HydrophobicContact CE1-CG2 3.9Å; F151-I222 HydrophobicContact CE1-CG1 3.7Å; F151-I222 HydrophobicContact CZ-CG1 3.95Å
152C97.8Very high97.2Very high12 Ų1233.8 Ų33.88%0.08116%0.164CC..Hα-helixtrans-67-33.4-176.9-60.70000112.3I142 W148 I221I142-C152 HydrophobicContact CD1-CB 3.78Å; W148-C152 VanDerWaalsContact O-CB 3.3Å; W148-C152 WeakPolarHBondContact O-CB 3.38Å; W148-C152 PolarHBondContact O-N 3.47Å; W148-C152 PolarHBondContact O-SG 2.96Å; C152-I221 HydrophobicContact CB-CD1 4.46Å
153G97.8Very high97.3Very high0 Ų034 Ų340%017%0.167CC..Hα-helixtrans-68.7-35.1177.700000113.2A133 I149 F151 M157A133-G153 WeakPolarHBondContact CB-O 3.14Å; I149-G153 WeakPolarHBondContact O-CA 3.3Å; I149-G153 PolarHBondContact O-N 3.31Å; F151-G153 VanDerWaalsContact C-N 3.32Å; F151-G153 PolarHBondContact O-N 3.44Å; G153-M157 WeakPolarHBondContact O-CE 3.31Å
154F98.7Very high97.4Very high8 Ų834 Ų344%0.03516%0.164CC..Hα-helixtrans-97.2-25.7-177.1-77.1-69000114.8F150 F151 G156 M157 F158 L264 A267 Y286 L287 F290 I294F150-F154 HydrophobicContact CD1-CD2 4.22Å; F150-F154 HydrophobicContact CD2-CD2 4.02Å; F150-F154 AromaticContact CD2-CE2 3.83Å; F150-F154 HydrophobicContact CD2-CE2 3.83Å; F150-F154 HydrophobicContact CE1-CD2 4.1Å; F150-F154 AromaticContact CE2-CD2 3.91Å; F150-F154 HydrophobicContact CE2-CD2 3.91Å; F150-F154 AromaticContact CE2-CE2 3.59Å; F150-F154 HydrophobicContact CE2-CE2 3.59Å; F150-F154 HydrophobicContact CG-CD2 4.18Å; F150-F154 HydrophobicContact CG-CE2 4.43Å; F150-F154 AromaticContact CZ-CD2 3.93Å; F150-F154 HydrophobicContact CZ-CD2 3.93Å; F150-F154 AromaticContact CZ-CE2 3.99Å; F150-F154 HydrophobicContact CZ-CE2 3.99Å; F150-F154 VanDerWaalsContact O-CD2 3.27Å; F150-F154 WeakPolarHBondContact O-CD2 3.43Å; F150-F154 PolarHBondContact O-N 3.31Å; F151-F154 PolarHBondContact O-N 2.84Å; F154-G156 PolarHBondContact O-N 3.2Å; F154-M157 HydrophobicContact CD1-SD 3.92Å; F154-M157 HydrophobicContact CE1-SD 4.3Å; F154-M157 PolarHBondContact O-N 3.31Å; F154-F158 PolarHBondContact O-N 2.83Å; F154-L264 HydrophobicContact CB-CD2 4.07Å; F154-L264 HydrophobicContact CD1-CD2 3.9Å; F154-L264 HydrophobicContact CG-CD2 4.09Å; F154-A267 HydrophobicContact CE1-CB 4.5Å; F154-A267 HydrophobicContact CE2-CB 4.31Å; F154-A267 HydrophobicContact CZ-CB 3.99Å; F154-Y286 HydrophobicContact CE2-CD1 4.48Å; F154-Y286 HydrophobicContact CE2-CE1 4.26Å; F154-Y286 HydrophobicContact CZ-CD1 4.32Å; F154-Y286 HydrophobicContact CZ-CE1 4.13Å; F154-L287 HydrophobicContact CD2-CD2 3.93Å; F154-L287 HydrophobicContact CE2-CD2 3.6Å; F154-L287 HydrophobicContact CZ-CD2 3.96Å; F154-F290 HydrophobicContact CE1-CB 3.51Å; F154-F290 HydrophobicContact CE1-CG 4.41Å; F154-F290 HydrophobicContact CZ-CB 3.6Å; F154-F290 HydrophobicContact CZ-CG 4.16Å; F154-I294 HydrophobicContact CD1-CD1 3.68Å; F154-I294 HydrophobicContact CE1-CD1 3.9Å
155I98.1Very high97.8Very high26 Ų2628.8 Ų28.813%0.13314%0.144CC..Hα-helixtrans-63.1-39-171.5-169.362.5000112.9F151 F158 M159 I221 A225F151-I155 HydrophobicContact CE2-CB 4.35Å; F151-I155 HydrophobicContact CE2-CD1 4.04Å; F151-I155 HydrophobicContact CE2-CG1 4.21Å; F151-I155 HydrophobicContact CZ-CB 4.33Å; F151-I155 HydrophobicContact CZ-CD1 4.27Å; F151-I155 HydrophobicContact CZ-CG1 4.04Å; F151-I155 VanDerWaalsContact O-CB 3.26Å; F151-I155 WeakPolarHBondContact O-CB 3.28Å; F151-I155 WeakPolarHBondContact O-CG2 3.43Å; F151-I155 PolarHBondContact O-N 3.48Å; I155-F158 HydrophobicContact CD1-CD1 4.06Å; I155-F158 PolarHBondContact O-N 3.06Å; I155-M159 HydrophobicContact CD1-CE 4.31Å; I155-M159 HydrophobicContact CG1-CG 4.49Å; I155-M159 VanDerWaalsContact O-CG 3.29Å; I155-M159 WeakPolarHBondContact O-CG 3.45Å; I155-M159 PolarHBondContact O-N 2.85Å; I155-I221 HydrophobicContact CG2-CG2 3.53Å; I155-A225 HydrophobicContact CD1-CB 3.91Å; I155-A225 HydrophobicContact CG1-CB 3.74Å
156G97.1Very high97.9Very high29 Ų2925.6 Ų25.630%0.29913%0.131SC..Hα-helixtrans-62.9-43.3176.300000112.4F154 F158 M159 F160F154-G156 PolarHBondContact O-N 3.2Å; G156-F158 VanDerWaalsContact C-N 3.34Å; G156-F158 PolarHBondContact O-N 2.93Å; G156-M159 PolarHBondContact O-N 3.1Å; G156-F160 PolarHBondContact O-N 3.01Å
157M98.1Very high97.9Very high5 Ų524 Ų243%0.02512%0.121CC..Hα-helixtrans-64.5-39.9176.9-52.5167.6-17000111.4T129 V130 A133 G153 F154 F161 I294T129-M157 HydrophobicContact CG2-CG 4.23Å; V130-M157 HydrophobicContact CB-CE 4.13Å; V130-M157 HydrophobicContact CG1-CE 3.98Å; V130-M157 HydrophobicContact CG2-CE 4.11Å; V130-M157 HydrophobicContact CG2-CG 4.45Å; V130-M157 HydrophobicContact CG2-SD 4.37Å; A133-M157 HydrophobicContact CB-CE 4.13Å; G153-M157 WeakPolarHBondContact O-CE 3.31Å; F154-M157 HydrophobicContact CD1-SD 3.92Å; F154-M157 HydrophobicContact CE1-SD 4.3Å; F154-M157 PolarHBondContact O-N 3.31Å; M157-F161 PolarHBondContact O-N 3.49Å; M157-I294 HydrophobicContact CB-CD1 4.19Å; M157-I294 HydrophobicContact CB-CG2 3.9Å; M157-I294 HydrophobicContact SD-CD1 3.97Å
158F98.5Very high98Very high39 Ų3919.1 Ų19.117%0.17110%0.095CC..Hα-helixtrans-64.7-42.6174.3175.4-112.5000111.8F154 I155 G156 F161 C162 F233 I260 L264F154-F158 PolarHBondContact O-N 2.83Å; I155-F158 HydrophobicContact CD1-CD1 4.06Å; I155-F158 PolarHBondContact O-N 3.06Å; G156-F158 VanDerWaalsContact C-N 3.34Å; G156-F158 PolarHBondContact O-N 2.93Å; F158-F161 WeakPolarHBondContact O-CB 3.08Å; F158-F161 PolarHBondContact O-N 2.88Å; F158-C162 WeakPolarHBondContact CZ-SG 3.3Å; F158-C162 PolarHBondContact O-N 3.2Å; F158-C162 PolarHBondContact O-SG 3.32Å; F158-F233 HydrophobicContact CZ-CE2 4.28Å; F158-F233 HydrophobicContact CZ-CZ 4.45Å; F158-I260 HydrophobicContact CD2-CG1 3.78Å; F158-I260 HydrophobicContact CE2-CG1 4.36Å; F158-I260 HydrophobicContact CE2-CG2 4.32Å; F158-L264 HydrophobicContact CB-CD1 4.42Å; F158-L264 HydrophobicContact CD2-CD1 3.79Å; F158-L264 HydrophobicContact CE2-CD1 4.45Å; F158-L264 HydrophobicContact CG-CD1 4.28Å
159M97.3Very high98Very high23 Ų2314.4 Ų14.411%0.1138%0.077CC..Hα-helixtrans-63-43.9176.6-71.6-59.591.700111.9I155 G156 F161 C162 A163 A225 C229 Y232I155-M159 HydrophobicContact CD1-CE 4.31Å; I155-M159 HydrophobicContact CG1-CG 4.49Å; I155-M159 VanDerWaalsContact O-CG 3.29Å; I155-M159 WeakPolarHBondContact O-CG 3.45Å; I155-M159 PolarHBondContact O-N 2.85Å; G156-M159 PolarHBondContact O-N 3.1Å; M159-F161 VanDerWaalsContact C-N 3.32Å; M159-F161 PolarHBondContact O-N 3Å; M159-C162 PolarHBondContact O-N 3.22Å; M159-A163 PolarHBondContact O-N 3.47Å; M159-A225 HydrophobicContact SD-CB 4.44Å; M159-C229 WeakPolarHBondContact CE-SG 3.44Å; M159-Y232 HydrophobicContact SD-CD2 4.41Å; M159-Y232 HydrophobicContact SD-CE2 4.14Å
160F97.6Very high98Very high21 Ų2114.7 Ų14.79%0.0928%0.079CC..Hα-helixtrans-59.1-43.5174.5-175.8-91.4000112.1H122 D125 A126 T129 G156 A163 H164H122-F160 WeakPolarHBondContact O-CZ 3.38Å; D125-F160 HydrophobicContact CB-CD2 4.47Å; D125-F160 HydrophobicContact CB-CE2 3.45Å; D125-F160 VanDerWaalsContact CB-CE2 3.45Å; D125-F160 HydrophobicContact CB-CZ 3.67Å; A126-F160 HydrophobicContact CB-CD1 4.18Å; A126-F160 HydrophobicContact CB-CE1 3.51Å; A126-F160 HydrophobicContact CB-CZ 4.05Å; T129-F160 HydrophobicContact CG2-CB 4.36Å; G156-F160 PolarHBondContact O-N 3.01Å; F160-A163 PolarHBondContact O-N 2.82Å; F160-H164 AromaticContact CD1-ND1 3.93Å; F160-H164 AromaticContact CE1-CE1 3.59Å; F160-H164 AromaticContact CE1-ND1 3.57Å; F160-H164 AromaticContact CE2-CE1 3.51Å; F160-H164 AromaticContact CZ-CE1 3.16Å; F160-H164 WeakPolarHBondContact CZ-CE1 3.42Å; F160-H164 AromaticContact CZ-ND1 3.64Å; F160-H164 PolarHBondContact O-N 3.32Å; F160-H164 PolarHBondContact O-ND1 2.99Å
161F98.6Very high97.9Very high0 Ų014.4 Ų14.40%08%0.084CC..Hα-helixtrans-61.2-44.7174.4-176-87.2000111.7M157 F158 M159 A163 H164 W165 P256 I260 I297 L301M157-F161 PolarHBondContact O-N 3.49Å; F158-F161 WeakPolarHBondContact O-CB 3.08Å; F158-F161 PolarHBondContact O-N 2.88Å; M159-F161 VanDerWaalsContact C-N 3.32Å; M159-F161 PolarHBondContact O-N 3Å; F161-A163 VanDerWaalsContact C-N 3.34Å; F161-A163 PolarHBondContact O-N 3.44Å; F161-H164 PolarHBondContact O-N 3.31Å; F161-W165 HydrophobicContact CD1-CB 4.5Å; F161-W165 HydrophobicContact CD1-CE3 4.21Å; F161-W165 HydrophobicContact CE1-CB 4.36Å; F161-W165 HydrophobicContact CE1-CD2 4.36Å; F161-W165 AromaticContact CE1-CE3 3.88Å; F161-W165 HydrophobicContact CE1-CE3 3.88Å; F161-W165 WeakPolarHBondContact O-CB 3.38Å; F161-W165 PolarHBondContact O-N 3.46Å; F161-P256 HydrophobicContact CE1-CB 4.06Å; F161-P256 HydrophobicContact CZ-CB 3.92Å; F161-P256 WeakPolarHBondContact CZ-O 3.44Å; F161-I260 HydrophobicContact CB-CD1 4.39Å; F161-I260 HydrophobicContact CB-CG1 4.38Å; F161-I260 HydrophobicContact CD1-CB 3.68Å; F161-I260 HydrophobicContact CD1-CG1 3.95Å; F161-I260 HydrophobicContact CD1-CG2 3.66Å; F161-I260 HydrophobicContact CD2-CB 4.33Å; F161-I260 HydrophobicContact CD2-CD1 4.44Å; F161-I260 HydrophobicContact CE1-CB 3.61Å; F161-I260 HydrophobicContact CE1-CG1 4.4Å; F161-I260 HydrophobicContact CE1-CG2 3.44Å; F161-I260 VanDerWaalsContact CE1-CG2 3.44Å; F161-I260 HydrophobicContact CE2-CB 4.28Å; F161-I260 HydrophobicContact CG-CB 4.05Å; F161-I260 HydrophobicContact CG-CD1 4.23Å; F161-I260 HydrophobicContact CG-CG1 4.02Å; F161-I260 HydrophobicContact CZ-CB 3.92Å; F161-I260 HydrophobicContact CZ-CG2 4.14Å; F161-I297 HydrophobicContact CE2-CG2 3.79Å; F161-L301 HydrophobicContact CD1-CD2 4.47Å; F161-L301 HydrophobicContact CD2-CD2 4.08Å; F161-L301 HydrophobicContact CE1-CD2 4.09Å; F161-L301 HydrophobicContact CE2-CB 4.4Å; F161-L301 HydrophobicContact CE2-CD2 3.64Å; F161-L301 HydrophobicContact CG-CD2 4.47Å; F161-L301 HydrophobicContact CZ-CD2 3.67Å
162C98.3Very high97.8Very high0 Ų012.6 Ų12.60%08%0.079CC..Hα-helixtrans-63.7-35.8178.1-76.90000113.2F158 M159 H164 W165 Q166 Y232F158-C162 WeakPolarHBondContact CZ-SG 3.3Å; F158-C162 PolarHBondContact O-N 3.2Å; F158-C162 PolarHBondContact O-SG 3.32Å; M159-C162 PolarHBondContact O-N 3.22Å; C162-H164 VanDerWaalsContact C-N 3.29Å; C162-H164 PolarHBondContact O-N 2.86Å; C162-W165 PolarHBondContact O-N 3.25Å; C162-Q166 PolarHBondContact O-N 3.44Å; C162-Y232 HydrophobicContact CB-CD2 3.48Å; C162-Y232 VanDerWaalsContact CB-CD2 3.48Å; C162-Y232 HydrophobicContact CB-CE2 4.13Å; C162-Y232 HydrophobicContact CB-CG 4.18Å
163A97.6Very high97.6Very high12 Ų1212.7 Ų12.710%0.0998%0.078CC..Hα-helixtrans-60.2-40.6173.400000111.6M159 F160 F161 Q166 T167 L173 Y232M159-A163 PolarHBondContact O-N 3.47Å; F160-A163 PolarHBondContact O-N 2.82Å; F161-A163 VanDerWaalsContact C-N 3.34Å; F161-A163 PolarHBondContact O-N 3.44Å; A163-Q166 WeakPolarHBondContact O-CG 3.28Å; A163-T167 PolarHBondContact O-N 3.17Å; A163-T167 PolarHBondContact O-OG1 3.29Å; A163-L173 HydrophobicContact CB-CD1 4.39Å; A163-Y232 HydrophobicContact CB-CE1 4.43Å; A163-Y232 HydrophobicContact CB-CE2 4.45Å
164H98.2Very high97.4Very high11 Ų1118.3 Ų18.35%0.05110%0.099CC..Hα-helixtrans-77.3-29.3175.7-71.783.1000112.8H122 F160 F161 C162 T167 Y168 L301 V302H122-H164 AromaticContact CD2-NE2 3.68Å; H122-H164 AromaticContact CG-NE2 3.62Å; F160-H164 AromaticContact CD1-ND1 3.93Å; F160-H164 AromaticContact CE1-CE1 3.59Å; F160-H164 AromaticContact CE1-ND1 3.57Å; F160-H164 AromaticContact CE2-CE1 3.51Å; F160-H164 AromaticContact CZ-CE1 3.16Å; F160-H164 WeakPolarHBondContact CZ-CE1 3.42Å; F160-H164 AromaticContact CZ-ND1 3.64Å; F160-H164 PolarHBondContact O-N 3.32Å; F160-H164 PolarHBondContact O-ND1 2.99Å; F161-H164 PolarHBondContact O-N 3.31Å; C162-H164 VanDerWaalsContact C-N 3.29Å; C162-H164 PolarHBondContact O-N 2.86Å; H164-T167 WeakPolarHBondContact O-CB 3.5Å; H164-T167 PolarHBondContact O-N 3.46Å; H164-Y168 WeakPolarHBondContact O-CB 3.41Å; H164-Y168 PolarHBondContact O-N 3.19Å; H164-L301 HydrophobicContact CB-CD2 3.92Å; H164-L301 HydrophobicContact CB-CG 4.25Å; H164-V302 WeakPolarHBondContact CD2-CG2 3.2Å
165W98.5Very high97Very high10 Ų1021.5 Ų21.54%0.03811%0.113CC..Hα-helixtrans-65.2-48.5173.7-175.6-1.3000111.1F161 C162 T167 Y168 V169 F233 I236 V253 L254 P256 G257 L301F161-W165 HydrophobicContact CD1-CB 4.5Å; F161-W165 HydrophobicContact CD1-CE3 4.21Å; F161-W165 HydrophobicContact CE1-CB 4.36Å; F161-W165 HydrophobicContact CE1-CD2 4.36Å; F161-W165 AromaticContact CE1-CE3 3.88Å; F161-W165 HydrophobicContact CE1-CE3 3.88Å; F161-W165 WeakPolarHBondContact O-CB 3.38Å; F161-W165 PolarHBondContact O-N 3.46Å; C162-W165 PolarHBondContact O-N 3.25Å; W165-T167 PolarHBondContact O-N 2.87Å; W165-Y168 PolarHBondContact O-N 2.87Å; W165-V169 WeakPolarHBondContact O-CG2 3.37Å; W165-V169 PolarHBondContact O-N 3.24Å; W165-F233 HydrophobicContact CH2-CE1 4.05Å; W165-F233 HydrophobicContact CH2-CZ 4.32Å; W165-F233 HydrophobicContact CZ3-CE1 4.22Å; W165-F233 HydrophobicContact CZ3-CZ 4.05Å; W165-I236 HydrophobicContact CB-CD1 4.16Å; W165-I236 HydrophobicContact CD2-CD1 3.64Å; W165-I236 HydrophobicContact CD2-CG1 4.36Å; W165-I236 HydrophobicContact CE3-CD1 4.06Å; W165-I236 HydrophobicContact CG-CD1 3.71Å; W165-I236 HydrophobicContact CG-CG1 4.12Å; W165-I236 HydrophobicContact CZ2-CG2 3.91Å; W165-V253 VanDerWaalsContact CE2-O 3.3Å; W165-V253 WeakPolarHBondContact CZ2-O 3.4Å; W165-V253 PolarHBondContact NE1-O 3.38Å; W165-L254 HydrophobicContact CZ2-CD2 4.42Å; W165-P256 HydrophobicContact CD2-CB 3.88Å; W165-P256 HydrophobicContact CG-CB 3.81Å; W165-P256 HydrophobicContact CG-CG 4.18Å; W165-G257 VanDerWaalsContact CZ3-CA 3.45Å; W165-L301 HydrophobicContact CB-CD2 4.1Å
166Q97.9Very high96.5Very high3 Ų321.2 Ų21.21%0.01412%0.117CC..Hα-helixtrans-59.8-31.2174.365.6148.8-43.900112.1C162 A163 V169 S170 R174 Y232 V235 I236C162-Q166 PolarHBondContact O-N 3.44Å; A163-Q166 WeakPolarHBondContact O-CG 3.28Å; Q166-V169 PolarHBondContact O-N 2.95Å; Q166-S170 WeakPolarHBondContact O-CB 3.18Å; Q166-S170 PolarHBondContact O-N 3.41Å; Q166-S170 PolarHBondContact O-OG 3.05Å; Q166-R174 PolarHBondContact NE2-O 3.23Å; Q166-Y232 HydrophobicContact CG-CD1 4.23Å; Q166-V235 HydrophobicContact CB-CB 4.19Å; Q166-V235 HydrophobicContact CB-CG1 3.98Å; Q166-I236 HydrophobicContact CB-CG1 4.06Å
167T97.7Very high96.1Very high7 Ų725 Ų254%0.04313%0.13CC..Hα-helixtrans-72.4-42.4178.5-55.70000111.1A163 H164 W165 V169 S170 G171 L173 H305A163-T167 PolarHBondContact O-N 3.17Å; A163-T167 PolarHBondContact O-OG1 3.29Å; H164-T167 WeakPolarHBondContact O-CB 3.5Å; H164-T167 PolarHBondContact O-N 3.46Å; W165-T167 PolarHBondContact O-N 2.87Å; T167-V169 PolarHBondContact O-N 3Å; T167-S170 PolarHBondContact O-N 3.45Å; T167-G171 VanDerWaalsContact O-CA 3.31Å; T167-G171 WeakPolarHBondContact O-CA 3.32Å; T167-G171 PolarHBondContact O-N 3.14Å; T167-L173 HydrophobicContact CG2-CB 4.2Å; T167-L173 WeakPolarHBondContact OG1-CA 3.26Å; T167-L173 WeakPolarHBondContact OG1-CD1 3.18Å; T167-H305 PolarHBondContact O-ND1 3.1Å
168Y98.1Very high95.7Very high1 Ų128 Ų280%0.00415%0.148CC..Hα-helixtrans-60.9-30.8171.5-177.6-109.8000112.7H164 W165 T247 V248 A249 T251 P256 L301 A304 H305 S309H164-Y168 WeakPolarHBondContact O-CB 3.41Å; H164-Y168 PolarHBondContact O-N 3.19Å; W165-Y168 PolarHBondContact O-N 2.87Å; Y168-T247 HydrophobicContact CD1-CG2 3.56Å; Y168-T247 VanDerWaalsContact CE1-CB 3.47Å; Y168-T247 HydrophobicContact CE1-CG2 3.42Å; Y168-T247 VanDerWaalsContact CE1-CG2 3.42Å; Y168-V248 HydrophobicContact CD2-CG2 3.81Å; Y168-V248 HydrophobicContact CE2-CG2 3.95Å; Y168-V248 WeakPolarHBondContact O-CG1 3.27Å; Y168-V248 WeakPolarHBondContact O-CG2 3.43Å; Y168-V248 PolarHBondContact O-N 2.84Å; Y168-A249 HydrophobicContact CE2-CB 4.14Å; Y168-A249 WeakPolarHBondContact OH-CB 3.48Å; Y168-T251 PolarHBondContact OH-OG1 3.43Å; Y168-T251 VanDerWaalsContact OH-OG1 3.1Å; Y168-P256 HydrophobicContact CD1-CG 3.74Å; Y168-P256 HydrophobicContact CE1-CG 4Å; Y168-L301 HydrophobicContact CD1-CD1 4.02Å; Y168-L301 HydrophobicContact CD2-CD1 4.14Å; Y168-L301 HydrophobicContact CG-CD1 3.7Å; Y168-A304 HydrophobicContact CD2-CB 4.23Å; Y168-A304 HydrophobicContact CE2-CB 3.8Å; Y168-H305 HydrophobicContact CD2-CB 3.9Å; Y168-S309 PolarHBondContact OH-O 3.19Å
169V98.1Very high95.3Very high0 Ų027.1 Ų27.10%015%0.145CC..Hα-helixtrans-79.5-50.8176.2173.20000111.8W165 Q166 T167 I236 G240 V241 T247 V253W165-V169 WeakPolarHBondContact O-CG2 3.37Å; W165-V169 PolarHBondContact O-N 3.24Å; Q166-V169 PolarHBondContact O-N 2.95Å; T167-V169 PolarHBondContact O-N 3Å; V169-I236 HydrophobicContact CG2-CG1 4.39Å; V169-I236 HydrophobicContact CG2-CG2 4.34Å; V169-G240 WeakPolarHBondContact O-CA 3.46Å; V169-V241 PolarHBondContact O-N 3.09Å; V169-T247 HydrophobicContact CG2-CG2 3.94Å; V169-V253 HydrophobicContact CG1-CB 4.41Å; V169-V253 HydrophobicContact CG1-CG1 3.84Å; V169-V253 HydrophobicContact CG2-CB 3.97Å; V169-V253 HydrophobicContact CG2-CG1 4.1Å
170S97.2Very high95.1Very high8 Ų829 Ų296%0.05616%0.158CC..Hα-helixtrans-98.2-8.3-166.870.40000115.1Q166 T167 T172 G239 V241Q166-S170 WeakPolarHBondContact O-CB 3.18Å; Q166-S170 PolarHBondContact O-N 3.41Å; Q166-S170 PolarHBondContact O-OG 3.05Å; T167-S170 PolarHBondContact O-N 3.45Å; S170-T172 PolarHBondContact O-N 3.49Å; S170-T172 PolarHBondContact OG-O 3.28Å; S170-G239 VanDerWaalsContact CA-O 3.27Å; S170-G239 WeakPolarHBondContact CA-O 3.35Å; S170-G239 WeakPolarHBondContact CB-O 3.33Å; S170-V241 VanDerWaalsContact O-CG1 3.26Å; S170-V241 WeakPolarHBondContact O-CG1 3.27Å
171G96.3Very high95Very high21 Ų2129 Ų2922%0.21616%0.16CC..SBendtrans75.21.9-177.400000114.8T167T167-G171 VanDerWaalsContact O-CA 3.31Å; T167-G171 WeakPolarHBondContact O-CA 3.32Å; T167-G171 PolarHBondContact O-N 3.14Å
172T95.9Very high94.9Very high29 Ų2929.6 Ų29.618%0.17816%0.163CC..SBendtrans-141.8131.7-176-61.40000110.5S24 S170S24-T172 WeakPolarHBondContact O-CA 3.33Å; S24-T172 WeakPolarHBondContact OG-CG2 3.5Å; S24-T172 PolarHBondContact OG-OG1 3.31Å; S170-T172 PolarHBondContact O-N 3.49Å; S170-T172 PolarHBondContact OG-O 3.28Å
173L94.7Very high94.8Very high13 Ų1333.1 Ų33.17%0.06818%0.184CC..EExtended strand (participates in β ladder)trans-74.7125172.4-175.364000109.4S24 A25 S26 A163 T167 F175S24-L173 PolarHBondContact O-N 2.93Å; A25-L173 CarbonylContact C-O 3.59Å; A25-L173 WeakPolarHBondContact CA-O 3.4Å; A25-L173 HydrophobicContact CB-CB 4.22Å; S26-L173 PolarHBondContact N-O 3.05Å; A163-L173 HydrophobicContact CB-CD1 4.39Å; T167-L173 HydrophobicContact CG2-CB 4.2Å; T167-L173 WeakPolarHBondContact OG1-CA 3.26Å; T167-L173 WeakPolarHBondContact OG1-CD1 3.18Å; L173-F175 HydrophobicContact CD2-CE1 3.95Å; L173-F175 HydrophobicContact CD2-CE2 4.42Å; L173-F175 HydrophobicContact CD2-CZ 3.63Å; L173-F175 HydrophobicContact CG-CE1 4.29Å; L173-F175 HydrophobicContact CG-CZ 4.11Å
174R93.4Very high94.8Very high119 Ų11933.2 Ų33.245%0.44918%0.182SC..EExtended strand (participates in β ladder)trans-115.3117.7-176.9-53.4-173.2173.7-149.4-1.6111S26 Q166S26-R174 CarbonylContact O-C 3.52Å; S26-R174 WeakPolarHBondContact O-CA 3.42Å; Q166-R174 PolarHBondContact NE2-O 3.23Å
175F89.6Confident94.8Very high74 Ų7434.7 Ų34.733%0.32519%0.19SC..EExtended strand (participates in β ladder)trans-85.3137.3176.7-59.1-70.9000111.7A25 S26 L173 D179A25-F175 HydrophobicContact CB-CE2 3.76Å; S26-F175 WeakPolarHBondContact O-CD2 3.3Å; S26-F175 PolarHBondContact O-N 2.93Å; L173-F175 HydrophobicContact CD2-CE1 3.95Å; L173-F175 HydrophobicContact CD2-CE2 4.42Å; L173-F175 HydrophobicContact CD2-CZ 3.63Å; L173-F175 HydrophobicContact CG-CE1 4.29Å; L173-F175 HydrophobicContact CG-CZ 4.11Å; F175-D179 VanDerWaalsContact CA-OD2 3.23Å; F175-D179 WeakPolarHBondContact CA-OD2 3.33Å
176G87.9Confident94.8Very high21 Ų2136.4 Ų36.422%0.21621%0.207CC..  trans-86.5177.9175.200000112.9S29 V178 D179S29-G176 WeakPolarHBondContact CA-O 3.23Å; G176-V178 VanDerWaalsContact C-N 3.33Å; G176-D179 PolarHBondContact N-OD2 3.09Å
177L88.3Confident94.8Very high108 Ų10837 Ų3757%0.56521%0.209SC*.SBendtrans-67-36.6172.2-73.1173.4000112.3L30L30-L177 WeakPolarHBondContact CB-O 3.42Å; L30-L177 PolarHBondContact N-O 3.46Å
178V90.3Very high94.8Very high69 Ų6937.6 Ų37.642%0.41821%0.212SC..SBendtrans-114115.7171.7179.40000106.2G176 E182G176-V178 VanDerWaalsContact C-N 3.33Å; V178-E182 HydrophobicContact CG1-CB 4.08Å
179D90.8Very high94.9Very high19 Ų1941.9 Ų41.910%0.10223%0.234CC..  trans-139.6-165.7-174.9-142.8-56.9000109.9F175 G176 T181 E182 V183F175-D179 VanDerWaalsContact CA-OD2 3.23Å; F175-D179 WeakPolarHBondContact CA-OD2 3.33Å; G176-D179 PolarHBondContact N-OD2 3.09Å; D179-T181 PolarHBondContact O-N 3.14Å; D179-T181 VanDerWaalsContact O-N 3.09Å; D179-E182 PolarHBondContact N-OE2 3.16Å; D179-E182 PolarHBondContact O-N 3.3Å; D179-V183 WeakPolarHBondContact O-CG2 3.33Å; D179-V183 PolarHBondContact O-N 2.71Å; D179-V183 VanDerWaalsContact O-N 3.16Å
180V93Very high94.9Very high63 Ų6342.9 Ų42.938%0.38224%0.239SC..Hα-helixtrans-50.9-38.3-174.7179.10000112.7V183 Q184V180-V183 PolarHBondContact O-N 2.78Å; V180-Q184 HydrophobicContact CG1-CG 4.11Å; V180-Q184 WeakPolarHBondContact O-CB 3.1Å; V180-Q184 VanDerWaalsContact O-CG 3.32Å; V180-Q184 WeakPolarHBondContact O-CG 3.43Å; V180-Q184 PolarHBondContact O-N 2.82Å
181T95.1Very high95Very high21 Ų2142.5 Ų42.513%0.12924%0.237CC..Hα-helixtrans-62.2-51.4-178.8-63.70000112F31 W39 Q97 D179 V183 I185F31-T181 HydrophobicContact CB-CG2 4.12Å; W39-T181 HydrophobicContact CH2-CG2 4.06Å; W39-T181 HydrophobicContact CZ2-CG2 4.41Å; Q97-T181 PolarHBondContact NE2-O 3.08Å; D179-T181 PolarHBondContact O-N 3.14Å; D179-T181 VanDerWaalsContact O-N 3.09Å; T181-V183 VanDerWaalsContact C-N 3.35Å; T181-V183 PolarHBondContact O-N 2.94Å; T181-I185 HydrophobicContact CG2-CD1 3.93Å; T181-I185 VanDerWaalsContact O-CG1 3.32Å; T181-I185 WeakPolarHBondContact O-CG1 3.24Å; T181-I185 PolarHBondContact O-N 2.85Å
182E95.8Very high95.1Very high13 Ų1344.8 Ų44.86%0.06124%0.243CC..Hα-helixtrans-64.5-41.6-179.8-6667.2-148.900111.2S29 L30 F31 V178 D179 I185 A186S29-E182 WeakPolarHBondContact CB-OE1 3.37Å; S29-E182 VanDerWaalsContact CB-OE2 3.3Å; S29-E182 WeakPolarHBondContact CB-OE2 3.39Å; S29-E182 VanDerWaalsContact OG-CD 3.31Å; S29-E182 PolarHBondContact OG-OE1 3.39Å; S29-E182 PolarHBondContact OG-OE2 3.39Å; L30-E182 HydrophobicContact CB-CG 4.35Å; L30-E182 PolarHBondContact N-OE1 2.92Å; F31-E182 HydrophobicContact CB-CG 4.35Å; F31-E182 HydrophobicContact CD2-CB 4.2Å; F31-E182 HydrophobicContact CD2-CG 3.67Å; F31-E182 HydrophobicContact CE2-CG 4.17Å; F31-E182 HydrophobicContact CG-CG 4.1Å; F31-E182 PolarHBondContact N-OE1 3.5Å; V178-E182 HydrophobicContact CG1-CB 4.08Å; D179-E182 PolarHBondContact N-OE2 3.16Å; D179-E182 PolarHBondContact O-N 3.3Å; E182-I185 PolarHBondContact O-N 2.94Å; E182-A186 WeakPolarHBondContact O-CB 3.37Å; E182-A186 PolarHBondContact O-N 3.44Å
183V96.1Very high95.2Very high74 Ų7446.4 Ų46.445%0.44825%0.25SC..Hα-helixtrans-64.4-46.6-179.5174.50000110.7D179 V180 T181 A186 I187D179-V183 WeakPolarHBondContact O-CG2 3.33Å; D179-V183 PolarHBondContact O-N 2.71Å; D179-V183 VanDerWaalsContact O-N 3.16Å; V180-V183 PolarHBondContact O-N 2.78Å; T181-V183 VanDerWaalsContact C-N 3.35Å; T181-V183 PolarHBondContact O-N 2.94Å; V183-A186 WeakPolarHBondContact O-CB 3.27Å; V183-A186 PolarHBondContact O-N 3.2Å; V183-I187 HydrophobicContact CG1-CD1 3.81Å; V183-I187 VanDerWaalsContact O-CG1 3.28Å; V183-I187 WeakPolarHBondContact O-CG1 3.41Å; V183-I187 PolarHBondContact O-N 2.93Å
184Q97.9Very high95.4Very high13 Ų1345.8 Ų45.86%0.06125%0.247CC..Hα-helixtrans-64.9-39.8177.6-75.7176.4-8.900112.1L93 Q97 V180 A186 I187 I188L93-Q184 HydrophobicContact CD1-CG 4.21Å; Q97-Q184 VanDerWaalsContact CB-OE1 3.26Å; V180-Q184 HydrophobicContact CG1-CG 4.11Å; V180-Q184 WeakPolarHBondContact O-CB 3.1Å; V180-Q184 VanDerWaalsContact O-CG 3.32Å; V180-Q184 WeakPolarHBondContact O-CG 3.43Å; V180-Q184 PolarHBondContact O-N 2.82Å; Q184-A186 VanDerWaalsContact C-N 3.34Å; Q184-A186 PolarHBondContact O-N 2.87Å; Q184-I187 PolarHBondContact O-N 3.47Å; Q184-I188 VanDerWaalsContact O-CG1 3.26Å; Q184-I188 WeakPolarHBondContact O-CG1 3.31Å; Q184-I188 PolarHBondContact O-N 2.9Å
185I98.1Very high95.6Very high42 Ų4240.2 Ų40.222%0.21523%0.226CC..Hα-helixtrans-61.4-44174-70.9167.5000110.7F31 T181 E182 I187 I188 I189F31-I185 HydrophobicContact CB-CD1 4.14Å; F31-I185 HydrophobicContact CD2-CD1 3.91Å; F31-I185 HydrophobicContact CG-CD1 4.43Å; T181-I185 HydrophobicContact CG2-CD1 3.93Å; T181-I185 VanDerWaalsContact O-CG1 3.32Å; T181-I185 WeakPolarHBondContact O-CG1 3.24Å; T181-I185 PolarHBondContact O-N 2.85Å; E182-I185 PolarHBondContact O-N 2.94Å; I185-I187 VanDerWaalsContact C-N 3.32Å; I185-I187 PolarHBondContact O-N 3.42Å; I185-I188 PolarHBondContact O-N 3.39Å; I185-I189 HydrophobicContact CG2-CD1 4.1Å; I185-I189 WeakPolarHBondContact O-CG1 3.16Å; I185-I189 PolarHBondContact O-N 2.98Å
186A98.1Very high96Very high47 Ų4744.8 Ų44.839%0.38825%0.246SC..Hα-helixtrans-60.2-42.4175.900000111.6E182 V183 Q184 I189 M190E182-A186 WeakPolarHBondContact O-CB 3.37Å; E182-A186 PolarHBondContact O-N 3.44Å; V183-A186 WeakPolarHBondContact O-CB 3.27Å; V183-A186 PolarHBondContact O-N 3.2Å; Q184-A186 VanDerWaalsContact C-N 3.34Å; Q184-A186 PolarHBondContact O-N 2.87Å; A186-I189 WeakPolarHBondContact O-CB 3.42Å; A186-I189 PolarHBondContact O-N 3.18Å; A186-M190 VanDerWaalsContact O-CG 3.24Å; A186-M190 WeakPolarHBondContact O-CG 3.28Å; A186-M190 PolarHBondContact O-N 3.15Å
187I98.6Very high96.4Very high14 Ų1445.5 Ų45.57%0.07225%0.254CS..Hα-helixtrans-67.8-38.1178-66.7166.6000111.6L93 V132 T136 V183 Q184 I185 I189 M190 Y191L93-I187 HydrophobicContact CD2-CB 3.96Å; L93-I187 HydrophobicContact CD2-CG2 3.57Å; V132-I187 HydrophobicContact CG1-CD1 3.41Å; V132-I187 VanDerWaalsContact CG1-CD1 3.41Å; V132-I187 HydrophobicContact CG1-CG2 4.41Å; T136-I187 HydrophobicContact CG2-CG1 4.28Å; T136-I187 VanDerWaalsContact OG1-CG2 3.32Å; T136-I187 WeakPolarHBondContact OG1-CG2 3.41Å; V183-I187 HydrophobicContact CG1-CD1 3.81Å; V183-I187 VanDerWaalsContact O-CG1 3.28Å; V183-I187 WeakPolarHBondContact O-CG1 3.41Å; V183-I187 PolarHBondContact O-N 2.93Å; Q184-I187 PolarHBondContact O-N 3.47Å; I185-I187 VanDerWaalsContact C-N 3.32Å; I185-I187 PolarHBondContact O-N 3.42Å; I187-I189 VanDerWaalsContact C-N 3.3Å; I187-I189 PolarHBondContact O-N 2.64Å; I187-M190 HydrophobicContact CG1-SD 4.29Å; I187-M190 WeakPolarHBondContact O-CB 3.48Å; I187-M190 PolarHBondContact O-N 2.9Å; I187-M190 VanDerWaalsContact O-N 3.14Å; I187-Y191 HydrophobicContact CG2-CD2 4.05Å; I187-Y191 HydrophobicContact CG2-CE2 3.59Å; I187-Y191 WeakPolarHBondContact O-CD2 3.21Å; I187-Y191 PolarHBondContact O-N 3.24Å
188I98.8Very high96.8Very high21 Ų2140.9 Ų40.911%0.10823%0.232CC..Hα-helixtrans-58.3-45.4171.8-68.9161.1000110A90 L93 F94 Q184 I185 M190 Y191 L192A90-I188 HydrophobicContact CB-CG2 4.31Å; L93-I188 HydrophobicContact CB-CG1 4.03Å; L93-I188 HydrophobicContact CD2-CG1 3.95Å; L93-I188 HydrophobicContact CG-CD1 4.27Å; L93-I188 HydrophobicContact CG-CG1 3.93Å; F94-I188 HydrophobicContact CB-CD1 3.93Å; F94-I188 HydrophobicContact CD2-CD1 4.46Å; Q184-I188 VanDerWaalsContact O-CG1 3.26Å; Q184-I188 WeakPolarHBondContact O-CG1 3.31Å; Q184-I188 PolarHBondContact O-N 2.9Å; I185-I188 PolarHBondContact O-N 3.39Å; I188-M190 VanDerWaalsContact C-N 3.32Å; I188-M190 PolarHBondContact O-N 3.5Å; I188-Y191 PolarHBondContact O-N 2.62Å; I188-L192 HydrophobicContact CG2-CD1 4.39Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 3.29Å
189I98.6Very high97.1Very high90 Ų9037.6 Ų37.646%0.46221%0.212SC..Hα-helixtrans-60.9-42.4175.1-66.3164.2000110.7I185 A186 I187 Y191 L192 M193I185-I189 HydrophobicContact CG2-CD1 4.1Å; I185-I189 WeakPolarHBondContact O-CG1 3.16Å; I185-I189 PolarHBondContact O-N 2.98Å; A186-I189 WeakPolarHBondContact O-CB 3.42Å; A186-I189 PolarHBondContact O-N 3.18Å; I187-I189 VanDerWaalsContact C-N 3.3Å; I187-I189 PolarHBondContact O-N 2.64Å; I189-Y191 PolarHBondContact O-N 2.88Å; I189-L192 PolarHBondContact O-N 3.01Å; I189-M193 HydrophobicContact CG2-CG 4.35Å; I189-M193 HydrophobicContact CG2-SD 4.04Å; I189-M193 VanDerWaalsContact O-CG 3.3Å; I189-M193 WeakPolarHBondContact O-CG 3.46Å; I189-M193 PolarHBondContact O-N 2.67Å
190M98.4Very high97.3Very high21 Ų2139.5 Ų39.510%0.10323%0.231CC..Hα-helixtrans-60.8-42.8176.3-66.1165.267.600111.8T136 S139 C140 A186 I187 I188 M193 S194 W202 P217T136-M190 HydrophobicContact CG2-CE 3.56Å; T136-M190 HydrophobicContact CG2-SD 4.3Å; S139-M190 PolarHBondContact OG-O 3.26Å; C140-M190 WeakPolarHBondContact SG-CE 3.29Å; A186-M190 VanDerWaalsContact O-CG 3.24Å; A186-M190 WeakPolarHBondContact O-CG 3.28Å; A186-M190 PolarHBondContact O-N 3.15Å; I187-M190 HydrophobicContact CG1-SD 4.29Å; I187-M190 WeakPolarHBondContact O-CB 3.48Å; I187-M190 PolarHBondContact O-N 2.9Å; I187-M190 VanDerWaalsContact O-N 3.14Å; I188-M190 VanDerWaalsContact C-N 3.32Å; I188-M190 PolarHBondContact O-N 3.5Å; M190-M193 PolarHBondContact O-N 3.23Å; M190-S194 PolarHBondContact O-N 3.28Å; M190-S194 PolarHBondContact O-OG 2.79Å; M190-S194 VanDerWaalsContact O-OG 3.08Å; M190-W202 HydrophobicContact CB-CH2 4.08Å; M190-W202 HydrophobicContact CB-CZ2 3.98Å; M190-W202 HydrophobicContact CG-CH2 3.84Å; M190-W202 HydrophobicContact CG-CZ2 4.27Å; M190-P217 HydrophobicContact CE-CB 3.8Å; M190-P217 HydrophobicContact CE-CG 4.08Å; M190-P217 HydrophobicContact SD-CB 4.37Å
191Y98.8Very high97.4Very high0 Ų038.7 Ų38.70%022%0.224CC..Hα-helixtrans-61.4-42.7173.6-71.6-44.3000112.2L70 F86 L93 G135 T136 I187 I188 I189 M193 S194 A195L70-Y191 HydrophobicContact CD1-CD1 4.46Å; L70-Y191 HydrophobicContact CD1-CE1 3.82Å; F86-Y191 HydrophobicContact CD1-CD1 4.41Å; L93-Y191 HydrophobicContact CB-CE2 4.42Å; L93-Y191 HydrophobicContact CD2-CE2 3.97Å; G135-Y191 VanDerWaalsContact C-OH 3.24Å; G135-Y191 VanDerWaalsContact CA-OH 3.26Å; G135-Y191 WeakPolarHBondContact CA-OH 3.36Å; G135-Y191 WeakPolarHBondContact O-CE1 3.31Å; T136-Y191 PolarHBondContact N-OH 3.36Å; I187-Y191 HydrophobicContact CG2-CD2 4.05Å; I187-Y191 HydrophobicContact CG2-CE2 3.59Å; I187-Y191 WeakPolarHBondContact O-CD2 3.21Å; I187-Y191 PolarHBondContact O-N 3.24Å; I188-Y191 PolarHBondContact O-N 2.62Å; I189-Y191 PolarHBondContact O-N 2.88Å; Y191-M193 VanDerWaalsContact C-N 3.34Å; Y191-M193 PolarHBondContact O-N 2.86Å; Y191-S194 PolarHBondContact O-N 3.38Å; Y191-A195 WeakPolarHBondContact O-CB 3.47Å; Y191-A195 PolarHBondContact O-N 2.83Å
192L98.8Very high97.5Very high69 Ų6937.9 Ų37.936%0.36122%0.218SC..Hα-helixtrans-62.7-42175.9-66.1174.1000111.5L87 A90 I188 I189 S194 A195 F196L87-L192 HydrophobicContact CD2-CD2 3.87Å; A90-L192 HydrophobicContact CB-CD2 3.86Å; A90-L192 HydrophobicContact CB-CG 4.09Å; I188-L192 HydrophobicContact CG2-CD1 4.39Å; I188-L192 WeakPolarHBondContact O-CG 3.37Å; I188-L192 PolarHBondContact O-N 3.29Å; I189-L192 PolarHBondContact O-N 3.01Å; L192-S194 PolarHBondContact O-N 2.63Å; L192-A195 WeakPolarHBondContact O-CB 3.44Å; L192-A195 PolarHBondContact O-N 3.5Å; L192-F196 HydrophobicContact CD2-CE2 4.43Å; L192-F196 WeakPolarHBondContact O-CD2 3.36Å; L192-F196 PolarHBondContact O-N 3.2Å; L192-F196 VanDerWaalsContact O-N 3.17Å
193M98.4Very high97.4Very high64 Ų6439.8 Ų39.832%0.31523%0.227SC..Hα-helixtrans-58.8-46.4175.2-71.81746600111.6I189 M190 Y191 F196 G197 L201 W202 L213I189-M193 HydrophobicContact CG2-CG 4.35Å; I189-M193 HydrophobicContact CG2-SD 4.04Å; I189-M193 VanDerWaalsContact O-CG 3.3Å; I189-M193 WeakPolarHBondContact O-CG 3.46Å; I189-M193 PolarHBondContact O-N 2.67Å; M190-M193 PolarHBondContact O-N 3.23Å; Y191-M193 VanDerWaalsContact C-N 3.34Å; Y191-M193 PolarHBondContact O-N 2.86Å; M193-F196 PolarHBondContact O-N 3.08Å; M193-G197 PolarHBondContact O-N 3.39Å; M193-L201 HydrophobicContact CB-CD2 3.93Å; M193-L201 HydrophobicContact CE-CD2 4.18Å; M193-L201 WeakPolarHBondContact O-CD2 3.5Å; M193-W202 HydrophobicContact CB-CH2 4.4Å; M193-W202 HydrophobicContact CB-CZ2 3.99Å; M193-W202 HydrophobicContact CE-CH2 3.71Å; M193-W202 HydrophobicContact CE-CZ2 4.28Å; M193-W202 HydrophobicContact CE-CZ3 4.02Å; M193-W202 HydrophobicContact SD-CH2 3.9Å; M193-W202 HydrophobicContact SD-CZ2 4.42Å; M193-L213 HydrophobicContact CE-CD2 3.7Å; M193-L213 HydrophobicContact CE-CG 4.48Å
194S98.3Very high97.4Very high0 Ų040.7 Ų40.70%023%0.23CC..Hα-helixtrans-66.4-34.9176-55.10000112.6S139 M190 Y191 L192 F196 G198 W202S139-S194 PolarHBondContact O-OG 2.87Å; S139-S194 WeakPolarHBondContact OG-CB 3.25Å; S139-S194 PolarHBondContact OG-OG 3.25Å; M190-S194 PolarHBondContact O-N 3.28Å; M190-S194 PolarHBondContact O-OG 2.79Å; M190-S194 VanDerWaalsContact O-OG 3.08Å; Y191-S194 PolarHBondContact O-N 3.38Å; L192-S194 PolarHBondContact O-N 2.63Å; S194-F196 VanDerWaalsContact C-N 3.34Å; S194-F196 PolarHBondContact O-N 2.81Å; S194-G198 WeakPolarHBondContact O-CA 3.3Å; S194-G198 PolarHBondContact O-N 2.95Å; S194-W202 PolarHBondContact OG-NE1 3.39Å
195A98.4Very high97.3Very high2 Ų244.2 Ų44.22%0.01725%0.252CS..Hα-helixtrans-61.4-4217700000112.6S83 F86 L87 Y191 L192S83-A195 WeakPolarHBondContact CB-O 3.45Å; S83-A195 PolarHBondContact OG-O 3.5Å; F86-A195 HydrophobicContact CB-CB 3.73Å; L87-A195 HydrophobicContact CD2-CB 3.64Å; L87-A195 HydrophobicContact CG-CB 3.77Å; Y191-A195 WeakPolarHBondContact O-CB 3.47Å; Y191-A195 PolarHBondContact O-N 2.83Å; L192-A195 WeakPolarHBondContact O-CB 3.44Å; L192-A195 PolarHBondContact O-N 3.5Å
196F98.1Very high97.1Very high169 Ų16945 Ų4574%0.74126%0.256SS*.Hα-helixtrans-93.8-30.4-175.6-64.1-65.8000114L87 L192 M193 S194L87-F196 HydrophobicContact CD2-CE2 4.35Å; L87-F196 HydrophobicContact CD2-CZ 4.19Å; L192-F196 HydrophobicContact CD2-CE2 4.43Å; L192-F196 WeakPolarHBondContact O-CD2 3.36Å; L192-F196 PolarHBondContact O-N 3.2Å; L192-F196 VanDerWaalsContact O-N 3.17Å; M193-F196 PolarHBondContact O-N 3.08Å; S194-F196 VanDerWaalsContact C-N 3.34Å; S194-F196 PolarHBondContact O-N 2.81Å
197G96.8Very high96.7Very high37 Ų3749 Ų4938%0.38128%0.279SS..Hα-helixtrans-104.9-8-178.800000115.1M193 L201M193-G197 PolarHBondContact O-N 3.39Å; G197-L201 PolarHBondContact O-N 3.29Å
198G96.5Very high96.4Very high11 Ų1155.3 Ų55.311%0.11332%0.317CS..THydrogen-bonded Turntrans68.6174.8-169.900000112.9E80 S194 A200 L201E80-G198 WeakPolarHBondContact OE1-CA 3.23Å; S194-G198 WeakPolarHBondContact O-CA 3.3Å; S194-G198 PolarHBondContact O-N 2.95Å; G198-A200 PolarHBondContact O-N 3.42Å; G198-L201 VanDerWaalsContact O-CB 3.23Å; G198-L201 WeakPolarHBondContact O-CB 3.32Å; G198-L201 PolarHBondContact O-N 3.48Å
199V95.3Very high96.1Very high0 Ų057.8 Ų57.80%033%0.333CS..G310 helixtrans-64.2-29.3174-179.80000111E80 F86 L201 W202E80-V199 VanDerWaalsContact CD-N 3.28Å; E80-V199 PolarHBondContact OE1-N 3.48Å; E80-V199 WeakPolarHBondContact OE2-CA 3.37Å; E80-V199 WeakPolarHBondContact OE2-CB 3.31Å; E80-V199 PolarHBondContact OE2-N 3.04Å; F86-V199 HydrophobicContact CE2-CG2 4.27Å; F86-V199 HydrophobicContact CZ-CG2 3.69Å; V199-L201 PolarHBondContact O-N 3.25Å; V199-W202 WeakPolarHBondContact O-CB 3.45Å; V199-W202 PolarHBondContact O-N 2.96Å; V199-W202 VanDerWaalsContact O-N 3.16Å
200A94.6Very high95.9Very high59 Ų5956 Ų5649%0.48834%0.337SS..G310 helixtrans-58.8-29175.200000113.5G198 W202 Q203G198-A200 PolarHBondContact O-N 3.42Å; A200-W202 PolarHBondContact O-N 2.83Å; A200-Q203 PolarHBondContact O-N 3.47Å
201L96.4Very high95.8Very high45 Ų4558.3 Ų58.324%0.23635%0.349CS..G310 helixtrans-51.6-40.6175.117765.8000111.9M193 G197 G198 V199 Q203 N204 L213M193-L201 HydrophobicContact CB-CD2 3.93Å; M193-L201 HydrophobicContact CE-CD2 4.18Å; M193-L201 WeakPolarHBondContact O-CD2 3.5Å; G197-L201 PolarHBondContact O-N 3.29Å; G198-L201 VanDerWaalsContact O-CB 3.23Å; G198-L201 WeakPolarHBondContact O-CB 3.32Å; G198-L201 PolarHBondContact O-N 3.48Å; V199-L201 PolarHBondContact O-N 3.25Å; L201-Q203 PolarHBondContact O-N 3.21Å; L201-N204 WeakPolarHBondContact O-CB 3.46Å; L201-N204 PolarHBondContact O-N 2.96Å; L201-N204 VanDerWaalsContact O-N 3.13Å; L201-L213 HydrophobicContact CD1-CD2 4.29Å; L201-L213 HydrophobicContact CD2-CD2 4.31Å; L201-L213 HydrophobicContact CG-CD2 3.86Å
202W96.2Very high95.6Very high4 Ų459.9 Ų59.92%0.01536%0.359CS..G310 helixtrans-67.7-20.6-176.8-63.5105.5000113.5S139 C140 M190 M193 S194 V199 A200 L213 Y214 P217S139-W202 PolarHBondContact O-NE1 2.84Å; C140-W202 HydrophobicContact CB-CD2 4.37Å; C140-W202 HydrophobicContact CB-CG 4.39Å; M190-W202 HydrophobicContact CB-CH2 4.08Å; M190-W202 HydrophobicContact CB-CZ2 3.98Å; M190-W202 HydrophobicContact CG-CH2 3.84Å; M190-W202 HydrophobicContact CG-CZ2 4.27Å; M193-W202 HydrophobicContact CB-CH2 4.4Å; M193-W202 HydrophobicContact CB-CZ2 3.99Å; M193-W202 HydrophobicContact CE-CH2 3.71Å; M193-W202 HydrophobicContact CE-CZ2 4.28Å; M193-W202 HydrophobicContact CE-CZ3 4.02Å; M193-W202 HydrophobicContact SD-CH2 3.9Å; M193-W202 HydrophobicContact SD-CZ2 4.42Å; S194-W202 PolarHBondContact OG-NE1 3.39Å; V199-W202 WeakPolarHBondContact O-CB 3.45Å; V199-W202 PolarHBondContact O-N 2.96Å; V199-W202 VanDerWaalsContact O-N 3.16Å; A200-W202 PolarHBondContact O-N 2.83Å; W202-L213 HydrophobicContact CE3-CB 4.44Å; W202-L213 HydrophobicContact CE3-CD2 4.03Å; W202-L213 HydrophobicContact CE3-CG 3.82Å; W202-L213 HydrophobicContact CZ3-CD2 4.24Å; W202-L213 HydrophobicContact CZ3-CG 4.02Å; W202-L213 PolarHBondContact O-N 3.43Å; W202-Y214 WeakPolarHBondContact O-CD1 3.37Å; W202-Y214 PolarHBondContact O-N 3.05Å; W202-P217 HydrophobicContact CE3-CG 4.2Å; W202-P217 HydrophobicContact CH2-CG 4.12Å; W202-P217 HydrophobicContact CZ3-CG 3.48Å; W202-P217 VanDerWaalsContact CZ3-CG 3.48Å
203Q94.1Very high95.4Very high54 Ų5457.8 Ų57.825%0.25235%0.348SS..G310 helixtrans-87.9-10.5177.6-58.2-57.4-42.300112.8Y145 A200 L201 V205Y145-Q203 PolarHBondContact OH-OE1 2.8Å; A200-Q203 PolarHBondContact O-N 3.47Å; L201-Q203 PolarHBondContact O-N 3.21Å; Q203-V205 PolarHBondContact O-N 3.34Å
204N95.7Very high95.2Very high92 Ų9256.2 Ų56.249%0.49234%0.339SS..PPolyproline II helixtrans-66129.5178.7-69.5-23000110.8L201 P212 L213L201-N204 WeakPolarHBondContact O-CB 3.46Å; L201-N204 PolarHBondContact O-N 2.96Å; L201-N204 VanDerWaalsContact O-N 3.13Å; N204-P212 WeakPolarHBondContact O-CA 3.25Å; N204-L213 PolarHBondContact O-N 2.86Å
205V96.4Very high95.1Very high88 Ų8857.7 Ų57.753%0.53335%0.348SS..BIsolated β-bridgetrans-79122.6175.3-179.90000109Q203 P207 P212Q203-V205 PolarHBondContact O-N 3.34Å; V205-P207 WeakPolarHBondContact O-CD 3.43Å; V205-P212 HydrophobicContact CG2-CG 4.48Å
206L92.9Very high94.9Very high58 Ų5861 Ų6130%0.30436%0.362SS..PPolyproline II helixtrans-71.1124.4178.3-65.7-175000110.5V208 V209 G210 M211 L213 F216L206-V208 VanDerWaalsContact C-N 3.26Å; L206-V208 PolarHBondContact O-N 2.85Å; L206-V208 VanDerWaalsContact O-N 3.12Å; L206-V209 HydrophobicContact CB-CB 4.49Å; L206-V209 PolarHBondContact O-N 3.31Å; L206-G210 PolarHBondContact O-N 3.06Å; L206-M211 PolarHBondContact N-O 3.35Å; L206-L213 HydrophobicContact CD1-CD1 4.1Å; L206-L213 HydrophobicContact CD2-CD1 4.35Å; L206-L213 HydrophobicContact CG-CD1 4.47Å; L206-F216 HydrophobicContact CD1-CD2 4.15Å; L206-F216 HydrophobicContact CD1-CE2 3.39Å; L206-F216 HydrophobicContact CD1-CZ 3.66Å; L206-F216 HydrophobicContact CG-CE2 4.27Å
207P90.3Very high94.8Very high132 Ų13254.1 Ų54.186%0.85733%0.334SS*.THydrogen-bonded Turntrans-57.8-31.8-171.9-2834.3000115.5V205V205-P207 WeakPolarHBondContact O-CD 3.43Å
208V92.3Very high94.8Very high145 Ų14552.8 Ų52.888%0.87932%0.318SS*.THydrogen-bonded Turntrans-84.8-33.4-176.7-179.20000112.2L206L206-V208 VanDerWaalsContact C-N 3.26Å; L206-V208 PolarHBondContact O-N 2.85Å; L206-V208 VanDerWaalsContact O-N 3.12Å
209V92.9Very high94.7Very high73 Ų7356.3 Ų56.344%0.44233%0.333SS..THydrogen-bonded Turntrans-101.1-22.6-172.1-174.10000112.1L206 M211 F216L206-V209 HydrophobicContact CB-CB 4.49Å; L206-V209 PolarHBondContact O-N 3.31Å; V209-M211 HydrophobicContact CG1-CB 4.3Å; V209-M211 HydrophobicContact CG1-CE 3.42Å; V209-M211 VanDerWaalsContact CG1-CE 3.42Å; V209-M211 HydrophobicContact CG1-CG 4.25Å; V209-M211 PolarHBondContact O-N 3.4Å; V209-F216 HydrophobicContact CB-CZ 4.11Å; V209-F216 HydrophobicContact CG1-CZ 3.85Å; V209-F216 HydrophobicContact CG2-CZ 4.1Å
210G94.8Very high94.8Very high54 Ų5458.6 Ų58.656%0.55736%0.356SS*.  trans7113.3-179.100000114.4L206L206-G210 PolarHBondContact O-N 3.06Å
211M94.9Very high94.8Very high68 Ų6858.2 Ų58.234%0.33535%0.345SS..SBendtrans-114.7147.2178.8-67.2-166.2-74.200111.9L206 V209 V215 M219L206-M211 PolarHBondContact N-O 3.35Å; V209-M211 HydrophobicContact CG1-CB 4.3Å; V209-M211 HydrophobicContact CG1-CE 3.42Å; V209-M211 VanDerWaalsContact CG1-CE 3.42Å; V209-M211 HydrophobicContact CG1-CG 4.25Å; V209-M211 PolarHBondContact O-N 3.4Å; M211-V215 HydrophobicContact SD-CG1 4.06Å; M211-M219 HydrophobicContact CE-CE 4.2Å
212P95.3Very high94.8Very high33 Ų3358.8 Ų58.821%0.21435%0.348CS..BIsolated β-bridgetrans-59.4145.8169.6-22.133.1000112.2N204 V205 Y214 V215N204-P212 WeakPolarHBondContact O-CA 3.25Å; V205-P212 HydrophobicContact CG2-CG 4.48Å; P212-Y214 VanDerWaalsContact C-N 3.29Å; P212-Y214 HydrophobicContact CB-CD1 3.5Å; P212-Y214 HydrophobicContact CB-CE1 3.39Å; P212-Y214 HydrophobicContact CG-CD1 4.42Å; P212-Y214 HydrophobicContact CG-CE1 3.81Å; P212-Y214 PolarHBondContact O-N 3.21Å; P212-V215 HydrophobicContact CB-CG2 4.38Å; P212-V215 WeakPolarHBondContact O-CB 3.43Å; P212-V215 WeakPolarHBondContact O-CG2 3.38Å; P212-V215 PolarHBondContact O-N 2.98Å; P212-V215 VanDerWaalsContact O-N 3.16Å
213L95.4Very high94.8Very high26 Ų2660.4 Ų60.414%0.13637%0.367CS..THydrogen-bonded Turntrans-61.4-32.5-176.7-17764.2000113.8M193 L201 W202 N204 L206 V215 F216 P217M193-L213 HydrophobicContact CE-CD2 3.7Å; M193-L213 HydrophobicContact CE-CG 4.48Å; L201-L213 HydrophobicContact CD1-CD2 4.29Å; L201-L213 HydrophobicContact CD2-CD2 4.31Å; L201-L213 HydrophobicContact CG-CD2 3.86Å; W202-L213 HydrophobicContact CE3-CB 4.44Å; W202-L213 HydrophobicContact CE3-CD2 4.03Å; W202-L213 HydrophobicContact CE3-CG 3.82Å; W202-L213 HydrophobicContact CZ3-CD2 4.24Å; W202-L213 HydrophobicContact CZ3-CG 4.02Å; W202-L213 PolarHBondContact O-N 3.43Å; N204-L213 PolarHBondContact O-N 2.86Å; L206-L213 HydrophobicContact CD1-CD1 4.1Å; L206-L213 HydrophobicContact CD2-CD1 4.35Å; L206-L213 HydrophobicContact CG-CD1 4.47Å; L213-V215 PolarHBondContact O-N 3.17Å; L213-V215 VanDerWaalsContact O-N 3.09Å; L213-F216 HydrophobicContact CD1-CD2 4.3Å; L213-F216 PolarHBondContact O-N 2.86Å; L213-F216 VanDerWaalsContact O-N 3.17Å; L213-P217 WeakPolarHBondContact O-CD 3.49Å
214Y93.9Very high94.8Very high30 Ų3059.1 Ų59.112%0.11837%0.367CS..THydrogen-bonded Turntrans-60.3-20.8178.378-99.5000113.7I142 Y145 W202 P212 F216 P217 I218I142-Y214 HydrophobicContact CG2-CD2 4.46Å; Y145-Y214 HydrophobicContact CD2-CE2 4.46Å; Y145-Y214 HydrophobicContact CE2-CE1 4.02Å; Y145-Y214 HydrophobicContact CE2-CE2 4.11Å; Y145-Y214 AromaticContact CE2-CZ 3.8Å; Y145-Y214 AromaticContact CZ-CZ 3.83Å; W202-Y214 WeakPolarHBondContact O-CD1 3.37Å; W202-Y214 PolarHBondContact O-N 3.05Å; P212-Y214 VanDerWaalsContact C-N 3.29Å; P212-Y214 HydrophobicContact CB-CD1 3.5Å; P212-Y214 HydrophobicContact CB-CE1 3.39Å; P212-Y214 HydrophobicContact CG-CD1 4.42Å; P212-Y214 HydrophobicContact CG-CE1 3.81Å; P212-Y214 PolarHBondContact O-N 3.21Å; Y214-F216 VanDerWaalsContact C-N 3.29Å; Y214-F216 PolarHBondContact O-N 3.1Å; Y214-P217 WeakPolarHBondContact O-CD 3.26Å; Y214-I218 HydrophobicContact CD2-CD1 3.76Å; Y214-I218 HydrophobicContact CE2-CD1 4.13Å; Y214-I218 WeakPolarHBondContact O-CG1 3.32Å
215V94.8Very high94.8Very high31 Ų3155.2 Ų55.219%0.18835%0.348CS..Hα-helixtrans-67.1-32.2179.6179.70000111.2M211 P212 L213 I218 M219M211-V215 HydrophobicContact SD-CG1 4.06Å; P212-V215 HydrophobicContact CB-CG2 4.38Å; P212-V215 WeakPolarHBondContact O-CB 3.43Å; P212-V215 WeakPolarHBondContact O-CG2 3.38Å; P212-V215 PolarHBondContact O-N 2.98Å; P212-V215 VanDerWaalsContact O-N 3.16Å; L213-V215 PolarHBondContact O-N 3.17Å; L213-V215 VanDerWaalsContact O-N 3.09Å; V215-I218 PolarHBondContact O-N 2.91Å; V215-M219 HydrophobicContact CG1-CE 4.1Å; V215-M219 HydrophobicContact CG1-CG 4.11Å; V215-M219 HydrophobicContact CG1-SD 4.18Å; V215-M219 WeakPolarHBondContact O-CG 3.37Å; V215-M219 PolarHBondContact O-N 2.73Å
216F95.3Very high94.7Very high71 Ų7156.8 Ų56.831%0.31135%0.353SS..Hα-helixtrans-68.5-48.3-176.1-66.2-95.6000113.3L206 V209 L213 Y214 I218 M219 G220L206-F216 HydrophobicContact CD1-CD2 4.15Å; L206-F216 HydrophobicContact CD1-CE2 3.39Å; L206-F216 HydrophobicContact CD1-CZ 3.66Å; L206-F216 HydrophobicContact CG-CE2 4.27Å; V209-F216 HydrophobicContact CB-CZ 4.11Å; V209-F216 HydrophobicContact CG1-CZ 3.85Å; V209-F216 HydrophobicContact CG2-CZ 4.1Å; L213-F216 HydrophobicContact CD1-CD2 4.3Å; L213-F216 PolarHBondContact O-N 2.86Å; L213-F216 VanDerWaalsContact O-N 3.17Å; Y214-F216 VanDerWaalsContact C-N 3.29Å; Y214-F216 PolarHBondContact O-N 3.1Å; F216-I218 VanDerWaalsContact C-N 3.28Å; F216-I218 PolarHBondContact O-N 2.83Å; F216-M219 HydrophobicContact CB-CE 4.43Å; F216-M219 HydrophobicContact CD1-CE 3.64Å; F216-M219 HydrophobicContact CE1-CE 4.01Å; F216-M219 HydrophobicContact CG-CE 4Å; F216-M219 PolarHBondContact O-N 3.43Å; F216-G220 PolarHBondContact O-N 3.34Å
217P95.6Very high94.8Very high26 Ų2658.8 Ų58.817%0.16936%0.357CS..Hα-helixtrans-55-42.5169.9-26.633.1000112.8M190 W202 L213 Y214 G220 I221M190-P217 HydrophobicContact CE-CB 3.8Å; M190-P217 HydrophobicContact CE-CG 4.08Å; M190-P217 HydrophobicContact SD-CB 4.37Å; W202-P217 HydrophobicContact CE3-CG 4.2Å; W202-P217 HydrophobicContact CH2-CG 4.12Å; W202-P217 HydrophobicContact CZ3-CG 3.48Å; W202-P217 VanDerWaalsContact CZ3-CG 3.48Å; L213-P217 WeakPolarHBondContact O-CD 3.49Å; Y214-P217 WeakPolarHBondContact O-CD 3.26Å; P217-G220 PolarHBondContact O-N 3.5Å; P217-I221 VanDerWaalsContact O-CG1 3.27Å; P217-I221 WeakPolarHBondContact O-CG1 3.1Å; P217-I221 PolarHBondContact O-N 2.88Å
218I96.1Very high95Very high9 Ų953.3 Ų53.35%0.04632%0.322CS..Hα-helixtrans-63.3-45.1178.7-65.6177.9000111.1W148 Y214 V215 F216 G220 I221 I222W148-I218 HydrophobicContact CB-CD1 4.2Å; W148-I218 HydrophobicContact CD2-CD1 3.99Å; W148-I218 HydrophobicContact CD2-CG2 4.28Å; W148-I218 HydrophobicContact CE3-CD1 4.27Å; W148-I218 HydrophobicContact CE3-CG2 3.7Å; W148-I218 HydrophobicContact CG-CD1 3.96Å; W148-I218 HydrophobicContact CH2-CG2 3.94Å; W148-I218 HydrophobicContact CZ2-CG2 4.47Å; W148-I218 HydrophobicContact CZ3-CG2 3.52Å; Y214-I218 HydrophobicContact CD2-CD1 3.76Å; Y214-I218 HydrophobicContact CE2-CD1 4.13Å; Y214-I218 WeakPolarHBondContact O-CG1 3.32Å; V215-I218 PolarHBondContact O-N 2.91Å; F216-I218 VanDerWaalsContact C-N 3.28Å; F216-I218 PolarHBondContact O-N 2.83Å; I218-G220 VanDerWaalsContact C-N 3.3Å; I218-G220 PolarHBondContact O-N 2.67Å; I218-I221 PolarHBondContact O-N 3.26Å; I218-I222 HydrophobicContact CG2-CD1 3.86Å; I218-I222 HydrophobicContact CG2-CG1 4.43Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.13Å; I218-I222 PolarHBondContact O-N 3.08Å
219M96.1Very high95.1Very high85 Ų8547.8 Ų47.842%0.41929%0.29SS..Hα-helixtrans-60.7-40.8174.7-72.7-171.3-60.600111.7M211 V215 F216 I222 G223M211-M219 HydrophobicContact CE-CE 4.2Å; V215-M219 HydrophobicContact CG1-CE 4.1Å; V215-M219 HydrophobicContact CG1-CG 4.11Å; V215-M219 HydrophobicContact CG1-SD 4.18Å; V215-M219 WeakPolarHBondContact O-CG 3.37Å; V215-M219 PolarHBondContact O-N 2.73Å; F216-M219 HydrophobicContact CB-CE 4.43Å; F216-M219 HydrophobicContact CD1-CE 3.64Å; F216-M219 HydrophobicContact CE1-CE 4.01Å; F216-M219 HydrophobicContact CG-CE 4Å; F216-M219 PolarHBondContact O-N 3.43Å; M219-I222 PolarHBondContact O-N 2.94Å; M219-G223 PolarHBondContact O-N 3.37Å
220G95.7Very high95.2Very high48 Ų4852 Ų5250%0.49530%0.298SS..Hα-helixtrans-60.9-45.9174.200000112.4F216 P217 I218 G223 G224F216-G220 PolarHBondContact O-N 3.34Å; P217-G220 PolarHBondContact O-N 3.5Å; I218-G220 VanDerWaalsContact C-N 3.3Å; I218-G220 PolarHBondContact O-N 2.67Å; G220-G223 PolarHBondContact O-N 2.93Å; G220-G224 PolarHBondContact O-N 3.45Å
221I95.6Very high95.2Very high50 Ų5051.9 Ų51.926%0.25629%0.285SS..Hα-helixtrans-60.6-46.7175.7-70.3165.8000110.6F151 C152 I155 P217 I218 A225F151-I221 HydrophobicContact CE1-CG2 3.9Å; C152-I221 HydrophobicContact CB-CD1 4.46Å; I155-I221 HydrophobicContact CG2-CG2 3.53Å; P217-I221 VanDerWaalsContact O-CG1 3.27Å; P217-I221 WeakPolarHBondContact O-CG1 3.1Å; P217-I221 PolarHBondContact O-N 2.88Å; I218-I221 PolarHBondContact O-N 3.26Å; I221-A225 WeakPolarHBondContact O-CB 3.22Å; I221-A225 PolarHBondContact O-N 3.48Å
222I96.6Very high95.3Very high57 Ų5749.7 Ų49.729%0.29227%0.273SS..Hα-helixtrans-62.5-50.1178.4-68.2167.1000110.6W148 F151 I218 M219 G224 A225 L226W148-I222 HydrophobicContact CH2-CD1 4.12Å; W148-I222 HydrophobicContact CZ3-CD1 4.02Å; F151-I222 HydrophobicContact CE1-CG1 3.7Å; F151-I222 HydrophobicContact CZ-CG1 3.95Å; I218-I222 HydrophobicContact CG2-CD1 3.86Å; I218-I222 HydrophobicContact CG2-CG1 4.43Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.13Å; I218-I222 PolarHBondContact O-N 3.08Å; M219-I222 PolarHBondContact O-N 2.94Å; I222-G224 PolarHBondContact O-N 3.43Å; I222-A225 PolarHBondContact O-N 3.04Å; I222-L226 HydrophobicContact CG2-CD1 3.89Å; I222-L226 HydrophobicContact CG2-CG 4.35Å; I222-L226 WeakPolarHBondContact O-CB 3.3Å; I222-L226 VanDerWaalsContact O-CG 3.28Å; I222-L226 WeakPolarHBondContact O-CG 3.41Å; I222-L226 PolarHBondContact O-N 2.82Å
223G95.9Very high95.3Very high39 Ų3951.3 Ų51.340%0.40228%0.277SS..Hα-helixtrans-61.1-46.2-179.900000112.2M219 G220 L226 Y227M219-G223 PolarHBondContact O-N 3.37Å; G220-G223 PolarHBondContact O-N 2.93Å; G223-L226 PolarHBondContact O-N 2.93Å; G223-Y227 WeakPolarHBondContact O-CB 3.49Å; G223-Y227 PolarHBondContact O-N 3.23Å
224G94.5Very high95.4Very high26 Ų2656.8 Ų56.827%0.26830%0.297SS..Hα-helixtrans-62.8-42.6176.200000112.6G220 I222 Y227 S228G220-G224 PolarHBondContact O-N 3.45Å; I222-G224 PolarHBondContact O-N 3.43Å; G224-Y227 PolarHBondContact O-N 3.24Å; G224-S228 VanDerWaalsContact O-CB 3.25Å; G224-S228 WeakPolarHBondContact O-CB 3.49Å; G224-S228 PolarHBondContact O-N 3.28Å; G224-S228 PolarHBondContact O-OG 3.36Å
225A94.6Very high95.6Very high11 Ų1156 Ų569%0.09130%0.295CS..Hα-helixtrans-65.1-43.8176.200000112I155 M159 I221 I222 S228 C229I155-A225 HydrophobicContact CD1-CB 3.91Å; I155-A225 HydrophobicContact CG1-CB 3.74Å; M159-A225 HydrophobicContact SD-CB 4.44Å; I221-A225 WeakPolarHBondContact O-CB 3.22Å; I221-A225 PolarHBondContact O-N 3.48Å; I222-A225 PolarHBondContact O-N 3.04Å; A225-S228 PolarHBondContact O-N 3.29Å; A225-C229 WeakPolarHBondContact O-CB 3.32Å; A225-C229 PolarHBondContact O-N 3.17Å; A225-C229 PolarHBondContact O-SG 3.2Å
226L95.7Very high95.7Very high121 Ų12154.5 Ų54.563%0.63429%0.286SS*.Hα-helixtrans-62-45.8176.6-72.9173.3000111.5I222 G223 Y230I222-L226 HydrophobicContact CG2-CD1 3.89Å; I222-L226 HydrophobicContact CG2-CG 4.35Å; I222-L226 WeakPolarHBondContact O-CB 3.3Å; I222-L226 VanDerWaalsContact O-CG 3.28Å; I222-L226 WeakPolarHBondContact O-CG 3.41Å; I222-L226 PolarHBondContact O-N 2.82Å; G223-L226 PolarHBondContact O-N 2.93Å; L226-Y230 WeakPolarHBondContact O-CB 3.46Å; L226-Y230 PolarHBondContact O-N 3.2Å
227Y94.4Very high95.8Very high99 Ų9956 Ų5639%0.38830%0.297SS..Hα-helixtrans-62-48.2176.8177.1-102.7000111.8G223 G224 Y230 N231G223-Y227 WeakPolarHBondContact O-CB 3.49Å; G223-Y227 PolarHBondContact O-N 3.23Å; G224-Y227 PolarHBondContact O-N 3.24Å; Y227-Y230 PolarHBondContact O-N 3.02Å; Y227-N231 VanDerWaalsContact CE1-ND2 3.3Å; Y227-N231 WeakPolarHBondContact CE1-ND2 3.42Å; Y227-N231 VanDerWaalsContact CZ-ND2 3.26Å; Y227-N231 PolarHBondContact O-N 2.85Å; Y227-N231 PolarHBondContact O-ND2 3.19Å
228S94.3Very high95.9Very high17 Ų1760.2 Ų60.212%0.11932%0.318CS..Hα-helixtrans-66.3-45.6-179.2-55.70000111.5G224 A225 Y230 N231 Y232G224-S228 VanDerWaalsContact O-CB 3.25Å; G224-S228 WeakPolarHBondContact O-CB 3.49Å; G224-S228 PolarHBondContact O-N 3.28Å; G224-S228 PolarHBondContact O-OG 3.36Å; A225-S228 PolarHBondContact O-N 3.29Å; S228-Y230 VanDerWaalsContact C-N 3.34Å; S228-Y230 PolarHBondContact O-N 2.99Å; S228-N231 PolarHBondContact O-N 3.44Å; S228-Y232 WeakPolarHBondContact O-CB 3.39Å; S228-Y232 VanDerWaalsContact O-CD2 3.31Å; S228-Y232 WeakPolarHBondContact O-CD2 3.29Å; S228-Y232 PolarHBondContact O-N 3Å
229C94.4Very high95.9Very high30 Ų3060.9 Ų60.920%0.20333%0.327CS..Hα-helixtrans-54.6-48.6172.9-82.50000111.7M159 A225 N231 Y232 F233M159-C229 WeakPolarHBondContact CE-SG 3.44Å; A225-C229 WeakPolarHBondContact O-CB 3.32Å; A225-C229 PolarHBondContact O-N 3.17Å; A225-C229 PolarHBondContact O-SG 3.2Å; C229-N231 VanDerWaalsContact C-N 3.3Å; C229-N231 PolarHBondContact O-N 2.82Å; C229-Y232 PolarHBondContact O-N 2.95Å; C229-F233 HydrophobicContact CB-CD2 4.38Å; C229-F233 WeakPolarHBondContact O-CB 3.46Å; C229-F233 WeakPolarHBondContact O-CD2 3.46Å; C229-F233 PolarHBondContact O-N 3Å
230Y95.3Very high95.9Very high160 Ų16057.9 Ų57.963%0.62732%0.318SS*.Hα-helixtrans-55.4-48.8179.1174.7-95.9000111.1L226 Y227 S228 Y234L226-Y230 WeakPolarHBondContact O-CB 3.46Å; L226-Y230 PolarHBondContact O-N 3.2Å; Y227-Y230 PolarHBondContact O-N 3.02Å; S228-Y230 VanDerWaalsContact C-N 3.34Å; S228-Y230 PolarHBondContact O-N 2.99Å; Y230-Y234 WeakPolarHBondContact O-CB 3.45Å; Y230-Y234 PolarHBondContact O-N 2.9Å
231N94.8Very high95.9Very high53 Ų5359.9 Ų59.928%0.28332%0.321SS..Hα-helixtrans-65.4-46179.3-68.1-45.4000112.5Y227 S228 C229 Y234 V235Y227-N231 VanDerWaalsContact CE1-ND2 3.3Å; Y227-N231 WeakPolarHBondContact CE1-ND2 3.42Å; Y227-N231 VanDerWaalsContact CZ-ND2 3.26Å; Y227-N231 PolarHBondContact O-N 2.85Å; Y227-N231 PolarHBondContact O-ND2 3.19Å; S228-N231 PolarHBondContact O-N 3.44Å; C229-N231 VanDerWaalsContact C-N 3.3Å; C229-N231 PolarHBondContact O-N 2.82Å; N231-Y234 PolarHBondContact O-N 3.17Å; N231-V235 WeakPolarHBondContact O-CG2 3.43Å; N231-V235 PolarHBondContact O-N 2.86Å
232Y96.4Very high95.9Very high21 Ų2158.3 Ų58.38%0.08232%0.317CS..Hα-helixtrans-63.5-48.1179.9-62.6-23.6000111.7M159 C162 A163 Q166 S228 C229 Y234 V235 I236M159-Y232 HydrophobicContact SD-CD2 4.41Å; M159-Y232 HydrophobicContact SD-CE2 4.14Å; C162-Y232 HydrophobicContact CB-CD2 3.48Å; C162-Y232 VanDerWaalsContact CB-CD2 3.48Å; C162-Y232 HydrophobicContact CB-CE2 4.13Å; C162-Y232 HydrophobicContact CB-CG 4.18Å; A163-Y232 HydrophobicContact CB-CE1 4.43Å; A163-Y232 HydrophobicContact CB-CE2 4.45Å; Q166-Y232 HydrophobicContact CG-CD1 4.23Å; S228-Y232 WeakPolarHBondContact O-CB 3.39Å; S228-Y232 VanDerWaalsContact O-CD2 3.31Å; S228-Y232 WeakPolarHBondContact O-CD2 3.29Å; S228-Y232 PolarHBondContact O-N 3Å; C229-Y232 PolarHBondContact O-N 2.95Å; Y232-Y234 VanDerWaalsContact C-N 3.34Å; Y232-Y234 PolarHBondContact O-N 2.75Å; Y232-V235 PolarHBondContact O-N 3.5Å; Y232-I236 WeakPolarHBondContact O-CD1 3.01Å; Y232-I236 VanDerWaalsContact O-CG1 3.26Å; Y232-I236 WeakPolarHBondContact O-CG1 3.39Å; Y232-I236 PolarHBondContact O-N 2.84Å
233F96.9Very high95.8Very high67 Ų6762.4 Ų62.429%0.29433%0.332SS..Hα-helixtrans-70.1-30.9-180-82.4-86.4000112.6F158 W165 C229 V235 I236 L237F158-F233 HydrophobicContact CZ-CE2 4.28Å; F158-F233 HydrophobicContact CZ-CZ 4.45Å; W165-F233 HydrophobicContact CH2-CE1 4.05Å; W165-F233 HydrophobicContact CH2-CZ 4.32Å; W165-F233 HydrophobicContact CZ3-CE1 4.22Å; W165-F233 HydrophobicContact CZ3-CZ 4.05Å; C229-F233 HydrophobicContact CB-CD2 4.38Å; C229-F233 WeakPolarHBondContact O-CB 3.46Å; C229-F233 WeakPolarHBondContact O-CD2 3.46Å; C229-F233 PolarHBondContact O-N 3Å; F233-V235 VanDerWaalsContact C-N 3.31Å; F233-V235 PolarHBondContact O-N 3.32Å; F233-I236 HydrophobicContact CD1-CD1 4.47Å; F233-I236 PolarHBondContact O-N 3.17Å; F233-L237 WeakPolarHBondContact O-CB 3.37Å; F233-L237 VanDerWaalsContact O-CG 3.25Å; F233-L237 WeakPolarHBondContact O-CG 3.34Å; F233-L237 PolarHBondContact O-N 3.48Å
234Y97Very high95.7Very high141 Ų14169 Ų6955%0.55336%0.359SS*.Hα-helixtrans-58-45.4169.8-179.7-94.9000111.3Y230 N231 Y232 N238Y230-Y234 WeakPolarHBondContact O-CB 3.45Å; Y230-Y234 PolarHBondContact O-N 2.9Å; N231-Y234 PolarHBondContact O-N 3.17Å; Y232-Y234 VanDerWaalsContact C-N 3.34Å; Y232-Y234 PolarHBondContact O-N 2.75Å; Y234-N238 WeakPolarHBondContact O-CB 3.24Å; Y234-N238 PolarHBondContact O-N 2.9Å; Y234-N238 VanDerWaalsContact O-N 3.16Å; Y234-N238 PolarHBondContact O-ND2 2.86Å
235V96.8Very high95.7Very high13 Ų1369.8 Ų69.88%0.07937%0.366CS..Hα-helixtrans-70.6-42.1176.8178.10000111.9Q166 N231 Y232 F233 L237 N238 G239Q166-V235 HydrophobicContact CB-CB 4.19Å; Q166-V235 HydrophobicContact CB-CG1 3.98Å; N231-V235 WeakPolarHBondContact O-CG2 3.43Å; N231-V235 PolarHBondContact O-N 2.86Å; Y232-V235 PolarHBondContact O-N 3.5Å; F233-V235 VanDerWaalsContact C-N 3.31Å; F233-V235 PolarHBondContact O-N 3.32Å; V235-L237 VanDerWaalsContact C-N 3.28Å; V235-L237 PolarHBondContact O-N 3.22Å; V235-N238 PolarHBondContact O-N 2.76Å; V235-G239 WeakPolarHBondContact O-CA 3.41Å; V235-G239 PolarHBondContact O-N 2.84Å
236I97.7Very high95.8Very high0 Ų070.1 Ų70.10%037%0.368CS..Hα-helixtrans-59.9-39.6179-71.7161.2000111.3W165 Q166 V169 Y232 F233 V253W165-I236 HydrophobicContact CB-CD1 4.16Å; W165-I236 HydrophobicContact CD2-CD1 3.64Å; W165-I236 HydrophobicContact CD2-CG1 4.36Å; W165-I236 HydrophobicContact CE3-CD1 4.06Å; W165-I236 HydrophobicContact CG-CD1 3.71Å; W165-I236 HydrophobicContact CG-CG1 4.12Å; W165-I236 HydrophobicContact CZ2-CG2 3.91Å; Q166-I236 HydrophobicContact CB-CG1 4.06Å; V169-I236 HydrophobicContact CG2-CG1 4.39Å; V169-I236 HydrophobicContact CG2-CG2 4.34Å; Y232-I236 WeakPolarHBondContact O-CD1 3.01Å; Y232-I236 VanDerWaalsContact O-CG1 3.26Å; Y232-I236 WeakPolarHBondContact O-CG1 3.39Å; Y232-I236 PolarHBondContact O-N 2.84Å; F233-I236 HydrophobicContact CD1-CD1 4.47Å; F233-I236 PolarHBondContact O-N 3.17Å; I236-V253 HydrophobicContact CG2-CB 4.43Å; I236-V253 WeakPolarHBondContact O-CB 3.43Å
237L97.4Very high95.8Very high104 Ų10464.3 Ų64.355%0.54534%0.337SS..Hα-helixtrans-85.9-23.8-175.4-64.5174.2000113.7F233 V235 L254F233-L237 WeakPolarHBondContact O-CB 3.37Å; F233-L237 VanDerWaalsContact O-CG 3.25Å; F233-L237 WeakPolarHBondContact O-CG 3.34Å; F233-L237 PolarHBondContact O-N 3.48Å; V235-L237 VanDerWaalsContact C-N 3.28Å; V235-L237 PolarHBondContact O-N 3.22Å; L237-L254 HydrophobicContact CD2-CD2 4.07Å
238N96.9Very high95.9Very high114 Ų11460.7 Ų60.761%0.6133%0.325SS*.Hα-helixtrans-123.7-8.5-172.4-56.4-77.6000114.6Y234 V235Y234-N238 WeakPolarHBondContact O-CB 3.24Å; Y234-N238 PolarHBondContact O-N 2.9Å; Y234-N238 VanDerWaalsContact O-N 3.16Å; Y234-N238 PolarHBondContact O-ND2 2.86Å; V235-N238 PolarHBondContact O-N 2.76Å
239G95.9Very high96Very high23 Ų2360.6 Ų60.624%0.23733%0.326CS..  trans-109.915-167.600000115.7S170 V235 V241S170-G239 VanDerWaalsContact CA-O 3.27Å; S170-G239 WeakPolarHBondContact CA-O 3.35Å; S170-G239 WeakPolarHBondContact CB-O 3.33Å; V235-G239 WeakPolarHBondContact O-CA 3.41Å; V235-G239 PolarHBondContact O-N 2.84Å; G239-V241 PolarHBondContact O-N 3.32Å
240G97Very high96.1Very high21 Ų2162.6 Ų62.622%0.21633%0.334CS..  trans-65.6128.7-177.200000113.6V169 G245 S246V169-G240 WeakPolarHBondContact O-CA 3.46Å; G240-G245 WeakPolarHBondContact CA-O 3.48Å; G240-S246 CarbonylContact C-O 3.5Å; G240-S246 VanDerWaalsContact CA-O 3.28Å; G240-S246 WeakPolarHBondContact CA-O 3.28Å
241V96.7Very high96.1Very high91 Ų9155.9 Ų55.955%0.55231%0.31SS*.  trans-99.4-7.4-178.5-62.30000114.3V169 S170 G239 S246 V248V169-V241 PolarHBondContact O-N 3.09Å; S170-V241 VanDerWaalsContact O-CG1 3.26Å; S170-V241 WeakPolarHBondContact O-CG1 3.27Å; G239-V241 PolarHBondContact O-N 3.32Å; V241-S246 PolarHBondContact N-O 3.02Å; V241-V248 HydrophobicContact CG2-CG1 3.68Å
242G95.1Very high96.2Very high17 Ų1756.6 Ų56.618%0.17532%0.319CS..SBendtrans-77.2-179.2175.200000113N244 G245 S246 T247G242-N244 PolarHBondContact O-N 3.33Å; G242-G245 PolarHBondContact O-N 2.93Å; G242-G245 VanDerWaalsContact O-N 3.09Å; G242-S246 WeakPolarHBondContact CA-O 3.45Å; G242-S246 PolarHBondContact N-O 2.99Å; G242-T247 VanDerWaalsContact CA-O 3.29Å; G242-T247 WeakPolarHBondContact CA-O 3.3Å
243K93.9Very high96.2Very high143 Ų14356.7 Ų56.762%0.62232%0.322SS*.G310 helixtrans-53.9132177.1-70175.6-172.3129.20111G245 S246 D250K243-G245 PolarHBondContact O-N 3.35Å; K243-S246 PolarHBondContact N-OG 2.98Å; K243-S246 WeakPolarHBondContact O-CB 3.44Å; K243-S246 PolarHBondContact O-N 3.47Å; K243-S246 VanDerWaalsContact O-N 3.16Å; K243-S246 PolarHBondContact O-OG 3.48Å; K243-D250 WeakPolarHBondContact CD-OD2 3.39Å; K243-D250 WeakPolarHBondContact CE-OD2 3.34Å; K243-D250 WeakPolarHBondContact CG-OD1 3.35Å; K243-D250 PolarHBondContact N-OD1 3.06Å; K243-D250 IonicContact NZ-OD2 3.83Å; K243-D250 PolarHBondContact NZ-OD2 3.29Å
244N93.4Very high96.2Very high178 Ų17858 Ų5895%0.95233%0.331SS*.G310 helixtrans5730.2-179.6-51-37.5000114.3G242 S246G242-N244 PolarHBondContact O-N 3.33Å; N244-S246 VanDerWaalsContact C-N 3.35Å
245G94.4Very high96Very high41 Ų4153 Ų5342%0.42332%0.316SS..G310 helixtrans7623-179.300000113.8G240 G242 K243 V253G240-G245 WeakPolarHBondContact CA-O 3.48Å; G242-G245 PolarHBondContact O-N 2.93Å; G242-G245 VanDerWaalsContact O-N 3.09Å; K243-G245 PolarHBondContact O-N 3.35Å; G245-V253 WeakPolarHBondContact O-CG1 3.41Å
246S96.6Very high96Very high18 Ų1852.4 Ų52.413%0.12631%0.312CS..  trans-80.9-176.817561.50000112.1G240 V241 G242 K243 N244 D250 T251G240-S246 CarbonylContact C-O 3.5Å; G240-S246 VanDerWaalsContact CA-O 3.28Å; G240-S246 WeakPolarHBondContact CA-O 3.28Å; V241-S246 PolarHBondContact N-O 3.02Å; G242-S246 WeakPolarHBondContact CA-O 3.45Å; G242-S246 PolarHBondContact N-O 2.99Å; K243-S246 PolarHBondContact N-OG 2.98Å; K243-S246 WeakPolarHBondContact O-CB 3.44Å; K243-S246 PolarHBondContact O-N 3.47Å; K243-S246 VanDerWaalsContact O-N 3.16Å; K243-S246 PolarHBondContact O-OG 3.48Å; N244-S246 VanDerWaalsContact C-N 3.35Å; S246-D250 WeakPolarHBondContact OG-CA 3.38Å; S246-T251 WeakPolarHBondContact CB-O 3.38Å
247T97.3Very high96Very high0 Ų053.3 Ų53.30%032%0.321CS..  trans-68.6172.7177.759.20000112.6Y168 V169 G242 A249 D250 T251 V253Y168-T247 HydrophobicContact CD1-CG2 3.56Å; Y168-T247 VanDerWaalsContact CE1-CB 3.47Å; Y168-T247 HydrophobicContact CE1-CG2 3.42Å; Y168-T247 VanDerWaalsContact CE1-CG2 3.42Å; V169-T247 HydrophobicContact CG2-CG2 3.94Å; G242-T247 VanDerWaalsContact CA-O 3.29Å; G242-T247 WeakPolarHBondContact CA-O 3.3Å; T247-A249 PolarHBondContact O-N 3.5Å; T247-D250 PolarHBondContact O-N 3.36Å; T247-T251 WeakPolarHBondContact CB-O 3.21Å; T247-T251 VanDerWaalsContact CG2-O 3.29Å; T247-T251 WeakPolarHBondContact CG2-O 3.5Å; T247-T251 PolarHBondContact N-O 3.07Å; T247-T251 PolarHBondContact OG1-N 2.84Å; T247-T251 VanDerWaalsContact OG1-N 3.08Å; T247-T251 PolarHBondContact OG1-O 3.32Å; T247-T251 PolarHBondContact OG1-OG1 3.16Å; T247-V253 HydrophobicContact CG2-CB 4.46Å; T247-V253 HydrophobicContact CG2-CG1 4.2Å
248V96.3Very high95.9Very high22 Ų2253.7 Ų53.713%0.13332%0.323CS..THydrogen-bonded Turntrans-58.9-17.6175.3-61.40000114.4Y168 V241 R308Y168-V248 HydrophobicContact CD2-CG2 3.81Å; Y168-V248 HydrophobicContact CE2-CG2 3.95Å; Y168-V248 WeakPolarHBondContact O-CG1 3.27Å; Y168-V248 WeakPolarHBondContact O-CG2 3.43Å; Y168-V248 PolarHBondContact O-N 2.84Å; V241-V248 HydrophobicContact CG2-CG1 3.68Å; V248-R308 HydrophobicContact CB-CG 4.37Å; V248-R308 HydrophobicContact CG2-CG 4.42Å
249A95.9Very high95.9Very high15 Ų1548.5 Ų48.512%0.12430%0.295CS..THydrogen-bonded Turntrans-101.915.8176.800000113.3Y168 T247 T251 S309Y168-A249 HydrophobicContact CE2-CB 4.14Å; Y168-A249 WeakPolarHBondContact OH-CB 3.48Å; T247-A249 PolarHBondContact O-N 3.5Å; A249-T251 PolarHBondContact O-N 2.86Å; A249-S309 VanDerWaalsContact CB-C 3.44Å
250D96.4Very high96Very high73 Ų7347.6 Ų47.639%0.3929%0.285SS..SBendtrans59.322.5-176.3-66.7-31.6000114.6K243 S246 T247K243-D250 WeakPolarHBondContact CD-OD2 3.39Å; K243-D250 WeakPolarHBondContact CE-OD2 3.34Å; K243-D250 WeakPolarHBondContact CG-OD1 3.35Å; K243-D250 PolarHBondContact N-OD1 3.06Å; K243-D250 IonicContact NZ-OD2 3.83Å; K243-D250 PolarHBondContact NZ-OD2 3.29Å; S246-D250 WeakPolarHBondContact OG-CA 3.38Å; T247-D250 PolarHBondContact O-N 3.36Å
251T95.8Very high96Very high19 Ų1948 Ų4812%0.11729%0.289CS..SBendtrans-102.5162.3175.960.60000112.2Y168 S246 T247 A249 V253 E310Y168-T251 PolarHBondContact OH-OG1 3.43Å; Y168-T251 VanDerWaalsContact OH-OG1 3.1Å; S246-T251 WeakPolarHBondContact CB-O 3.38Å; T247-T251 WeakPolarHBondContact CB-O 3.21Å; T247-T251 VanDerWaalsContact CG2-O 3.29Å; T247-T251 WeakPolarHBondContact CG2-O 3.5Å; T247-T251 PolarHBondContact N-O 3.07Å; T247-T251 PolarHBondContact OG1-N 2.84Å; T247-T251 VanDerWaalsContact OG1-N 3.08Å; T247-T251 PolarHBondContact OG1-O 3.32Å; T247-T251 PolarHBondContact OG1-OG1 3.16Å; A249-T251 PolarHBondContact O-N 2.86Å; T251-V253 PolarHBondContact O-N 3.29Å; T251-E310 HydrophobicContact CG2-CB 4.02Å; T251-E310 HydrophobicContact CG2-CG 3.52Å
252S96.5Very high96Very high67 Ų6746.9 Ų46.947%0.46928%0.279SS..  trans-51.3135.4177.1175.60000112.3L254 T255S252-L254 PolarHBondContact O-N 3.21Å; S252-L254 VanDerWaalsContact O-N 3.11Å; S252-L254 PolarHBondContact OG-N 2.73Å; S252-T255 WeakPolarHBondContact O-CB 3.25Å; S252-T255 PolarHBondContact O-N 2.9Å; S252-T255 VanDerWaalsContact O-N 3.15Å; S252-T255 PolarHBondContact O-OG1 3.21Å
253V97Very high96.2Very high23 Ų2346 Ų4614%0.13927%0.271CS..THydrogen-bonded Turntrans-62-16.2174.6-57.40000112.7W165 V169 I236 G245 T247 T251W165-V253 VanDerWaalsContact CE2-O 3.3Å; W165-V253 WeakPolarHBondContact CZ2-O 3.4Å; W165-V253 PolarHBondContact NE1-O 3.38Å; V169-V253 HydrophobicContact CG1-CB 4.41Å; V169-V253 HydrophobicContact CG1-CG1 3.84Å; V169-V253 HydrophobicContact CG2-CB 3.97Å; V169-V253 HydrophobicContact CG2-CG1 4.1Å; I236-V253 HydrophobicContact CG2-CB 4.43Å; I236-V253 WeakPolarHBondContact O-CB 3.43Å; G245-V253 WeakPolarHBondContact O-CG1 3.41Å; T247-V253 HydrophobicContact CG2-CB 4.46Å; T247-V253 HydrophobicContact CG2-CG1 4.2Å; T251-V253 PolarHBondContact O-N 3.29Å
254L96.1Very high96.4Very high94 Ų9441.1 Ų41.149%0.49225%0.251SS..THydrogen-bonded Turntrans-91.9-11.4179.1-59.3-177.7000114.3W165 L237 S252 G257W165-L254 HydrophobicContact CZ2-CD2 4.42Å; L237-L254 HydrophobicContact CD2-CD2 4.07Å; S252-L254 PolarHBondContact O-N 3.21Å; S252-L254 VanDerWaalsContact O-N 3.11Å; S252-L254 PolarHBondContact OG-N 2.73Å; L254-G257 WeakPolarHBondContact O-CA 3.38Å; L254-G257 PolarHBondContact O-N 3.39Å
255T93.8Very high96.6Very high38 Ų3836.2 Ų36.223%0.23323%0.228CC..Hα-helixtrans-58.2-43.2-175-60.70000113.9S252 G257 L258 H259S252-T255 WeakPolarHBondContact O-CB 3.25Å; S252-T255 PolarHBondContact O-N 2.9Å; S252-T255 VanDerWaalsContact O-N 3.15Å; S252-T255 PolarHBondContact O-OG1 3.21Å; T255-G257 PolarHBondContact O-N 3.23Å; T255-L258 WeakPolarHBondContact O-CB 3.07Å; T255-L258 PolarHBondContact O-N 3.41Å; T255-L258 VanDerWaalsContact O-N 3.16Å; T255-H259 PolarHBondContact O-ND1 3.49Å; T255-H259 VanDerWaalsContact O-ND1 3.16Å
256P96.6Very high96.8Very high0 Ų035.3 Ų35.30%021%0.213CC..Hα-helixtrans-60.5-31176.2-2536.5000112.9F161 W165 Y168 L258 H259 I260 L301 L311F161-P256 HydrophobicContact CE1-CB 4.06Å; F161-P256 HydrophobicContact CZ-CB 3.92Å; F161-P256 WeakPolarHBondContact CZ-O 3.44Å; W165-P256 HydrophobicContact CD2-CB 3.88Å; W165-P256 HydrophobicContact CG-CB 3.81Å; W165-P256 HydrophobicContact CG-CG 4.18Å; Y168-P256 HydrophobicContact CD1-CG 3.74Å; Y168-P256 HydrophobicContact CE1-CG 4Å; P256-L258 PolarHBondContact O-N 3.31Å; P256-H259 WeakPolarHBondContact O-CB 3.42Å; P256-H259 PolarHBondContact O-N 2.9Å; P256-I260 PolarHBondContact O-N 3.48Å; P256-L301 HydrophobicContact CB-CD1 4.15Å; P256-L301 HydrophobicContact CB-CD2 4.45Å; P256-L301 HydrophobicContact CG-CD1 4.06Å; P256-L311 HydrophobicContact CB-CD2 4.5Å
257G96.8Very high96.9Very high18 Ų1834.5 Ų34.519%0.18621%0.207CC..Hα-helixtrans-58.1-32.6176.300000114W165 L254 T255 H259 G261W165-G257 VanDerWaalsContact CZ3-CA 3.45Å; L254-G257 WeakPolarHBondContact O-CA 3.38Å; L254-G257 PolarHBondContact O-N 3.39Å; T255-G257 PolarHBondContact O-N 3.23Å; G257-H259 VanDerWaalsContact C-N 3.3Å; G257-H259 PolarHBondContact O-N 3.05Å; G257-G261 WeakPolarHBondContact O-CA 3.25Å; G257-G261 PolarHBondContact O-N 3.11Å
258L96.1Very high97Very high112 Ų11239.3 Ų39.359%0.58623%0.228SC*.Hα-helixtrans-64.5-35.6176.4-64.2175.4000112.2T255 P256 L262T255-L258 WeakPolarHBondContact O-CB 3.07Å; T255-L258 PolarHBondContact O-N 3.41Å; T255-L258 VanDerWaalsContact O-N 3.16Å; P256-L258 PolarHBondContact O-N 3.31Å; L258-L262 WeakPolarHBondContact O-CB 3.19Å; L258-L262 PolarHBondContact O-N 3.33Å
259H96.1Very high97Very high5 Ų540.7 Ų40.72%0.02323%0.234CC..Hα-helixtrans-71.9-53.9-176.3-6469.1000110.7T255 P256 G257 G261 L262 V263 I297 L311 H312 L313T255-H259 PolarHBondContact O-ND1 3.49Å; T255-H259 VanDerWaalsContact O-ND1 3.16Å; P256-H259 WeakPolarHBondContact O-CB 3.42Å; P256-H259 PolarHBondContact O-N 2.9Å; G257-H259 VanDerWaalsContact C-N 3.3Å; G257-H259 PolarHBondContact O-N 3.05Å; H259-G261 VanDerWaalsContact C-N 3.34Å; H259-L262 PolarHBondContact O-N 3.04Å; H259-V263 PolarHBondContact O-N 3.37Å; H259-I297 HydrophobicContact CB-CG2 3.77Å; H259-L311 HydrophobicContact CB-CD2 4.47Å; H259-L311 PolarHBondContact CE1-O 3.37Å; H259-L311 WeakPolarHBondContact NE2-CG 3.33Å; H259-L311 PolarHBondContact NE2-O 2.8Å; H259-H312 VanDerWaalsContact NE2-C 3.34Å; H259-H312 PolarHBondContact NE2-O 3.28Å; H259-L313 VanDerWaalsContact NE2-CA 3.25Å; H259-L313 WeakPolarHBondContact NE2-CA 3.43Å; H259-L313 PolarHBondContact NE2-N 2.83Å
260I97.6Very high97.1Very high4 Ų440 Ų402%0.02123%0.229CC..Hα-helixtrans-67.7-37.3178.7-167.557.8000111.4F158 F161 P256 L262 V263 L264 I294F158-I260 HydrophobicContact CD2-CG1 3.78Å; F158-I260 HydrophobicContact CE2-CG1 4.36Å; F158-I260 HydrophobicContact CE2-CG2 4.32Å; F161-I260 HydrophobicContact CB-CD1 4.39Å; F161-I260 HydrophobicContact CB-CG1 4.38Å; F161-I260 HydrophobicContact CD1-CB 3.68Å; F161-I260 HydrophobicContact CD1-CG1 3.95Å; F161-I260 HydrophobicContact CD1-CG2 3.66Å; F161-I260 HydrophobicContact CD2-CB 4.33Å; F161-I260 HydrophobicContact CD2-CD1 4.44Å; F161-I260 HydrophobicContact CE1-CB 3.61Å; F161-I260 HydrophobicContact CE1-CG1 4.4Å; F161-I260 HydrophobicContact CE1-CG2 3.44Å; F161-I260 VanDerWaalsContact CE1-CG2 3.44Å; F161-I260 HydrophobicContact CE2-CB 4.28Å; F161-I260 HydrophobicContact CG-CB 4.05Å; F161-I260 HydrophobicContact CG-CD1 4.23Å; F161-I260 HydrophobicContact CG-CG1 4.02Å; F161-I260 HydrophobicContact CZ-CB 3.92Å; F161-I260 HydrophobicContact CZ-CG2 4.14Å; P256-I260 PolarHBondContact O-N 3.48Å; I260-L262 PolarHBondContact O-N 3.13Å; I260-V263 PolarHBondContact O-N 3.43Å; I260-L264 HydrophobicContact CD1-CD1 4.39Å; I260-L264 HydrophobicContact CD1-CG 4.28Å; I260-L264 HydrophobicContact CG1-CD1 3.98Å; I260-L264 HydrophobicContact CG1-CG 4.31Å; I260-L264 WeakPolarHBondContact O-CB 3.27Å; I260-L264 WeakPolarHBondContact O-CG 3.39Å; I260-L264 PolarHBondContact O-N 3.12Å; I260-I294 HydrophobicContact CD1-CD1 4.25Å; I260-I294 HydrophobicContact CD1-CG1 4.01Å; I260-I294 HydrophobicContact CD1-CG2 3.87Å
261G97.8Very high97.2Very high29 Ų2936.6 Ų36.630%0.29921%0.211SC..Hα-helixtrans-61.4-42.1175.900000112.5G257 H259 T265G257-G261 WeakPolarHBondContact O-CA 3.25Å; G257-G261 PolarHBondContact O-N 3.11Å; H259-G261 VanDerWaalsContact C-N 3.34Å; G261-T265 WeakPolarHBondContact O-CB 3.28Å; G261-T265 PolarHBondContact O-N 2.9Å; G261-T265 PolarHBondContact O-OG1 3.47Å
262L97.7Very high97.3Very high68 Ų6840.5 Ų40.536%0.35623%0.226SC..Hα-helixtrans-63.1-47.9175.3179.959.9000111.6L258 H259 I260 T265 L266 L313 F318L258-L262 WeakPolarHBondContact O-CB 3.19Å; L258-L262 PolarHBondContact O-N 3.33Å; H259-L262 PolarHBondContact O-N 3.04Å; I260-L262 PolarHBondContact O-N 3.13Å; L262-T265 PolarHBondContact O-N 3.26Å; L262-L266 HydrophobicContact CD1-CD1 4.07Å; L262-L266 HydrophobicContact CD1-CG 4.17Å; L262-L266 HydrophobicContact CG-CD1 4.08Å; L262-L266 WeakPolarHBondContact O-CB 3.37Å; L262-L266 VanDerWaalsContact O-CG 3.29Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 2.8Å; L262-L313 HydrophobicContact CD2-CD1 4.39Å; L262-F318 HydrophobicContact CB-CE1 4.18Å; L262-F318 HydrophobicContact CD2-CD1 4Å; L262-F318 HydrophobicContact CD2-CE1 3.6Å; L262-F318 HydrophobicContact CD2-CZ 3.9Å; L262-F318 HydrophobicContact CG-CD1 4.27Å; L262-F318 HydrophobicContact CG-CE1 3.77Å; L262-F318 HydrophobicContact CG-CZ 4.42Å
263V97.8Very high97.2Very high0 Ų044.8 Ų44.80%024%0.236CC..Hα-helixtrans-62-48178.6-178.80000111.6H259 I260 T265 L266 A267 F290 V293 I294 I297 F318H259-V263 PolarHBondContact O-N 3.37Å; I260-V263 PolarHBondContact O-N 3.43Å; V263-T265 VanDerWaalsContact C-N 3.31Å; V263-T265 PolarHBondContact O-N 3.19Å; V263-L266 PolarHBondContact O-N 3.09Å; V263-A267 WeakPolarHBondContact O-CB 3.49Å; V263-A267 PolarHBondContact O-N 3.2Å; V263-F290 HydrophobicContact CG1-CD1 3.98Å; V263-V293 HydrophobicContact CG1-CG1 3.97Å; V263-V293 HydrophobicContact CG2-CG1 3.75Å; V263-I294 HydrophobicContact CB-CG1 4.43Å; V263-I294 HydrophobicContact CG1-CD1 4.24Å; V263-I294 HydrophobicContact CG1-CG1 3.72Å; V263-I297 HydrophobicContact CG2-CD1 3.34Å; V263-F318 HydrophobicContact CG2-CD1 4.18Å; V263-F318 HydrophobicContact CG2-CE1 3.34Å; V263-F318 HydrophobicContact CG2-CZ 3.93Å
264L98.4Very high97.2Very high39 Ų3944.2 Ų44.220%0.20423%0.233CC..Hα-helixtrans-66.2-35.3-179-68.9177.4000112F154 F158 I260 F268 I294F154-L264 HydrophobicContact CB-CD2 4.07Å; F154-L264 HydrophobicContact CD1-CD2 3.9Å; F154-L264 HydrophobicContact CG-CD2 4.09Å; F158-L264 HydrophobicContact CB-CD1 4.42Å; F158-L264 HydrophobicContact CD2-CD1 3.79Å; F158-L264 HydrophobicContact CE2-CD1 4.45Å; F158-L264 HydrophobicContact CG-CD1 4.28Å; I260-L264 HydrophobicContact CD1-CD1 4.39Å; I260-L264 HydrophobicContact CD1-CG 4.28Å; I260-L264 HydrophobicContact CG1-CD1 3.98Å; I260-L264 HydrophobicContact CG1-CG 4.31Å; I260-L264 WeakPolarHBondContact O-CB 3.27Å; I260-L264 WeakPolarHBondContact O-CG 3.39Å; I260-L264 PolarHBondContact O-N 3.12Å; L264-F268 VanDerWaalsContact O-CB 3.3Å; L264-F268 WeakPolarHBondContact O-CB 3.5Å; L264-F268 PolarHBondContact O-N 3.5Å; L264-I294 HydrophobicContact CD2-CD1 4.16Å
265T98.4Very high97Very high75 Ų7544 Ų4446%0.4624%0.239SC..Hα-helixtrans-68.8-42.9175.2-65.80000111G261 L262 V263 F268 I269G261-T265 WeakPolarHBondContact O-CB 3.28Å; G261-T265 PolarHBondContact O-N 2.9Å; G261-T265 PolarHBondContact O-OG1 3.47Å; L262-T265 PolarHBondContact O-N 3.26Å; V263-T265 VanDerWaalsContact C-N 3.31Å; V263-T265 PolarHBondContact O-N 3.19Å; T265-F268 PolarHBondContact O-N 3.36Å; T265-I269 HydrophobicContact CG2-CD1 3.63Å; T265-I269 HydrophobicContact CG2-CG1 4.27Å; T265-I269 WeakPolarHBondContact O-CB 3.27Å; T265-I269 VanDerWaalsContact O-CG1 3.25Å; T265-I269 WeakPolarHBondContact O-CG1 3.43Å; T265-I269 PolarHBondContact O-N 3.37Å
266L98.2Very high97Very high23 Ų2344.5 Ų44.512%0.1224%0.244CC..Hα-helixtrans-60.9-47.2173.5-73.4171.4000110.9L262 V263 F268 I269 I270 F290 F318 P321 F325L262-L266 HydrophobicContact CD1-CD1 4.07Å; L262-L266 HydrophobicContact CD1-CG 4.17Å; L262-L266 HydrophobicContact CG-CD1 4.08Å; L262-L266 WeakPolarHBondContact O-CB 3.37Å; L262-L266 VanDerWaalsContact O-CG 3.29Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 2.8Å; V263-L266 PolarHBondContact O-N 3.09Å; L266-F268 VanDerWaalsContact C-N 3.33Å; L266-F268 PolarHBondContact O-N 3.16Å; L266-I269 PolarHBondContact O-N 2.87Å; L266-I270 HydrophobicContact CB-CD1 4.45Å; L266-I270 VanDerWaalsContact O-CB 3.28Å; L266-I270 WeakPolarHBondContact O-CB 3.5Å; L266-I270 WeakPolarHBondContact O-CD1 3.48Å; L266-I270 WeakPolarHBondContact O-CG1 3.41Å; L266-I270 PolarHBondContact O-N 2.9Å; L266-F290 HydrophobicContact CB-CE1 4.43Å; L266-F318 HydrophobicContact CD1-CD1 4.25Å; L266-P321 HydrophobicContact CB-CB 4.46Å; L266-P321 HydrophobicContact CD1-CB 4.03Å; L266-F325 HydrophobicContact CD2-CB 4.18Å; L266-F325 HydrophobicContact CD2-CD2 4.04Å; L266-F325 HydrophobicContact CD2-CG 4.12Å
267A98.6Very high97Very high0 Ų049.6 Ų49.60%027%0.268CS..Hα-helixtrans-56.8-47.4175.500000111.3F150 F154 V263 I270 F271 Y286 F290F150-A267 HydrophobicContact CE2-CB 4.22Å; F150-A267 HydrophobicContact CZ-CB 4.15Å; F154-A267 HydrophobicContact CE1-CB 4.5Å; F154-A267 HydrophobicContact CE2-CB 4.31Å; F154-A267 HydrophobicContact CZ-CB 3.99Å; V263-A267 WeakPolarHBondContact O-CB 3.49Å; V263-A267 PolarHBondContact O-N 3.2Å; A267-I270 PolarHBondContact O-N 3.32Å; A267-F271 WeakPolarHBondContact O-CB 3.35Å; A267-F271 PolarHBondContact O-N 2.97Å; A267-Y286 VanDerWaalsContact CA-OH 3.29Å; A267-Y286 WeakPolarHBondContact CA-OH 3.12Å; A267-Y286 HydrophobicContact CB-CE1 4.34Å; A267-Y286 PolarHBondContact O-OH 2.7Å; A267-F290 HydrophobicContact CB-CD1 3.63Å; A267-F290 HydrophobicContact CB-CE1 3.7Å; A267-F290 HydrophobicContact CB-CG 4.06Å; A267-F290 HydrophobicContact CB-CZ 4.21Å
268F98.6Very high97Very high101 Ų10148.8 Ų48.844%0.44326%0.259SS..Hα-helixtrans-66.5-44-179.5-177.1-101.7000112.8F150 L264 T265 L266 I270 F271 K272F150-F268 HydrophobicContact CE1-CB 4.38Å; F150-F268 AromaticContact CE1-CD2 4Å; F150-F268 HydrophobicContact CE1-CD2 4Å; F150-F268 HydrophobicContact CZ-CB 3.87Å; F150-F268 HydrophobicContact CZ-CD2 4.12Å; L264-F268 VanDerWaalsContact O-CB 3.3Å; L264-F268 WeakPolarHBondContact O-CB 3.5Å; L264-F268 PolarHBondContact O-N 3.5Å; T265-F268 PolarHBondContact O-N 3.36Å; L266-F268 VanDerWaalsContact C-N 3.33Å; L266-F268 PolarHBondContact O-N 3.16Å; F268-I270 VanDerWaalsContact C-N 3.35Å; F268-F271 PolarHBondContact O-N 3.22Å; F268-K272 HydrophobicContact CD1-CG 4.33Å; F268-K272 HydrophobicContact CD2-CG 4.28Å; F268-K272 HydrophobicContact CE1-CG 3.89Å; F268-K272 HydrophobicContact CE2-CD 4.39Å; F268-K272 HydrophobicContact CE2-CG 3.83Å; F268-K272 HydrophobicContact CZ-CD 4.38Å; F268-K272 HydrophobicContact CZ-CG 3.62Å; F268-K272 WeakPolarHBondContact O-CB 3.49Å; F268-K272 WeakPolarHBondContact O-CG 3.46Å; F268-K272 PolarHBondContact O-N 3.01Å
269I98Very high97.1Very high51 Ų5143.5 Ų43.526%0.26223%0.232SC..Hα-helixtrans-63.1-44.7177.7-70171.5000110.1T265 L266 F271 K272 K273 F325T265-I269 HydrophobicContact CG2-CD1 3.63Å; T265-I269 HydrophobicContact CG2-CG1 4.27Å; T265-I269 WeakPolarHBondContact O-CB 3.27Å; T265-I269 VanDerWaalsContact O-CG1 3.25Å; T265-I269 WeakPolarHBondContact O-CG1 3.43Å; T265-I269 PolarHBondContact O-N 3.37Å; L266-I269 PolarHBondContact O-N 2.87Å; I269-F271 VanDerWaalsContact C-N 3.33Å; I269-F271 PolarHBondContact O-N 3.49Å; I269-K272 PolarHBondContact O-N 3.16Å; I269-K273 HydrophobicContact CG2-CD 4.12Å; I269-K273 HydrophobicContact CG2-CG 4.27Å; I269-K273 WeakPolarHBondContact O-CB 3.47Å; I269-K273 PolarHBondContact O-N 3.17Å; I269-F325 HydrophobicContact CG2-CD2 4.18Å; I269-F325 HydrophobicContact CG2-CE2 4.03Å
270I98.2Very high97.2Very high0 Ų046 Ų460%024%0.244CC..Hα-helixtrans-64.4-41.2-179.4-70.1161.4000110.8L266 A267 F268 S274 L278 Y286 F290 P321 L324 F325 Q328L266-I270 HydrophobicContact CB-CD1 4.45Å; L266-I270 VanDerWaalsContact O-CB 3.28Å; L266-I270 WeakPolarHBondContact O-CB 3.5Å; L266-I270 WeakPolarHBondContact O-CD1 3.48Å; L266-I270 WeakPolarHBondContact O-CG1 3.41Å; L266-I270 PolarHBondContact O-N 2.9Å; A267-I270 PolarHBondContact O-N 3.32Å; F268-I270 VanDerWaalsContact C-N 3.35Å; I270-S274 WeakPolarHBondContact O-CB 3.23Å; I270-S274 PolarHBondContact O-N 3.07Å; I270-L278 HydrophobicContact CG2-CD2 4.38Å; I270-Y286 WeakPolarHBondContact CB-OH 3.08Å; I270-Y286 HydrophobicContact CG2-CE2 3.78Å; I270-Y286 WeakPolarHBondContact CG2-OH 3.39Å; I270-F290 HydrophobicContact CD1-CE1 4.43Å; I270-F290 HydrophobicContact CD1-CZ 3.71Å; I270-P321 WeakPolarHBondContact CD1-O 3.3Å; I270-L324 HydrophobicContact CD1-CB 3.69Å; I270-L324 HydrophobicContact CG1-CB 4.35Å; I270-L324 HydrophobicContact CG2-CB 4.31Å; I270-F325 HydrophobicContact CD1-CB 4.16Å; I270-F325 HydrophobicContact CG1-CB 4.35Å; I270-Q328 VanDerWaalsContact CA-OE1 3.27Å; I270-Q328 PolarHBondContact O-NE2 2.88Å
271F98Very high97.2Very high3 Ų349.9 Ų49.91%0.01326%0.264CS..Hα-helixtrans-57.4-55.4170.1167.3-152.8000111.1P146 F150 A267 F268 I269 K273 F279 E280P146-F271 HydrophobicContact CB-CE2 4.17Å; P146-F271 HydrophobicContact CB-CZ 3.81Å; F150-F271 HydrophobicContact CB-CD1 4.32Å; F150-F271 HydrophobicContact CB-CE1 4.05Å; F150-F271 HydrophobicContact CD2-CB 4.27Å; F150-F271 AromaticContact CD2-CD1 3.46Å; F150-F271 HydrophobicContact CD2-CD1 3.46Å; F150-F271 VanDerWaalsContact CD2-CD1 3.46Å; F150-F271 HydrophobicContact CD2-CE1 4.07Å; F150-F271 HydrophobicContact CD2-CG 4.13Å; F150-F271 HydrophobicContact CE2-CB 4.08Å; F150-F271 AromaticContact CE2-CD1 3.88Å; F150-F271 HydrophobicContact CE2-CD1 3.88Å; F150-F271 HydrophobicContact CE2-CG 4.39Å; F150-F271 AromaticContact CG-CD1 3.89Å; F150-F271 HydrophobicContact CG-CD1 3.89Å; F150-F271 HydrophobicContact CG-CE1 4.08Å; A267-F271 WeakPolarHBondContact O-CB 3.35Å; A267-F271 PolarHBondContact O-N 2.97Å; F268-F271 PolarHBondContact O-N 3.22Å; I269-F271 VanDerWaalsContact C-N 3.33Å; I269-F271 PolarHBondContact O-N 3.49Å; F271-K273 PolarHBondContact O-N 3.37Å; F271-F279 HydrophobicContact CB-CB 4.22Å; F271-F279 HydrophobicContact CB-CG 4.46Å; F271-F279 HydrophobicContact CD1-CD1 4.2Å; F271-F279 HydrophobicContact CD2-CB 3.67Å; F271-F279 AromaticContact CD2-CD1 3.51Å; F271-F279 HydrophobicContact CD2-CD1 3.51Å; F271-F279 AromaticContact CD2-CG 3.92Å; F271-F279 HydrophobicContact CD2-CG 3.92Å; F271-F279 HydrophobicContact CE1-CD1 4.2Å; F271-F279 HydrophobicContact CE1-CE1 4.39Å; F271-F279 HydrophobicContact CE2-CB 4.38Å; F271-F279 AromaticContact CE2-CD1 3.56Å; F271-F279 HydrophobicContact CE2-CD1 3.56Å; F271-F279 HydrophobicContact CE2-CE1 4.38Å; F271-F279 HydrophobicContact CE2-CG 4.38Å; F271-F279 HydrophobicContact CG-CB 4.15Å; F271-F279 AromaticContact CG-CD1 3.86Å; F271-F279 HydrophobicContact CG-CD1 3.86Å; F271-F279 HydrophobicContact CG-CG 4.17Å; F271-F279 AromaticContact CZ-CD1 3.89Å; F271-F279 HydrophobicContact CZ-CD1 3.89Å; F271-F279 HydrophobicContact CZ-CE1 4.28Å; F271-E280 HydrophobicContact CE2-CG 4.25Å; F271-E280 WeakPolarHBondContact CE2-OE1 3.29Å
272K97.1Very high97.2Very high100 Ų10051.3 Ų51.344%0.43526%0.263SS..Hα-helixtrans-75.1-22.1-170.9-66.9-53.5-175.3-168.60115.6N147 F268 I269N147-K272 PolarHBondContact OD1-NZ 3.36Å; F268-K272 HydrophobicContact CD1-CG 4.33Å; F268-K272 HydrophobicContact CD2-CG 4.28Å; F268-K272 HydrophobicContact CE1-CG 3.89Å; F268-K272 HydrophobicContact CE2-CD 4.39Å; F268-K272 HydrophobicContact CE2-CG 3.83Å; F268-K272 HydrophobicContact CZ-CD 4.38Å; F268-K272 HydrophobicContact CZ-CG 3.62Å; F268-K272 WeakPolarHBondContact O-CB 3.49Å; F268-K272 WeakPolarHBondContact O-CG 3.46Å; F268-K272 PolarHBondContact O-N 3.01Å; I269-K272 PolarHBondContact O-N 3.16Å
273K95.3Very high97.3Very high158 Ų15848.1 Ų48.169%0.68725%0.246SC*.Hα-helixtrans-100.3-5.2-179.5-73.5-158.6170.4-169.60114.5I269 F271 S275I269-K273 HydrophobicContact CG2-CD 4.12Å; I269-K273 HydrophobicContact CG2-CG 4.27Å; I269-K273 WeakPolarHBondContact O-CB 3.47Å; I269-K273 PolarHBondContact O-N 3.17Å; F271-K273 PolarHBondContact O-N 3.37Å; K273-S275 PolarHBondContact O-N 3.45Å
274S95.4Very high97.3Very high11 Ų1148.2 Ų48.28%0.07725%0.247CC..  trans-61.8123.4179.1-173.40000111I270 S276 H277 L278 Q328 E336I270-S274 WeakPolarHBondContact O-CB 3.23Å; I270-S274 PolarHBondContact O-N 3.07Å; S274-S276 VanDerWaalsContact C-N 3.35Å; S274-S276 PolarHBondContact OG-OG 3.06Å; S274-H277 PolarHBondContact OG-N 2.82Å; S274-L278 WeakPolarHBondContact OG-CB 3.45Å; S274-L278 PolarHBondContact OG-N 3.33Å; S274-Q328 VanDerWaalsContact CA-NE2 3.35Å; S274-E336 WeakPolarHBondContact CB-OE1 3.4Å; S274-E336 PolarHBondContact OG-OE1 2.9Å; S274-E336 PolarHBondContact OG-OE2 3.23Å; S274-E336 VanDerWaalsContact OG-OE2 3.07Å
275S92Very high97.3Very high88 Ų8847.2 Ų47.262%0.61524%0.242SC*.SBendtrans-79.5-23.4174.854.80000111.9K273 E336K273-S275 PolarHBondContact O-N 3.45Å; S275-E336 PolarHBondContact N-OE2 3.44Å; S275-E336 PolarHBondContact OG-OE2 3.31Å
276S94.7Very high97.3Very high49 Ų4943.7 Ų43.734%0.34322%0.22SC..SBendtrans-91.85.7177.362.30000114.1S274 L278 N281 E336S274-S276 VanDerWaalsContact C-N 3.35Å; S274-S276 PolarHBondContact OG-OG 3.06Å; S276-L278 VanDerWaalsContact C-N 3.25Å; S276-L278 PolarHBondContact O-N 2.89Å; S276-N281 PolarHBondContact O-ND2 3.3Å; S276-E336 WeakPolarHBondContact CB-OE2 3.16Å; S276-E336 PolarHBondContact N-OE2 3.42Å; S276-E336 PolarHBondContact OG-OE2 3.25Å
277H96.3Very high97.4Very high108 Ų10842.6 Ų42.650%0.521%0.214SC..  trans52.544.9-173.1-61.3-72.5000112.1S274 F279 E280 N281S274-H277 PolarHBondContact OG-N 2.82Å; H277-F279 VanDerWaalsContact C-N 3.3Å; H277-F279 PolarHBondContact O-N 3.19Å; H277-E280 VanDerWaalsContact C-OE2 3.26Å; H277-E280 WeakPolarHBondContact CA-OE2 3.47Å; H277-E280 HydrophobicContact CB-CB 4.21Å; H277-E280 IonicContact ND1-OE1 3.46Å; H277-E280 PolarHBondContact ND1-OE1 3.16Å; H277-E280 PolarHBondContact O-N 3.08Å; H277-E280 VanDerWaalsContact O-N 3.15Å; H277-N281 WeakPolarHBondContact O-CB 3.49Å; H277-N281 PolarHBondContact O-N 3.24Å; H277-N281 PolarHBondContact O-ND2 2.98Å
278L97.4Very high97.4Very high1 Ų143.4 Ų43.41%0.00522%0.219CC..Hα-helixtrans-51.8-46.2-171.9178.168.6000112.7I270 S274 S276 H282 Y286 L324 E336 H337 L340I270-L278 HydrophobicContact CG2-CD2 4.38Å; S274-L278 WeakPolarHBondContact OG-CB 3.45Å; S274-L278 PolarHBondContact OG-N 3.33Å; S276-L278 VanDerWaalsContact C-N 3.25Å; S276-L278 PolarHBondContact O-N 2.89Å; L278-H282 WeakPolarHBondContact O-CB 3.36Å; L278-H282 PolarHBondContact O-N 3.22Å; L278-Y286 HydrophobicContact CD2-CD2 4.33Å; L278-Y286 HydrophobicContact CD2-CE2 4.3Å; L278-L324 HydrophobicContact CD2-CD2 3.9Å; L278-E336 HydrophobicContact CB-CB 4.34Å; L278-E336 HydrophobicContact CD1-CB 3.87Å; L278-E336 HydrophobicContact CD2-CB 4.11Å; L278-E336 HydrophobicContact CG-CB 4.31Å; L278-H337 HydrophobicContact CD1-CB 4.18Å; L278-L340 HydrophobicContact CD1-CB 4.14Å; L278-L340 HydrophobicContact CD1-CD2 3.83Å; L278-L340 HydrophobicContact CD2-CB 4.33Å; L278-L340 HydrophobicContact CD2-CD2 4.32Å; L278-L340 HydrophobicContact CG-CD2 4.07Å
279F98.2Very high97.4Very high0 Ų038.6 Ų38.60%020%0.198CC..Hα-helixtrans-70.7-41.6-178.3175.5-111.6000111.7P146 I149 F150 F271 H277 N281 H282 P283 Y286 L287P146-F279 WeakPolarHBondContact O-CE1 3.33Å; I149-F279 HydrophobicContact CG1-CZ 4.49Å; I149-F279 HydrophobicContact CG2-CE1 3.84Å; I149-F279 HydrophobicContact CG2-CZ 3.83Å; F150-F279 HydrophobicContact CB-CE1 3.76Å; F150-F279 HydrophobicContact CB-CZ 3.84Å; F150-F279 HydrophobicContact CD2-CE1 4.13Å; F150-F279 HydrophobicContact CD2-CE2 4.42Å; F150-F279 HydrophobicContact CD2-CZ 4.07Å; F150-F279 HydrophobicContact CG-CE1 4.47Å; F150-F279 HydrophobicContact CG-CZ 4.46Å; F271-F279 HydrophobicContact CB-CB 4.22Å; F271-F279 HydrophobicContact CB-CG 4.46Å; F271-F279 HydrophobicContact CD1-CD1 4.2Å; F271-F279 HydrophobicContact CD2-CB 3.67Å; F271-F279 AromaticContact CD2-CD1 3.51Å; F271-F279 HydrophobicContact CD2-CD1 3.51Å; F271-F279 AromaticContact CD2-CG 3.92Å; F271-F279 HydrophobicContact CD2-CG 3.92Å; F271-F279 HydrophobicContact CE1-CD1 4.2Å; F271-F279 HydrophobicContact CE1-CE1 4.39Å; F271-F279 HydrophobicContact CE2-CB 4.38Å; F271-F279 AromaticContact CE2-CD1 3.56Å; F271-F279 HydrophobicContact CE2-CD1 3.56Å; F271-F279 HydrophobicContact CE2-CE1 4.38Å; F271-F279 HydrophobicContact CE2-CG 4.38Å; F271-F279 HydrophobicContact CG-CB 4.15Å; F271-F279 AromaticContact CG-CD1 3.86Å; F271-F279 HydrophobicContact CG-CD1 3.86Å; F271-F279 HydrophobicContact CG-CG 4.17Å; F271-F279 AromaticContact CZ-CD1 3.89Å; F271-F279 HydrophobicContact CZ-CD1 3.89Å; F271-F279 HydrophobicContact CZ-CE1 4.28Å; H277-F279 VanDerWaalsContact C-N 3.3Å; H277-F279 PolarHBondContact O-N 3.19Å; F279-N281 VanDerWaalsContact C-N 3.32Å; F279-N281 PolarHBondContact O-N 3.25Å; F279-H282 CarbonylContact O-C 3.43Å; F279-H282 PolarHBondContact O-N 3.31Å; F279-P283 HydrophobicContact CD2-CB 4.37Å; F279-P283 HydrophobicContact CE2-CB 4.02Å; F279-P283 HydrophobicContact CZ-CB 4.28Å; F279-P283 WeakPolarHBondContact O-CA 3.34Å; F279-P283 VanDerWaalsContact O-CB 3.27Å; F279-P283 WeakPolarHBondContact O-CB 3.2Å; F279-P283 WeakPolarHBondContact O-CD 3.27Å; F279-Y286 HydrophobicContact CB-CD2 4.19Å; F279-Y286 HydrophobicContact CB-CE2 4.34Å; F279-Y286 HydrophobicContact CB-CG 4.42Å; F279-Y286 AromaticContact CD2-CD1 3.38Å; F279-Y286 HydrophobicContact CD2-CD1 3.38Å; F279-Y286 HydrophobicContact CD2-CD2 4.06Å; F279-Y286 AromaticContact CD2-CE1 3.98Å; F279-Y286 HydrophobicContact CD2-CE1 3.98Å; F279-Y286 AromaticContact CD2-CG 3.44Å; F279-Y286 HydrophobicContact CD2-CG 3.44Å; F279-Y286 VanDerWaalsContact CD2-CG 3.44Å; F279-Y286 AromaticContact CE2-CD1 3.79Å; F279-Y286 HydrophobicContact CE2-CD1 3.79Å; F279-Y286 HydrophobicContact CE2-CE1 4.48Å; F279-Y286 HydrophobicContact CE2-CG 4.17Å; F279-Y286 HydrophobicContact CG-CD1 4.4Å; F279-Y286 HydrophobicContact CG-CG 4.38Å; F279-L287 HydrophobicContact CE2-CD2 4.29Å; F279-L287 HydrophobicContact CE2-CG 4.29Å
280E97.3Very high97.4Very high59 Ų5936.2 Ų36.228%0.27619%0.185SC..Hα-helixtrans-66.5-35.6179.9-59.593.2142.900112P146 F271 H277P146-E280 HydrophobicContact CB-CG 3.88Å; P146-E280 HydrophobicContact CG-CB 4.47Å; P146-E280 HydrophobicContact CG-CG 3.68Å; F271-E280 HydrophobicContact CE2-CG 4.25Å; F271-E280 WeakPolarHBondContact CE2-OE1 3.29Å; H277-E280 VanDerWaalsContact C-OE2 3.26Å; H277-E280 WeakPolarHBondContact CA-OE2 3.47Å; H277-E280 HydrophobicContact CB-CB 4.21Å; H277-E280 IonicContact ND1-OE1 3.46Å; H277-E280 PolarHBondContact ND1-OE1 3.16Å; H277-E280 PolarHBondContact O-N 3.08Å; H277-E280 VanDerWaalsContact O-N 3.15Å
281N97.8Very high97.5Very high85 Ų8536.2 Ų36.246%0.45519%0.185SC..Hα-helixtrans-82.1-28.8179.5-69.2-27.7000113.1S276 H277 F279S276-N281 PolarHBondContact O-ND2 3.3Å; H277-N281 WeakPolarHBondContact O-CB 3.49Å; H277-N281 PolarHBondContact O-N 3.24Å; H277-N281 PolarHBondContact O-ND2 2.98Å; F279-N281 VanDerWaalsContact C-N 3.32Å; F279-N281 PolarHBondContact O-N 3.25Å
282H98.3Very high97.5Very high58 Ų5836.3 Ų36.327%0.26919%0.186SC..SBendtrans-134.451.3-176.1-55.4-69.1000113.6L278 F279 C284 L285 Y286 H337 L340L278-H282 WeakPolarHBondContact O-CB 3.36Å; L278-H282 PolarHBondContact O-N 3.22Å; F279-H282 CarbonylContact O-C 3.43Å; F279-H282 PolarHBondContact O-N 3.31Å; H282-C284 PolarHBondContact O-N 3.3Å; H282-L285 HydrophobicContact CB-CB 4.41Å; H282-L285 PolarHBondContact O-N 3.21Å; H282-Y286 WeakPolarHBondContact O-CB 3.29Å; H282-Y286 PolarHBondContact O-N 2.94Å; H282-H337 AromaticContact CD2-CD2 3.7Å; H282-H337 AromaticContact CD2-CG 3.83Å; H282-H337 AromaticContact CE1-CD2 3.78Å; H282-H337 AromaticContact CE1-CE1 3.62Å; H282-H337 AromaticContact CE1-CG 3.91Å; H282-H337 AromaticContact CE1-ND1 3.81Å; H282-H337 AromaticContact CE1-NE2 3.62Å; H282-H337 AromaticContact CG-CD2 3.8Å; H282-H337 AromaticContact ND1-CD2 3.86Å; H282-H337 AromaticContact ND1-NE2 3.69Å; H282-H337 AromaticContact NE2-CD2 3.68Å; H282-H337 AromaticContact NE2-CE1 3.97Å; H282-H337 AromaticContact NE2-CG 3.51Å; H282-H337 AromaticContact NE2-ND1 3.7Å; H282-H337 AromaticContact NE2-NE2 3.99Å; H282-L340 HydrophobicContact CB-CD2 4.13Å
283P98.5Very high97.6Very high2 Ų231.6 Ų31.61%0.01317%0.166CC..Hα-helixtrans-65.6-39.7-169.224.9-34000113.1T76 I149 F279 Y286 L287T76-P283 WeakPolarHBondContact O-CG 3.16Å; I149-P283 HydrophobicContact CD1-CB 3.84Å; I149-P283 HydrophobicContact CD1-CG 4.27Å; F279-P283 HydrophobicContact CD2-CB 4.37Å; F279-P283 HydrophobicContact CE2-CB 4.02Å; F279-P283 HydrophobicContact CZ-CB 4.28Å; F279-P283 WeakPolarHBondContact O-CA 3.34Å; F279-P283 VanDerWaalsContact O-CB 3.27Å; F279-P283 WeakPolarHBondContact O-CB 3.2Å; F279-P283 WeakPolarHBondContact O-CD 3.27Å; P283-Y286 WeakPolarHBondContact O-CB 3.34Å; P283-Y286 PolarHBondContact O-N 3.49Å; P283-L287 WeakPolarHBondContact O-CB 3.31Å; P283-L287 VanDerWaalsContact O-CG 3.28Å; P283-L287 WeakPolarHBondContact O-CG 3.5Å; P283-L287 PolarHBondContact O-N 3.42Å
284C98.8Very high97.7Very high2 Ų224.2 Ų24.21%0.01413%0.134CC..Hα-helixtrans-65.7-45.8179.4-65.40000111.7V71 P75 V134 H282 Y286 L287 L288V71-C284 HydrophobicContact CG1-CB 4.01Å; V71-C284 HydrophobicContact CG2-CB 4.28Å; P75-C284 VanDerWaalsContact O-CB 3.27Å; P75-C284 WeakPolarHBondContact O-CB 3.38Å; P75-C284 PolarHBondContact O-SG 2.95Å; V134-C284 HydrophobicContact CG1-CB 4.19Å; H282-C284 PolarHBondContact O-N 3.3Å; C284-Y286 VanDerWaalsContact C-N 3.27Å; C284-Y286 PolarHBondContact O-N 2.9Å; C284-L287 PolarHBondContact O-N 2.87Å; C284-L288 WeakPolarHBondContact O-CB 3.26Å; C284-L288 VanDerWaalsContact O-CG 3.23Å; C284-L288 WeakPolarHBondContact O-CG 3.42Å; C284-L288 PolarHBondContact O-N 3.32Å
285L98.8Very high97.9Very high18 Ų1823.8 Ų23.89%0.09413%0.131CC..Hα-helixtrans-61.4-39.5176.117861.8000111.2H282 L288 T289 L340 W341 M344H282-L285 HydrophobicContact CB-CB 4.41Å; H282-L285 PolarHBondContact O-N 3.21Å; L285-L288 PolarHBondContact O-N 3.35Å; L285-T289 WeakPolarHBondContact O-CB 3.42Å; L285-T289 PolarHBondContact O-N 3.13Å; L285-T289 PolarHBondContact O-OG1 3.47Å; L285-L340 HydrophobicContact CB-CD2 4.28Å; L285-L340 HydrophobicContact CD2-CD2 3.72Å; L285-L340 HydrophobicContact CD2-CG 3.88Å; L285-L340 HydrophobicContact CG-CD2 3.81Å; L285-L340 HydrophobicContact CG-CG 3.91Å; L285-W341 HydrophobicContact CD1-CD2 4.09Å; L285-W341 HydrophobicContact CD1-CE3 3.95Å; L285-W341 HydrophobicContact CD1-CH2 3.89Å; L285-W341 HydrophobicContact CD1-CZ2 4.02Å; L285-W341 HydrophobicContact CD1-CZ3 3.85Å; L285-W341 HydrophobicContact CD2-CD2 3.84Å; L285-W341 VanDerWaalsContact CD2-CE2 3.47Å; L285-W341 HydrophobicContact CD2-CG 4.05Å; L285-W341 HydrophobicContact CD2-CZ2 3.91Å; L285-M344 HydrophobicContact CD1-CB 4.07Å; L285-M344 HydrophobicContact CD1-CG 3.92Å
286Y98.8Very high98.2Very high0 Ų019.8 Ų19.80%010%0.102CC..Hα-helixtrans-63.5-49.6176.8-166.8-80.3000112.5F154 A267 I270 L278 F279 H282 P283 C284 L288 T289 F290 L340F154-Y286 HydrophobicContact CE2-CD1 4.48Å; F154-Y286 HydrophobicContact CE2-CE1 4.26Å; F154-Y286 HydrophobicContact CZ-CD1 4.32Å; F154-Y286 HydrophobicContact CZ-CE1 4.13Å; A267-Y286 VanDerWaalsContact CA-OH 3.29Å; A267-Y286 WeakPolarHBondContact CA-OH 3.12Å; A267-Y286 HydrophobicContact CB-CE1 4.34Å; A267-Y286 PolarHBondContact O-OH 2.7Å; I270-Y286 WeakPolarHBondContact CB-OH 3.08Å; I270-Y286 HydrophobicContact CG2-CE2 3.78Å; I270-Y286 WeakPolarHBondContact CG2-OH 3.39Å; L278-Y286 HydrophobicContact CD2-CD2 4.33Å; L278-Y286 HydrophobicContact CD2-CE2 4.3Å; F279-Y286 HydrophobicContact CB-CD2 4.19Å; F279-Y286 HydrophobicContact CB-CE2 4.34Å; F279-Y286 HydrophobicContact CB-CG 4.42Å; F279-Y286 AromaticContact CD2-CD1 3.38Å; F279-Y286 HydrophobicContact CD2-CD1 3.38Å; F279-Y286 HydrophobicContact CD2-CD2 4.06Å; F279-Y286 AromaticContact CD2-CE1 3.98Å; F279-Y286 HydrophobicContact CD2-CE1 3.98Å; F279-Y286 AromaticContact CD2-CG 3.44Å; F279-Y286 HydrophobicContact CD2-CG 3.44Å; F279-Y286 VanDerWaalsContact CD2-CG 3.44Å; F279-Y286 AromaticContact CE2-CD1 3.79Å; F279-Y286 HydrophobicContact CE2-CD1 3.79Å; F279-Y286 HydrophobicContact CE2-CE1 4.48Å; F279-Y286 HydrophobicContact CE2-CG 4.17Å; F279-Y286 HydrophobicContact CG-CD1 4.4Å; F279-Y286 HydrophobicContact CG-CG 4.38Å; H282-Y286 WeakPolarHBondContact O-CB 3.29Å; H282-Y286 PolarHBondContact O-N 2.94Å; P283-Y286 WeakPolarHBondContact O-CB 3.34Å; P283-Y286 PolarHBondContact O-N 3.49Å; C284-Y286 VanDerWaalsContact C-N 3.27Å; C284-Y286 PolarHBondContact O-N 2.9Å; Y286-L288 VanDerWaalsContact C-N 3.33Å; Y286-L288 PolarHBondContact O-N 2.98Å; Y286-T289 PolarHBondContact O-N 3.25Å; Y286-F290 AromaticContact CD1-CD2 3.76Å; Y286-F290 HydrophobicContact CD1-CD2 3.76Å; Y286-F290 HydrophobicContact CD1-CE2 4.15Å; Y286-F290 HydrophobicContact CD2-CE2 4.26Å; Y286-F290 AromaticContact CE1-CD2 3.41Å; Y286-F290 HydrophobicContact CE1-CD2 3.41Å; Y286-F290 VanDerWaalsContact CE1-CD2 3.41Å; Y286-F290 AromaticContact CE1-CE2 3.53Å; Y286-F290 HydrophobicContact CE1-CE2 3.53Å; Y286-F290 HydrophobicContact CE1-CG 4.26Å; Y286-F290 HydrophobicContact CE1-CZ 4.43Å; Y286-F290 HydrophobicContact CE2-CD2 4.26Å; Y286-F290 AromaticContact CE2-CE2 3.67Å; Y286-F290 HydrophobicContact CE2-CE2 3.67Å; Y286-F290 HydrophobicContact CG-CD2 4.29Å; Y286-F290 HydrophobicContact CG-CE2 4.46Å; Y286-F290 AromaticContact CZ-CD2 3.68Å; Y286-F290 AromaticContact CZ-CE2 3.24Å; Y286-F290 AromaticContact CZ-CZ 3.98Å; Y286-F290 PolarHBondContact O-N 3.19Å; Y286-F290 WeakPolarHBondContact OH-CE2 3.19Å; Y286-L340 HydrophobicContact CD2-CD1 4.18Å; Y286-L340 HydrophobicContact CD2-CD2 4.38Å
287L98.8Very high98.4Very high1 Ų117.6 Ų17.61%0.0059%0.087CC..Hα-helixtrans-61.8-40.4176.9-71.4178.5000111.7V134 I149 F154 F279 P283 C284 G291V134-L287 HydrophobicContact CG2-CB 3.72Å; V134-L287 HydrophobicContact CG2-CD1 4.2Å; I149-L287 HydrophobicContact CD1-CD1 4.48Å; I149-L287 HydrophobicContact CG1-CD1 4.07Å; F154-L287 HydrophobicContact CD2-CD2 3.93Å; F154-L287 HydrophobicContact CE2-CD2 3.6Å; F154-L287 HydrophobicContact CZ-CD2 3.96Å; F279-L287 HydrophobicContact CE2-CD2 4.29Å; F279-L287 HydrophobicContact CE2-CG 4.29Å; P283-L287 WeakPolarHBondContact O-CB 3.31Å; P283-L287 VanDerWaalsContact O-CG 3.28Å; P283-L287 WeakPolarHBondContact O-CG 3.5Å; P283-L287 PolarHBondContact O-N 3.42Å; C284-L287 PolarHBondContact O-N 2.87Å; L287-G291 VanDerWaalsContact O-CA 3.27Å; L287-G291 WeakPolarHBondContact O-CA 3.21Å; L287-G291 PolarHBondContact O-N 3.11Å
288L98.8Very high98.5Very high17 Ų1712.5 Ų12.59%0.0896%0.063CC..Hα-helixtrans-61.4-47.4173.3-72.1168.4000110.9V130 F131 V134 C284 L285 Y286 G291 M292 M344V130-L288 HydrophobicContact CG1-CD2 4.07Å; F131-L288 HydrophobicContact CD1-CD2 4.02Å; F131-L288 HydrophobicContact CE1-CD2 3.65Å; F131-L288 HydrophobicContact CZ-CD2 3.96Å; V134-L288 HydrophobicContact CG2-CD2 4.33Å; V134-L288 HydrophobicContact CG2-CG 4.31Å; C284-L288 WeakPolarHBondContact O-CB 3.26Å; C284-L288 VanDerWaalsContact O-CG 3.23Å; C284-L288 WeakPolarHBondContact O-CG 3.42Å; C284-L288 PolarHBondContact O-N 3.32Å; L285-L288 PolarHBondContact O-N 3.35Å; Y286-L288 VanDerWaalsContact C-N 3.33Å; Y286-L288 PolarHBondContact O-N 2.98Å; L288-G291 PolarHBondContact O-N 2.6Å; L288-M292 VanDerWaalsContact O-CG 3.29Å; L288-M292 WeakPolarHBondContact O-CG 3.25Å; L288-M292 PolarHBondContact O-N 3.19Å; L288-M344 HydrophobicContact CB-CE 4Å; L288-M344 HydrophobicContact CB-SD 4.05Å
289T98.8Very high98.5Very high0 Ų012.6 Ų12.60%06%0.064CC..Hα-helixtrans-58.8-56.7-177.9-58.40000112L285 Y286 G291 M292 V293 L340 A343 M344L285-T289 WeakPolarHBondContact O-CB 3.42Å; L285-T289 PolarHBondContact O-N 3.13Å; L285-T289 PolarHBondContact O-OG1 3.47Å; Y286-T289 PolarHBondContact O-N 3.25Å; T289-G291 VanDerWaalsContact C-N 3.31Å; T289-G291 PolarHBondContact O-N 3.17Å; T289-M292 PolarHBondContact O-N 2.83Å; T289-V293 PolarHBondContact O-N 3.16Å; T289-L340 HydrophobicContact CG2-CD1 4.07Å; T289-A343 HydrophobicContact CG2-CB 3.84Å; T289-M344 HydrophobicContact CG2-CB 4.44Å; T289-M344 WeakPolarHBondContact OG1-CB 3.41Å
290F98.8Very high98.5Very high0 Ų014.4 Ų14.40%07%0.071CC..Hα-helixtrans-71.8-29179.3-77.5-91.6000112.2F154 V263 L266 A267 I270 Y286 V293 I294 P321 L324F154-F290 HydrophobicContact CE1-CB 3.51Å; F154-F290 HydrophobicContact CE1-CG 4.41Å; F154-F290 HydrophobicContact CZ-CB 3.6Å; F154-F290 HydrophobicContact CZ-CG 4.16Å; V263-F290 HydrophobicContact CG1-CD1 3.98Å; L266-F290 HydrophobicContact CB-CE1 4.43Å; A267-F290 HydrophobicContact CB-CD1 3.63Å; A267-F290 HydrophobicContact CB-CE1 3.7Å; A267-F290 HydrophobicContact CB-CG 4.06Å; A267-F290 HydrophobicContact CB-CZ 4.21Å; I270-F290 HydrophobicContact CD1-CE1 4.43Å; I270-F290 HydrophobicContact CD1-CZ 3.71Å; Y286-F290 AromaticContact CD1-CD2 3.76Å; Y286-F290 HydrophobicContact CD1-CD2 3.76Å; Y286-F290 HydrophobicContact CD1-CE2 4.15Å; Y286-F290 HydrophobicContact CD2-CE2 4.26Å; Y286-F290 AromaticContact CE1-CD2 3.41Å; Y286-F290 HydrophobicContact CE1-CD2 3.41Å; Y286-F290 VanDerWaalsContact CE1-CD2 3.41Å; Y286-F290 AromaticContact CE1-CE2 3.53Å; Y286-F290 HydrophobicContact CE1-CE2 3.53Å; Y286-F290 HydrophobicContact CE1-CG 4.26Å; Y286-F290 HydrophobicContact CE1-CZ 4.43Å; Y286-F290 HydrophobicContact CE2-CD2 4.26Å; Y286-F290 AromaticContact CE2-CE2 3.67Å; Y286-F290 HydrophobicContact CE2-CE2 3.67Å; Y286-F290 HydrophobicContact CG-CD2 4.29Å; Y286-F290 HydrophobicContact CG-CE2 4.46Å; Y286-F290 AromaticContact CZ-CD2 3.68Å; Y286-F290 AromaticContact CZ-CE2 3.24Å; Y286-F290 AromaticContact CZ-CZ 3.98Å; Y286-F290 PolarHBondContact O-N 3.19Å; Y286-F290 WeakPolarHBondContact OH-CE2 3.19Å; F290-V293 WeakPolarHBondContact O-CB 3.4Å; F290-V293 PolarHBondContact O-N 3.25Å; F290-I294 WeakPolarHBondContact O-CG1 3.48Å; F290-I294 PolarHBondContact O-N 2.84Å; F290-P321 HydrophobicContact CD1-CG 4.26Å; F290-P321 HydrophobicContact CE1-CB 3.81Å; F290-P321 HydrophobicContact CE1-CG 3.86Å; F290-P321 HydrophobicContact CZ-CB 4.21Å; F290-P321 HydrophobicContact CZ-CG 4.42Å; F290-L324 HydrophobicContact CE2-CD1 4.11Å; F290-L324 HydrophobicContact CZ-CD1 4.3Å
291G98.8Very high98.5Very high0 Ų011.6 Ų11.60%06%0.058CC..Hα-helixtrans-59.4-43.8172.100000112.2V130 L287 L288 T289 V293 I294 A295V130-G291 VanDerWaalsContact CG2-C 3.47Å; V130-G291 WeakPolarHBondContact CG2-O 3.13Å; L287-G291 VanDerWaalsContact O-CA 3.27Å; L287-G291 WeakPolarHBondContact O-CA 3.21Å; L287-G291 PolarHBondContact O-N 3.11Å; L288-G291 PolarHBondContact O-N 2.6Å; T289-G291 VanDerWaalsContact C-N 3.31Å; T289-G291 PolarHBondContact O-N 3.17Å; G291-V293 VanDerWaalsContact C-N 3.31Å; G291-V293 PolarHBondContact O-N 3.21Å; G291-I294 PolarHBondContact O-N 3.34Å; G291-A295 WeakPolarHBondContact O-CB 3.34Å; G291-A295 PolarHBondContact O-N 2.98Å
292M98.8Very high98.6Very high5 Ų57.7 Ų7.73%0.0254%0.037CC..Hα-helixtrans-62.9-37.4175.3-65.5-54.3165.400112.2F131 L288 T289 K296 M344 L348 L351F131-M292 HydrophobicContact CE2-CE 3.62Å; F131-M292 HydrophobicContact CZ-CE 3.68Å; L288-M292 VanDerWaalsContact O-CG 3.29Å; L288-M292 WeakPolarHBondContact O-CG 3.25Å; L288-M292 PolarHBondContact O-N 3.19Å; T289-M292 PolarHBondContact O-N 2.83Å; M292-K296 PolarHBondContact O-N 3.4Å; M292-M344 HydrophobicContact CE-CE 4.16Å; M292-M344 HydrophobicContact CG-CE 4.21Å; M292-M344 HydrophobicContact CG-SD 4.33Å; M292-L348 HydrophobicContact CE-CD1 4.46Å; M292-L348 HydrophobicContact SD-CD1 4.34Å; M292-L351 HydrophobicContact CB-CD2 4.36Å; M292-L351 HydrophobicContact SD-CD2 3.67Å
293V98.7Very high98.5Very high2 Ų25.2 Ų5.21%0.0123%0.026CC..Hα-helixtrans-63-49.6174176.80000110.4V263 T289 F290 G291 A295 K296 I297 A317 P321 S347V263-V293 HydrophobicContact CG1-CG1 3.97Å; V263-V293 HydrophobicContact CG2-CG1 3.75Å; T289-V293 PolarHBondContact O-N 3.16Å; F290-V293 WeakPolarHBondContact O-CB 3.4Å; F290-V293 PolarHBondContact O-N 3.25Å; G291-V293 VanDerWaalsContact C-N 3.31Å; G291-V293 PolarHBondContact O-N 3.21Å; V293-A295 PolarHBondContact O-N 3.43Å; V293-K296 PolarHBondContact O-N 3.27Å; V293-I297 HydrophobicContact CG1-CD1 4.15Å; V293-I297 WeakPolarHBondContact O-CG1 3.21Å; V293-I297 PolarHBondContact O-N 3.26Å; V293-I297 VanDerWaalsContact O-N 3.08Å; V293-A317 HydrophobicContact CG1-CB 4.05Å; V293-A317 WeakPolarHBondContact CG2-O 3.36Å; V293-P321 HydrophobicContact CG1-CG 4.35Å; V293-P321 HydrophobicContact CG2-CG 3.86Å; V293-S347 VanDerWaalsContact CG2-OG 3.25Å; V293-S347 WeakPolarHBondContact CG2-OG 3.2Å
294I98.8Very high98.5Very high3 Ų35.3 Ų5.32%0.0153%0.027CC..Hα-helixtrans-62.6-43.6178.7-65169.3000110.5F154 M157 I260 V263 L264 F290 G291 K296 I297 S298F154-I294 HydrophobicContact CD1-CD1 3.68Å; F154-I294 HydrophobicContact CE1-CD1 3.9Å; M157-I294 HydrophobicContact CB-CD1 4.19Å; M157-I294 HydrophobicContact CB-CG2 3.9Å; M157-I294 HydrophobicContact SD-CD1 3.97Å; I260-I294 HydrophobicContact CD1-CD1 4.25Å; I260-I294 HydrophobicContact CD1-CG1 4.01Å; I260-I294 HydrophobicContact CD1-CG2 3.87Å; V263-I294 HydrophobicContact CB-CG1 4.43Å; V263-I294 HydrophobicContact CG1-CD1 4.24Å; V263-I294 HydrophobicContact CG1-CG1 3.72Å; L264-I294 HydrophobicContact CD2-CD1 4.16Å; F290-I294 WeakPolarHBondContact O-CG1 3.48Å; F290-I294 PolarHBondContact O-N 2.84Å; G291-I294 PolarHBondContact O-N 3.34Å; I294-K296 VanDerWaalsContact C-N 3.33Å; I294-K296 PolarHBondContact O-N 2.83Å; I294-I297 PolarHBondContact O-N 3.43Å; I294-S298 WeakPolarHBondContact O-CB 3.38Å; I294-S298 PolarHBondContact O-N 2.98Å; I294-S298 PolarHBondContact O-OG 2.91Å; I294-S298 VanDerWaalsContact O-OG 3.04Å
295A98.8Very high98.4Very high2 Ų26 Ų62%0.0173%0.03CC..Hα-helixtrans-58.1-44.1177.300000111.6A126 V127 V130 G291 V293 I297 S298 N299 L351A126-A295 HydrophobicContact CB-CB 4.11Å; V127-A295 HydrophobicContact CG2-CB 4.15Å; V130-A295 HydrophobicContact CG2-CB 4.45Å; G291-A295 WeakPolarHBondContact O-CB 3.34Å; G291-A295 PolarHBondContact O-N 2.98Å; V293-A295 PolarHBondContact O-N 3.43Å; A295-I297 PolarHBondContact O-N 2.75Å; A295-S298 PolarHBondContact O-N 2.8Å; A295-N299 PolarHBondContact O-N 2.83Å; A295-N299 PolarHBondContact O-OD1 2.83Å; A295-L351 HydrophobicContact CB-CD2 4.23Å
296K98.3Very high98.3Very high4 Ų45.2 Ų5.22%0.0173%0.026CC..Hα-helixtrans-61.8-46.5175.9-173.7176.3173-136.30111.9M292 V293 I294 S298 N299 K300 D315 T316 A317 D350 L351 Y354M292-K296 PolarHBondContact O-N 3.4Å; V293-K296 PolarHBondContact O-N 3.27Å; I294-K296 VanDerWaalsContact C-N 3.33Å; I294-K296 PolarHBondContact O-N 2.83Å; K296-S298 VanDerWaalsContact C-N 3.34Å; K296-S298 PolarHBondContact O-N 3.44Å; K296-N299 PolarHBondContact O-N 3.34Å; K296-K300 WeakPolarHBondContact O-CG 3.33Å; K296-K300 PolarHBondContact O-N 3.21Å; K296-D315 IonicContact NZ-OD1 3.84Å; K296-D315 PolarHBondContact NZ-OD1 3.5Å; K296-D315 IonicContact NZ-OD2 2.67Å; K296-T316 PolarHBondContact NZ-OG1 3.39Å; K296-A317 HydrophobicContact CD-CB 4Å; K296-D350 WeakPolarHBondContact CD-OD2 3.42Å; K296-D350 VanDerWaalsContact CE-OD2 3.24Å; K296-D350 WeakPolarHBondContact CE-OD2 3.25Å; K296-D350 VanDerWaalsContact NZ-CG 3.26Å; K296-D350 IonicContact NZ-OD1 2.63Å; K296-D350 PolarHBondContact NZ-OD1 2.69Å; K296-D350 IonicContact NZ-OD2 3.57Å; K296-D350 PolarHBondContact NZ-OD2 3.42Å; K296-L351 HydrophobicContact CB-CB 4.38Å; K296-L351 HydrophobicContact CB-CD1 3.79Å; K296-L351 HydrophobicContact CG-CD1 4.31Å; K296-Y354 HydrophobicContact CG-CD1 4.28Å
297I98.3Very high98.2Very high3 Ų35.2 Ų5.22%0.0153%0.026CC..Hα-helixtrans-65.7-39.5-179.5-61.4175.8000110.8F161 H259 V263 V293 I294 A295 N299 K300 L301 A317 F318F161-I297 HydrophobicContact CE2-CG2 3.79Å; H259-I297 HydrophobicContact CB-CG2 3.77Å; V263-I297 HydrophobicContact CG2-CD1 3.34Å; V293-I297 HydrophobicContact CG1-CD1 4.15Å; V293-I297 WeakPolarHBondContact O-CG1 3.21Å; V293-I297 PolarHBondContact O-N 3.26Å; V293-I297 VanDerWaalsContact O-N 3.08Å; I294-I297 PolarHBondContact O-N 3.43Å; A295-I297 PolarHBondContact O-N 2.75Å; I297-N299 VanDerWaalsContact C-N 3.33Å; I297-N299 PolarHBondContact O-N 2.87Å; I297-K300 WeakPolarHBondContact O-CB 3.38Å; I297-K300 PolarHBondContact O-N 3.03Å; I297-L301 PolarHBondContact O-N 3.49Å; I297-A317 HydrophobicContact CG1-CB 4.36Å; I297-F318 HydrophobicContact CD1-CE1 4.12Å; I297-F318 HydrophobicContact CD1-CE2 4.12Å; I297-F318 HydrophobicContact CD1-CZ 3.58Å
298S98.5Very high98.1Very high1 Ų111.8 Ų11.81%0.0075%0.051CC..Hα-helixtrans-58.1-44.7172-63.50000111.3I294 A295 K296 K300 L301 V302I294-S298 WeakPolarHBondContact O-CB 3.38Å; I294-S298 PolarHBondContact O-N 2.98Å; I294-S298 PolarHBondContact O-OG 2.91Å; I294-S298 VanDerWaalsContact O-OG 3.04Å; A295-S298 PolarHBondContact O-N 2.8Å; K296-S298 VanDerWaalsContact C-N 3.34Å; K296-S298 PolarHBondContact O-N 3.44Å; S298-K300 VanDerWaalsContact C-N 3.34Å; S298-K300 PolarHBondContact O-N 3.17Å; S298-L301 WeakPolarHBondContact O-CA 3.49Å; S298-L301 WeakPolarHBondContact O-CB 3.32Å; S298-L301 PolarHBondContact O-N 2.83Å; S298-V302 WeakPolarHBondContact O-CG2 3.32Å; S298-V302 PolarHBondContact O-N 3.33Å
299N98.2Very high98Very high3 Ų311.5 Ų11.52%0.0165%0.05CC..Hα-helixtrans-63.9-39177.7-66.8-2.6000112G123 A126 A295 K296 I297 L301 V302 I303 Y354 C355G123-N299 WeakPolarHBondContact CA-OD1 3.33Å; G123-N299 PolarHBondContact O-ND2 2.98Å; A126-N299 VanDerWaalsContact CB-OD1 3.25Å; A126-N299 WeakPolarHBondContact CB-OD1 3.35Å; A295-N299 PolarHBondContact O-N 2.83Å; A295-N299 PolarHBondContact O-OD1 2.83Å; K296-N299 PolarHBondContact O-N 3.34Å; I297-N299 VanDerWaalsContact C-N 3.33Å; I297-N299 PolarHBondContact O-N 2.87Å; N299-L301 VanDerWaalsContact C-N 3.29Å; N299-L301 PolarHBondContact O-N 3.41Å; N299-V302 PolarHBondContact O-N 3.4Å; N299-I303 WeakPolarHBondContact O-CD1 3.48Å; N299-I303 WeakPolarHBondContact O-CG1 3.4Å; N299-I303 PolarHBondContact O-N 3.36Å; N299-I303 VanDerWaalsContact O-N 3.07Å; N299-Y354 HydrophobicContact CB-CE1 4.31Å; N299-C355 PolarHBondContact ND2-SG 3.12Å
300K97.9Very high97.8Very high37 Ų3716.7 Ų16.716%0.1617%0.074CC..Hα-helixtrans-62.3-37.5172.1-67.5-167.174.9-176.80112.1K296 I297 S298 I303 A304 L311 D315 Y354K296-K300 WeakPolarHBondContact O-CG 3.33Å; K296-K300 PolarHBondContact O-N 3.21Å; I297-K300 WeakPolarHBondContact O-CB 3.38Å; I297-K300 PolarHBondContact O-N 3.03Å; S298-K300 VanDerWaalsContact C-N 3.34Å; S298-K300 PolarHBondContact O-N 3.17Å; K300-I303 PolarHBondContact O-N 3.44Å; K300-A304 VanDerWaalsContact O-CB 3.25Å; K300-A304 WeakPolarHBondContact O-CB 3.43Å; K300-A304 PolarHBondContact O-N 2.95Å; K300-L311 HydrophobicContact CB-CD1 3.71Å; K300-D315 WeakPolarHBondContact CD-OD2 3.25Å; K300-D315 WeakPolarHBondContact CE-OD2 3.27Å; K300-D315 IonicContact NZ-OD2 2.75Å; K300-D315 PolarHBondContact NZ-OD2 2.97Å; K300-Y354 HydrophobicContact CG-CE1 3.76Å; K300-Y354 HydrophobicContact CG-CE2 4.31Å
301L98.4Very high97.6Very high0 Ų017.2 Ų17.20%08%0.077CC..Hα-helixtrans-68-41.2177.8-179.761.4000112F161 H164 W165 Y168 P256 I297 S298 N299 I303 A304 H305 L311F161-L301 HydrophobicContact CD1-CD2 4.47Å; F161-L301 HydrophobicContact CD2-CD2 4.08Å; F161-L301 HydrophobicContact CE1-CD2 4.09Å; F161-L301 HydrophobicContact CE2-CB 4.4Å; F161-L301 HydrophobicContact CE2-CD2 3.64Å; F161-L301 HydrophobicContact CG-CD2 4.47Å; F161-L301 HydrophobicContact CZ-CD2 3.67Å; H164-L301 HydrophobicContact CB-CD2 3.92Å; H164-L301 HydrophobicContact CB-CG 4.25Å; W165-L301 HydrophobicContact CB-CD2 4.1Å; Y168-L301 HydrophobicContact CD1-CD1 4.02Å; Y168-L301 HydrophobicContact CD2-CD1 4.14Å; Y168-L301 HydrophobicContact CG-CD1 3.7Å; P256-L301 HydrophobicContact CB-CD1 4.15Å; P256-L301 HydrophobicContact CB-CD2 4.45Å; P256-L301 HydrophobicContact CG-CD1 4.06Å; I297-L301 PolarHBondContact O-N 3.49Å; S298-L301 WeakPolarHBondContact O-CA 3.49Å; S298-L301 WeakPolarHBondContact O-CB 3.32Å; S298-L301 PolarHBondContact O-N 2.83Å; N299-L301 VanDerWaalsContact C-N 3.29Å; N299-L301 PolarHBondContact O-N 3.41Å; L301-I303 VanDerWaalsContact C-N 3.33Å; L301-I303 PolarHBondContact O-N 3.18Å; L301-A304 PolarHBondContact O-N 2.9Å; L301-H305 PolarHBondContact O-N 3.45Å; L301-L311 HydrophobicContact CD1-CD2 4.25Å
302V98Very high97.2Very high3 Ų322.8 Ų22.82%0.01810%0.103CC..Hα-helixtrans-55.8-50.7171.6177.90000109.8L119 H122 H164 S298 N299 A304 H305 M306L119-V302 HydrophobicContact CD1-CB 4.17Å; L119-V302 HydrophobicContact CD1-CG1 3.66Å; H122-V302 HydrophobicContact CB-CG1 4.32Å; H122-V302 HydrophobicContact CB-CG2 4.09Å; H164-V302 WeakPolarHBondContact CD2-CG2 3.2Å; S298-V302 WeakPolarHBondContact O-CG2 3.32Å; S298-V302 PolarHBondContact O-N 3.33Å; N299-V302 PolarHBondContact O-N 3.4Å; V302-A304 PolarHBondContact O-N 2.77Å; V302-H305 WeakPolarHBondContact O-CB 3.39Å; V302-H305 PolarHBondContact O-N 3.46Å; V302-M306 HydrophobicContact CG1-CG 4.41Å; V302-M306 HydrophobicContact CG1-SD 3.77Å; V302-M306 VanDerWaalsContact O-CG 3.3Å; V302-M306 WeakPolarHBondContact O-CG 3.27Å; V302-M306 PolarHBondContact O-N 3.14Å
303I97.4Very high96.7Very high7 Ų726 Ų264%0.03612%0.12CC..Hα-helixtrans-63.6-42.3179.6-69.8162.5000111.5L10 L119 N299 K300 L301 H305 M306 T307 Y354 V358L10-I303 HydrophobicContact CD2-CG2 3.53Å; L119-I303 HydrophobicContact CD1-CD1 3.94Å; L119-I303 HydrophobicContact CD1-CG1 3.4Å; L119-I303 VanDerWaalsContact CD1-CG1 3.4Å; L119-I303 HydrophobicContact CD2-CD1 4.12Å; L119-I303 HydrophobicContact CD2-CG1 3.85Å; L119-I303 HydrophobicContact CG-CG1 4.29Å; N299-I303 WeakPolarHBondContact O-CD1 3.48Å; N299-I303 WeakPolarHBondContact O-CG1 3.4Å; N299-I303 PolarHBondContact O-N 3.36Å; N299-I303 VanDerWaalsContact O-N 3.07Å; K300-I303 PolarHBondContact O-N 3.44Å; L301-I303 VanDerWaalsContact C-N 3.33Å; L301-I303 PolarHBondContact O-N 3.18Å; I303-H305 VanDerWaalsContact C-N 3.25Å; I303-H305 PolarHBondContact O-N 3.16Å; I303-M306 PolarHBondContact O-N 3.09Å; I303-T307 HydrophobicContact CG2-CG2 4.09Å; I303-T307 WeakPolarHBondContact O-CB 3.14Å; I303-T307 WeakPolarHBondContact O-CG2 3.41Å; I303-T307 PolarHBondContact O-N 3.37Å; I303-T307 PolarHBondContact O-OG1 3.23Å; I303-Y354 HydrophobicContact CD1-CE1 3.7Å; I303-Y354 WeakPolarHBondContact CD1-OH 3.39Å; I303-V358 HydrophobicContact CD1-CB 4.27Å; I303-V358 HydrophobicContact CD1-CG1 3.71Å; I303-V358 HydrophobicContact CD1-CG2 3.87Å; I303-V358 HydrophobicContact CG1-CG1 4.41Å
304A97.5Very high96.4Very high3 Ų331.4 Ų31.43%0.02516%0.155CC..Hα-helixtrans-59.3-39.7177.300000111.2Y168 K300 L301 V302 R308 S309 L311Y168-A304 HydrophobicContact CD2-CB 4.23Å; Y168-A304 HydrophobicContact CE2-CB 3.8Å; K300-A304 VanDerWaalsContact O-CB 3.25Å; K300-A304 WeakPolarHBondContact O-CB 3.43Å; K300-A304 PolarHBondContact O-N 2.95Å; L301-A304 PolarHBondContact O-N 2.9Å; V302-A304 PolarHBondContact O-N 2.77Å; A304-R308 CarbonylContact O-C 3.36Å; A304-R308 VanDerWaalsContact O-CA 3.3Å; A304-R308 WeakPolarHBondContact O-CA 3.19Å; A304-R308 PolarHBondContact O-N 3.37Å; A304-S309 WeakPolarHBondContact CB-O 3.48Å; A304-S309 PolarHBondContact O-N 3.35Å; A304-L311 HydrophobicContact CB-CB 4.45Å; A304-L311 HydrophobicContact CB-CD1 4.29Å
305H97.4Very high96.2Very high18 Ų1832.9 Ų32.98%0.08316%0.163CC..Hα-helixtrans-63-56.7173165.867.3000111.8H21 T167 Y168 L301 V302 I303 T307 R308H21-H305 AromaticContact CE1-NE2 3.63Å; T167-H305 PolarHBondContact O-ND1 3.1Å; Y168-H305 HydrophobicContact CD2-CB 3.9Å; L301-H305 PolarHBondContact O-N 3.45Å; V302-H305 WeakPolarHBondContact O-CB 3.39Å; V302-H305 PolarHBondContact O-N 3.46Å; I303-H305 VanDerWaalsContact C-N 3.25Å; I303-H305 PolarHBondContact O-N 3.16Å; H305-T307 VanDerWaalsContact C-N 3.29Å; H305-T307 PolarHBondContact O-N 3.4Å; H305-R308 PolarHBondContact O-N 3.07Å; H305-R308 VanDerWaalsContact O-N 3.1Å
306M97.1Very high96.1Very high1 Ų136.1 Ų36.11%0.00518%0.182CC..Hα-helixtrans-64.4-33.8-174.8-61.7173.376.500113L18 A115 E118 L119 V302 I303L18-M306 HydrophobicContact CD1-CB 3.73Å; L18-M306 HydrophobicContact CD1-CE 4.1Å; A115-M306 HydrophobicContact CB-CE 3.6Å; A115-M306 WeakPolarHBondContact O-CE 3.47Å; E118-M306 HydrophobicContact CB-CE 4.29Å; E118-M306 HydrophobicContact CG-CE 4.34Å; L119-M306 HydrophobicContact CB-CE 4.23Å; L119-M306 HydrophobicContact CB-SD 3.91Å; L119-M306 HydrophobicContact CD1-SD 4.38Å; V302-M306 HydrophobicContact CG1-CG 4.41Å; V302-M306 HydrophobicContact CG1-SD 3.77Å; V302-M306 VanDerWaalsContact O-CG 3.3Å; V302-M306 WeakPolarHBondContact O-CG 3.27Å; V302-M306 PolarHBondContact O-N 3.14Å; I303-M306 PolarHBondContact O-N 3.09Å
307T97Very high96Very high0 Ų036 Ų360%018%0.182CC..THydrogen-bonded Turntrans-94.73.6178.865.80000113Q14 R17 L18 I303 H305 S309Q14-T307 HydrophobicContact CB-CG2 4.06Å; R17-T307 WeakPolarHBondContact CB-O 3.39Å; R17-T307 PolarHBondContact NE-O 2.88Å; R17-T307 PolarHBondContact NH2-O 2.84Å; L18-T307 HydrophobicContact CB-CG2 4.21Å; L18-T307 HydrophobicContact CD1-CG2 3.78Å; I303-T307 HydrophobicContact CG2-CG2 4.09Å; I303-T307 WeakPolarHBondContact O-CB 3.14Å; I303-T307 WeakPolarHBondContact O-CG2 3.41Å; I303-T307 PolarHBondContact O-N 3.37Å; I303-T307 PolarHBondContact O-OG1 3.23Å; H305-T307 VanDerWaalsContact C-N 3.29Å; H305-T307 PolarHBondContact O-N 3.4Å; T307-S309 PolarHBondContact O-N 2.86Å; T307-S309 PolarHBondContact OG1-OG 3.3Å
308R96.4Very high95.9Very high138 Ų13837.2 Ų37.252%0.52119%0.187SC..THydrogen-bonded Turntrans44.748.8-175.7-57.8-176-178.5172.50.4112.4V248 A304 H305V248-R308 HydrophobicContact CB-CG 4.37Å; V248-R308 HydrophobicContact CG2-CG 4.42Å; A304-R308 CarbonylContact O-C 3.36Å; A304-R308 VanDerWaalsContact O-CA 3.3Å; A304-R308 WeakPolarHBondContact O-CA 3.19Å; A304-R308 PolarHBondContact O-N 3.37Å; H305-R308 PolarHBondContact O-N 3.07Å; H305-R308 VanDerWaalsContact O-N 3.1Å
309S96.3Very high95.9Very high11 Ų1141.3 Ų41.38%0.07721%0.208CC..  trans-118.4153.8-178.170.60000111.4Q14 Y168 A249 A304 T307Q14-S309 PolarHBondContact NE2-OG 3.18Å; Y168-S309 PolarHBondContact OH-O 3.19Å; A249-S309 VanDerWaalsContact CB-C 3.44Å; A304-S309 WeakPolarHBondContact CB-O 3.48Å; A304-S309 PolarHBondContact O-N 3.35Å; T307-S309 PolarHBondContact O-N 2.86Å; T307-S309 PolarHBondContact OG1-OG 3.3Å
310E94.5Very high95.8Very high109 Ų10941.2 Ų41.251%0.50921%0.208SC..  trans-61.7145.8175.7-47.3-169.1155.300111.7T251 H312T251-E310 HydrophobicContact CG2-CB 4.02Å; T251-E310 HydrophobicContact CG2-CG 3.52Å; E310-H312 IonicContact OE2-CE1 3.59Å
311L94.3Very high95.8Very high11 Ų1139.4 Ų39.46%0.05820%0.2CC..  trans-90.9105.5171.5-171.371.4000109.5P256 H259 K300 L301 A304P256-L311 HydrophobicContact CB-CD2 4.5Å; H259-L311 HydrophobicContact CB-CD2 4.47Å; H259-L311 PolarHBondContact CE1-O 3.37Å; H259-L311 WeakPolarHBondContact NE2-CG 3.33Å; H259-L311 PolarHBondContact NE2-O 2.8Å; K300-L311 HydrophobicContact CB-CD1 3.71Å; L301-L311 HydrophobicContact CD1-CD2 4.25Å; A304-L311 HydrophobicContact CB-CB 4.45Å; A304-L311 HydrophobicContact CB-CD1 4.29Å
312H91Very high95.8Very high118 Ų11840.5 Ų40.555%0.54621%0.211SC..  trans-78.6129.7179.1-63.3-63.5000112.4H259 E310H259-H312 VanDerWaalsContact NE2-C 3.34Å; H259-H312 PolarHBondContact NE2-O 3.28Å; E310-H312 IonicContact OE2-CE1 3.59Å
313L88.5Confident95.7Very high73 Ų7343.7 Ų43.738%0.38223%0.228SC..SBendtrans-67.6-43.4-179.4-171.869.2000114.4H259 L262 D315H259-L313 VanDerWaalsContact NE2-CA 3.25Å; H259-L313 WeakPolarHBondContact NE2-CA 3.43Å; H259-L313 PolarHBondContact NE2-N 2.83Å; L262-L313 HydrophobicContact CD2-CD1 4.39Å; L313-D315 PolarHBondContact O-N 2.88Å; L313-D315 VanDerWaalsContact O-N 3.11Å
314P92.5Very high95.7Very high115 Ų11543.4 Ų43.475%0.74723%0.227SC*.  trans-62.3117.5175.5-21.834.5000110.2
315D94.6Very high95.7Very high33 Ų3346.6 Ų46.618%0.17624%0.24CC..  trans-152.6144-176.8-165.5-87.7000111.9K296 K300 L313 A317 F318K296-D315 IonicContact NZ-OD1 3.84Å; K296-D315 PolarHBondContact NZ-OD1 3.5Å; K296-D315 IonicContact NZ-OD2 2.67Å; K300-D315 WeakPolarHBondContact CD-OD2 3.25Å; K300-D315 WeakPolarHBondContact CE-OD2 3.27Å; K300-D315 IonicContact NZ-OD2 2.75Å; K300-D315 PolarHBondContact NZ-OD2 2.97Å; L313-D315 PolarHBondContact O-N 2.88Å; L313-D315 VanDerWaalsContact O-N 3.11Å; D315-A317 PolarHBondContact O-N 2.98Å; D315-A317 WeakPolarHBondContact OD1-CB 3.43Å; D315-A317 PolarHBondContact OD1-N 2.59Å; D315-F318 HydrophobicContact CB-CD2 4.04Å; D315-F318 HydrophobicContact CB-CE2 4.18Å; D315-F318 PolarHBondContact O-N 3.49Å
316T95.6Very high95.7Very high70 Ų7049.9 Ų49.943%0.42926%0.258SS..G310 helixtrans-64.1-18.6178.6470000113.4K296 F318 I319 D350K296-T316 PolarHBondContact NZ-OG1 3.39Å; T316-F318 PolarHBondContact O-N 3.33Å; T316-F318 VanDerWaalsContact O-N 3.16Å; T316-I319 HydrophobicContact CG2-CD1 4.06Å; T316-I319 WeakPolarHBondContact O-CB 3.46Å; T316-I319 WeakPolarHBondContact O-CG1 3.32Å; T316-I319 PolarHBondContact O-N 3.4Å; T316-I319 VanDerWaalsContact O-N 3.07Å; T316-D350 WeakPolarHBondContact CB-OD1 3.35Å; T316-D350 VanDerWaalsContact OG1-CG 3.23Å; T316-D350 PolarHBondContact OG1-OD1 3.48Å; T316-D350 PolarHBondContact OG1-OD2 2.93Å
317A95.9Very high95.7Very high2 Ų250 Ų502%0.01726%0.259CS..G310 helixtrans-58.5-29.3176.500000112.3V293 K296 I297 D315 I319 P321 D350V293-A317 HydrophobicContact CG1-CB 4.05Å; V293-A317 WeakPolarHBondContact CG2-O 3.36Å; K296-A317 HydrophobicContact CD-CB 4Å; I297-A317 HydrophobicContact CG1-CB 4.36Å; D315-A317 PolarHBondContact O-N 2.98Å; D315-A317 WeakPolarHBondContact OD1-CB 3.43Å; D315-A317 PolarHBondContact OD1-N 2.59Å; A317-I319 VanDerWaalsContact C-N 3.33Å; A317-P321 WeakPolarHBondContact O-CD 3.39Å; A317-D350 WeakPolarHBondContact CA-OD2 3.38Å; A317-D350 PolarHBondContact N-OD2 3.42Å
318F96.9Very high95.6Very high28 Ų2851 Ų5112%0.12326%0.263CS..G310 helixtrans-82.6-5.8-178.3-64.7-76.1000113.8L262 V263 L266 I297 D315 T316 G322L262-F318 HydrophobicContact CB-CE1 4.18Å; L262-F318 HydrophobicContact CD2-CD1 4Å; L262-F318 HydrophobicContact CD2-CE1 3.6Å; L262-F318 HydrophobicContact CD2-CZ 3.9Å; L262-F318 HydrophobicContact CG-CD1 4.27Å; L262-F318 HydrophobicContact CG-CE1 3.77Å; L262-F318 HydrophobicContact CG-CZ 4.42Å; V263-F318 HydrophobicContact CG2-CD1 4.18Å; V263-F318 HydrophobicContact CG2-CE1 3.34Å; V263-F318 HydrophobicContact CG2-CZ 3.93Å; L266-F318 HydrophobicContact CD1-CD1 4.25Å; I297-F318 HydrophobicContact CD1-CE1 4.12Å; I297-F318 HydrophobicContact CD1-CE2 4.12Å; I297-F318 HydrophobicContact CD1-CZ 3.58Å; D315-F318 HydrophobicContact CB-CD2 4.04Å; D315-F318 HydrophobicContact CB-CE2 4.18Å; D315-F318 PolarHBondContact O-N 3.49Å; T316-F318 PolarHBondContact O-N 3.33Å; T316-F318 VanDerWaalsContact O-N 3.16Å; F318-G322 WeakPolarHBondContact O-CA 3.48Å; F318-G322 PolarHBondContact O-N 3.44Å
319I97.6Very high95.6Very high87 Ų8752 Ų5245%0.44627%0.268SS..Hα-helixtrans-62-49.1179.9-66.2172.1000110.5T316 A317 G322 L323 L346T316-I319 HydrophobicContact CG2-CD1 4.06Å; T316-I319 WeakPolarHBondContact O-CB 3.46Å; T316-I319 WeakPolarHBondContact O-CG1 3.32Å; T316-I319 PolarHBondContact O-N 3.4Å; T316-I319 VanDerWaalsContact O-N 3.07Å; A317-I319 VanDerWaalsContact C-N 3.33Å; I319-G322 PolarHBondContact O-N 2.85Å; I319-L323 HydrophobicContact CG2-CD1 4.19Å; I319-L323 HydrophobicContact CG2-CG 4.43Å; I319-L323 WeakPolarHBondContact O-CG 3.43Å; I319-L323 PolarHBondContact O-N 2.71Å; I319-L346 HydrophobicContact CG2-CD1 4.13Å
320G97.4Very high95.5Very high1 Ų157.3 Ų57.31%0.0129%0.29CS..Hα-helixtrans-58.5-58.3179.200000113.1G322 L323 L324G320-G322 VanDerWaalsContact C-N 3.26Å; G320-G322 PolarHBondContact O-N 3.22Å; G320-L323 PolarHBondContact O-N 2.94Å; G320-L324 PolarHBondContact O-N 3.3Å
321P97.5Very high95.4Very high0 Ų059.2 Ų59.20%030%0.304CS..Hα-helixtrans-55.9-37.6173.4-28.936.8000113.7L266 I270 F290 V293 A317 L324 F325L266-P321 HydrophobicContact CB-CB 4.46Å; L266-P321 HydrophobicContact CD1-CB 4.03Å; I270-P321 WeakPolarHBondContact CD1-O 3.3Å; F290-P321 HydrophobicContact CD1-CG 4.26Å; F290-P321 HydrophobicContact CE1-CB 3.81Å; F290-P321 HydrophobicContact CE1-CG 3.86Å; F290-P321 HydrophobicContact CZ-CB 4.21Å; F290-P321 HydrophobicContact CZ-CG 4.42Å; V293-P321 HydrophobicContact CG1-CG 4.35Å; V293-P321 HydrophobicContact CG2-CG 3.86Å; A317-P321 WeakPolarHBondContact O-CD 3.39Å; P321-L324 PolarHBondContact O-N 3.39Å; P321-F325 WeakPolarHBondContact O-CB 3.26Å; P321-F325 PolarHBondContact O-N 3.02Å
322G97.4Very high95.4Very high22 Ų2260 Ų6023%0.22731%0.31CS..Hα-helixtrans-63.5-41.8176.700000112.8F318 I319 G320 F325 L326F318-G322 WeakPolarHBondContact O-CA 3.48Å; F318-G322 PolarHBondContact O-N 3.44Å; I319-G322 PolarHBondContact O-N 2.85Å; G320-G322 VanDerWaalsContact C-N 3.26Å; G320-G322 PolarHBondContact O-N 3.22Å; G322-F325 PolarHBondContact O-N 3.35Å; G322-L326 WeakPolarHBondContact O-CB 3.43Å; G322-L326 VanDerWaalsContact O-CG 3.24Å; G322-L326 WeakPolarHBondContact O-CG 3.33Å; G322-L326 PolarHBondContact O-N 2.96Å
323L97.2Very high95.4Very high71 Ų7161.2 Ų61.237%0.37231%0.314SS..Hα-helixtrans-62.3-43.8175-71.6173.2000111.6I319 G320 L326 N327 V339 I342 L346I319-L323 HydrophobicContact CG2-CD1 4.19Å; I319-L323 HydrophobicContact CG2-CG 4.43Å; I319-L323 WeakPolarHBondContact O-CG 3.43Å; I319-L323 PolarHBondContact O-N 2.71Å; G320-L323 PolarHBondContact O-N 2.94Å; L323-L326 PolarHBondContact O-N 3.34Å; L323-N327 VanDerWaalsContact O-CB 3.26Å; L323-N327 WeakPolarHBondContact O-CB 3.25Å; L323-N327 PolarHBondContact O-N 3.18Å; L323-V339 HydrophobicContact CB-CG1 4.12Å; L323-I342 HydrophobicContact CD1-CG2 4.35Å; L323-L346 HydrophobicContact CD1-CD1 3.8Å
324L97.6Very high95.7Very high1 Ų161 Ų611%0.00531%0.312CS..Hα-helixtrans-61.2-48.7175.5-77.6166.6000111.7I270 L278 F290 G320 P321 L326 N327 Q328 V339 L340 A343I270-L324 HydrophobicContact CD1-CB 3.69Å; I270-L324 HydrophobicContact CG1-CB 4.35Å; I270-L324 HydrophobicContact CG2-CB 4.31Å; L278-L324 HydrophobicContact CD2-CD2 3.9Å; F290-L324 HydrophobicContact CE2-CD1 4.11Å; F290-L324 HydrophobicContact CZ-CD1 4.3Å; G320-L324 PolarHBondContact O-N 3.3Å; P321-L324 PolarHBondContact O-N 3.39Å; L324-L326 PolarHBondContact O-N 2.98Å; L324-N327 PolarHBondContact O-N 3.47Å; L324-Q328 PolarHBondContact O-N 2.85Å; L324-V339 HydrophobicContact CD2-CB 3.99Å; L324-V339 HydrophobicContact CD2-CG1 3.75Å; L324-V339 HydrophobicContact CG-CG1 4.01Å; L324-L340 HydrophobicContact CD1-CD1 3.91Å; L324-L340 HydrophobicContact CD2-CB 4.23Å; L324-A343 HydrophobicContact CD1-CB 4Å; L324-A343 HydrophobicContact CG-CB 4.32Å
325F97.4Very high95.9Very high70 Ų7059.9 Ų59.931%0.30730%0.3SS..Hα-helixtrans-60.4-46.6178.5176.2-94.8000112L266 I269 I270 P321 G322 Q328 Y329L266-F325 HydrophobicContact CD2-CB 4.18Å; L266-F325 HydrophobicContact CD2-CD2 4.04Å; L266-F325 HydrophobicContact CD2-CG 4.12Å; I269-F325 HydrophobicContact CG2-CD2 4.18Å; I269-F325 HydrophobicContact CG2-CE2 4.03Å; I270-F325 HydrophobicContact CD1-CB 4.16Å; I270-F325 HydrophobicContact CG1-CB 4.35Å; P321-F325 WeakPolarHBondContact O-CB 3.26Å; P321-F325 PolarHBondContact O-N 3.02Å; G322-F325 PolarHBondContact O-N 3.35Å; F325-Q328 PolarHBondContact O-N 3.35Å; F325-Y329 WeakPolarHBondContact O-CB 3.44Å; F325-Y329 PolarHBondContact O-N 3.43Å
326L96.9Very high96.1Very high87 Ų8758.5 Ų58.546%0.45529%0.292SS..Hα-helixtrans-65.4-40.2178.4-71.9172.2000111.6G322 L323 L324 Q328 Y329 F330G322-L326 WeakPolarHBondContact O-CB 3.43Å; G322-L326 VanDerWaalsContact O-CG 3.24Å; G322-L326 WeakPolarHBondContact O-CG 3.33Å; G322-L326 PolarHBondContact O-N 2.96Å; L323-L326 PolarHBondContact O-N 3.34Å; L324-L326 PolarHBondContact O-N 2.98Å; L326-Q328 PolarHBondContact O-N 3.16Å; L326-Y329 WeakPolarHBondContact O-CB 3.48Å; L326-Y329 PolarHBondContact O-N 2.96Å; L326-F330 WeakPolarHBondContact O-CD2 3.31Å; L326-F330 PolarHBondContact O-N 3.48Å
327N96.7Very high96.2Very high4 Ų458.1 Ų58.12%0.02129%0.286CS..Hα-helixtrans-58.3-48.5176-173.150000111L323 L324 Y329 F330 S332 F333 I334 V339L323-N327 VanDerWaalsContact O-CB 3.26Å; L323-N327 WeakPolarHBondContact O-CB 3.25Å; L323-N327 PolarHBondContact O-N 3.18Å; L324-N327 PolarHBondContact O-N 3.47Å; N327-Y329 PolarHBondContact O-N 2.85Å; N327-F330 CarbonylContact O-C 3.58Å; N327-F330 PolarHBondContact O-N 3.17Å; N327-S332 VanDerWaalsContact O-CA 3.28Å; N327-S332 WeakPolarHBondContact O-CA 3.37Å; N327-S332 PolarHBondContact O-N 3.15Å; N327-F333 VanDerWaalsContact OD1-CD1 3.24Å; N327-F333 WeakPolarHBondContact OD1-CD1 3.43Å; N327-F333 WeakPolarHBondContact OD1-CE1 3.42Å; N327-F333 PolarHBondContact OD1-N 3.17Å; N327-I334 PolarHBondContact ND2-O 3.42Å; N327-I334 PolarHBondContact OD1-N 2.82Å; N327-I334 PolarHBondContact OD1-O 3.02Å; N327-V339 HydrophobicContact CB-CG2 4.37Å
328Q96.1Very high96.3Very high21 Ų2162.5 Ų62.510%0.09831%0.308CS..Hα-helixtrans-64.3-37.7175.9-71.1-176.8-16.600113I270 S274 L324 F325 L326 F330 N331 E336I270-Q328 VanDerWaalsContact CA-OE1 3.27Å; I270-Q328 PolarHBondContact O-NE2 2.88Å; S274-Q328 VanDerWaalsContact CA-NE2 3.35Å; L324-Q328 PolarHBondContact O-N 2.85Å; F325-Q328 PolarHBondContact O-N 3.35Å; L326-Q328 PolarHBondContact O-N 3.16Å; Q328-F330 PolarHBondContact O-N 3.16Å; Q328-N331 PolarHBondContact O-N 3.24Å; Q328-N331 VanDerWaalsContact O-N 3.08Å; Q328-E336 WeakPolarHBondContact CG-OE1 3.48Å; Q328-E336 PolarHBondContact NE2-OE1 3.27Å
329Y95.1Very high96.3Very high159 Ų15961.5 Ų61.562%0.62430%0.304SS*.Hα-helixtrans-59.3-37175.7-179.2-94.9000112F325 L326 N327 N331F325-Y329 WeakPolarHBondContact O-CB 3.44Å; F325-Y329 PolarHBondContact O-N 3.43Å; L326-Y329 WeakPolarHBondContact O-CB 3.48Å; L326-Y329 PolarHBondContact O-N 2.96Å; N327-Y329 PolarHBondContact O-N 2.85Å; Y329-N331 VanDerWaalsContact C-N 3.27Å; Y329-N331 PolarHBondContact O-N 3.02Å
330F94.8Very high96.4Very high122 Ų12257.4 Ų57.454%0.53528%0.283SS..THydrogen-bonded Turntrans-91.833.3174.7-65.9-67.5000113.2L326 N327 Q328 S332 F333L326-F330 WeakPolarHBondContact O-CD2 3.31Å; L326-F330 PolarHBondContact O-N 3.48Å; N327-F330 CarbonylContact O-C 3.58Å; N327-F330 PolarHBondContact O-N 3.17Å; Q328-F330 PolarHBondContact O-N 3.16Å; F330-S332 VanDerWaalsContact C-N 3.33Å; F330-S332 PolarHBondContact O-N 3.27Å; F330-F333 HydrophobicContact CB-CD1 3.89Å; F330-F333 HydrophobicContact CB-CE1 4.4Å
331N93.1Very high96.5Very high149 Ų14963.7 Ų63.780%0.79731%0.306SS*.THydrogen-bonded Turntrans58.636.7176.7-59.9-49.2000114.7Q328 Y329 F333Q328-N331 PolarHBondContact O-N 3.24Å; Q328-N331 VanDerWaalsContact O-N 3.08Å; Y329-N331 VanDerWaalsContact C-N 3.27Å; Y329-N331 PolarHBondContact O-N 3.02Å; N331-F333 PolarHBondContact O-N 3.03Å
332S93.3Very high96.5Very high26 Ų2667.4 Ų67.418%0.18233%0.326CS..  trans54.751.4176.2-57.50000112.8N327 F330 I334 E336N327-S332 VanDerWaalsContact O-CA 3.28Å; N327-S332 WeakPolarHBondContact O-CA 3.37Å; N327-S332 PolarHBondContact O-N 3.15Å; F330-S332 VanDerWaalsContact C-N 3.33Å; F330-S332 PolarHBondContact O-N 3.27Å; S332-I334 CarbonylContact C-O 3.48Å; S332-I334 PolarHBondContact O-N 3.33Å; S332-E336 VanDerWaalsContact OG-CD 3.29Å; S332-E336 WeakPolarHBondContact OG-CG 3.44Å; S332-E336 PolarHBondContact OG-OE2 3.37Å
333F91.9Very high96.6Very high144 Ų14466.4 Ų66.463%0.63232%0.315SS*.SBendtrans-62.9-26.6-178.475.4-82.3000113.5N327 F330 N331N327-F333 VanDerWaalsContact OD1-CD1 3.24Å; N327-F333 WeakPolarHBondContact OD1-CD1 3.43Å; N327-F333 WeakPolarHBondContact OD1-CE1 3.42Å; N327-F333 PolarHBondContact OD1-N 3.17Å; F330-F333 HydrophobicContact CB-CD1 3.89Å; F330-F333 HydrophobicContact CB-CE1 4.4Å; N331-F333 PolarHBondContact O-N 3.03Å
334I95.3Very high96.6Very high69 Ų6964 Ų6435%0.35430%0.302SS..SBendtrans-104.9145.5164.4-61.6163.7000107.9N327 S332 E336 I338 V339N327-I334 PolarHBondContact ND2-O 3.42Å; N327-I334 PolarHBondContact OD1-N 2.82Å; N327-I334 PolarHBondContact OD1-O 3.02Å; S332-I334 CarbonylContact C-O 3.48Å; S332-I334 PolarHBondContact O-N 3.33Å; I334-E336 PolarHBondContact O-N 3.01Å; I334-E336 VanDerWaalsContact O-N 3.16Å; I334-I338 HydrophobicContact CG2-CB 4.47Å; I334-V339 HydrophobicContact CB-CG2 3.84Å; I334-V339 HydrophobicContact CG2-CG2 3.6Å
335D96.8Very high96.7Very high91 Ų9167.8 Ų67.849%0.48733%0.325SS..  trans-49.2120.9171.1-177.3-67.9000111.4H337 I338 V339D335-H337 PolarHBondContact O-N 3.19Å; D335-H337 WeakPolarHBondContact OD1-CA 3.36Å; D335-H337 VanDerWaalsContact OD1-CB 3.24Å; D335-H337 WeakPolarHBondContact OD1-CB 3.28Å; D335-H337 PolarHBondContact OD1-N 3.37Å; D335-I338 HydrophobicContact CB-CB 4.29Å; D335-I338 HydrophobicContact CB-CD1 3.89Å; D335-I338 HydrophobicContact CB-CG1 3.94Å; D335-I338 PolarHBondContact O-N 3.16Å; D335-I338 VanDerWaalsContact O-N 3.14Å; D335-I338 PolarHBondContact OD1-N 2.99Å; D335-I338 VanDerWaalsContact OD1-N 3.1Å; D335-V339 WeakPolarHBondContact O-CG2 3.36Å; D335-V339 PolarHBondContact O-N 2.87Å; D335-V339 VanDerWaalsContact O-N 3.09Å
336E97.3Very high96.7Very high4 Ų468 Ų682%0.01933%0.329CS..Hα-helixtrans-61.5-31-174.7-71.3-177.577.800112.8S274 S275 S276 L278 Q328 S332 I334 V339 L340S274-E336 WeakPolarHBondContact CB-OE1 3.4Å; S274-E336 PolarHBondContact OG-OE1 2.9Å; S274-E336 PolarHBondContact OG-OE2 3.23Å; S274-E336 VanDerWaalsContact OG-OE2 3.07Å; S275-E336 PolarHBondContact N-OE2 3.44Å; S275-E336 PolarHBondContact OG-OE2 3.31Å; S276-E336 WeakPolarHBondContact CB-OE2 3.16Å; S276-E336 PolarHBondContact N-OE2 3.42Å; S276-E336 PolarHBondContact OG-OE2 3.25Å; L278-E336 HydrophobicContact CB-CB 4.34Å; L278-E336 HydrophobicContact CD1-CB 3.87Å; L278-E336 HydrophobicContact CD2-CB 4.11Å; L278-E336 HydrophobicContact CG-CB 4.31Å; Q328-E336 WeakPolarHBondContact CG-OE1 3.48Å; Q328-E336 PolarHBondContact NE2-OE1 3.27Å; S332-E336 VanDerWaalsContact OG-CD 3.29Å; S332-E336 WeakPolarHBondContact OG-CG 3.44Å; S332-E336 PolarHBondContact OG-OE2 3.37Å; I334-E336 PolarHBondContact O-N 3.01Å; I334-E336 VanDerWaalsContact O-N 3.16Å; E336-V339 PolarHBondContact O-N 2.88Å; E336-L340 WeakPolarHBondContact O-CB 3.49Å; E336-L340 PolarHBondContact O-N 2.87Å
337H97.8Very high96.8Very high62 Ų6264 Ų6429%0.28731%0.309SS..Hα-helixtrans-71.9-36.5178174-140.7000111.3L278 H282 D335 L340 W341L278-H337 HydrophobicContact CD1-CB 4.18Å; H282-H337 AromaticContact CD2-CD2 3.7Å; H282-H337 AromaticContact CD2-CG 3.83Å; H282-H337 AromaticContact CE1-CD2 3.78Å; H282-H337 AromaticContact CE1-CE1 3.62Å; H282-H337 AromaticContact CE1-CG 3.91Å; H282-H337 AromaticContact CE1-ND1 3.81Å; H282-H337 AromaticContact CE1-NE2 3.62Å; H282-H337 AromaticContact CG-CD2 3.8Å; H282-H337 AromaticContact ND1-CD2 3.86Å; H282-H337 AromaticContact ND1-NE2 3.69Å; H282-H337 AromaticContact NE2-CD2 3.68Å; H282-H337 AromaticContact NE2-CE1 3.97Å; H282-H337 AromaticContact NE2-CG 3.51Å; H282-H337 AromaticContact NE2-ND1 3.7Å; H282-H337 AromaticContact NE2-NE2 3.99Å; D335-H337 PolarHBondContact O-N 3.19Å; D335-H337 WeakPolarHBondContact OD1-CA 3.36Å; D335-H337 VanDerWaalsContact OD1-CB 3.24Å; D335-H337 WeakPolarHBondContact OD1-CB 3.28Å; D335-H337 PolarHBondContact OD1-N 3.37Å; H337-L340 PolarHBondContact O-N 3.26Å; H337-W341 AromaticContact CD2-CD1 3.63Å; H337-W341 AromaticContact CD2-NE1 3.68Å; H337-W341 AromaticContact CE1-NE1 3.78Å; H337-W341 AromaticContact NE2-CD1 3.4Å; H337-W341 AromaticContact NE2-NE1 2.99Å; H337-W341 PolarHBondContact NE2-NE1 2.87Å; H337-W341 PolarHBondContact O-N 3.02Å; H337-W341 VanDerWaalsContact O-N 3.07Å
338I98.1Very high96.8Very high94 Ų9467.3 Ų67.348%0.48233%0.326SS..Hα-helixtrans-62.7-46.9170.5-61.6180000110.4I334 D335 L340 W341 I342I334-I338 HydrophobicContact CG2-CB 4.47Å; D335-I338 HydrophobicContact CB-CB 4.29Å; D335-I338 HydrophobicContact CB-CD1 3.89Å; D335-I338 HydrophobicContact CB-CG1 3.94Å; D335-I338 PolarHBondContact O-N 3.16Å; D335-I338 VanDerWaalsContact O-N 3.14Å; D335-I338 PolarHBondContact OD1-N 2.99Å; D335-I338 VanDerWaalsContact OD1-N 3.1Å; I338-L340 VanDerWaalsContact C-N 3.26Å; I338-L340 PolarHBondContact O-N 3.17Å; I338-W341 PolarHBondContact O-N 3.09Å; I338-I342 HydrophobicContact CG2-CD1 4.06Å; I338-I342 WeakPolarHBondContact O-CG1 3.34Å; I338-I342 PolarHBondContact O-N 3.12Å
339V98.3Very high96.9Very high8 Ų870.5 Ų70.55%0.04835%0.346CS..Hα-helixtrans-62.9-35.6178.2-1760000111.1L323 L324 N327 I334 D335 E336 I342 A343L323-V339 HydrophobicContact CB-CG1 4.12Å; L324-V339 HydrophobicContact CD2-CB 3.99Å; L324-V339 HydrophobicContact CD2-CG1 3.75Å; L324-V339 HydrophobicContact CG-CG1 4.01Å; N327-V339 HydrophobicContact CB-CG2 4.37Å; I334-V339 HydrophobicContact CB-CG2 3.84Å; I334-V339 HydrophobicContact CG2-CG2 3.6Å; D335-V339 WeakPolarHBondContact O-CG2 3.36Å; D335-V339 PolarHBondContact O-N 2.87Å; D335-V339 VanDerWaalsContact O-N 3.09Å; E336-V339 PolarHBondContact O-N 2.88Å; V339-I342 PolarHBondContact O-N 2.85Å; V339-A343 WeakPolarHBondContact O-CB 3.24Å; V339-A343 PolarHBondContact O-N 3.25Å
340L98.6Very high97Very high0 Ų064.1 Ų64.10%032%0.323CS..Hα-helixtrans-63.3-43.5175.5-17861000112.1L278 H282 L285 Y286 T289 L324 E336 H337 I338 A343 M344L278-L340 HydrophobicContact CD1-CB 4.14Å; L278-L340 HydrophobicContact CD1-CD2 3.83Å; L278-L340 HydrophobicContact CD2-CB 4.33Å; L278-L340 HydrophobicContact CD2-CD2 4.32Å; L278-L340 HydrophobicContact CG-CD2 4.07Å; H282-L340 HydrophobicContact CB-CD2 4.13Å; L285-L340 HydrophobicContact CB-CD2 4.28Å; L285-L340 HydrophobicContact CD2-CD2 3.72Å; L285-L340 HydrophobicContact CD2-CG 3.88Å; L285-L340 HydrophobicContact CG-CD2 3.81Å; L285-L340 HydrophobicContact CG-CG 3.91Å; Y286-L340 HydrophobicContact CD2-CD1 4.18Å; Y286-L340 HydrophobicContact CD2-CD2 4.38Å; T289-L340 HydrophobicContact CG2-CD1 4.07Å; L324-L340 HydrophobicContact CD1-CD1 3.91Å; L324-L340 HydrophobicContact CD2-CB 4.23Å; E336-L340 WeakPolarHBondContact O-CB 3.49Å; E336-L340 PolarHBondContact O-N 2.87Å; H337-L340 PolarHBondContact O-N 3.26Å; I338-L340 VanDerWaalsContact C-N 3.26Å; I338-L340 PolarHBondContact O-N 3.17Å; L340-A343 PolarHBondContact O-N 2.79Å; L340-M344 WeakPolarHBondContact O-CB 3.19Å; L340-M344 PolarHBondContact O-N 2.94Å
341W98.6Very high97.2Very high133 Ų13358.6 Ų58.650%0.50430%0.299SS..Hα-helixtrans-63.3-41.4173.7-87.1109000112.7L285 H337 I338 A343 M344 V345L285-W341 HydrophobicContact CD1-CD2 4.09Å; L285-W341 HydrophobicContact CD1-CE3 3.95Å; L285-W341 HydrophobicContact CD1-CH2 3.89Å; L285-W341 HydrophobicContact CD1-CZ2 4.02Å; L285-W341 HydrophobicContact CD1-CZ3 3.85Å; L285-W341 HydrophobicContact CD2-CD2 3.84Å; L285-W341 VanDerWaalsContact CD2-CE2 3.47Å; L285-W341 HydrophobicContact CD2-CG 4.05Å; L285-W341 HydrophobicContact CD2-CZ2 3.91Å; H337-W341 AromaticContact CD2-CD1 3.63Å; H337-W341 AromaticContact CD2-NE1 3.68Å; H337-W341 AromaticContact CE1-NE1 3.78Å; H337-W341 AromaticContact NE2-CD1 3.4Å; H337-W341 AromaticContact NE2-NE1 2.99Å; H337-W341 PolarHBondContact NE2-NE1 2.87Å; H337-W341 PolarHBondContact O-N 3.02Å; H337-W341 VanDerWaalsContact O-N 3.07Å; I338-W341 PolarHBondContact O-N 3.09Å; W341-A343 VanDerWaalsContact C-N 3.33Å; W341-A343 PolarHBondContact O-N 3.4Å; W341-M344 PolarHBondContact O-N 3.4Å; W341-V345 WeakPolarHBondContact O-CG2 3.45Å; W341-V345 PolarHBondContact O-N 3.5Å
342I98.5Very high97.3Very high79 Ų7955 Ų5541%0.40528%0.283SS..Hα-helixtrans-59.8-47.2174.3-66.9168.3000109.7L323 I338 V339 M344 V345 L346L323-I342 HydrophobicContact CD1-CG2 4.35Å; I338-I342 HydrophobicContact CG2-CD1 4.06Å; I338-I342 WeakPolarHBondContact O-CG1 3.34Å; I338-I342 PolarHBondContact O-N 3.12Å; V339-I342 PolarHBondContact O-N 2.85Å; I342-M344 PolarHBondContact O-N 3.21Å; I342-V345 PolarHBondContact O-N 3.16Å; I342-L346 HydrophobicContact CG2-CD1 3.85Å; I342-L346 HydrophobicContact CG2-CG 4.31Å; I342-L346 WeakPolarHBondContact O-CB 3.26Å; I342-L346 VanDerWaalsContact O-CG 3.27Å; I342-L346 WeakPolarHBondContact O-CG 3.42Å; I342-L346 PolarHBondContact O-N 2.83Å
343A98.6Very high97.4Very high0 Ų058.4 Ų58.40%029%0.292CS..Hα-helixtrans-59.9-44.8177.200000111.6T289 L324 V339 L340 W341 V345 L346 S347T289-A343 HydrophobicContact CG2-CB 3.84Å; L324-A343 HydrophobicContact CD1-CB 4Å; L324-A343 HydrophobicContact CG-CB 4.32Å; V339-A343 WeakPolarHBondContact O-CB 3.24Å; V339-A343 PolarHBondContact O-N 3.25Å; L340-A343 PolarHBondContact O-N 2.79Å; W341-A343 VanDerWaalsContact C-N 3.33Å; W341-A343 PolarHBondContact O-N 3.4Å; A343-V345 PolarHBondContact O-N 3.39Å; A343-L346 PolarHBondContact O-N 2.88Å; A343-S347 WeakPolarHBondContact O-CB 3.24Å; A343-S347 PolarHBondContact O-N 2.87Å; A343-S347 PolarHBondContact O-OG 3.35Å; A343-S347 VanDerWaalsContact O-OG 3.06Å
344M98.6Very high97.7Very high22 Ų2253 Ų5311%0.10827%0.267CS..Hα-helixtrans-56.8-50.7176.1-18055.2-171.100111.9L285 L288 T289 M292 L340 W341 I342 L346 S347 L348L285-M344 HydrophobicContact CD1-CB 4.07Å; L285-M344 HydrophobicContact CD1-CG 3.92Å; L288-M344 HydrophobicContact CB-CE 4Å; L288-M344 HydrophobicContact CB-SD 4.05Å; T289-M344 HydrophobicContact CG2-CB 4.44Å; T289-M344 WeakPolarHBondContact OG1-CB 3.41Å; M292-M344 HydrophobicContact CE-CE 4.16Å; M292-M344 HydrophobicContact CG-CE 4.21Å; M292-M344 HydrophobicContact CG-SD 4.33Å; L340-M344 WeakPolarHBondContact O-CB 3.19Å; L340-M344 PolarHBondContact O-N 2.94Å; W341-M344 PolarHBondContact O-N 3.4Å; I342-M344 PolarHBondContact O-N 3.21Å; M344-L346 PolarHBondContact O-N 3.06Å; M344-S347 PolarHBondContact O-N 3.33Å; M344-L348 WeakPolarHBondContact O-CB 3.28Å; M344-L348 PolarHBondContact O-N 2.84Å
345V98.6Very high97.7Very high80 Ų8051.5 Ų51.549%0.48526%0.262SS..Hα-helixtrans-63.3-44.2-179.5172.60000110.8W341 I342 A343 L348 V349W341-V345 WeakPolarHBondContact O-CG2 3.45Å; W341-V345 PolarHBondContact O-N 3.5Å; I342-V345 PolarHBondContact O-N 3.16Å; A343-V345 PolarHBondContact O-N 3.39Å; V345-L348 PolarHBondContact O-N 3.33Å; V345-V349 HydrophobicContact CG1-CG2 4.31Å; V345-V349 WeakPolarHBondContact O-CB 3.41Å; V345-V349 VanDerWaalsContact O-CG2 3.27Å; V345-V349 WeakPolarHBondContact O-CG2 3.29Å; V345-V349 PolarHBondContact O-N 2.96Å
346L98.3Very high97.7Very high74 Ų7450.5 Ų50.539%0.38726%0.26SS..Hα-helixtrans-61.2-48.1177.2-71.7175.4000111.5I319 L323 I342 A343 M344 L348 V349 D350I319-L346 HydrophobicContact CG2-CD1 4.13Å; L323-L346 HydrophobicContact CD1-CD1 3.8Å; I342-L346 HydrophobicContact CG2-CD1 3.85Å; I342-L346 HydrophobicContact CG2-CG 4.31Å; I342-L346 WeakPolarHBondContact O-CB 3.26Å; I342-L346 VanDerWaalsContact O-CG 3.27Å; I342-L346 WeakPolarHBondContact O-CG 3.42Å; I342-L346 PolarHBondContact O-N 2.83Å; A343-L346 PolarHBondContact O-N 2.88Å; M344-L346 PolarHBondContact O-N 3.06Å; L346-L348 VanDerWaalsContact C-N 3.35Å; L346-L348 PolarHBondContact O-N 3.48Å; L346-V349 PolarHBondContact O-N 3.15Å; L346-D350 WeakPolarHBondContact O-CB 3.49Å; L346-D350 PolarHBondContact O-N 3.5Å
347S98.3Very high97.6Very high4 Ų451.4 Ų51.43%0.02827%0.27CS..Hα-helixtrans-63-40.1179-65.60000112.2V293 A343 M344 L351V293-S347 VanDerWaalsContact CG2-OG 3.25Å; V293-S347 WeakPolarHBondContact CG2-OG 3.2Å; A343-S347 WeakPolarHBondContact O-CB 3.24Å; A343-S347 PolarHBondContact O-N 2.87Å; A343-S347 PolarHBondContact O-OG 3.35Å; A343-S347 VanDerWaalsContact O-OG 3.06Å; M344-S347 PolarHBondContact O-N 3.33Å; S347-L351 VanDerWaalsContact O-CB 3.28Å; S347-L351 WeakPolarHBondContact O-CB 3.35Å; S347-L351 PolarHBondContact O-N 2.86Å
348L98.1Very high97.5Very high73 Ų7348.5 Ų48.538%0.38226%0.257SS..Hα-helixtrans-65.3-50.9176.5-179.163.1000111.6M292 M344 V345 L346 D350 L351 T352M292-L348 HydrophobicContact CE-CD1 4.46Å; M292-L348 HydrophobicContact SD-CD1 4.34Å; M344-L348 WeakPolarHBondContact O-CB 3.28Å; M344-L348 PolarHBondContact O-N 2.84Å; V345-L348 PolarHBondContact O-N 3.33Å; L346-L348 VanDerWaalsContact C-N 3.35Å; L346-L348 PolarHBondContact O-N 3.48Å; L348-D350 VanDerWaalsContact C-N 3.3Å; L348-D350 PolarHBondContact O-N 2.92Å; L348-L351 PolarHBondContact O-N 3.25Å; L348-T352 WeakPolarHBondContact O-CB 3.14Å; L348-T352 PolarHBondContact O-N 3.37Å; L348-T352 PolarHBondContact O-OG1 3.45Å
349V97.8Very high97.5Very high87 Ų8744.8 Ų44.853%0.52724%0.239SC..Hα-helixtrans-60.1-43.3179.1169.40000110.8V345 L346 R353V345-V349 HydrophobicContact CG1-CG2 4.31Å; V345-V349 WeakPolarHBondContact O-CB 3.41Å; V345-V349 VanDerWaalsContact O-CG2 3.27Å; V345-V349 WeakPolarHBondContact O-CG2 3.29Å; V345-V349 PolarHBondContact O-N 2.96Å; L346-V349 PolarHBondContact O-N 3.15Å; V349-R353 WeakPolarHBondContact O-CB 3.47Å; V349-R353 PolarHBondContact O-N 2.87Å
350D97Very high97.3Very high25 Ų2549.3 Ų49.313%0.13426%0.262CS..Hα-helixtrans-65.7-43.6-179.6-175.350.7000112.2K296 T316 A317 L346 L348 Y354K296-D350 WeakPolarHBondContact CD-OD2 3.42Å; K296-D350 VanDerWaalsContact CE-OD2 3.24Å; K296-D350 WeakPolarHBondContact CE-OD2 3.25Å; K296-D350 VanDerWaalsContact NZ-CG 3.26Å; K296-D350 IonicContact NZ-OD1 2.63Å; K296-D350 PolarHBondContact NZ-OD1 2.69Å; K296-D350 IonicContact NZ-OD2 3.57Å; K296-D350 PolarHBondContact NZ-OD2 3.42Å; T316-D350 WeakPolarHBondContact CB-OD1 3.35Å; T316-D350 VanDerWaalsContact OG1-CG 3.23Å; T316-D350 PolarHBondContact OG1-OD1 3.48Å; T316-D350 PolarHBondContact OG1-OD2 2.93Å; A317-D350 WeakPolarHBondContact CA-OD2 3.38Å; A317-D350 PolarHBondContact N-OD2 3.42Å; L346-D350 WeakPolarHBondContact O-CB 3.49Å; L346-D350 PolarHBondContact O-N 3.5Å; L348-D350 VanDerWaalsContact C-N 3.3Å; L348-D350 PolarHBondContact O-N 2.92Å; D350-Y354 VanDerWaalsContact O-CB 3.27Å; D350-Y354 WeakPolarHBondContact O-CB 3.29Å; D350-Y354 PolarHBondContact O-N 2.89Å
351L97.8Very high97.2Very high7 Ų750.5 Ų50.54%0.03727%0.268CS..Hα-helixtrans-62-52.6172.9172.863.4000111.6V127 M292 A295 K296 S347 L348 R353 Y354 C355V127-L351 HydrophobicContact CG2-CD2 3.93Å; M292-L351 HydrophobicContact CB-CD2 4.36Å; M292-L351 HydrophobicContact SD-CD2 3.67Å; A295-L351 HydrophobicContact CB-CD2 4.23Å; K296-L351 HydrophobicContact CB-CB 4.38Å; K296-L351 HydrophobicContact CB-CD1 3.79Å; K296-L351 HydrophobicContact CG-CD1 4.31Å; S347-L351 VanDerWaalsContact O-CB 3.28Å; S347-L351 WeakPolarHBondContact O-CB 3.35Å; S347-L351 PolarHBondContact O-N 2.86Å; L348-L351 PolarHBondContact O-N 3.25Å; L351-R353 VanDerWaalsContact C-N 3.31Å; L351-R353 PolarHBondContact O-N 3.38Å; L351-Y354 PolarHBondContact O-N 2.85Å; L351-Y354 VanDerWaalsContact O-N 3.17Å; L351-C355 WeakPolarHBondContact O-CB 3.28Å; L351-C355 PolarHBondContact O-N 3.4Å; L351-C355 PolarHBondContact O-SG 3.08Å
352T96.7Very high97.1Very high74 Ų7444.2 Ų44.245%0.45424%0.244SC..Hα-helixtrans-60.5-42.7-178.6-58.80000111.3L348 T356L348-T352 WeakPolarHBondContact O-CB 3.14Å; L348-T352 PolarHBondContact O-N 3.37Å; L348-T352 PolarHBondContact O-OG1 3.45Å; T352-T356 VanDerWaalsContact O-CB 3.24Å; T352-T356 WeakPolarHBondContact O-CB 3.3Å; T352-T356 PolarHBondContact O-N 3.33Å; T352-T356 PolarHBondContact O-OG1 2.84Å
353R95.5Very high97Very high97 Ų9740.8 Ų40.837%0.36623%0.227SC..Hα-helixtrans-60.9-47.9175.3175.9-176.9159.5-170.3-10111.1V349 L351 G357V349-R353 WeakPolarHBondContact O-CB 3.47Å; V349-R353 PolarHBondContact O-N 2.87Å; L351-R353 VanDerWaalsContact C-N 3.31Å; L351-R353 PolarHBondContact O-N 3.38Å; R353-G357 PolarHBondContact O-N 3.32Å
354Y96.8Very high96.8Very high30 Ų3044.1 Ų44.112%0.11825%0.251CS..Hα-helixtrans-60.8-52.9-179.8-179.2-106.6000111.5P9 K296 N299 K300 I303 D350 L351 T356 G357 V358P9-Y354 HydrophobicContact CB-CD2 4.19Å; P9-Y354 HydrophobicContact CB-CE2 4Å; K296-Y354 HydrophobicContact CG-CD1 4.28Å; N299-Y354 HydrophobicContact CB-CE1 4.31Å; K300-Y354 HydrophobicContact CG-CE1 3.76Å; K300-Y354 HydrophobicContact CG-CE2 4.31Å; I303-Y354 HydrophobicContact CD1-CE1 3.7Å; I303-Y354 WeakPolarHBondContact CD1-OH 3.39Å; D350-Y354 VanDerWaalsContact O-CB 3.27Å; D350-Y354 WeakPolarHBondContact O-CB 3.29Å; D350-Y354 PolarHBondContact O-N 2.89Å; L351-Y354 PolarHBondContact O-N 2.85Å; L351-Y354 VanDerWaalsContact O-N 3.17Å; Y354-T356 PolarHBondContact O-N 3.42Å; Y354-G357 PolarHBondContact O-N 3.28Å; Y354-V358 HydrophobicContact CD2-CG2 4.22Å; Y354-V358 HydrophobicContact CE1-CG2 4.19Å; Y354-V358 HydrophobicContact CE2-CG2 3.82Å; Y354-V358 WeakPolarHBondContact O-CG2 3.24Å; Y354-V358 PolarHBondContact O-N 3.4Å
355C96.4Very high96.7Very high37 Ų3746 Ų4625%0.2526%0.26CS..Hα-helixtrans-59.9-46.3179.7-70.90000112N299 L351 V358 C359N299-C355 PolarHBondContact ND2-SG 3.12Å; L351-C355 WeakPolarHBondContact O-CB 3.28Å; L351-C355 PolarHBondContact O-N 3.4Å; L351-C355 PolarHBondContact O-SG 3.08Å; C355-V358 PolarHBondContact O-N 3.44Å; C355-C359 WeakPolarHBondContact O-CB 3.45Å; C355-C359 PolarHBondContact O-N 3.38Å; C355-C359 PolarHBondContact O-SG 3.23Å
356T95.8Very high96.5Very high71 Ų7144.7 Ų44.744%0.43625%0.249SC..Hα-helixtrans-63.3-46.2178.8-55.20000111.2T352 Y354 V358 C359 L360T352-T356 VanDerWaalsContact O-CB 3.24Å; T352-T356 WeakPolarHBondContact O-CB 3.3Å; T352-T356 PolarHBondContact O-N 3.33Å; T352-T356 PolarHBondContact O-OG1 2.84Å; Y354-T356 PolarHBondContact O-N 3.42Å; T356-V358 PolarHBondContact O-N 2.79Å; T356-C359 PolarHBondContact O-N 2.9Å; T356-L360 HydrophobicContact CG2-CD1 3.81Å; T356-L360 HydrophobicContact CG2-CG 4.3Å; T356-L360 WeakPolarHBondContact O-CB 3.18Å; T356-L360 VanDerWaalsContact O-CG 3.29Å; T356-L360 WeakPolarHBondContact O-CG 3.4Å; T356-L360 PolarHBondContact O-N 3.44Å
357G95.7Very high96.3Very high23 Ų2351.4 Ų51.424%0.23727%0.27CS..Hα-helixtrans-60-46.8179.100000112.1R353 Y354 Q361R353-G357 PolarHBondContact O-N 3.32Å; Y354-G357 PolarHBondContact O-N 3.28Å; G357-Q361 VanDerWaalsContact O-CB 3.23Å; G357-Q361 WeakPolarHBondContact O-CB 3.47Å; G357-Q361 PolarHBondContact O-N 3.06Å
358V96.3Very high96.1Very high1 Ų153.3 Ų53.31%0.00628%0.279CS..Hα-helixtrans-65.1-46.3179.3173.60000110.9P9 L10 L119 I303 Y354 C355 T356 L360 Q361 I362P9-V358 HydrophobicContact CB-CG2 3.63Å; P9-V358 HydrophobicContact CG-CB 4.34Å; P9-V358 HydrophobicContact CG-CG2 3.58Å; L10-V358 HydrophobicContact CD1-CG1 4.13Å; L10-V358 HydrophobicContact CG-CG2 4.5Å; L119-V358 HydrophobicContact CD2-CG1 3.45Å; L119-V358 VanDerWaalsContact CD2-CG1 3.45Å; I303-V358 HydrophobicContact CD1-CB 4.27Å; I303-V358 HydrophobicContact CD1-CG1 3.71Å; I303-V358 HydrophobicContact CD1-CG2 3.87Å; I303-V358 HydrophobicContact CG1-CG1 4.41Å; Y354-V358 HydrophobicContact CD2-CG2 4.22Å; Y354-V358 HydrophobicContact CE1-CG2 4.19Å; Y354-V358 HydrophobicContact CE2-CG2 3.82Å; Y354-V358 WeakPolarHBondContact O-CG2 3.24Å; Y354-V358 PolarHBondContact O-N 3.4Å; C355-V358 PolarHBondContact O-N 3.44Å; T356-V358 PolarHBondContact O-N 2.79Å; V358-L360 PolarHBondContact O-N 3.47Å; V358-Q361 PolarHBondContact O-N 3.04Å; V358-I362 HydrophobicContact CG1-CD1 3.44Å; V358-I362 VanDerWaalsContact CG1-CD1 3.44Å; V358-I362 HydrophobicContact CG1-CG1 4.15Å; V358-I362 WeakPolarHBondContact O-CB 3.28Å; V358-I362 VanDerWaalsContact O-CG1 3.31Å; V358-I362 WeakPolarHBondContact O-CG1 3.36Å; V358-I362 PolarHBondContact O-N 3.3Å
359C96.6Very high95.9Very high15 Ų1555.8 Ų55.810%0.10129%0.289CS..Hα-helixtrans-60.3-46.6-179.5-68.90000111.7L116 C355 T356 A363L116-C359 HydrophobicContact CD1-CB 4.13Å; C355-C359 WeakPolarHBondContact O-CB 3.45Å; C355-C359 PolarHBondContact O-N 3.38Å; C355-C359 PolarHBondContact O-SG 3.23Å; T356-C359 PolarHBondContact O-N 2.9Å; C359-A363 WeakPolarHBondContact O-CB 3.41Å; C359-A363 PolarHBondContact O-N 2.8Å
360L95.9Very high95.8Very high104 Ų10452.4 Ų52.455%0.54527%0.268SS..Hα-helixtrans-67-40.3179.4-68.5177.2000112.2T356 V358 S364 V370T356-L360 HydrophobicContact CG2-CD1 3.81Å; T356-L360 HydrophobicContact CG2-CG 4.3Å; T356-L360 WeakPolarHBondContact O-CB 3.18Å; T356-L360 VanDerWaalsContact O-CG 3.29Å; T356-L360 WeakPolarHBondContact O-CG 3.4Å; T356-L360 PolarHBondContact O-N 3.44Å; V358-L360 PolarHBondContact O-N 3.47Å; L360-S364 WeakPolarHBondContact O-CB 3.37Å; L360-S364 PolarHBondContact O-N 2.61Å; L360-V370 HydrophobicContact CD2-CG2 4.48Å
361Q96Very high95.8Very high24 Ų2456.6 Ų56.611%0.11229%0.285CS..Hα-helixtrans-65.9-46.5179.6-166-17615.900111.3E8 P9 L10 L15 G357 V358 S364 H365E8-Q361 PolarHBondContact OE2-NE2 3.22Å; P9-Q361 VanDerWaalsContact CD-OE1 3.27Å; L10-Q361 VanDerWaalsContact CB-OE1 3.28Å; L10-Q361 PolarHBondContact O-NE2 3.47Å; L15-Q361 HydrophobicContact CD1-CG 4.14Å; L15-Q361 HydrophobicContact CD2-CG 4.36Å; G357-Q361 VanDerWaalsContact O-CB 3.23Å; G357-Q361 WeakPolarHBondContact O-CB 3.47Å; G357-Q361 PolarHBondContact O-N 3.06Å; V358-Q361 PolarHBondContact O-N 3.04Å; Q361-S364 PolarHBondContact O-N 3.22Å; Q361-H365 WeakPolarHBondContact O-CB 3.41Å; Q361-H365 PolarHBondContact O-N 3.49Å
362I96.3Very high95.6Very high1 Ų159.4 Ų59.41%0.00531%0.305CS..Hα-helixtrans-65.4-44.5176.7-66.2172.9000110.7L10 L15 L18 L116 L119 V358 S364 H365 L366L10-I362 HydrophobicContact CD1-CD1 3.92Å; L10-I362 HydrophobicContact CD1-CG1 3.74Å; L15-I362 HydrophobicContact CD2-CG1 4.14Å; L18-I362 HydrophobicContact CD2-CB 4.2Å; L18-I362 HydrophobicContact CD2-CD1 3.66Å; L18-I362 HydrophobicContact CD2-CG1 3.64Å; L18-I362 HydrophobicContact CD2-CG2 3.53Å; L116-I362 HydrophobicContact CB-CG2 3.8Å; L116-I362 HydrophobicContact CD1-CB 4.18Å; L116-I362 HydrophobicContact CD1-CG2 4.11Å; L116-I362 HydrophobicContact CG-CG2 4.4Å; L119-I362 HydrophobicContact CD2-CD1 3.46Å; L119-I362 VanDerWaalsContact CD2-CD1 3.46Å; V358-I362 HydrophobicContact CG1-CD1 3.44Å; V358-I362 VanDerWaalsContact CG1-CD1 3.44Å; V358-I362 HydrophobicContact CG1-CG1 4.15Å; V358-I362 WeakPolarHBondContact O-CB 3.28Å; V358-I362 VanDerWaalsContact O-CG1 3.31Å; V358-I362 WeakPolarHBondContact O-CG1 3.36Å; V358-I362 PolarHBondContact O-N 3.3Å; I362-S364 VanDerWaalsContact C-N 3.3Å; I362-S364 PolarHBondContact O-N 3.18Å; I362-H365 PolarHBondContact O-N 3.46Å; I362-H365 VanDerWaalsContact O-N 3.12Å; I362-L366 HydrophobicContact CG2-CD1 3.63Å; I362-L366 HydrophobicContact CG2-CG 4.08Å; I362-L366 WeakPolarHBondContact O-CB 3.39Å; I362-L366 WeakPolarHBondContact O-CG 3.43Å; I362-L366 PolarHBondContact O-N 2.76Å
363A95.7Very high95.3Very high7 Ų757.7 Ų57.76%0.05829%0.293CS..Hα-helixtrans-57.9-44.1177.400000111.6L116 C359 R367 I368 V370L116-A363 HydrophobicContact CD2-CB 3.79Å; C359-A363 WeakPolarHBondContact O-CB 3.41Å; C359-A363 PolarHBondContact O-N 2.8Å; A363-R367 WeakPolarHBondContact O-CA 3.43Å; A363-R367 PolarHBondContact O-N 2.74Å; A363-I368 HydrophobicContact CB-CG1 4.36Å; A363-I368 WeakPolarHBondContact CB-O 3.33Å; A363-I368 PolarHBondContact O-N 3.39Å; A363-V370 HydrophobicContact CB-CG2 3.69Å
364S95.3Very high94.6Very high71 Ų7155.9 Ų55.950%0.49729%0.293SS..Hα-helixtrans-63.9-40.4175.1-1750000112.3L360 Q361 I362 R367L360-S364 WeakPolarHBondContact O-CB 3.37Å; L360-S364 PolarHBondContact O-N 2.61Å; Q361-S364 PolarHBondContact O-N 3.22Å; I362-S364 VanDerWaalsContact C-N 3.3Å; I362-S364 PolarHBondContact O-N 3.18Å; S364-R367 PolarHBondContact O-N 2.9Å
365H95.4Very high93.4Very high62 Ų6259.9 Ų59.929%0.28732%0.322SS..Hα-helixtrans-66.5-48.2179.9-174.863.7000111.7L15 E19 Q361 I362 R367L15-H365 HydrophobicContact CD1-CB 4.41Å; L15-H365 HydrophobicContact CD2-CB 4.12Å; L15-H365 PolarHBondContact O-NE2 3.07Å; E19-H365 IonicContact OE1-CD2 3.41Å; E19-H365 IonicContact OE1-CE1 3.13Å; E19-H365 IonicContact OE1-NE2 2.88Å; E19-H365 PolarHBondContact OE1-NE2 2.92Å; E19-H365 VanDerWaalsContact OE1-NE2 3.13Å; Q361-H365 WeakPolarHBondContact O-CB 3.41Å; Q361-H365 PolarHBondContact O-N 3.49Å; I362-H365 PolarHBondContact O-N 3.46Å; I362-H365 VanDerWaalsContact O-N 3.12Å; H365-R367 VanDerWaalsContact C-N 3.26Å; H365-R367 PolarHBondContact O-N 3.4Å
366L94.1Very high91.7Very high51 Ų5164 Ų6427%0.26734%0.338SS..Hα-helixtrans-79-5.1179.2-60.7-178.9000113.6E19 I362 I368E19-L366 HydrophobicContact CG-CD2 4.23Å; I362-L366 HydrophobicContact CG2-CD1 3.63Å; I362-L366 HydrophobicContact CG2-CG 4.08Å; I362-L366 WeakPolarHBondContact O-CB 3.39Å; I362-L366 WeakPolarHBondContact O-CG 3.43Å; I362-L366 PolarHBondContact O-N 2.76Å; L366-I368 VanDerWaalsContact C-N 3.31Å; L366-I368 HydrophobicContact CB-CD1 4.11Å; L366-I368 HydrophobicContact CB-CG1 4.05Å; L366-I368 HydrophobicContact CB-CG2 4.48Å; L366-I368 HydrophobicContact CD1-CD1 4.1Å; L366-I368 PolarHBondContact O-N 3.25Å
367R94.6Very high89.6Confident216 Ų21666.4 Ų66.482%0.81536%0.355SS*.THydrogen-bonded Turntrans56.540.4-176.9-53.8-179.9-177.6178.10.8113.5A363 S364 H365A363-R367 WeakPolarHBondContact O-CA 3.43Å; A363-R367 PolarHBondContact O-N 2.74Å; S364-R367 PolarHBondContact O-N 2.9Å; H365-R367 VanDerWaalsContact C-N 3.26Å; H365-R367 PolarHBondContact O-N 3.4Å
368I94.3Very high87.1Confident43 Ų4372.4 Ų72.422%0.22138%0.382CS..  trans-114.1160.6176.461.2-178.8000110.7L116 A363 L366L116-I368 HydrophobicContact CB-CD1 3.87Å; L116-I368 HydrophobicContact CD2-CD1 3.67Å; L116-I368 HydrophobicContact CD2-CG1 4.06Å; L116-I368 HydrophobicContact CG-CD1 4.4Å; A363-I368 HydrophobicContact CB-CG1 4.36Å; A363-I368 WeakPolarHBondContact CB-O 3.33Å; A363-I368 PolarHBondContact O-N 3.39Å; L366-I368 VanDerWaalsContact C-N 3.31Å; L366-I368 HydrophobicContact CB-CD1 4.11Å; L366-I368 HydrophobicContact CB-CG1 4.05Å; L366-I368 HydrophobicContact CB-CG2 4.48Å; L366-I368 HydrophobicContact CD1-CD1 4.1Å; L366-I368 PolarHBondContact O-N 3.25Å
369Q94.3Very high84.6Confident126 Ų12676.9 Ų76.959%0.58942%0.419SS*.  trans-96.5140.8171.6-61.1-60.7-45.700109.5S372 T374Q369-S372 WeakPolarHBondContact CB-O 3.48Å; Q369-T374 PolarHBondContact N-OG1 2.85Å
370V95.3Very high81.9Confident16 Ų1683.9 Ų83.910%0.09745%0.45CS..SBendtrans-67.6-41.6-176.6-175.70000111.5N53 L116 F120 L360 A363N53-V370 VanDerWaalsContact CB-O 3.31Å; N53-V370 WeakPolarHBondContact CB-O 3.49Å; N53-V370 PolarHBondContact ND2-O 3.29Å; L116-V370 HydrophobicContact CD2-CG2 4.3Å; F120-V370 HydrophobicContact CD2-CG1 4.35Å; F120-V370 HydrophobicContact CE2-CG1 4.14Å; L360-V370 HydrophobicContact CD2-CG2 4.48Å; A363-V370 HydrophobicContact CB-CG2 3.69Å
371F96.7Very high79.3Confident112 Ų11290.8 Ų90.849%0.49147%0.469SS..SBendtrans-121.919.3-173-59.2-60.5000113.6N53 I57 F120N53-F371 HydrophobicContact CB-CD1 4.14Å; N53-F371 HydrophobicContact CB-CE1 4.19Å; I57-F371 HydrophobicContact CB-CE1 4.37Å; I57-F371 HydrophobicContact CG2-CE1 3.94Å; F120-F371 HydrophobicContact CE1-CE1 4.33Å; F120-F371 AromaticContact CE2-CE1 3.99Å; F120-F371 HydrophobicContact CE2-CE1 3.99Å; F120-F371 AromaticContact CE2-CZ 3.95Å; F120-F371 HydrophobicContact CE2-CZ 3.95Å; F120-F371 AromaticContact CZ-CE1 3.58Å; F120-F371 HydrophobicContact CZ-CE1 3.58Å; F120-F371 AromaticContact CZ-CZ 3.82Å; F120-F371 HydrophobicContact CZ-CZ 3.82Å
372S93.4Very high76.6Confident66 Ų66100 Ų10046%0.46252%0.519SS..SBendtrans-140.4146.1174.9-177.20000109Q369 T374Q369-S372 WeakPolarHBondContact CB-O 3.48Å; S372-T374 PolarHBondContact O-N 3.46Å
373I90.6Very high75.6Confident39 Ų39105 Ų10520%0.254%0.544CS..PPolyproline II helixtrans-78.5121.4173.2-65.9163.6000107.8T48 A51 T110 P375T48-I373 WeakPolarHBondContact O-CD1 3.47Å; A51-I373 HydrophobicContact CB-CG1 4.3Å; T110-I373 HydrophobicContact CG2-CD1 3.78Å; I373-P375 WeakPolarHBondContact O-CD 3.42Å
374T80.6Confident74.5Confident59 Ų59110.2 Ų110.236%0.36257%0.57SS.*PPolyproline II helixtrans-66.2125.6173.7-54.10000108.5Q369 S372 Q376Q369-T374 PolarHBondContact N-OG1 2.85Å; S372-T374 PolarHBondContact O-N 3.46Å; T374-Q376 PolarHBondContact O-N 3.42Å
375P71.8Confident73.3Confident113 Ų113112.3 Ų112.373%0.73457%0.574SS**PPolyproline II helixtrans-58.5124.4174.1-19.630.3000109.1I373I373-P375 WeakPolarHBondContact O-CD 3.42Å
376Q61.2Low72Confident123 Ų123115.3 Ų115.358%0.57559%0.591SS**PPolyproline II helixtrans-66.3130.6169-66.2-150.6-2.800107.8N111 T374 N378N111-Q376 PolarHBondContact ND2-NE2 3.21Å; N111-Q376 PolarHBondContact O-NE2 2.85Å; T374-Q376 PolarHBondContact O-N 3.42Å; Q376-N378 PolarHBondContact O-N 2.91Å
377P52.3Low70.7Confident123 Ų123119.3 Ų119.380%0.79961%0.611SS**PPolyproline II helixtrans-57.3121.4172.722.7-29000106.9A379P377-A379 PolarHBondContact O-N 2.75Å
378N43.6Very low69.1Low148 Ų148112.9 Ų112.979%0.79160%0.598SS**  trans-34.6111.9-174.5-70.7-35.3000111.1Q376 H380Q376-N378 PolarHBondContact O-N 2.91Å; N378-H380 PolarHBondContact O-N 3.38Å
379A43.4Very low67.3Low95 Ų95117.9 Ų117.979%0.78563%0.625SS**  trans-55.2114.1151.100000104.8P377 R381P377-A379 PolarHBondContact O-N 2.75Å; A379-R381 PolarHBondContact O-N 3.08Å; A379-R381 VanDerWaalsContact O-N 3.08Å
380H39Very low65.2Low162 Ų162117.2 Ų117.275%0.7563%0.627SS**  trans-43.1119.6-179.5-79.8-91.6000109.4N378 D382N378-H380 PolarHBondContact O-N 3.38Å; H380-D382 PolarHBondContact O-N 3.34Å
381R41.5Very low62.7Low250 Ų250125.7 Ų125.794%0.94367%0.671SS**  trans-68.891.5157.8-76.4-178.2174.5-176.4-2.1105.2A379A379-R381 PolarHBondContact O-N 3.08Å; A379-R381 VanDerWaalsContact O-N 3.08Å
382D38.4Very low59.6Low218 Ų218126.9 Ų126.9100%1.16669%0.688SS**  trans-78.60156.3-71.6-17.3000109.3H380H380-D382 PolarHBondContact O-N 3.34Å

Retrieved 382 of 382 residues in 121.4 ms (Link to these results)

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