A0A096MLK8_PAPAN Loading...

Lysophosphatidic acid receptor 4

AlphaFold DB , UniProt , Accession A0A096MLK8, Species PAPAN (Papio anubis, Olive baboon), Gene LPAR4, Length 370 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M33.8Very low31.4Very low250 Ų250171.3 Ų171.3100%1.23282%0.818SS**  0116.90-146.1158.7-177.500106.6
2G35.3Very low31.1Very low75 Ų75169.5 Ų169.577%0.77381%0.808SS**  trans80.491.7179.300000114.1
3D29.8Very low31Very low125 Ų125165.9 Ų165.967%0.66880%0.797SS**  68.1113.961.4-155.613.7000113.6
4R33.8Very low30.9Very low235 Ų235162.1 Ų162.189%0.88780%0.796SS**  trans-169.7102.4135.3-103.1175.3-131.1-129.85.4110.4
5R31Very low31Very low197 Ų197162.5 Ų162.574%0.74380%0.803SS**  trans-60137.5154.5-85.5171.9-85.5-170.8-6.3109.8
6F32.1Very low31.1Very low183 Ų183159.1 Ų159.180%0.80380%0.8SS**  trans-136.8117.6145.6-104.9-89.6000108
7I30.9Very low31.4Very low137 Ų137156.7 Ų156.770%0.70380%0.802SS**  trans-93.8120.1167.1-66.2178.8000104.5F9I7-F9 HydrophobicContact CG2-CD2 4.47Å
8D30Very low31.6Very low153 Ų153157.2 Ų157.282%0.81881%0.805SS**  trans-119.8124.3162.6-99.5-29.5000108.9
9F31.9Very low31.7Very low171 Ų171161.3 Ų161.375%0.7581%0.81SS**  trans-110.6112.8173.1-122.6-84.3000106.4I7I7-F9 HydrophobicContact CG2-CD2 4.47Å
10Q28.9Very low31.9Very low187 Ų187159.5 Ų159.587%0.87481%0.81SS**  trans-142.5134.6158.3-85.6-58.6-7500111.6
11F28.6Very low32Very low171 Ų171163.8 Ų163.875%0.7582%0.816SS**  trans-68.2152.6175.6-114.2-114.7000112.1
12Q26.7Very low32.2Very low150 Ų150159.4 Ų159.470%0.70180%0.797SS**  147.5117.1120.8-157.589.91900112.1
13D31Very low32.3Very low123 Ų123158.9 Ų158.966%0.65879%0.792SS**  trans25.6131148.1-53.2-39.9000121.6
14S29Very low32.8Very low113 Ų113160.3 Ų160.379%0.7980%0.799SS**  157119.7110.4-66.30000112.6
15N32.5Very low33.2Very low168 Ų168153.4 Ų153.490%0.89879%0.792SS**  trans29.2109.9150.8-78.6-17.8000120
16S32.3Very low33.8Very low108 Ų108150 Ų15076%0.75579%0.793SS**  trans-148.5129.1133.458.50000111.5L18S16-L18 PolarHBondContact O-N 3.3Å
17S36.8Very low34.6Very low118 Ų118144.9 Ų144.983%0.82579%0.785SS**  trans-58.8120.4177.950.40000112.8
18L35.3Very low35.2Very low166 Ų166144.6 Ų144.687%0.86979%0.785SS**  trans-126.1118.1155.8-99.399.1000110.6S16S16-L18 PolarHBondContact O-N 3.3Å
19R32.8Very low36.4Very low235 Ų235144.7 Ų144.789%0.88779%0.785SS**  trans-51.7139.1178.3-61.7176.9-175.5-1610.5111.2R21R19-R21 PolarHBondContact O-N 3.02Å
20P35.2Very low37.9Very low125 Ų125140 Ų14081%0.81277%0.771SS**  trans-68.3129.5166.320.5-15.6000108.6L22P20-L22 PolarHBondContact O-N 3.35Å
21R34.9Very low40.2Very low249 Ų249132.4 Ų132.494%0.9474%0.738SS**  trans-55107.5169.1-74.1-175.9176.8-154.8-0.2108R19 G23R19-R21 PolarHBondContact O-N 3.02Å; R21-G23 PolarHBondContact O-N 3.44Å
22L37.5Very low42.5Very low159 Ų159130.4 Ų130.483%0.83273%0.734SS**  trans-62.2102.6165.1-165.272.2000106P20 N24P20-L22 PolarHBondContact O-N 3.35Å; L22-N24 PolarHBondContact O-N 3.46Å; L22-N24 VanDerWaalsContact O-N 3.1Å
23G37.4Very low45.1Very low64 Ų64124.7 Ų124.766%0.6671%0.709SS**  trans-55118.9169.100000107.4R21 A25R21-G23 PolarHBondContact O-N 3.44Å; G23-A25 PolarHBondContact O-N 2.92Å
24N40.3Very low47.6Very low155 Ų155124.4 Ų124.483%0.82971%0.708SS**  trans-62.481.7164.3-93.8-9.8000107.4L22 T26L22-N24 PolarHBondContact O-N 3.46Å; L22-N24 VanDerWaalsContact O-N 3.1Å; N24-T26 PolarHBondContact O-N 2.9Å
25A43Very low50.1Low89 Ų89122.2 Ų122.274%0.73669%0.687SS**  trans-69.892.7153.100000105.1G23 A27G23-A25 PolarHBondContact O-N 2.92Å; A25-A27 PolarHBondContact O-N 3.25Å
26T42.5Very low52.7Low125 Ų125115.7 Ų115.777%0.76766%0.655SS**  trans-54.392.1151.623.60000106N24 N28N24-T26 PolarHBondContact O-N 2.9Å; T26-N28 VanDerWaalsContact C-N 3.3Å; T26-N28 PolarHBondContact O-N 3.17Å
27A48.8Very low55.5Low76 Ų76113.9 Ų113.963%0.62863%0.633SS**  trans-56.8104.5165.200000105.1A25 N29A25-A27 PolarHBondContact O-N 3.25Å; A27-N29 PolarHBondContact O-N 2.98Å
28N43.5Very low58.1Low132 Ų132109.6 Ų109.671%0.70660%0.6SS**  trans-51.8109.1171.6-95.8-18.1000106.4T26 T30T26-N28 VanDerWaalsContact C-N 3.3Å; T26-N28 PolarHBondContact O-N 3.17Å; N28-T30 PolarHBondContact O-N 3.5Å
29N55.9Low60.8Low154 Ų154103.1 Ų103.182%0.82456%0.564SS**  trans-68.529-179.6-84-16.3000112.4A27A27-N29 PolarHBondContact O-N 2.98Å
30T63.8Low63.7Low73 Ų7396.5 Ų96.545%0.44855%0.546SS..  trans-96.5113.2178.7570000108.8N28 I32N28-T30 PolarHBondContact O-N 3.5Å; T30-I32 HydrophobicContact CG2-CD1 4.48Å; T30-I32 PolarHBondContact O-N 2.84Å
31C76.2Confident66.6Low27 Ų2793.3 Ų93.318%0.18252%0.522CS..  trans-79.251.5177.4-55.50000111.4C283 E286 K290C31-C283 WeakPolarHBondContact CA-SG 3.42Å; C31-C283 HydrophobicContact CB-CB 4.3Å; C31-C283 WeakPolarHBondContact CB-SG 3.13Å; C31-C283 WeakPolarHBondContact SG-CA 3.39Å; C31-C283 WeakPolarHBondContact SG-CB 3.08Å; C31-C283 CovalentContact SG-SG 2.04Å; C31-C283 PolarHBondContact SG-SG 2.97Å; C31-E286 HydrophobicContact CB-CG 4.45Å; C31-K290 PolarHBondContact O-NZ 2.79Å
32I77.6Confident69.4Low129 Ų12982 Ų8266%0.66248%0.48SS*.  trans-82.1130.3179-59.5170000107.8T30T30-I32 HydrophobicContact CG2-CD1 4.48Å; T30-I32 PolarHBondContact O-N 2.84Å
33V81.3Confident72.2Confident31 Ų3174.4 Ų74.419%0.18844%0.44CS..  trans-128.3130.6173.2179.60000105.9D35 R287 K290 I291V33-D35 PolarHBondContact O-N 2.91Å; V33-R287 HydrophobicContact CG2-CB 3.93Å; V33-R287 HydrophobicContact CG2-CG 3.54Å; V33-K290 HydrophobicContact CB-CD 4.35Å; V33-K290 HydrophobicContact CG2-CD 4.28Å; V33-I291 HydrophobicContact CG1-CD1 4.27Å; V33-I291 HydrophobicContact CG1-CG1 3.86Å
34D82.1Confident75.1Confident117 Ų11773.8 Ų73.863%0.62643%0.429SS*.  trans-71.7108.8165.6179.413.7000108.5S36D34-S36 VanDerWaalsContact CG-OG 3.31Å; D34-S36 WeakPolarHBondContact OD1-CB 3.49Å; D34-S36 PolarHBondContact OD1-N 3.26Å; D34-S36 PolarHBondContact OD1-OG 3.47Å; D34-S36 PolarHBondContact OD2-OG 3.27Å
35D82.9Confident77.8Confident66 Ų6667.8 Ų67.835%0.35340%0.398SS..  trans-9810.6179.671.1-23.8000112.3V33 F37 K38V33-D35 PolarHBondContact O-N 2.91Å; D35-F37 PolarHBondContact O-N 2.99Å; D35-F37 VanDerWaalsContact O-N 3.13Å; D35-K38 HydrophobicContact CB-CD 4.22Å; D35-K38 VanDerWaalsContact O-CB 3.3Å; D35-K38 WeakPolarHBondContact O-CB 3.49Å; D35-K38 VanDerWaalsContact O-CD 3.31Å; D35-K38 WeakPolarHBondContact O-CD 3.4Å; D35-K38 WeakPolarHBondContact O-CG 3.37Å; D35-K38 PolarHBondContact O-N 3.43Å; D35-K38 WeakPolarHBondContact OD2-CE 3.23Å; D35-K38 IonicContact OD2-NZ 2.72Å; D35-K38 PolarHBondContact OD2-NZ 3.14Å
36S86.1Confident80.4Confident32 Ų3264.2 Ų64.222%0.22437%0.366CS..THydrogen-bonded Turntrans-61.4-24.2-176.667.70000114D34 K38 Y39D34-S36 VanDerWaalsContact CG-OG 3.31Å; D34-S36 WeakPolarHBondContact OD1-CB 3.49Å; D34-S36 PolarHBondContact OD1-N 3.26Å; D34-S36 PolarHBondContact OD1-OG 3.47Å; D34-S36 PolarHBondContact OD2-OG 3.27Å; S36-K38 PolarHBondContact O-N 2.89Å; S36-Y39 WeakPolarHBondContact O-CD2 3.41Å; S36-Y39 PolarHBondContact O-N 3.48Å
37F91.6Very high83Confident70 Ų7059.9 Ų59.931%0.30734%0.34SS..Hα-helixtrans-58.6-28.7174.580.3-89.2000112.7D35 Y39 N40 L41 I291 P294 I295D35-F37 PolarHBondContact O-N 2.99Å; D35-F37 VanDerWaalsContact O-N 3.13Å; F37-Y39 PolarHBondContact O-N 3.05Å; F37-N40 PolarHBondContact O-N 3.06Å; F37-L41 HydrophobicContact CD2-CD2 4.36Å; F37-L41 HydrophobicContact CE2-CD2 4.08Å; F37-L41 WeakPolarHBondContact O-CB 3.3Å; F37-L41 PolarHBondContact O-N 3.19Å; F37-I291 HydrophobicContact CZ-CG2 4.33Å; F37-P294 HydrophobicContact CE2-CG 3.93Å; F37-P294 HydrophobicContact CZ-CG 3.65Å; F37-I295 HydrophobicContact CE2-CG1 4.29Å
38K91.7Very high85.3Confident28 Ų2859.7 Ų59.712%0.12233%0.332CS..Hα-helixtrans-58.2-34.7-177.779.2-167.3175.1-179.20112D35 S36 N42 E190 P294D35-K38 HydrophobicContact CB-CD 4.22Å; D35-K38 VanDerWaalsContact O-CB 3.3Å; D35-K38 WeakPolarHBondContact O-CB 3.49Å; D35-K38 VanDerWaalsContact O-CD 3.31Å; D35-K38 WeakPolarHBondContact O-CD 3.4Å; D35-K38 WeakPolarHBondContact O-CG 3.37Å; D35-K38 PolarHBondContact O-N 3.43Å; D35-K38 WeakPolarHBondContact OD2-CE 3.23Å; D35-K38 IonicContact OD2-NZ 2.72Å; D35-K38 PolarHBondContact OD2-NZ 3.14Å; S36-K38 PolarHBondContact O-N 2.89Å; K38-N42 WeakPolarHBondContact O-CB 3.34Å; K38-N42 PolarHBondContact O-N 2.97Å; K38-N42 PolarHBondContact O-ND2 3.39Å; K38-N42 PolarHBondContact O-OD1 3.26Å; K38-E190 IonicContact NZ-OE2 3.99Å; K38-E190 PolarHBondContact NZ-OE2 2.95Å; K38-P294 HydrophobicContact CB-CB 3.66Å; K38-P294 HydrophobicContact CB-CG 3.94Å
39Y91.7Very high87.8Confident30 Ų3053.4 Ų53.412%0.11830%0.298CS..Hα-helixtrans-65.5-49.6-177.8-68.4-65.1000111S36 F37 G43 Y98 N99 R102 E190S36-Y39 WeakPolarHBondContact O-CD2 3.41Å; S36-Y39 PolarHBondContact O-N 3.48Å; F37-Y39 PolarHBondContact O-N 3.05Å; Y39-G43 PolarHBondContact O-N 2.7Å; Y39-Y98 HydrophobicContact CE1-CE1 4.38Å; Y39-N99 WeakPolarHBondContact CB-O 3.3Å; Y39-N99 WeakPolarHBondContact O-CB 3.21Å; Y39-R102 HydrophobicContact CD1-CG 4.37Å; Y39-R102 HydrophobicContact CD2-CG 4.43Å; Y39-R102 HydrophobicContact CG-CG 4.23Å; Y39-E190 PolarHBondContact OH-OE2 3.42Å
40N94.3Very high89.8Confident96 Ų9648.9 Ų48.951%0.51327%0.271SS..Hα-helixtrans-66.9-42.1178.3-66.8-13.3000111.5F37 A44F37-N40 PolarHBondContact O-N 3.06Å; N40-A44 WeakPolarHBondContact O-CB 3.29Å; N40-A44 PolarHBondContact O-N 3.17Å
41L95.3Very high91.4Very high57 Ų5750 Ų5030%0.29827%0.273SS..Hα-helixtrans-60.4-54.7177.7176.364.4000111.6F37 G43 A44 V45 I295F37-L41 HydrophobicContact CD2-CD2 4.36Å; F37-L41 HydrophobicContact CE2-CD2 4.08Å; F37-L41 WeakPolarHBondContact O-CB 3.3Å; F37-L41 PolarHBondContact O-N 3.19Å; L41-G43 VanDerWaalsContact C-N 3.35Å; L41-G43 PolarHBondContact O-N 3.41Å; L41-A44 PolarHBondContact O-N 3.45Å; L41-V45 HydrophobicContact CD1-CG2 4.11Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.21Å; L41-I295 HydrophobicContact CD2-CG1 3.86Å
42N94.3Very high92.3Very high11 Ų1152.6 Ų52.66%0.05929%0.285CS..Hα-helixtrans-61.7-43.8-179.9-67.9-13.2000110.9K38 A44 V45 Y46 N99 C298K38-N42 WeakPolarHBondContact O-CB 3.34Å; K38-N42 PolarHBondContact O-N 2.97Å; K38-N42 PolarHBondContact O-ND2 3.39Å; K38-N42 PolarHBondContact O-OD1 3.26Å; N42-A44 PolarHBondContact O-N 3.31Å; N42-V45 PolarHBondContact O-N 3.06Å; N42-Y46 HydrophobicContact CB-CD2 4.29Å; N42-Y46 HydrophobicContact CB-CE2 3.97Å; N42-Y46 WeakPolarHBondContact O-CB 3.45Å; N42-Y46 WeakPolarHBondContact O-CD2 3.12Å; N42-Y46 PolarHBondContact O-N 3.41Å; N42-N99 HydrophobicContact CB-CB 4.49Å; N42-N99 VanDerWaalsContact CB-OD1 3.29Å; N42-N99 WeakPolarHBondContact CB-OD1 3.38Å; N42-N99 PolarHBondContact ND2-OD1 3.29Å; N42-C298 PolarHBondContact OD1-SG 3.42Å
43G96.2Very high93.1Very high0 Ų046.5 Ų46.50%025%0.253CS..Hα-helixtrans-57.6-46.3177.800000112.3Y39 L41 S47Y39-G43 PolarHBondContact O-N 2.7Å; L41-G43 VanDerWaalsContact C-N 3.35Å; L41-G43 PolarHBondContact O-N 3.41Å; G43-S47 WeakPolarHBondContact O-CB 3.42Å; G43-S47 PolarHBondContact O-N 3.28Å; G43-S47 VanDerWaalsContact O-N 3.16Å; G43-S47 PolarHBondContact O-OG 3.46Å
44A97.2Very high93.8Very high52 Ų5247.7 Ų47.743%0.4326%0.258SS..Hα-helixtrans-65.9-50.7177.600000112.3N40 L41 N42 S47 V48N40-A44 WeakPolarHBondContact O-CB 3.29Å; N40-A44 PolarHBondContact O-N 3.17Å; L41-A44 PolarHBondContact O-N 3.45Å; N42-A44 PolarHBondContact O-N 3.31Å; A44-S47 WeakPolarHBondContact O-CB 3.32Å; A44-S47 PolarHBondContact O-N 3.21Å; A44-V48 PolarHBondContact O-N 2.95Å
45V97.2Very high94.4Very high28 Ų2847 Ų4717%0.1725%0.254CS..Hα-helixtrans-64.9-44.9-178175.10000111.2L41 N42 S47 V48 V49 C298 L302L41-V45 HydrophobicContact CD1-CG2 4.11Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.21Å; N42-V45 PolarHBondContact O-N 3.06Å; V45-S47 PolarHBondContact O-N 3.43Å; V45-V48 PolarHBondContact O-N 2.82Å; V45-V48 VanDerWaalsContact O-N 3.12Å; V45-V49 HydrophobicContact CG1-CG2 4.05Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 2.63Å; V45-C298 HydrophobicContact CB-CB 4.16Å; V45-C298 HydrophobicContact CG1-CB 3.88Å; V45-C298 HydrophobicContact CG2-CB 4.06Å; V45-L302 HydrophobicContact CG1-CD2 4.47Å; V45-L302 HydrophobicContact CG1-CG 4.49Å
46Y97.3Very high94.7Very high14 Ų1445.7 Ų45.76%0.05525%0.248CC..Hα-helixtrans-62.8-32177.8-66.4-11.9000112.3N42 F50 L92 K95 L297 T301N42-Y46 HydrophobicContact CB-CD2 4.29Å; N42-Y46 HydrophobicContact CB-CE2 3.97Å; N42-Y46 WeakPolarHBondContact O-CB 3.45Å; N42-Y46 WeakPolarHBondContact O-CD2 3.12Å; N42-Y46 PolarHBondContact O-N 3.41Å; Y46-F50 WeakPolarHBondContact O-CB 3.25Å; Y46-F50 PolarHBondContact O-N 3Å; Y46-L92 HydrophobicContact CD1-CD2 4.19Å; Y46-L92 HydrophobicContact CD2-CD2 4.27Å; Y46-L92 HydrophobicContact CG-CD2 3.93Å; Y46-K95 HydrophobicContact CD2-CB 3.94Å; Y46-K95 HydrophobicContact CE2-CB 4.16Å; Y46-L297 WeakPolarHBondContact OH-CD2 3.47Å; Y46-T301 HydrophobicContact CD1-CG2 4.45Å; Y46-T301 HydrophobicContact CE1-CG2 3.75Å
47S97.8Very high95.1Very high34 Ų3444.1 Ų44.124%0.23824%0.238CC..Hα-helixtrans-64.7-43.6173.7-58.80000111.7G43 A44 V45 F50 I51 I96G43-S47 WeakPolarHBondContact O-CB 3.42Å; G43-S47 PolarHBondContact O-N 3.28Å; G43-S47 VanDerWaalsContact O-N 3.16Å; G43-S47 PolarHBondContact O-OG 3.46Å; A44-S47 WeakPolarHBondContact O-CB 3.32Å; A44-S47 PolarHBondContact O-N 3.21Å; V45-S47 PolarHBondContact O-N 3.43Å; S47-F50 PolarHBondContact O-N 3.46Å; S47-I51 WeakPolarHBondContact O-CG1 3.2Å; S47-I51 PolarHBondContact O-N 3.19Å; S47-I51 VanDerWaalsContact O-N 3.14Å; S47-I96 WeakPolarHBondContact OG-CG2 3.4Å
48V97.1Very high95.1Very high73 Ų7343.3 Ų43.344%0.44224%0.24SC..Hα-helixtrans-64.2-47.9175.2174.60000110.9A44 V45 F50 I51 L52A44-V48 PolarHBondContact O-N 2.95Å; V45-V48 PolarHBondContact O-N 2.82Å; V45-V48 VanDerWaalsContact O-N 3.12Å; V48-F50 VanDerWaalsContact C-N 3.27Å; V48-F50 PolarHBondContact O-N 3.03Å; V48-I51 PolarHBondContact O-N 2.92Å; V48-L52 HydrophobicContact CG1-CD1 3.7Å; V48-L52 HydrophobicContact CG1-CG 4.25Å; V48-L52 WeakPolarHBondContact O-CB 3.46Å; V48-L52 WeakPolarHBondContact O-CG 3.39Å; V48-L52 PolarHBondContact O-N 3.13Å
49V96.9Very high95Very high0 Ų045 Ų450%025%0.253CS..Hα-helixtrans-61.5-38178.3175.90000111V45 G53 V89 L92 T301 L302 C304V45-V49 HydrophobicContact CG1-CG2 4.05Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 2.63Å; V49-G53 VanDerWaalsContact O-CA 3.25Å; V49-G53 WeakPolarHBondContact O-CA 3.4Å; V49-G53 PolarHBondContact O-N 2.74Å; V49-V89 HydrophobicContact CG1-CG2 4.35Å; V49-L92 HydrophobicContact CB-CD1 3.98Å; V49-L92 HydrophobicContact CG1-CD1 3.63Å; V49-T301 WeakPolarHBondContact CG1-O 3.33Å; V49-L302 HydrophobicContact CG2-CD2 3.82Å; V49-L302 HydrophobicContact CG2-CG 4.41Å; V49-C304 HydrophobicContact CG1-CB 4.34Å
50F97.7Very high94.8Very high58 Ų5843.7 Ų43.725%0.25425%0.248SC..Hα-helixtrans-61.1-53.4176.8172.8-109.6000111.5Y46 S47 V48 L54 V89 L92 P93 I96Y46-F50 WeakPolarHBondContact O-CB 3.25Å; Y46-F50 PolarHBondContact O-N 3Å; S47-F50 PolarHBondContact O-N 3.46Å; V48-F50 VanDerWaalsContact C-N 3.27Å; V48-F50 PolarHBondContact O-N 3.03Å; F50-L54 HydrophobicContact CE2-CD2 4.03Å; F50-L54 HydrophobicContact CZ-CD2 3.92Å; F50-L54 WeakPolarHBondContact O-CB 3.33Å; F50-L54 PolarHBondContact O-N 3.13Å; F50-V89 HydrophobicContact CD2-CG1 3.77Å; F50-V89 WeakPolarHBondContact CD2-O 3.44Å; F50-V89 HydrophobicContact CE2-CG1 4.41Å; F50-L92 HydrophobicContact CB-CB 4.14Å; F50-L92 HydrophobicContact CB-CD1 4.14Å; F50-L92 HydrophobicContact CD2-CB 4.35Å; F50-P93 HydrophobicContact CD2-CG 3.85Å; F50-P93 HydrophobicContact CE1-CG 4.43Å; F50-P93 HydrophobicContact CE2-CG 3.49Å; F50-P93 VanDerWaalsContact CE2-CG 3.49Å; F50-P93 HydrophobicContact CG-CG 4.47Å; F50-P93 HydrophobicContact CZ-CG 3.81Å; F50-I96 HydrophobicContact CB-CD1 4.03Å; F50-I96 HydrophobicContact CG-CD1 4.47Å
51I96.5Very high94.6Very high97 Ų9741 Ų4150%0.49723%0.233SC..Hα-helixtrans-64-53.4-177.4-64.5168.8000110.5S47 V48 I55S47-I51 WeakPolarHBondContact O-CG1 3.2Å; S47-I51 PolarHBondContact O-N 3.19Å; S47-I51 VanDerWaalsContact O-N 3.14Å; V48-I51 PolarHBondContact O-N 2.92Å; I51-I55 HydrophobicContact CG2-CD1 3.98Å; I51-I55 WeakPolarHBondContact O-CD1 3.36Å; I51-I55 VanDerWaalsContact O-CG1 3.24Å; I51-I55 WeakPolarHBondContact O-CG1 3.37Å; I51-I55 PolarHBondContact O-N 3.06Å
52L95.6Very high94.2Very high82 Ų8243.8 Ų43.843%0.42924%0.243SC..Hα-helixtrans-66.5-52.6-176.5-65.3-178.1000110.8V48 L54 I55 T56V48-L52 HydrophobicContact CG1-CD1 3.7Å; V48-L52 HydrophobicContact CG1-CG 4.25Å; V48-L52 WeakPolarHBondContact O-CB 3.46Å; V48-L52 WeakPolarHBondContact O-CG 3.39Å; V48-L52 PolarHBondContact O-N 3.13Å; L52-L54 VanDerWaalsContact C-N 3.32Å; L52-L54 PolarHBondContact O-N 3.26Å; L52-I55 PolarHBondContact O-N 3.32Å; L52-T56 WeakPolarHBondContact O-CB 3.47Å; L52-T56 WeakPolarHBondContact O-CG2 3.24Å; L52-T56 PolarHBondContact O-N 3.5Å; L52-T56 PolarHBondContact O-OG1 3.12Å
53G95.4Very high93.7Very high0 Ų043.5 Ų43.50%024%0.242CC..Hα-helixtrans-61.1-38.6-177.300000112.8V49 N57V49-G53 VanDerWaalsContact O-CA 3.25Å; V49-G53 WeakPolarHBondContact O-CA 3.4Å; V49-G53 PolarHBondContact O-N 2.74Å; G53-N57 VanDerWaalsContact O-CB 3.22Å; G53-N57 WeakPolarHBondContact O-CB 3.26Å; G53-N57 PolarHBondContact O-N 2.67Å; G53-N57 PolarHBondContact O-ND2 3.01Å
54L95.4Very high93.2Very high56 Ų5643.6 Ų43.629%0.29324%0.242SC..Hα-helixtrans-65.7-49.8178.2-176.465.8000110.5F50 L52 S58 L86 V89F50-L54 HydrophobicContact CE2-CD2 4.03Å; F50-L54 HydrophobicContact CZ-CD2 3.92Å; F50-L54 WeakPolarHBondContact O-CB 3.33Å; F50-L54 PolarHBondContact O-N 3.13Å; L52-L54 VanDerWaalsContact C-N 3.32Å; L52-L54 PolarHBondContact O-N 3.26Å; L54-S58 WeakPolarHBondContact O-CB 3.22Å; L54-S58 PolarHBondContact O-N 3.36Å; L54-S58 PolarHBondContact O-OG 2.71Å; L54-L86 HydrophobicContact CD1-CD2 4.16Å; L54-V89 HydrophobicContact CB-CG1 3.82Å; L54-V89 HydrophobicContact CD1-CG1 4.49Å
55I93.6Very high92.4Very high102 Ų10244.3 Ų44.352%0.52324%0.244SC..Hα-helixtrans-62-53.4-179.3-66.4168.4000109.7I51 L52 V59I51-I55 HydrophobicContact CG2-CD1 3.98Å; I51-I55 WeakPolarHBondContact O-CD1 3.36Å; I51-I55 VanDerWaalsContact O-CG1 3.24Å; I51-I55 WeakPolarHBondContact O-CG1 3.37Å; I51-I55 PolarHBondContact O-N 3.06Å; L52-I55 PolarHBondContact O-N 3.32Å; I55-V59 WeakPolarHBondContact O-CB 3.31Å; I55-V59 VanDerWaalsContact O-CG2 3.26Å; I55-V59 WeakPolarHBondContact O-CG2 3.32Å; I55-V59 PolarHBondContact O-N 2.96Å
56T90.8Very high91.6Very high39 Ų3950.4 Ų50.424%0.23927%0.268CS..Hα-helixtrans-71.1-41.3-169.960.30000112.6L52 S60 P308L52-T56 WeakPolarHBondContact O-CB 3.47Å; L52-T56 WeakPolarHBondContact O-CG2 3.24Å; L52-T56 PolarHBondContact O-N 3.5Å; L52-T56 PolarHBondContact O-OG1 3.12Å; T56-S60 VanDerWaalsContact O-CB 3.32Å; T56-S60 WeakPolarHBondContact O-CB 3.39Å; T56-S60 PolarHBondContact O-N 3.43Å; T56-S60 PolarHBondContact O-OG 2.84Å; T56-P308 HydrophobicContact CG2-CG 3.91Å; T56-P308 WeakPolarHBondContact OG1-CG 3.28Å
57N93.1Very high90.3Very high0 Ų056.5 Ų56.50%029%0.291CS..Hα-helixtrans-76.1-31.5179.7-65.6-65.4000112G53 S60 L61 D85 L86 C304 Y311G53-N57 VanDerWaalsContact O-CB 3.22Å; G53-N57 WeakPolarHBondContact O-CB 3.26Å; G53-N57 PolarHBondContact O-N 2.67Å; G53-N57 PolarHBondContact O-ND2 3.01Å; N57-S60 PolarHBondContact O-N 3.35Å; N57-L61 WeakPolarHBondContact O-CB 3.1Å; N57-L61 PolarHBondContact O-N 2.88Å; N57-D85 HydrophobicContact CB-CB 4.47Å; N57-L86 HydrophobicContact CB-CD1 4.28Å; N57-L86 HydrophobicContact CB-CD2 3.78Å; N57-L86 HydrophobicContact CB-CG 3.65Å; N57-C304 PolarHBondContact ND2-O 3.33Å; N57-Y311 PolarHBondContact OD1-OH 3.34Å
58S92.4Very high89Confident52 Ų5255.7 Ų55.736%0.36428%0.284SS..Hα-helixtrans-65.7-46.1174.2-61.60000111.4L54 S60 L61 F62 L86L54-S58 WeakPolarHBondContact O-CB 3.22Å; L54-S58 PolarHBondContact O-N 3.36Å; L54-S58 PolarHBondContact O-OG 2.71Å; S58-S60 VanDerWaalsContact C-N 3.29Å; S58-S60 PolarHBondContact O-N 2.87Å; S58-L61 PolarHBondContact O-N 3.43Å; S58-F62 WeakPolarHBondContact O-CB 3.37Å; S58-F62 PolarHBondContact O-N 3.41Å; S58-L86 WeakPolarHBondContact OG-CD2 3.46Å
59V89.4Confident87.2Confident64 Ų6459.9 Ų59.939%0.38830%0.296SS..Hα-helixtrans-60.5-42.9174.8170.40000110.3I55 F62 V63 F322I55-V59 WeakPolarHBondContact O-CB 3.31Å; I55-V59 VanDerWaalsContact O-CG2 3.26Å; I55-V59 WeakPolarHBondContact O-CG2 3.32Å; I55-V59 PolarHBondContact O-N 2.96Å; V59-F62 PolarHBondContact O-N 2.91Å; V59-V63 VanDerWaalsContact O-CG2 3.32Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.45Å; V59-F322 HydrophobicContact CG1-CZ 4.44Å
60S88.4Confident85.5Confident2 Ų262.8 Ų62.81%0.01431%0.31CS..Hα-helixtrans-63.4-49.2-179.8-58.90000111.9T56 N57 S58 F62 V63 F64 Y311T56-S60 VanDerWaalsContact O-CB 3.32Å; T56-S60 WeakPolarHBondContact O-CB 3.39Å; T56-S60 PolarHBondContact O-N 3.43Å; T56-S60 PolarHBondContact O-OG 2.84Å; N57-S60 PolarHBondContact O-N 3.35Å; S58-S60 VanDerWaalsContact C-N 3.29Å; S58-S60 PolarHBondContact O-N 2.87Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 2.86Å; S60-V63 PolarHBondContact O-N 2.99Å; S60-F64 WeakPolarHBondContact O-CD2 3.33Å; S60-F64 WeakPolarHBondContact O-CG 3.36Å; S60-F64 PolarHBondContact O-N 3.24Å; S60-Y311 VanDerWaalsContact OG-CD2 3.31Å; S60-Y311 WeakPolarHBondContact OG-CD2 3.17Å
61L89.3Confident84Confident39 Ų3968.2 Ų68.220%0.20433%0.329CS..Hα-helixtrans-61.6-41.9177.8-16671.1000111.4N57 S58 V63 F64 C65 T79 A82 L86N57-L61 WeakPolarHBondContact O-CB 3.1Å; N57-L61 PolarHBondContact O-N 2.88Å; S58-L61 PolarHBondContact O-N 3.43Å; L61-V63 PolarHBondContact O-N 2.93Å; L61-F64 PolarHBondContact O-N 3.4Å; L61-C65 WeakPolarHBondContact O-CB 3.4Å; L61-C65 PolarHBondContact O-N 3.42Å; L61-C65 PolarHBondContact O-SG 3.28Å; L61-C65 VanDerWaalsContact O-SG 3.35Å; L61-T79 HydrophobicContact CD1-CG2 3.71Å; L61-A82 HydrophobicContact CD1-CB 4.43Å; L61-L86 HydrophobicContact CB-CD1 4.09Å; L61-L86 HydrophobicContact CD2-CD1 3.69Å; L61-L86 HydrophobicContact CG-CD1 4.48Å
62F87.4Confident83.1Confident116 Ų11665.4 Ų65.451%0.50932%0.318SS..Hα-helixtrans-58.2-47.6174.2175.8-96.2000111.9S58 V59 S60 F64 F66 R67S58-F62 WeakPolarHBondContact O-CB 3.37Å; S58-F62 PolarHBondContact O-N 3.41Å; V59-F62 PolarHBondContact O-N 2.91Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 2.86Å; F62-F64 VanDerWaalsContact C-N 3.34Å; F62-F64 PolarHBondContact O-N 3.3Å; F62-F66 AromaticContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CE2 4.05Å; F62-F66 HydrophobicContact CD2-CG 4.28Å; F62-F66 HydrophobicContact CE2-CB 4.29Å; F62-F66 AromaticContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CG 4.21Å; F62-F66 HydrophobicContact CG-CD2 4.2Å; F62-F66 WeakPolarHBondContact O-CB 2.99Å; F62-F66 WeakPolarHBondContact O-CD2 3.33Å; F62-F66 PolarHBondContact O-N 3.37Å; F62-R67 HydrophobicContact CE1-CG 4.21Å
63V84.1Confident82.5Confident6 Ų663.7 Ų63.74%0.03631%0.308CS..Iπ-helixtrans-62.8-42.2177.5172.50000110.8V59 S60 L61 R67 M68 F318V59-V63 VanDerWaalsContact O-CG2 3.32Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.45Å; S60-V63 PolarHBondContact O-N 2.99Å; L61-V63 PolarHBondContact O-N 2.93Å; V63-R67 HydrophobicContact CG1-CB 4.26Å; V63-R67 CarbonylContact O-C 3.53Å; V63-R67 WeakPolarHBondContact O-CA 3.4Å; V63-R67 WeakPolarHBondContact O-CB 3.4Å; V63-R67 PolarHBondContact O-N 3.29Å; V63-M68 HydrophobicContact CG1-CG 4.12Å; V63-M68 HydrophobicContact CG1-SD 4.17Å; V63-M68 PolarHBondContact O-N 3.45Å; V63-F318 HydrophobicContact CB-CD2 4.19Å; V63-F318 HydrophobicContact CB-CE2 4.09Å; V63-F318 HydrophobicContact CG1-CD2 3.67Å; V63-F318 HydrophobicContact CG1-CE2 4.08Å; V63-F318 HydrophobicContact CG2-CE2 4.44Å
64F84Confident82.1Confident1 Ų163.7 Ų63.70%0.00431%0.308CS..Iπ-helixtrans-68.7-39-179-59.3-27.6000113.7S60 L61 F62 M68 I78 Y311 L315 F318S60-F64 WeakPolarHBondContact O-CD2 3.33Å; S60-F64 WeakPolarHBondContact O-CG 3.36Å; S60-F64 PolarHBondContact O-N 3.24Å; L61-F64 PolarHBondContact O-N 3.4Å; F62-F64 VanDerWaalsContact C-N 3.34Å; F62-F64 PolarHBondContact O-N 3.3Å; F64-M68 HydrophobicContact CD1-CE 4.11Å; F64-M68 HydrophobicContact CD1-SD 3.73Å; F64-M68 HydrophobicContact CE1-SD 4.09Å; F64-I78 HydrophobicContact CD2-CG2 4.16Å; F64-I78 HydrophobicContact CE1-CG2 4.39Å; F64-I78 HydrophobicContact CE2-CG2 3.38Å; F64-I78 HydrophobicContact CZ-CG2 3.52Å; F64-Y311 AromaticContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CE2 4.04Å; F64-Y311 HydrophobicContact CE2-CG 4.17Å; F64-Y311 HydrophobicContact CZ-CD1 4.31Å; F64-Y311 AromaticContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CE2 4.31Å; F64-Y311 AromaticContact CZ-CG 3.7Å; F64-Y311 HydrophobicContact CZ-CG 3.7Å; F64-L315 HydrophobicContact CD1-CD1 4.06Å; F64-L315 HydrophobicContact CE1-CD1 3.33Å; F64-L315 HydrophobicContact CZ-CD1 3.72Å; F64-F318 HydrophobicContact CD1-CD2 4.2Å; F64-F318 HydrophobicContact CE1-CB 4.34Å; F64-F318 AromaticContact CE1-CD2 3.37Å; F64-F318 HydrophobicContact CE1-CD2 3.37Å; F64-F318 AromaticContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CG 4.03Å; F64-F318 AromaticContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CE2 4.01Å
65C81.8Confident81.7Confident68 Ų6861 Ų6146%0.45929%0.294SS..Iπ-helixtrans-81.1-39.5-178.1-670000112.5L61L61-C65 WeakPolarHBondContact O-CB 3.4Å; L61-C65 PolarHBondContact O-N 3.42Å; L61-C65 PolarHBondContact O-SG 3.28Å; L61-C65 VanDerWaalsContact O-SG 3.35Å
66F79.3Confident81.6Confident156 Ų15657.2 Ų57.268%0.68428%0.275SS*.Iπ-helixtrans-110.6-28.1-167.9-60.9-77.9000114.7F62F62-F66 AromaticContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CE2 4.05Å; F62-F66 HydrophobicContact CD2-CG 4.28Å; F62-F66 HydrophobicContact CE2-CB 4.29Å; F62-F66 AromaticContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CG 4.21Å; F62-F66 HydrophobicContact CG-CD2 4.2Å; F62-F66 WeakPolarHBondContact O-CB 2.99Å; F62-F66 WeakPolarHBondContact O-CD2 3.33Å; F62-F66 PolarHBondContact O-N 3.37Å
67R70.9Confident81.7Confident141 Ų14155.9 Ų55.953%0.53227%0.265SS..Iπ-helixtrans-104.7-31-175.7-57.6-69.3-83.7-178.1-10.1112.2F62 V63F62-R67 HydrophobicContact CE1-CG 4.21Å; V63-R67 HydrophobicContact CG1-CB 4.26Å; V63-R67 CarbonylContact O-C 3.53Å; V63-R67 WeakPolarHBondContact O-CA 3.4Å; V63-R67 WeakPolarHBondContact O-CB 3.4Å; V63-R67 PolarHBondContact O-N 3.29Å
68M70.1Confident81.6Confident17 Ų1755.9 Ų55.98%0.08427%0.265CS..SBendtrans-98.9111.4173.7-66-175.53200108.9V63 F64 M70 A75 L315 F318V63-M68 HydrophobicContact CG1-CG 4.12Å; V63-M68 HydrophobicContact CG1-SD 4.17Å; V63-M68 PolarHBondContact O-N 3.45Å; F64-M68 HydrophobicContact CD1-CE 4.11Å; F64-M68 HydrophobicContact CD1-SD 3.73Å; F64-M68 HydrophobicContact CE1-SD 4.09Å; M68-M70 PolarHBondContact O-N 3.37Å; M68-A75 HydrophobicContact CE-CB 4.49Å; M68-L315 HydrophobicContact CE-CD1 4.04Å; M68-L315 HydrophobicContact CE-CD2 4.28Å; M68-F318 HydrophobicContact SD-CB 4.24Å
69K59.8Low81.6Confident161 Ų16154.2 Ų54.270%0.725%0.253SS*.  trans-55.8112.8156.6-73.1-178.9177.5-179.20105.2R71K69-R71 HydrophobicContact CB-CG 4.05Å; K69-R71 WeakPolarHBondContact O-CA 3.41Å; K69-R71 VanDerWaalsContact O-CB 3.25Å; K69-R71 WeakPolarHBondContact O-CB 3.4Å; K69-R71 WeakPolarHBondContact O-CG 3.1Å; K69-R71 PolarHBondContact O-N 3.18Å
70M61.6Low81.9Confident61 Ų6152.5 Ų52.530%0.324%0.242SC..  trans-56.678.3-175-65.9-146.477.900111.5M68 A75 I76 T79 R152M68-M70 PolarHBondContact O-N 3.37Å; M70-A75 HydrophobicContact CE-CB 4.01Å; M70-A75 VanDerWaalsContact CE-O 3.29Å; M70-A75 WeakPolarHBondContact CE-O 3.43Å; M70-I76 HydrophobicContact CE-CG1 4.49Å; M70-T79 HydrophobicContact CE-CG2 4.1Å; M70-T79 WeakPolarHBondContact CE-OG1 3.17Å; M70-T79 HydrophobicContact SD-CG2 4.44Å; M70-R152 VanDerWaalsContact O-CZ 3.22Å; M70-R152 PolarHBondContact O-NE 2.96Å; M70-R152 PolarHBondContact O-NH1 3.41Å
71R64.9Low82.1Confident172 Ų17252.4 Ų52.465%0.64924%0.241SC*.  trans-93-26.3-160.9-90.3173.4174.4169.5-3.9112.7K69 R152K69-R71 HydrophobicContact CB-CG 4.05Å; K69-R71 WeakPolarHBondContact O-CA 3.41Å; K69-R71 VanDerWaalsContact O-CB 3.25Å; K69-R71 WeakPolarHBondContact O-CB 3.4Å; K69-R71 WeakPolarHBondContact O-CG 3.1Å; K69-R71 PolarHBondContact O-N 3.18Å; R71-R152 VanDerWaalsContact CA-NH2 3.31Å; R71-R152 PolarHBondContact O-NE 2.7Å; R71-R152 PolarHBondContact O-NH2 3.25Å
72S77Confident82.4Confident39 Ų3950.6 Ų50.627%0.27323%0.232SC..SBendtrans-106.1150.6178.963.10000112.6T74 A75S72-T74 VanDerWaalsContact C-N 3.34Å; S72-A75 WeakPolarHBondContact O-CB 3.44Å; S72-A75 PolarHBondContact O-N 2.95Å; S72-A75 WeakPolarHBondContact OG-CB 3.33Å; S72-A75 PolarHBondContact OG-N 2.93Å
73E84.4Confident82.8Confident45 Ų4548.3 Ų48.321%0.2122%0.224CC..Hα-helixtrans-60.9-44.1176-62.470.7-146.900110.7A75 I76 R150E73-A75 PolarHBondContact O-N 2.92Å; E73-I76 WeakPolarHBondContact O-CB 3.44Å; E73-I76 PolarHBondContact O-N 2.87Å; E73-R150 HydrophobicContact CG-CB 4.39Å; E73-R150 VanDerWaalsContact CG-O 3.32Å; E73-R150 WeakPolarHBondContact CG-O 3.45Å
74T85.9Confident83.4Confident1 Ų148 Ų481%0.00622%0.223CC..Hα-helixtrans-59.8-31.6177.1-32.70000112.8S72 I76 F77 I78 I132 D135 R136 T314S72-T74 VanDerWaalsContact C-N 3.34Å; T74-I76 PolarHBondContact O-N 3.26Å; T74-F77 PolarHBondContact O-N 3.06Å; T74-I78 HydrophobicContact CG2-CD1 4.21Å; T74-I78 PolarHBondContact O-N 3.35Å; T74-I78 VanDerWaalsContact O-N 3.12Å; T74-I132 HydrophobicContact CG2-CG1 4.27Å; T74-I132 HydrophobicContact CG2-CG2 3.96Å; T74-D135 PolarHBondContact OG1-OD2 3.4Å; T74-R136 PolarHBondContact OG1-NH2 3.42Å; T74-T314 HydrophobicContact CG2-CG2 3.7Å
75A87.3Confident83.9Confident0 Ų048 Ų480%022%0.223CC..Hα-helixtrans-65.7-27.7178.600000112.2M68 M70 S72 E73 T79 L315M68-A75 HydrophobicContact CE-CB 4.49Å; M70-A75 HydrophobicContact CE-CB 4.01Å; M70-A75 VanDerWaalsContact CE-O 3.29Å; M70-A75 WeakPolarHBondContact CE-O 3.43Å; S72-A75 WeakPolarHBondContact O-CB 3.44Å; S72-A75 PolarHBondContact O-N 2.95Å; S72-A75 WeakPolarHBondContact OG-CB 3.33Å; S72-A75 PolarHBondContact OG-N 2.93Å; E73-A75 PolarHBondContact O-N 2.92Å; A75-T79 VanDerWaalsContact O-CB 3.31Å; A75-T79 WeakPolarHBondContact O-CB 3.45Å; A75-T79 PolarHBondContact O-N 2.87Å; A75-T79 PolarHBondContact O-OG1 2.99Å; A75-L315 HydrophobicContact CB-CD2 4.04Å
76I92Very high84.6Confident22 Ų2245.7 Ų45.711%0.11321%0.206CC..Hα-helixtrans-66.1-48.6176.6-60.3172.5000109.7M70 E73 T74 I78 T79 N80 R152M70-I76 HydrophobicContact CE-CG1 4.49Å; E73-I76 WeakPolarHBondContact O-CB 3.44Å; E73-I76 PolarHBondContact O-N 2.87Å; T74-I76 PolarHBondContact O-N 3.26Å; I76-I78 PolarHBondContact O-N 2.92Å; I76-T79 PolarHBondContact O-N 2.99Å; I76-N80 PolarHBondContact O-N 3.29Å; I76-N80 VanDerWaalsContact O-N 3.08Å; I76-N80 PolarHBondContact O-ND2 3.3Å; I76-R152 HydrophobicContact CD1-CB 3.78Å; I76-R152 HydrophobicContact CD1-CG 4.01Å
77F93.3Very high85.4Confident10 Ų1042.5 Ų42.54%0.04420%0.195CC..Hα-helixtrans-61-44.2176.7-59.9-56.4000111.9T74 T79 N80 L81 F128 C131 I132 D135 V158 C159T74-F77 PolarHBondContact O-N 3.06Å; F77-T79 VanDerWaalsContact C-N 3.33Å; F77-T79 PolarHBondContact O-N 3.19Å; F77-N80 PolarHBondContact O-N 3.36Å; F77-L81 WeakPolarHBondContact O-CB 3.01Å; F77-L81 PolarHBondContact O-N 3.41Å; F77-F128 HydrophobicContact CD1-CD1 4.42Å; F77-C131 HydrophobicContact CD1-CB 3.62Å; F77-C131 HydrophobicContact CD2-CB 4.22Å; F77-C131 HydrophobicContact CE1-CB 3.7Å; F77-C131 HydrophobicContact CE2-CB 4.28Å; F77-C131 HydrophobicContact CG-CB 3.92Å; F77-C131 HydrophobicContact CZ-CB 4.04Å; F77-I132 HydrophobicContact CB-CD1 4.27Å; F77-I132 HydrophobicContact CB-CG1 3.69Å; F77-I132 HydrophobicContact CG-CG1 4.46Å; F77-D135 HydrophobicContact CE2-CB 4.18Å; F77-V158 HydrophobicContact CE1-CB 4.13Å; F77-V158 HydrophobicContact CE1-CG1 3.87Å; F77-V158 HydrophobicContact CZ-CG1 4.4Å; F77-C159 WeakPolarHBondContact CD1-SG 3.36Å
78I91.1Very high86.7Confident0 Ų036 Ų360%017%0.171CC..Hα-helixtrans-62.3-38.6178-76.6170.8000112.4F64 T74 I76 L81 A82 I132 Y311 T314 L315F64-I78 HydrophobicContact CD2-CG2 4.16Å; F64-I78 HydrophobicContact CE1-CG2 4.39Å; F64-I78 HydrophobicContact CE2-CG2 3.38Å; F64-I78 HydrophobicContact CZ-CG2 3.52Å; T74-I78 HydrophobicContact CG2-CD1 4.21Å; T74-I78 PolarHBondContact O-N 3.35Å; T74-I78 VanDerWaalsContact O-N 3.12Å; I76-I78 PolarHBondContact O-N 2.92Å; I78-L81 WeakPolarHBondContact O-CB 3.49Å; I78-L81 PolarHBondContact O-N 3.42Å; I78-A82 PolarHBondContact O-N 3.43Å; I78-I132 HydrophobicContact CG1-CD1 3.73Å; I78-I132 HydrophobicContact CG1-CG1 4.44Å; I78-Y311 HydrophobicContact CB-CD1 4.36Å; I78-Y311 HydrophobicContact CB-CE1 4.41Å; I78-Y311 HydrophobicContact CG1-CD1 4.32Å; I78-Y311 HydrophobicContact CG2-CD1 3.33Å; I78-Y311 HydrophobicContact CG2-CE1 3.53Å; I78-Y311 HydrophobicContact CG2-CG 4Å; I78-T314 HydrophobicContact CD1-CG2 3.45Å; I78-T314 VanDerWaalsContact CD1-CG2 3.45Å; I78-L315 HydrophobicContact CB-CD1 4.46Å; I78-L315 HydrophobicContact CD1-CD1 3.83Å; I78-L315 HydrophobicContact CD1-CD2 4.18Å; I78-L315 HydrophobicContact CD1-CG 3.81Å; I78-L315 HydrophobicContact CG2-CD1 3.85Å
79T91.9Very high87.9Confident17 Ų1735.2 Ų35.210%0.10417%0.167CC..Hα-helixtrans-70.3-37.7179.4-60.40000111.3L61 M70 A75 I76 F77 A82 L83L61-T79 HydrophobicContact CD1-CG2 3.71Å; M70-T79 HydrophobicContact CE-CG2 4.1Å; M70-T79 WeakPolarHBondContact CE-OG1 3.17Å; M70-T79 HydrophobicContact SD-CG2 4.44Å; A75-T79 VanDerWaalsContact O-CB 3.31Å; A75-T79 WeakPolarHBondContact O-CB 3.45Å; A75-T79 PolarHBondContact O-N 2.87Å; A75-T79 PolarHBondContact O-OG1 2.99Å; I76-T79 PolarHBondContact O-N 2.99Å; F77-T79 VanDerWaalsContact C-N 3.33Å; F77-T79 PolarHBondContact O-N 3.19Å; T79-A82 PolarHBondContact O-N 2.93Å; T79-L83 WeakPolarHBondContact O-CB 3.27Å; T79-L83 PolarHBondContact O-N 3.25Å
80N94.9Very high89.7Confident29 Ų2931.1 Ų31.116%0.15516%0.158CC..Hα-helixtrans-69.2-34.6174.5-76.8-88.7000112.3I76 F77 L83 S84 F128 W163I76-N80 PolarHBondContact O-N 3.29Å; I76-N80 VanDerWaalsContact O-N 3.08Å; I76-N80 PolarHBondContact O-ND2 3.3Å; F77-N80 PolarHBondContact O-N 3.36Å; N80-L83 PolarHBondContact O-N 2.97Å; N80-S84 WeakPolarHBondContact O-CB 3.2Å; N80-S84 PolarHBondContact O-N 2.89Å; N80-F128 HydrophobicContact CB-CD1 4.15Å; N80-F128 HydrophobicContact CB-CD2 4.47Å; N80-F128 HydrophobicContact CB-CE1 3.58Å; N80-F128 HydrophobicContact CB-CE2 3.95Å; N80-F128 HydrophobicContact CB-CZ 3.49Å; N80-F128 VanDerWaalsContact CB-CZ 3.49Å; N80-W163 PolarHBondContact OD1-NE1 2.93Å
81L94.1Very high91.4Very high0 Ų028.8 Ų28.80%015%0.147CC..Hα-helixtrans-58.2-56.2170.1-178.759.9000110.4F77 I78 L83 S84 D85 S125 F128 L129 I132 Y311F77-L81 WeakPolarHBondContact O-CB 3.01Å; F77-L81 PolarHBondContact O-N 3.41Å; I78-L81 WeakPolarHBondContact O-CB 3.49Å; I78-L81 PolarHBondContact O-N 3.42Å; L81-L83 VanDerWaalsContact C-N 3.25Å; L81-L83 PolarHBondContact O-N 2.79Å; L81-S84 WeakPolarHBondContact O-CA 3.22Å; L81-S84 VanDerWaalsContact O-CB 3.31Å; L81-S84 WeakPolarHBondContact O-CB 3.08Å; L81-S84 PolarHBondContact O-N 3.42Å; L81-D85 PolarHBondContact O-N 2.65Å; L81-S125 VanDerWaalsContact CD1-OG 3.29Å; L81-S125 WeakPolarHBondContact CD1-OG 3.42Å; L81-F128 HydrophobicContact CB-CB 4.19Å; L81-F128 HydrophobicContact CB-CD2 4.44Å; L81-F128 HydrophobicContact CD1-CB 4.31Å; L81-L129 HydrophobicContact CD2-CD2 4.01Å; L81-L129 HydrophobicContact CD2-CG 4.43Å; L81-I132 HydrophobicContact CD2-CD1 4.49Å; L81-Y311 HydrophobicContact CD2-CE1 4.19Å
82A94.4Very high92.9Very high0 Ų020.7 Ų20.70%012%0.116CC..Hα-helixtrans-55.8-38.7177.700000113.2L61 I78 T79 D85 L86 Y311L61-A82 HydrophobicContact CD1-CB 4.43Å; I78-A82 PolarHBondContact O-N 3.43Å; T79-A82 PolarHBondContact O-N 2.93Å; A82-D85 PolarHBondContact O-N 2.67Å; A82-L86 WeakPolarHBondContact O-CG 3.14Å; A82-L86 PolarHBondContact O-N 3.29Å; A82-Y311 WeakPolarHBondContact CA-OH 3.12Å; A82-Y311 HydrophobicContact CB-CE2 4.21Å; A82-Y311 VanDerWaalsContact CB-OH 3.27Å; A82-Y311 WeakPolarHBondContact CB-OH 3.42Å; A82-Y311 PolarHBondContact N-OH 2.76Å
83L95.4Very high93.9Very high68 Ų6821.2 Ų21.236%0.35612%0.119SC..Hα-helixtrans-64.9-44.2176179.761.5000111.5T79 N80 L81 D85 L86 L87 W163T79-L83 WeakPolarHBondContact O-CB 3.27Å; T79-L83 PolarHBondContact O-N 3.25Å; N80-L83 PolarHBondContact O-N 2.97Å; L81-L83 VanDerWaalsContact C-N 3.25Å; L81-L83 PolarHBondContact O-N 2.79Å; L83-D85 VanDerWaalsContact C-N 3.34Å; L83-D85 PolarHBondContact O-N 3.06Å; L83-L86 PolarHBondContact O-N 3.05Å; L83-L87 HydrophobicContact CG-CD1 4.46Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 3.19Å; L83-W163 HydrophobicContact CB-CZ2 4.43Å; L83-W163 HydrophobicContact CD2-CZ2 4.05Å; L83-W163 HydrophobicContact CG-CZ2 4.19Å
84S96.5Very high94.4Very high1 Ų122.3 Ų22.31%0.00712%0.123CC..Hα-helixtrans-60.9-42176-171.80000112.1N80 L81 L87 F88 N121N80-S84 WeakPolarHBondContact O-CB 3.2Å; N80-S84 PolarHBondContact O-N 2.89Å; L81-S84 WeakPolarHBondContact O-CA 3.22Å; L81-S84 VanDerWaalsContact O-CB 3.31Å; L81-S84 WeakPolarHBondContact O-CB 3.08Å; L81-S84 PolarHBondContact O-N 3.42Å; S84-L87 PolarHBondContact O-N 2.9Å; S84-F88 PolarHBondContact O-N 3.43Å; S84-F88 VanDerWaalsContact O-N 3.15Å; S84-N121 PolarHBondContact O-ND2 3.01Å; S84-N121 WeakPolarHBondContact OG-CA 3.25Å
85D96.1Very high94.7Very high0 Ų023.7 Ų23.70%013%0.129CC..Hα-helixtrans-63.8-44.2176.7-60.1-43.5000111.8N57 L81 A82 L83 F88 V89 N121 S125 N303 C304N57-D85 HydrophobicContact CB-CB 4.47Å; L81-D85 PolarHBondContact O-N 2.65Å; A82-D85 PolarHBondContact O-N 2.67Å; L83-D85 VanDerWaalsContact C-N 3.34Å; L83-D85 PolarHBondContact O-N 3.06Å; D85-F88 PolarHBondContact O-N 2.98Å; D85-V89 VanDerWaalsContact O-CB 3.32Å; D85-V89 WeakPolarHBondContact O-CB 2.94Å; D85-V89 VanDerWaalsContact O-CG2 3.24Å; D85-V89 WeakPolarHBondContact O-CG2 3.29Å; D85-V89 PolarHBondContact O-N 3.49Å; D85-N121 WeakPolarHBondContact CA-ND2 3.47Å; D85-N121 PolarHBondContact OD1-ND2 3.35Å; D85-S125 PolarHBondContact OD1-OG 3.23Å; D85-N303 PolarHBondContact OD1-OD1 3.46Å; D85-C304 HydrophobicContact CB-CB 4.08Å; D85-C304 PolarHBondContact OD1-SG 2.93Å
86L95.8Very high95.2Very high19 Ų1924.9 Ų24.910%0.09914%0.135CC..Hα-helixtrans-62.9-44.3176.6-76.8170.4000112.7L54 N57 S58 L61 A82 L83 F88 V89 C90L54-L86 HydrophobicContact CD1-CD2 4.16Å; N57-L86 HydrophobicContact CB-CD1 4.28Å; N57-L86 HydrophobicContact CB-CD2 3.78Å; N57-L86 HydrophobicContact CB-CG 3.65Å; S58-L86 WeakPolarHBondContact OG-CD2 3.46Å; L61-L86 HydrophobicContact CB-CD1 4.09Å; L61-L86 HydrophobicContact CD2-CD1 3.69Å; L61-L86 HydrophobicContact CG-CD1 4.48Å; A82-L86 WeakPolarHBondContact O-CG 3.14Å; A82-L86 PolarHBondContact O-N 3.29Å; L83-L86 PolarHBondContact O-N 3.05Å; L86-F88 VanDerWaalsContact C-N 3.27Å; L86-F88 PolarHBondContact O-N 3.34Å; L86-V89 PolarHBondContact O-N 3.03Å; L86-C90 WeakPolarHBondContact O-CB 3.49Å; L86-C90 PolarHBondContact O-N 3.42Å; L86-C90 PolarHBondContact O-SG 3.45Å
87L96.1Very high95.4Very high90 Ų9027.8 Ų27.847%0.47115%0.147SC..Hα-helixtrans-58.7-42.3177.8-71.7176.3000111.3L83 S84 W163L83-L87 HydrophobicContact CG-CD1 4.46Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 3.19Å; S84-L87 PolarHBondContact O-N 2.9Å; L87-W163 HydrophobicContact CD1-CH2 3.81Å; L87-W163 HydrophobicContact CD1-CZ3 4.11Å
88F97.1Very high95.4Very high5 Ų527.4 Ų27.42%0.02215%0.146CC..Hα-helixtrans-68.9-49.1176.5166.5-116.8000112.7S84 D85 L86 C90 T91 L92 F118 N121 T301S84-F88 PolarHBondContact O-N 3.43Å; S84-F88 VanDerWaalsContact O-N 3.15Å; D85-F88 PolarHBondContact O-N 2.98Å; L86-F88 VanDerWaalsContact C-N 3.27Å; L86-F88 PolarHBondContact O-N 3.34Å; F88-C90 VanDerWaalsContact C-N 3.25Å; F88-C90 PolarHBondContact O-N 3.29Å; F88-T91 WeakPolarHBondContact O-CA 3.31Å; F88-T91 PolarHBondContact O-N 2.92Å; F88-T91 PolarHBondContact O-OG1 2.99Å; F88-L92 HydrophobicContact CE1-CD1 4.27Å; F88-L92 HydrophobicContact CE1-CD2 4.11Å; F88-L92 HydrophobicContact CE1-CG 4.4Å; F88-L92 HydrophobicContact CE2-CD2 3.77Å; F88-L92 HydrophobicContact CE2-CG 4.47Å; F88-L92 HydrophobicContact CZ-CD1 4.48Å; F88-L92 HydrophobicContact CZ-CD2 3.5Å; F88-L92 VanDerWaalsContact CZ-CD2 3.5Å; F88-L92 HydrophobicContact CZ-CG 4.23Å; F88-L92 PolarHBondContact O-N 3.12Å; F88-F118 HydrophobicContact CD2-CB 4.2Å; F88-F118 HydrophobicContact CE2-CB 4.02Å; F88-F118 AromaticContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CG 4.39Å; F88-F118 HydrophobicContact CZ-CD2 4.09Å; F88-N121 HydrophobicContact CB-CB 3.52Å; F88-N121 HydrophobicContact CD1-CB 4.26Å; F88-N121 HydrophobicContact CD2-CB 4.47Å; F88-N121 HydrophobicContact CG-CB 3.85Å; F88-T301 HydrophobicContact CE1-CG2 3.99Å; F88-T301 HydrophobicContact CZ-CG2 3.63Å
89V97.1Very high95.5Very high0 Ų027.6 Ų27.60%015%0.147CC..Hα-helixtrans-58.2-38.7-179.3166.40000111.4V49 F50 L54 D85 L86 T91 L92 C304V49-V89 HydrophobicContact CG1-CG2 4.35Å; F50-V89 HydrophobicContact CD2-CG1 3.77Å; F50-V89 WeakPolarHBondContact CD2-O 3.44Å; F50-V89 HydrophobicContact CE2-CG1 4.41Å; L54-V89 HydrophobicContact CB-CG1 3.82Å; L54-V89 HydrophobicContact CD1-CG1 4.49Å; D85-V89 VanDerWaalsContact O-CB 3.32Å; D85-V89 WeakPolarHBondContact O-CB 2.94Å; D85-V89 VanDerWaalsContact O-CG2 3.24Å; D85-V89 WeakPolarHBondContact O-CG2 3.29Å; D85-V89 PolarHBondContact O-N 3.49Å; L86-V89 PolarHBondContact O-N 3.03Å; V89-T91 PolarHBondContact O-N 3.39Å; V89-T91 VanDerWaalsContact O-N 3.14Å; V89-L92 HydrophobicContact CB-CD1 4.45Å; V89-L92 HydrophobicContact CG2-CD1 4.18Å; V89-L92 WeakPolarHBondContact O-CB 3.43Å; V89-L92 PolarHBondContact O-N 2.73Å; V89-C304 HydrophobicContact CG2-CB 4.28Å
90C96.9Very high95.6Very high74 Ų7432 Ų3250%0.516%0.164SC..THydrogen-bonded Turntrans-60.8-21.6174.6-73.70000113.9L86 F88L86-C90 WeakPolarHBondContact O-CB 3.49Å; L86-C90 PolarHBondContact O-N 3.42Å; L86-C90 PolarHBondContact O-SG 3.45Å; F88-C90 VanDerWaalsContact C-N 3.25Å; F88-C90 PolarHBondContact O-N 3.29Å
91T96.3Very high95.5Very high13 Ų1334.9 Ų34.98%0.0818%0.18CC..THydrogen-bonded Turntrans-89.8-13.4175.1730000113.9F88 V89 P93 F94 A117F88-T91 WeakPolarHBondContact O-CA 3.31Å; F88-T91 PolarHBondContact O-N 2.92Å; F88-T91 PolarHBondContact O-OG1 2.99Å; V89-T91 PolarHBondContact O-N 3.39Å; V89-T91 VanDerWaalsContact O-N 3.14Å; T91-P93 VanDerWaalsContact C-CD 3.43Å; T91-F94 PolarHBondContact O-N 3.45Å; T91-A117 HydrophobicContact CG2-CB 3.74Å
92L96.6Very high95.3Very high1 Ų140.2 Ų40.21%0.00520%0.2CC..Hα-helixtrans-60.7-35.8-177.7-70.4179.6000114.6Y46 V49 F50 F88 V89 F94 K95 I96Y46-L92 HydrophobicContact CD1-CD2 4.19Å; Y46-L92 HydrophobicContact CD2-CD2 4.27Å; Y46-L92 HydrophobicContact CG-CD2 3.93Å; V49-L92 HydrophobicContact CB-CD1 3.98Å; V49-L92 HydrophobicContact CG1-CD1 3.63Å; F50-L92 HydrophobicContact CB-CB 4.14Å; F50-L92 HydrophobicContact CB-CD1 4.14Å; F50-L92 HydrophobicContact CD2-CB 4.35Å; F88-L92 HydrophobicContact CE1-CD1 4.27Å; F88-L92 HydrophobicContact CE1-CD2 4.11Å; F88-L92 HydrophobicContact CE1-CG 4.4Å; F88-L92 HydrophobicContact CE2-CD2 3.77Å; F88-L92 HydrophobicContact CE2-CG 4.47Å; F88-L92 HydrophobicContact CZ-CD1 4.48Å; F88-L92 HydrophobicContact CZ-CD2 3.5Å; F88-L92 VanDerWaalsContact CZ-CD2 3.5Å; F88-L92 HydrophobicContact CZ-CG 4.23Å; F88-L92 PolarHBondContact O-N 3.12Å; V89-L92 HydrophobicContact CB-CD1 4.45Å; V89-L92 HydrophobicContact CG2-CD1 4.18Å; V89-L92 WeakPolarHBondContact O-CB 3.43Å; V89-L92 PolarHBondContact O-N 2.73Å; L92-F94 PolarHBondContact O-N 3.23Å; L92-K95 CarbonylContact O-C 3.53Å; L92-K95 WeakPolarHBondContact O-CA 3.38Å; L92-K95 PolarHBondContact O-N 3.35Å; L92-I96 HydrophobicContact CB-CD1 4.32Å; L92-I96 VanDerWaalsContact O-CG1 3.26Å; L92-I96 WeakPolarHBondContact O-CG1 3.43Å; L92-I96 PolarHBondContact O-N 2.93Å
93P97.4Very high95.1Very high51 Ų5143.3 Ų43.333%0.33122%0.215SC..Hα-helixtrans-52.9-40.4177.5-30.337.7000113.6F50 T91 I96 F97F50-P93 HydrophobicContact CD2-CG 3.85Å; F50-P93 HydrophobicContact CE1-CG 4.43Å; F50-P93 HydrophobicContact CE2-CG 3.49Å; F50-P93 VanDerWaalsContact CE2-CG 3.49Å; F50-P93 HydrophobicContact CG-CG 4.47Å; F50-P93 HydrophobicContact CZ-CG 3.81Å; T91-P93 VanDerWaalsContact C-CD 3.43Å; P93-I96 PolarHBondContact O-N 2.95Å; P93-F97 PolarHBondContact O-N 2.92Å
94F95.5Very high94.8Very high67 Ų6740.2 Ų40.229%0.29420%0.198SC..Hα-helixtrans-67.1-40177.2-54-68.7000111.9T91 L92 Y98 W104 F106 L110T91-F94 PolarHBondContact O-N 3.45Å; L92-F94 PolarHBondContact O-N 3.23Å; F94-Y98 WeakPolarHBondContact O-CB 3.42Å; F94-Y98 PolarHBondContact O-N 3.22Å; F94-W104 HydrophobicContact CB-CH2 3.59Å; F94-W104 HydrophobicContact CB-CZ2 4.49Å; F94-W104 HydrophobicContact CB-CZ3 3.94Å; F94-F106 HydrophobicContact CB-CD2 4.07Å; F94-F106 HydrophobicContact CB-CE2 4.01Å; F94-F106 AromaticContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD2 4.02Å; F94-F106 AromaticContact CD1-CE1 3.8Å; F94-F106 HydrophobicContact CD1-CE1 3.8Å; F94-F106 AromaticContact CD1-CE2 4Å; F94-F106 HydrophobicContact CD1-CE2 4Å; F94-F106 AromaticContact CD1-CG 3.94Å; F94-F106 HydrophobicContact CD1-CG 3.94Å; F94-F106 AromaticContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CE1-CD1 4.22Å; F94-F106 HydrophobicContact CE1-CE1 4.29Å; F94-F106 HydrophobicContact CG-CD2 4.49Å; F94-L110 HydrophobicContact CB-CD2 4.35Å; F94-L110 HydrophobicContact CD1-CD2 3.4Å; F94-L110 HydrophobicContact CD2-CD1 4.49Å; F94-L110 HydrophobicContact CD2-CD2 3.84Å; F94-L110 HydrophobicContact CD2-CG 4.35Å; F94-L110 HydrophobicContact CE1-CD2 3.49Å; F94-L110 VanDerWaalsContact CE1-CD2 3.49Å; F94-L110 HydrophobicContact CE2-CD1 4.25Å; F94-L110 HydrophobicContact CE2-CD2 3.92Å; F94-L110 HydrophobicContact CG-CD2 3.58Å; F94-L110 HydrophobicContact CG-CG 4.4Å; F94-L110 HydrophobicContact CZ-CD2 3.75Å
95K93.6Very high94.7Very high31 Ų3143.3 Ų43.314%0.13522%0.218CC..Hα-helixtrans-68.5-37.9175.1-73.4-71.7-174.9179.80111.8Y46 L92 Y98 N99 W104 S114Y46-K95 HydrophobicContact CD2-CB 3.94Å; Y46-K95 HydrophobicContact CE2-CB 4.16Å; L92-K95 CarbonylContact O-C 3.53Å; L92-K95 WeakPolarHBondContact O-CA 3.38Å; L92-K95 PolarHBondContact O-N 3.35Å; K95-Y98 PolarHBondContact O-N 3.35Å; K95-N99 WeakPolarHBondContact O-CB 3.47Å; K95-N99 PolarHBondContact O-N 2.94Å; K95-N99 PolarHBondContact O-ND2 2.61Å; K95-W104 HydrophobicContact CD-CZ3 4.23Å; K95-S114 WeakPolarHBondContact CE-OG 3.38Å; K95-S114 WeakPolarHBondContact CG-OG 3.32Å
96I96.8Very high94.4Very high24 Ų2446.7 Ų46.712%0.12323%0.233CC..Hα-helixtrans-61.2-50.1175.7-67.9161.2000109.5S47 F50 L92 P93 Y98 N99 F100S47-I96 WeakPolarHBondContact OG-CG2 3.4Å; F50-I96 HydrophobicContact CB-CD1 4.03Å; F50-I96 HydrophobicContact CG-CD1 4.47Å; L92-I96 HydrophobicContact CB-CD1 4.32Å; L92-I96 VanDerWaalsContact O-CG1 3.26Å; L92-I96 WeakPolarHBondContact O-CG1 3.43Å; L92-I96 PolarHBondContact O-N 2.93Å; P93-I96 PolarHBondContact O-N 2.95Å; I96-Y98 VanDerWaalsContact C-N 3.32Å; I96-Y98 PolarHBondContact O-N 3.08Å; I96-N99 PolarHBondContact O-N 2.8Å; I96-F100 HydrophobicContact CG2-CD2 3.71Å; I96-F100 HydrophobicContact CG2-CE2 3.65Å; I96-F100 WeakPolarHBondContact O-CD2 3.11Å; I96-F100 PolarHBondContact O-N 3.06Å; I96-F100 VanDerWaalsContact O-N 3.08Å
97F96.3Very high94.2Very high84 Ų8447.6 Ų47.637%0.36825%0.247SC..Hα-helixtrans-55.8-48.3175.7-177.4-83.1000111.5P93 N99 F100 N101 P105 F106P93-F97 PolarHBondContact O-N 2.92Å; F97-N99 PolarHBondContact O-N 3.24Å; F97-F100 PolarHBondContact O-N 3.39Å; F97-N101 HydrophobicContact CD1-CB 4.4Å; F97-N101 WeakPolarHBondContact CD2-ND2 3.46Å; F97-N101 HydrophobicContact CE1-CB 4Å; F97-N101 WeakPolarHBondContact CE2-ND2 3.45Å; F97-N101 HydrophobicContact CZ-CB 4.29Å; F97-N101 WeakPolarHBondContact O-CB 3.44Å; F97-N101 PolarHBondContact O-N 3.34Å; F97-N101 PolarHBondContact O-ND2 3.32Å; F97-P105 HydrophobicContact CD1-CG 4.16Å; F97-P105 HydrophobicContact CE1-CG 3.61Å; F97-P105 HydrophobicContact CZ-CG 4.31Å; F97-F106 HydrophobicContact CB-CE2 4.09Å; F97-F106 HydrophobicContact CB-CZ 3.91Å; F97-F106 AromaticContact CD1-CE2 3.72Å; F97-F106 HydrophobicContact CD1-CE2 3.72Å; F97-F106 AromaticContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD2-CZ 4.44Å; F97-F106 HydrophobicContact CE1-CZ 4.31Å; F97-F106 HydrophobicContact CG-CE2 4.1Å; F97-F106 AromaticContact CG-CZ 3.72Å; F97-F106 HydrophobicContact CG-CZ 3.72Å
98Y93.6Very high93.8Very high2 Ų245.5 Ų45.51%0.00824%0.236CC..Hα-helixtrans-59.8-43178.5167-106.5000113Y39 F94 K95 I96 R102 W104 E190Y39-Y98 HydrophobicContact CE1-CE1 4.38Å; F94-Y98 WeakPolarHBondContact O-CB 3.42Å; F94-Y98 PolarHBondContact O-N 3.22Å; K95-Y98 PolarHBondContact O-N 3.35Å; I96-Y98 VanDerWaalsContact C-N 3.32Å; I96-Y98 PolarHBondContact O-N 3.08Å; Y98-R102 WeakPolarHBondContact O-CA 3.27Å; Y98-R102 PolarHBondContact O-N 3.17Å; Y98-W104 HydrophobicContact CD2-CB 3.79Å; Y98-W104 HydrophobicContact CD2-CE3 4.23Å; Y98-W104 HydrophobicContact CE2-CB 4.26Å; Y98-W104 AromaticContact CG-CE3 3.98Å; Y98-W104 HydrophobicContact CG-CE3 3.98Å; Y98-E190 VanDerWaalsContact CE1-OE1 3.31Å; Y98-E190 WeakPolarHBondContact CE1-OE1 3.45Å; Y98-E190 PolarHBondContact OH-OE1 2.89Å
99N92.9Very high93.5Very high4 Ų450.3 Ų50.32%0.02127%0.266CS..Hα-helixtrans-68.9-38.5-177.7-82.4-76.6000111.9Y39 N42 K95 I96 F97Y39-N99 WeakPolarHBondContact CB-O 3.3Å; Y39-N99 WeakPolarHBondContact O-CB 3.21Å; N42-N99 HydrophobicContact CB-CB 4.49Å; N42-N99 VanDerWaalsContact CB-OD1 3.29Å; N42-N99 WeakPolarHBondContact CB-OD1 3.38Å; N42-N99 PolarHBondContact ND2-OD1 3.29Å; K95-N99 WeakPolarHBondContact O-CB 3.47Å; K95-N99 PolarHBondContact O-N 2.94Å; K95-N99 PolarHBondContact O-ND2 2.61Å; I96-N99 PolarHBondContact O-N 2.8Å; F97-N99 PolarHBondContact O-N 3.24Å
100F94.8Very high93.2Very high108 Ų10852.2 Ų52.247%0.47428%0.276SS..Hα-helixtrans-77.2-36.6177.4-72-56000113.7I96 F97I96-F100 HydrophobicContact CG2-CD2 3.71Å; I96-F100 HydrophobicContact CG2-CE2 3.65Å; I96-F100 WeakPolarHBondContact O-CD2 3.11Å; I96-F100 PolarHBondContact O-N 3.06Å; I96-F100 VanDerWaalsContact O-N 3.08Å; F97-F100 PolarHBondContact O-N 3.39Å
101N92.1Very high92.9Very high91 Ų9148.7 Ų48.749%0.48725%0.252SS..Hα-helixtrans-93.1-8.5-177.1-63.9-77.5000113.7F97 H103F97-N101 HydrophobicContact CD1-CB 4.4Å; F97-N101 WeakPolarHBondContact CD2-ND2 3.46Å; F97-N101 HydrophobicContact CE1-CB 4Å; F97-N101 WeakPolarHBondContact CE2-ND2 3.45Å; F97-N101 HydrophobicContact CZ-CB 4.29Å; F97-N101 WeakPolarHBondContact O-CB 3.44Å; F97-N101 PolarHBondContact O-N 3.34Å; F97-N101 PolarHBondContact O-ND2 3.32Å; N101-H103 PolarHBondContact O-N 3.49Å; N101-H103 VanDerWaalsContact O-N 3.08Å
102R89.8Confident92.7Very high111 Ų11150.6 Ų50.642%0.41926%0.259SS..SBendtrans52.628.2-174.8-55.5-175.5178.5-169.9-1.3113.3Y39 Y98Y39-R102 HydrophobicContact CD1-CG 4.37Å; Y39-R102 HydrophobicContact CD2-CG 4.43Å; Y39-R102 HydrophobicContact CG-CG 4.23Å; Y98-R102 WeakPolarHBondContact O-CA 3.27Å; Y98-R102 PolarHBondContact O-N 3.17Å
103H89.5Confident92.5Very high66 Ų6654.7 Ų54.731%0.30628%0.281SS..  trans-146.1132.6-174.9-179.578.6000110.5N101 P105 T186N101-H103 PolarHBondContact O-N 3.49Å; N101-H103 VanDerWaalsContact O-N 3.08Å; H103-P105 VanDerWaalsContact O-CD 3.24Å; H103-P105 WeakPolarHBondContact O-CD 3.43Å; H103-T186 PolarHBondContact ND1-N 2.76Å
104W90.9Very high92.2Very high2 Ų252.4 Ų52.41%0.00827%0.266CS..  trans-10596.4177.1-176.3-87.3000111.1F94 K95 Y98 F106 G107 L110 C111 T186 C188F94-W104 HydrophobicContact CB-CH2 3.59Å; F94-W104 HydrophobicContact CB-CZ2 4.49Å; F94-W104 HydrophobicContact CB-CZ3 3.94Å; K95-W104 HydrophobicContact CD-CZ3 4.23Å; Y98-W104 HydrophobicContact CD2-CB 3.79Å; Y98-W104 HydrophobicContact CD2-CE3 4.23Å; Y98-W104 HydrophobicContact CE2-CB 4.26Å; Y98-W104 AromaticContact CG-CE3 3.98Å; Y98-W104 HydrophobicContact CG-CE3 3.98Å; W104-F106 AromaticContact CD2-CD2 3.94Å; W104-F106 HydrophobicContact CD2-CD2 3.94Å; W104-F106 AromaticContact CE2-CD2 3.86Å; W104-F106 HydrophobicContact CE3-CD2 4.1Å; W104-F106 HydrophobicContact CH2-CD2 4.08Å; W104-F106 HydrophobicContact CZ2-CB 3.95Å; W104-F106 AromaticContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CG 4.4Å; W104-F106 HydrophobicContact CZ3-CD2 4.17Å; W104-G107 PolarHBondContact NE1-O 3.46Å; W104-L110 HydrophobicContact CZ2-CB 4Å; W104-L110 HydrophobicContact CZ2-CD2 4.28Å; W104-L110 HydrophobicContact CZ2-CG 4.08Å; W104-C111 HydrophobicContact CZ2-CB 4.15Å; W104-T186 HydrophobicContact CB-CG2 4.34Å; W104-T186 WeakPolarHBondContact CB-O 3.37Å; W104-T186 PolarHBondContact N-O 2.93Å; W104-T186 WeakPolarHBondContact O-CB 3.33Å; W104-T186 WeakPolarHBondContact O-CG2 3.2Å; W104-C188 HydrophobicContact CB-CB 3.93Å; W104-C188 HydrophobicContact CD2-CB 3.48Å; W104-C188 VanDerWaalsContact CD2-CB 3.48Å; W104-C188 HydrophobicContact CE3-CB 3.73Å; W104-C188 HydrophobicContact CG-CB 3.54Å
105P92.5Very high92Very high67 Ų6749.3 Ų49.344%0.43525%0.253SS..  trans-86.7-7.2-178.634.6-36.7000113.8F97 H103 G107F97-P105 HydrophobicContact CD1-CG 4.16Å; F97-P105 HydrophobicContact CE1-CG 3.61Å; F97-P105 HydrophobicContact CZ-CG 4.31Å; H103-P105 VanDerWaalsContact O-CD 3.24Å; H103-P105 WeakPolarHBondContact O-CD 3.43Å; P105-G107 VanDerWaalsContact C-N 3.28Å; P105-G107 PolarHBondContact O-N 3.28Å
106F91.7Very high91.9Very high71 Ų7148.7 Ų48.731%0.31125%0.252SS..SBendtrans-85.28.6-165.6-47.5-73.4000115.3F94 F97 W104 L110F94-F106 HydrophobicContact CB-CD2 4.07Å; F94-F106 HydrophobicContact CB-CE2 4.01Å; F94-F106 AromaticContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD2 4.02Å; F94-F106 AromaticContact CD1-CE1 3.8Å; F94-F106 HydrophobicContact CD1-CE1 3.8Å; F94-F106 AromaticContact CD1-CE2 4Å; F94-F106 HydrophobicContact CD1-CE2 4Å; F94-F106 AromaticContact CD1-CG 3.94Å; F94-F106 HydrophobicContact CD1-CG 3.94Å; F94-F106 AromaticContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CE1-CD1 4.22Å; F94-F106 HydrophobicContact CE1-CE1 4.29Å; F94-F106 HydrophobicContact CG-CD2 4.49Å; F97-F106 HydrophobicContact CB-CE2 4.09Å; F97-F106 HydrophobicContact CB-CZ 3.91Å; F97-F106 AromaticContact CD1-CE2 3.72Å; F97-F106 HydrophobicContact CD1-CE2 3.72Å; F97-F106 AromaticContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD2-CZ 4.44Å; F97-F106 HydrophobicContact CE1-CZ 4.31Å; F97-F106 HydrophobicContact CG-CE2 4.1Å; F97-F106 AromaticContact CG-CZ 3.72Å; F97-F106 HydrophobicContact CG-CZ 3.72Å; W104-F106 AromaticContact CD2-CD2 3.94Å; W104-F106 HydrophobicContact CD2-CD2 3.94Å; W104-F106 AromaticContact CE2-CD2 3.86Å; W104-F106 HydrophobicContact CE3-CD2 4.1Å; W104-F106 HydrophobicContact CH2-CD2 4.08Å; W104-F106 HydrophobicContact CZ2-CB 3.95Å; W104-F106 AromaticContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CG 4.4Å; W104-F106 HydrophobicContact CZ3-CD2 4.17Å; F106-L110 HydrophobicContact CB-CB 4.11Å; F106-L110 HydrophobicContact CB-CD2 3.44Å; F106-L110 VanDerWaalsContact CB-CD2 3.44Å; F106-L110 HydrophobicContact CB-CG 4.34Å; F106-L110 HydrophobicContact CD1-CD2 4.38Å; F106-L110 HydrophobicContact CG-CD2 3.91Å
107G90.4Very high91.8Very high38 Ų3848.4 Ų48.439%0.39225%0.252SS..Hα-helixtrans76.3170.5-18000000115.2W104 P105 C111W104-G107 PolarHBondContact NE1-O 3.46Å; P105-G107 VanDerWaalsContact C-N 3.28Å; P105-G107 PolarHBondContact O-N 3.28Å; G107-C111 PolarHBondContact O-N 3.44Å
108D87.8Confident91.6Very high46 Ų4645.4 Ų45.425%0.24624%0.24CC..Hα-helixtrans-67.7-39.7-174.1-175.971.3000112.9L110 C111 K112 T178 T179D108-L110 PolarHBondContact O-N 3.41Å; D108-C111 VanDerWaalsContact O-CB 3.3Å; D108-C111 WeakPolarHBondContact O-CB 3.14Å; D108-C111 PolarHBondContact O-N 2.91Å; D108-C111 VanDerWaalsContact O-N 3.13Å; D108-K112 PolarHBondContact O-N 3.39Å; D108-K112 WeakPolarHBondContact OD2-CE 3.46Å; D108-K112 IonicContact OD2-NZ 2.95Å; D108-K112 PolarHBondContact OD2-NZ 3.14Å; D108-T178 WeakPolarHBondContact OD1-CA 3.38Å; D108-T179 HydrophobicContact CB-CG2 4.32Å; D108-T179 PolarHBondContact OD1-N 2.98Å; D108-T179 VanDerWaalsContact OD1-N 3.07Å
109T90.7Very high91.5Very high105 Ų10546.4 Ų46.464%0.64425%0.245SC*.Hα-helixtrans-57.2-48.8179.7-53.60000111.7C111 K112 I113T109-C111 VanDerWaalsContact C-N 3.29Å; T109-C111 PolarHBondContact O-N 3.26Å; T109-K112 PolarHBondContact O-N 3.18Å; T109-I113 HydrophobicContact CG2-CD1 4.02Å; T109-I113 WeakPolarHBondContact O-CG1 3.34Å; T109-I113 PolarHBondContact O-N 3.42Å
110L91.9Very high91.5Very high41 Ų4146.4 Ų46.422%0.21525%0.245CC..Hα-helixtrans-71-29.2-179.3-162.267.9000111.9F94 W104 F106 D108 K112 I113 S114F94-L110 HydrophobicContact CB-CD2 4.35Å; F94-L110 HydrophobicContact CD1-CD2 3.4Å; F94-L110 HydrophobicContact CD2-CD1 4.49Å; F94-L110 HydrophobicContact CD2-CD2 3.84Å; F94-L110 HydrophobicContact CD2-CG 4.35Å; F94-L110 HydrophobicContact CE1-CD2 3.49Å; F94-L110 VanDerWaalsContact CE1-CD2 3.49Å; F94-L110 HydrophobicContact CE2-CD1 4.25Å; F94-L110 HydrophobicContact CE2-CD2 3.92Å; F94-L110 HydrophobicContact CG-CD2 3.58Å; F94-L110 HydrophobicContact CG-CG 4.4Å; F94-L110 HydrophobicContact CZ-CD2 3.75Å; W104-L110 HydrophobicContact CZ2-CB 4Å; W104-L110 HydrophobicContact CZ2-CD2 4.28Å; W104-L110 HydrophobicContact CZ2-CG 4.08Å; F106-L110 HydrophobicContact CB-CB 4.11Å; F106-L110 HydrophobicContact CB-CD2 3.44Å; F106-L110 VanDerWaalsContact CB-CD2 3.44Å; F106-L110 HydrophobicContact CB-CG 4.34Å; F106-L110 HydrophobicContact CD1-CD2 4.38Å; F106-L110 HydrophobicContact CG-CD2 3.91Å; D108-L110 PolarHBondContact O-N 3.41Å; L110-K112 VanDerWaalsContact C-N 3.35Å; L110-I113 HydrophobicContact CD1-CB 4.47Å; L110-I113 HydrophobicContact CD1-CD1 4.33Å; L110-I113 PolarHBondContact O-N 3.41Å; L110-S114 WeakPolarHBondContact O-CB 3.35Å; L110-S114 PolarHBondContact O-N 3.05Å
111C90.7Very high91.5Very high0 Ų041.3 Ų41.30%022%0.223CC..Hα-helixtrans-60.8-46.3172.3-179.60000111.1W104 G107 D108 T109 S114 G115 T179 C188W104-C111 HydrophobicContact CZ2-CB 4.15Å; G107-C111 PolarHBondContact O-N 3.44Å; D108-C111 VanDerWaalsContact O-CB 3.3Å; D108-C111 WeakPolarHBondContact O-CB 3.14Å; D108-C111 PolarHBondContact O-N 2.91Å; D108-C111 VanDerWaalsContact O-N 3.13Å; T109-C111 VanDerWaalsContact C-N 3.29Å; T109-C111 PolarHBondContact O-N 3.26Å; C111-S114 PolarHBondContact O-N 3.37Å; C111-G115 PolarHBondContact O-N 3.36Å; C111-T179 HydrophobicContact CB-CG2 3.84Å; C111-C188 WeakPolarHBondContact CA-SG 3.34Å; C111-C188 HydrophobicContact CB-CB 3.88Å; C111-C188 WeakPolarHBondContact CB-SG 3.36Å; C111-C188 WeakPolarHBondContact SG-CA 3.49Å; C111-C188 WeakPolarHBondContact SG-CB 3.3Å; C111-C188 CovalentContact SG-SG 2.03Å; C111-C188 PolarHBondContact SG-SG 3.44Å
112K90.4Very high91.5Very high52 Ų5237 Ų3723%0.22620%0.2CC..Hα-helixtrans-66.9-40.7177.4-70.1175172.7160.20112.6D108 T109 L110 G115 T116 S174 S177D108-K112 PolarHBondContact O-N 3.39Å; D108-K112 WeakPolarHBondContact OD2-CE 3.46Å; D108-K112 IonicContact OD2-NZ 2.95Å; D108-K112 PolarHBondContact OD2-NZ 3.14Å; T109-K112 PolarHBondContact O-N 3.18Å; L110-K112 VanDerWaalsContact C-N 3.35Å; K112-G115 PolarHBondContact O-N 3.02Å; K112-T116 VanDerWaalsContact O-CB 3.28Å; K112-T116 WeakPolarHBondContact O-CB 3.5Å; K112-T116 PolarHBondContact O-N 2.85Å; K112-T116 PolarHBondContact O-OG1 2.97Å; K112-S174 PolarHBondContact O-OG 3.12Å; K112-S177 WeakPolarHBondContact CE-O 3.25Å
113I92.9Very high91.7Very high88 Ų8833.1 Ų33.145%0.45119%0.185SC..Hα-helixtrans-60.2-48.6174.5-69.6167.6000110.1T109 L110 G115 T116 A117T109-I113 HydrophobicContact CG2-CD1 4.02Å; T109-I113 WeakPolarHBondContact O-CG1 3.34Å; T109-I113 PolarHBondContact O-N 3.42Å; L110-I113 HydrophobicContact CD1-CB 4.47Å; L110-I113 HydrophobicContact CD1-CD1 4.33Å; L110-I113 PolarHBondContact O-N 3.41Å; I113-G115 PolarHBondContact O-N 2.86Å; I113-T116 PolarHBondContact O-N 3.33Å; I113-A117 WeakPolarHBondContact O-CB 3.45Å; I113-A117 PolarHBondContact O-N 3.38Å
114S92.3Very high92Very high2 Ų230 Ų301%0.01417%0.171CC..Hα-helixtrans-64-41.6179.5-178.40000112.3K95 L110 C111 F118K95-S114 WeakPolarHBondContact CE-OG 3.38Å; K95-S114 WeakPolarHBondContact CG-OG 3.32Å; L110-S114 WeakPolarHBondContact O-CB 3.35Å; L110-S114 PolarHBondContact O-N 3.05Å; C111-S114 PolarHBondContact O-N 3.37Å; S114-F118 WeakPolarHBondContact O-CB 3.39Å; S114-F118 PolarHBondContact O-N 2.95Å
115G89.9Confident92.2Very high2 Ų229.9 Ų29.92%0.02117%0.17CC..Hα-helixtrans-62.9-43.317400000112.9C111 K112 I113 F118 L119C111-G115 PolarHBondContact O-N 3.36Å; K112-G115 PolarHBondContact O-N 3.02Å; I113-G115 PolarHBondContact O-N 2.86Å; G115-F118 PolarHBondContact O-N 3.19Å; G115-L119 WeakPolarHBondContact O-CG 3.32Å; G115-L119 PolarHBondContact O-N 3.48Å
116T91.9Very high92.2Very high19 Ų1926.7 Ų26.712%0.11715%0.149CC..Hα-helixtrans-64.5-45.3177.5-60.10000111.1K112 I113 F118 L119 T120 G170 I171 S174K112-T116 VanDerWaalsContact O-CB 3.28Å; K112-T116 WeakPolarHBondContact O-CB 3.5Å; K112-T116 PolarHBondContact O-N 2.85Å; K112-T116 PolarHBondContact O-OG1 2.97Å; I113-T116 PolarHBondContact O-N 3.33Å; T116-F118 VanDerWaalsContact C-N 3.33Å; T116-F118 PolarHBondContact O-N 2.94Å; T116-L119 PolarHBondContact O-N 2.8Å; T116-T120 WeakPolarHBondContact O-CB 3.24Å; T116-T120 PolarHBondContact O-N 2.99Å; T116-T120 PolarHBondContact O-OG1 3.35Å; T116-G170 PolarHBondContact OG1-O 2.88Å; T116-I171 HydrophobicContact CG2-CG1 3.79Å; T116-S174 PolarHBondContact N-OG 3.35Å; T116-S174 WeakPolarHBondContact OG1-CB 3.29Å; T116-S174 PolarHBondContact OG1-OG 3.14Å
117A94.8Very high92.4Very high17 Ų1725 Ų2514%0.1414%0.143CC..Hα-helixtrans-61.6-41.917800000111.4T91 I113 N121T91-A117 HydrophobicContact CG2-CB 3.74Å; I113-A117 WeakPolarHBondContact O-CB 3.45Å; I113-A117 PolarHBondContact O-N 3.38Å; A117-N121 WeakPolarHBondContact O-CB 3.24Å; A117-N121 PolarHBondContact O-N 3.32Å
118F92.4Very high92.6Very high22 Ų2223.1 Ų23.110%0.09613%0.125CC..Hα-helixtrans-60.7-50.5174.9170.2-100000112.6F88 S114 G115 T116 N121 I122 L297 T301F88-F118 HydrophobicContact CD2-CB 4.2Å; F88-F118 HydrophobicContact CE2-CB 4.02Å; F88-F118 AromaticContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CG 4.39Å; F88-F118 HydrophobicContact CZ-CD2 4.09Å; S114-F118 WeakPolarHBondContact O-CB 3.39Å; S114-F118 PolarHBondContact O-N 2.95Å; G115-F118 PolarHBondContact O-N 3.19Å; T116-F118 VanDerWaalsContact C-N 3.33Å; T116-F118 PolarHBondContact O-N 2.94Å; F118-N121 PolarHBondContact O-N 3.03Å; F118-I122 HydrophobicContact CD2-CD1 4.45Å; F118-I122 HydrophobicContact CE1-CD1 4.11Å; F118-I122 HydrophobicContact CE2-CD1 3.46Å; F118-I122 VanDerWaalsContact CE2-CD1 3.46Å; F118-I122 HydrophobicContact CE2-CG1 3.94Å; F118-I122 HydrophobicContact CZ-CD1 3.24Å; F118-I122 HydrophobicContact CZ-CG1 4.04Å; F118-I122 PolarHBondContact O-N 3.38Å; F118-L297 HydrophobicContact CE1-CD1 4.2Å; F118-L297 HydrophobicContact CE2-CD1 3.38Å; F118-L297 HydrophobicContact CZ-CD1 3.13Å; F118-T301 HydrophobicContact CE2-CG2 4.14Å
119L90.5Very high92.8Very high22 Ų2221 Ų2112%0.11511%0.113CC..Hα-helixtrans-64.8-41.9179-69.9171.8000111.7G115 T116 N121 Y123 A173 F189G115-L119 WeakPolarHBondContact O-CG 3.32Å; G115-L119 PolarHBondContact O-N 3.48Å; T116-L119 PolarHBondContact O-N 2.8Å; L119-N121 VanDerWaalsContact C-N 3.3Å; L119-N121 PolarHBondContact O-N 3.45Å; L119-Y123 HydrophobicContact CD2-CE2 3.95Å; L119-Y123 VanDerWaalsContact O-CD2 3.3Å; L119-Y123 WeakPolarHBondContact O-CD2 3.19Å; L119-Y123 PolarHBondContact O-N 3.3Å; L119-Y123 VanDerWaalsContact O-N 3.1Å; L119-A173 HydrophobicContact CD1-CB 3.55Å; L119-F189 HydrophobicContact CD1-CZ 4.25Å
120T93.4Very high93Very high5 Ų516.4 Ų16.43%0.0319%0.085CC..Hα-helixtrans-60.6-41.5176.2-68.60000111T116 G124 W163 V166 L167T116-T120 WeakPolarHBondContact O-CB 3.24Å; T116-T120 PolarHBondContact O-N 2.99Å; T116-T120 PolarHBondContact O-OG1 3.35Å; T120-G124 WeakPolarHBondContact O-CA 3.49Å; T120-G124 PolarHBondContact O-N 3.43Å; T120-W163 HydrophobicContact CG2-CE3 4.17Å; T120-W163 HydrophobicContact CG2-CH2 4.48Å; T120-W163 HydrophobicContact CG2-CZ3 3.57Å; T120-V166 HydrophobicContact CG2-CG2 3.82Å; T120-L167 HydrophobicContact CG2-CD2 4.12Å
121N95.2Very high93.1Very high0 Ų015.5 Ų15.50%08%0.082CC..Hα-helixtrans-66-55.8176.1178.3-98.3000112.5S84 D85 F88 A117 F118 L119 Y123 G124 S125 N303S84-N121 PolarHBondContact O-ND2 3.01Å; S84-N121 WeakPolarHBondContact OG-CA 3.25Å; D85-N121 WeakPolarHBondContact CA-ND2 3.47Å; D85-N121 PolarHBondContact OD1-ND2 3.35Å; F88-N121 HydrophobicContact CB-CB 3.52Å; F88-N121 HydrophobicContact CD1-CB 4.26Å; F88-N121 HydrophobicContact CD2-CB 4.47Å; F88-N121 HydrophobicContact CG-CB 3.85Å; A117-N121 WeakPolarHBondContact O-CB 3.24Å; A117-N121 PolarHBondContact O-N 3.32Å; F118-N121 PolarHBondContact O-N 3.03Å; L119-N121 VanDerWaalsContact C-N 3.3Å; L119-N121 PolarHBondContact O-N 3.45Å; N121-Y123 PolarHBondContact O-N 3.4Å; N121-G124 PolarHBondContact O-N 3.15Å; N121-S125 VanDerWaalsContact O-CB 3.25Å; N121-S125 WeakPolarHBondContact O-CB 3.32Å; N121-S125 PolarHBondContact O-N 2.93Å; N121-S125 PolarHBondContact O-OG 3.36Å; N121-N303 PolarHBondContact OD1-ND2 3.44Å
122I92.7Very high93.2Very high1 Ų115.5 Ų15.51%0.0058%0.082CC..Hα-helixtrans-56.7-52.5-176.5-79.8-159.6000111.8F118 M126 Y265 A300F118-I122 HydrophobicContact CD2-CD1 4.45Å; F118-I122 HydrophobicContact CE1-CD1 4.11Å; F118-I122 HydrophobicContact CE2-CD1 3.46Å; F118-I122 VanDerWaalsContact CE2-CD1 3.46Å; F118-I122 HydrophobicContact CE2-CG1 3.94Å; F118-I122 HydrophobicContact CZ-CD1 3.24Å; F118-I122 HydrophobicContact CZ-CG1 4.04Å; F118-I122 PolarHBondContact O-N 3.38Å; I122-M126 HydrophobicContact CG2-CE 3.23Å; I122-M126 WeakPolarHBondContact O-CE 3.31Å; I122-M126 WeakPolarHBondContact O-CG 3.39Å; I122-M126 PolarHBondContact O-N 2.9Å; I122-Y265 HydrophobicContact CD1-CD1 3.85Å; I122-Y265 HydrophobicContact CD1-CE1 3.54Å; I122-Y265 HydrophobicContact CG2-CD1 4.44Å; I122-Y265 HydrophobicContact CG2-CE1 4.19Å; I122-A300 HydrophobicContact CD1-CB 3.78Å
123Y93.3Very high93.2Very high29 Ų2913.4 Ų13.411%0.1147%0.074CC..Hα-helixtrans-77.3-32.9-178.1-65.1-70.6000112.3L119 N121 M126 L127 I208 E209L119-Y123 HydrophobicContact CD2-CE2 3.95Å; L119-Y123 VanDerWaalsContact O-CD2 3.3Å; L119-Y123 WeakPolarHBondContact O-CD2 3.19Å; L119-Y123 PolarHBondContact O-N 3.3Å; L119-Y123 VanDerWaalsContact O-N 3.1Å; N121-Y123 PolarHBondContact O-N 3.4Å; Y123-M126 HydrophobicContact CD1-CE 4.01Å; Y123-M126 HydrophobicContact CE1-CE 4.27Å; Y123-M126 PolarHBondContact O-N 2.85Å; Y123-L127 WeakPolarHBondContact O-CB 3.46Å; Y123-L127 VanDerWaalsContact O-CG 3.31Å; Y123-L127 WeakPolarHBondContact O-CG 3.25Å; Y123-L127 PolarHBondContact O-N 3.37Å; Y123-I208 HydrophobicContact CE1-CG2 3.83Å; Y123-I208 HydrophobicContact CE2-CG2 3.97Å; Y123-I208 WeakPolarHBondContact OH-CG2 3.39Å; Y123-E209 PolarHBondContact OH-OE1 3.41Å
124G95.5Very high93.2Very high0 Ų011.3 Ų11.30%07%0.065CC..Hα-helixtrans-61.2-48.8174.400000111.2T120 N121 M126 L127 F128T120-G124 WeakPolarHBondContact O-CA 3.49Å; T120-G124 PolarHBondContact O-N 3.43Å; N121-G124 PolarHBondContact O-N 3.15Å; G124-M126 PolarHBondContact O-N 3.14Å; G124-L127 PolarHBondContact O-N 2.89Å; G124-F128 WeakPolarHBondContact O-CB 3.29Å; G124-F128 WeakPolarHBondContact O-CD2 3.32Å; G124-F128 WeakPolarHBondContact O-CG 3.35Å; G124-F128 PolarHBondContact O-N 3.15Å
125S94.8Very high93.2Very high0 Ų011.6 Ų11.60%07%0.066CC..Hα-helixtrans-62-43.5178.8-61.70000111.6L81 D85 N121 L127 F128 L129 N303L81-S125 VanDerWaalsContact CD1-OG 3.29Å; L81-S125 WeakPolarHBondContact CD1-OG 3.42Å; D85-S125 PolarHBondContact OD1-OG 3.23Å; N121-S125 VanDerWaalsContact O-CB 3.25Å; N121-S125 WeakPolarHBondContact O-CB 3.32Å; N121-S125 PolarHBondContact O-N 2.93Å; N121-S125 PolarHBondContact O-OG 3.36Å; S125-L127 PolarHBondContact O-N 3.28Å; S125-F128 PolarHBondContact O-N 3.36Å; S125-L129 WeakPolarHBondContact O-CB 3.48Å; S125-L129 WeakPolarHBondContact O-CG 3.28Å; S125-L129 PolarHBondContact O-N 3.01Å; S125-N303 PolarHBondContact OG-OD1 2.88Å
126M93.8Very high93.2Very high0 Ų013.8 Ų13.80%07%0.074CC..Hα-helixtrans-58.1-46.7173.1-77.3-171.7-110.200112.8I122 Y123 G124 T130 F213 F258 F262 N266I122-M126 HydrophobicContact CG2-CE 3.23Å; I122-M126 WeakPolarHBondContact O-CE 3.31Å; I122-M126 WeakPolarHBondContact O-CG 3.39Å; I122-M126 PolarHBondContact O-N 2.9Å; Y123-M126 HydrophobicContact CD1-CE 4.01Å; Y123-M126 HydrophobicContact CE1-CE 4.27Å; Y123-M126 PolarHBondContact O-N 2.85Å; G124-M126 PolarHBondContact O-N 3.14Å; M126-T130 WeakPolarHBondContact O-CB 3.36Å; M126-T130 PolarHBondContact O-N 2.97Å; M126-T130 PolarHBondContact O-OG1 3.19Å; M126-F213 HydrophobicContact SD-CD2 3.96Å; M126-F258 HydrophobicContact CB-CE2 4.04Å; M126-F258 HydrophobicContact CG-CE2 3.89Å; M126-F258 HydrophobicContact CG-CZ 4.43Å; M126-F262 HydrophobicContact CE-CB 4.17Å; M126-F262 HydrophobicContact CE-CD1 3.8Å; M126-F262 HydrophobicContact CE-CG 4.14Å; M126-F262 HydrophobicContact CG-CB 3.94Å; M126-F262 HydrophobicContact CG-CD1 3.66Å; M126-F262 HydrophobicContact CG-CD2 3.61Å; M126-F262 HydrophobicContact CG-CE1 4.04Å; M126-F262 HydrophobicContact CG-CE2 4.06Å; M126-F262 HydrophobicContact CG-CG 3.43Å; M126-F262 VanDerWaalsContact CG-CG 3.43Å; M126-F262 HydrophobicContact CG-CZ 4.24Å; M126-F262 HydrophobicContact SD-CB 3.8Å; M126-F262 HydrophobicContact SD-CD1 4.19Å; M126-F262 HydrophobicContact SD-CG 3.94Å; M126-N266 VanDerWaalsContact CE-ND2 3.26Å; M126-N266 WeakPolarHBondContact CE-ND2 3.3Å
127L95.2Very high93.2Very high35 Ų3514.8 Ų14.818%0.1838%0.077CC..Hα-helixtrans-69.4-42.3-179.1-70.6173.2000112Y123 G124 S125 L129 T130 C131 V162 L165 V166 P216Y123-L127 WeakPolarHBondContact O-CB 3.46Å; Y123-L127 VanDerWaalsContact O-CG 3.31Å; Y123-L127 WeakPolarHBondContact O-CG 3.25Å; Y123-L127 PolarHBondContact O-N 3.37Å; G124-L127 PolarHBondContact O-N 2.89Å; S125-L127 PolarHBondContact O-N 3.28Å; L127-L129 PolarHBondContact O-N 3.4Å; L127-T130 CarbonylContact O-C 3.59Å; L127-T130 WeakPolarHBondContact O-CA 3.24Å; L127-T130 VanDerWaalsContact O-CB 3.3Å; L127-T130 WeakPolarHBondContact O-CB 3.46Å; L127-T130 PolarHBondContact O-N 3.49Å; L127-T130 VanDerWaalsContact O-N 3.16Å; L127-C131 PolarHBondContact O-N 2.97Å; L127-C131 PolarHBondContact O-SG 3.33Å; L127-V162 HydrophobicContact CB-CG1 3.82Å; L127-V162 HydrophobicContact CB-CG2 4.17Å; L127-V162 HydrophobicContact CD1-CG1 4.02Å; L127-L165 HydrophobicContact CD1-CD2 3.98Å; L127-V166 HydrophobicContact CD1-CG1 3.78Å; L127-P216 HydrophobicContact CD2-CG 3.85Å
128F95.1Very high93Very high0 Ų015.6 Ų15.60%08%0.078CC..Hα-helixtrans-64.3-40.6176.3-71.4-52.5000112.2F77 N80 L81 G124 S125 T130 C131 I132 C159 V162 W163F77-F128 HydrophobicContact CD1-CD1 4.42Å; N80-F128 HydrophobicContact CB-CD1 4.15Å; N80-F128 HydrophobicContact CB-CD2 4.47Å; N80-F128 HydrophobicContact CB-CE1 3.58Å; N80-F128 HydrophobicContact CB-CE2 3.95Å; N80-F128 HydrophobicContact CB-CZ 3.49Å; N80-F128 VanDerWaalsContact CB-CZ 3.49Å; L81-F128 HydrophobicContact CB-CB 4.19Å; L81-F128 HydrophobicContact CB-CD2 4.44Å; L81-F128 HydrophobicContact CD1-CB 4.31Å; G124-F128 WeakPolarHBondContact O-CB 3.29Å; G124-F128 WeakPolarHBondContact O-CD2 3.32Å; G124-F128 WeakPolarHBondContact O-CG 3.35Å; G124-F128 PolarHBondContact O-N 3.15Å; S125-F128 PolarHBondContact O-N 3.36Å; F128-T130 VanDerWaalsContact C-N 3.29Å; F128-T130 PolarHBondContact O-N 3.47Å; F128-C131 WeakPolarHBondContact O-CB 3.11Å; F128-C131 PolarHBondContact O-N 2.93Å; F128-I132 VanDerWaalsContact O-CG1 3.28Å; F128-I132 WeakPolarHBondContact O-CG1 3.42Å; F128-I132 PolarHBondContact O-N 3.31Å; F128-C159 HydrophobicContact CE1-CB 4.1Å; F128-V162 HydrophobicContact CD1-CG1 4.32Å; F128-V162 HydrophobicContact CE1-CB 4.01Å; F128-V162 HydrophobicContact CE1-CG1 3.82Å; F128-V162 HydrophobicContact CE1-CG2 4.47Å; F128-V162 HydrophobicContact CE2-CG1 4.02Å; F128-V162 HydrophobicContact CZ-CB 4.13Å; F128-V162 HydrophobicContact CZ-CG1 3.63Å; F128-W163 HydrophobicContact CE2-CZ2 4.45Å; F128-W163 AromaticContact CZ-NE1 3.75Å
129L92.2Very high92.8Very high1 Ų115.6 Ų15.61%0.0058%0.083CC..Hα-helixtrans-61.8-39.3172.4-70.3172.6000111.8L81 S125 L127 I132 S133 F258 F262 I310L81-L129 HydrophobicContact CD2-CD2 4.01Å; L81-L129 HydrophobicContact CD2-CG 4.43Å; S125-L129 WeakPolarHBondContact O-CB 3.48Å; S125-L129 WeakPolarHBondContact O-CG 3.28Å; S125-L129 PolarHBondContact O-N 3.01Å; L127-L129 PolarHBondContact O-N 3.4Å; L129-I132 HydrophobicContact CD2-CD1 4.45Å; L129-I132 PolarHBondContact O-N 3.45Å; L129-S133 PolarHBondContact O-N 3.42Å; L129-S133 PolarHBondContact O-OG 2.77Å; L129-F258 HydrophobicContact CB-CD2 4.5Å; L129-F258 HydrophobicContact CD1-CD2 4.41Å; L129-F262 HydrophobicContact CD1-CE2 3.59Å; L129-F262 HydrophobicContact CD1-CZ 4.34Å; L129-I310 HydrophobicContact CD2-CD1 3.51Å; L129-I310 HydrophobicContact CD2-CG2 4.38Å
130T93.9Very high92.6Very high8 Ų815.7 Ų15.75%0.0498%0.083CC..Hα-helixtrans-61.7-46.4173.2-51.80000111.5M126 L127 F128 I132 S133 V134 P216 L219 N220M126-T130 WeakPolarHBondContact O-CB 3.36Å; M126-T130 PolarHBondContact O-N 2.97Å; M126-T130 PolarHBondContact O-OG1 3.19Å; L127-T130 CarbonylContact O-C 3.59Å; L127-T130 WeakPolarHBondContact O-CA 3.24Å; L127-T130 VanDerWaalsContact O-CB 3.3Å; L127-T130 WeakPolarHBondContact O-CB 3.46Å; L127-T130 PolarHBondContact O-N 3.49Å; L127-T130 VanDerWaalsContact O-N 3.16Å; F128-T130 VanDerWaalsContact C-N 3.29Å; F128-T130 PolarHBondContact O-N 3.47Å; T130-I132 VanDerWaalsContact C-N 3.29Å; T130-I132 PolarHBondContact O-N 2.72Å; T130-S133 PolarHBondContact O-N 3.45Å; T130-S133 VanDerWaalsContact O-N 3.16Å; T130-V134 HydrophobicContact CG2-CG2 4.42Å; T130-V134 WeakPolarHBondContact O-CG2 3.47Å; T130-V134 PolarHBondContact O-N 2.91Å; T130-P216 WeakPolarHBondContact OG1-CB 3.23Å; T130-L219 HydrophobicContact CG2-CB 3.63Å; T130-L219 HydrophobicContact CG2-CD1 3.86Å; T130-L219 HydrophobicContact CG2-CG 4.42Å; T130-N220 PolarHBondContact OG1-ND2 3.38Å
131C94.7Very high92.4Very high22 Ų2217 Ų1715%0.1499%0.091CC..Hα-helixtrans-58.9-40.9176-670000111.5F77 L127 F128 V134 D135F77-C131 HydrophobicContact CD1-CB 3.62Å; F77-C131 HydrophobicContact CD2-CB 4.22Å; F77-C131 HydrophobicContact CE1-CB 3.7Å; F77-C131 HydrophobicContact CE2-CB 4.28Å; F77-C131 HydrophobicContact CG-CB 3.92Å; F77-C131 HydrophobicContact CZ-CB 4.04Å; L127-C131 PolarHBondContact O-N 2.97Å; L127-C131 PolarHBondContact O-SG 3.33Å; F128-C131 WeakPolarHBondContact O-CB 3.11Å; F128-C131 PolarHBondContact O-N 2.93Å; C131-V134 PolarHBondContact O-N 3.46Å; C131-D135 VanDerWaalsContact O-CB 3.24Å; C131-D135 WeakPolarHBondContact O-CB 3.35Å; C131-D135 PolarHBondContact O-N 3.17Å
132I91.8Very high92Very high0 Ų022.6 Ų22.60%011%0.113CC..Hα-helixtrans-63.1-46.5174.9-66.2162.3000110.4T74 F77 I78 L81 F128 L129 T130 V134 D135 R136T74-I132 HydrophobicContact CG2-CG1 4.27Å; T74-I132 HydrophobicContact CG2-CG2 3.96Å; F77-I132 HydrophobicContact CB-CD1 4.27Å; F77-I132 HydrophobicContact CB-CG1 3.69Å; F77-I132 HydrophobicContact CG-CG1 4.46Å; I78-I132 HydrophobicContact CG1-CD1 3.73Å; I78-I132 HydrophobicContact CG1-CG1 4.44Å; L81-I132 HydrophobicContact CD2-CD1 4.49Å; F128-I132 VanDerWaalsContact O-CG1 3.28Å; F128-I132 WeakPolarHBondContact O-CG1 3.42Å; F128-I132 PolarHBondContact O-N 3.31Å; L129-I132 HydrophobicContact CD2-CD1 4.45Å; L129-I132 PolarHBondContact O-N 3.45Å; T130-I132 VanDerWaalsContact C-N 3.29Å; T130-I132 PolarHBondContact O-N 2.72Å; I132-V134 PolarHBondContact O-N 3.22Å; I132-D135 PolarHBondContact O-N 2.95Å; I132-R136 VanDerWaalsContact O-CG 3.25Å; I132-R136 WeakPolarHBondContact O-CG 3.5Å; I132-R136 PolarHBondContact O-N 2.98Å
133S91.5Very high91.5Very high9 Ų924.9 Ų24.96%0.06313%0.128CC..Hα-helixtrans-60.3-43177.4-68.20000112.5L129 T130 R136 F137 N220L129-S133 PolarHBondContact O-N 3.42Å; L129-S133 PolarHBondContact O-OG 2.77Å; T130-S133 PolarHBondContact O-N 3.45Å; T130-S133 VanDerWaalsContact O-N 3.16Å; S133-R136 PolarHBondContact O-N 2.79Å; S133-F137 WeakPolarHBondContact O-CB 3.33Å; S133-F137 PolarHBondContact O-N 2.73Å; S133-N220 VanDerWaalsContact CB-OD1 3.29Å; S133-N220 WeakPolarHBondContact CB-OD1 3.48Å; S133-N220 PolarHBondContact OG-OD1 3.09Å
134V93.3Very high91.1Very high44 Ų4430.9 Ų30.927%0.26716%0.155SC..Hα-helixtrans-66.8-43.7176.2172.70000111.2T130 C131 I132 R136 F137 L138T130-V134 HydrophobicContact CG2-CG2 4.42Å; T130-V134 WeakPolarHBondContact O-CG2 3.47Å; T130-V134 PolarHBondContact O-N 2.91Å; C131-V134 PolarHBondContact O-N 3.46Å; I132-V134 PolarHBondContact O-N 3.22Å; V134-R136 VanDerWaalsContact C-N 3.28Å; V134-R136 PolarHBondContact O-N 3.15Å; V134-F137 WeakPolarHBondContact O-CB 3.4Å; V134-F137 PolarHBondContact O-N 3.4Å; V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.33Å; V134-L138 WeakPolarHBondContact O-CG 3.32Å; V134-L138 PolarHBondContact O-N 3.39Å
135D91.7Very high90.7Very high7 Ų740.4 Ų40.44%0.03719%0.191CC..Hα-helixtrans-56.7-43.7176.1177.466.7000111.1T74 F77 C131 I132 L138 A139 R150T74-D135 PolarHBondContact OG1-OD2 3.4Å; F77-D135 HydrophobicContact CE2-CB 4.18Å; C131-D135 VanDerWaalsContact O-CB 3.24Å; C131-D135 WeakPolarHBondContact O-CB 3.35Å; C131-D135 PolarHBondContact O-N 3.17Å; I132-D135 PolarHBondContact O-N 2.95Å; D135-L138 PolarHBondContact O-N 3.13Å; D135-A139 WeakPolarHBondContact O-CB 3.3Å; D135-A139 PolarHBondContact O-N 3.34Å; D135-R150 VanDerWaalsContact CG-NH2 3.27Å; D135-R150 PolarHBondContact O-NE 3.25Å; D135-R150 IonicContact OD1-CZ 3.87Å; D135-R150 VanDerWaalsContact OD1-CZ 3.26Å; D135-R150 IonicContact OD1-NE 2.66Å; D135-R150 PolarHBondContact OD1-NE 3Å; D135-R150 IonicContact OD1-NH2 2.93Å; D135-R150 PolarHBondContact OD1-NH2 3.45Å; D135-R150 IonicContact OD2-CZ 2.71Å; D135-R150 IonicContact OD2-NE 2.74Å; D135-R150 IonicContact OD2-NH2 3.26Å; D135-R150 PolarHBondContact OD2-NH2 3.25Å
136R89.3Confident90.4Very high49 Ų4940.6 Ų40.619%0.18519%0.192CC..Hα-helixtrans-69.3-39.2177.2-64.8-58.2-175.7-172.9-3.6112.9T74 I132 S133 V134 A139 I140 M250 T314T74-R136 PolarHBondContact OG1-NH2 3.42Å; I132-R136 VanDerWaalsContact O-CG 3.25Å; I132-R136 WeakPolarHBondContact O-CG 3.5Å; I132-R136 PolarHBondContact O-N 2.98Å; S133-R136 PolarHBondContact O-N 2.79Å; V134-R136 VanDerWaalsContact C-N 3.28Å; V134-R136 PolarHBondContact O-N 3.15Å; R136-A139 WeakPolarHBondContact O-CB 3.3Å; R136-A139 PolarHBondContact O-N 2.85Å; R136-I140 WeakPolarHBondContact O-CD1 3.34Å; R136-I140 WeakPolarHBondContact O-CG1 3.29Å; R136-I140 PolarHBondContact O-N 2.78Å; R136-I140 VanDerWaalsContact O-N 3.15Å; R136-M250 HydrophobicContact CB-CE 4.23Å; R136-M250 HydrophobicContact CG-CE 3.47Å; R136-M250 VanDerWaalsContact CG-CE 3.47Å; R136-M250 HydrophobicContact CG-SD 4.29Å; R136-M250 PolarHBondContact NE-SD 3.43Å; R136-M250 VanDerWaalsContact NE-SD 3.38Å; R136-T314 PolarHBondContact NH2-O 3.22Å
137F91.4Very high90Very high39 Ų3949.4 Ų49.417%0.17123%0.225CC..Hα-helixtrans-57-51.9171.4164.7-98.4000111.9S133 V134 A139 I140 V141 Y142 C223 V226 V227S133-F137 WeakPolarHBondContact O-CB 3.33Å; S133-F137 PolarHBondContact O-N 2.73Å; V134-F137 WeakPolarHBondContact O-CB 3.4Å; V134-F137 PolarHBondContact O-N 3.4Å; F137-A139 VanDerWaalsContact C-N 3.32Å; F137-A139 PolarHBondContact O-N 3.07Å; F137-I140 PolarHBondContact O-N 2.89Å; F137-V141 HydrophobicContact CD2-CB 4.22Å; F137-V141 HydrophobicContact CD2-CG2 3.61Å; F137-V141 HydrophobicContact CE2-CB 4.04Å; F137-V141 HydrophobicContact CE2-CG1 4.13Å; F137-V141 HydrophobicContact CE2-CG2 3.74Å; F137-V141 HydrophobicContact CG-CG2 4.45Å; F137-V141 HydrophobicContact CZ-CG1 4.46Å; F137-V141 VanDerWaalsContact O-CB 3.3Å; F137-V141 WeakPolarHBondContact O-CB 3.41Å; F137-V141 WeakPolarHBondContact O-CG2 3.24Å; F137-V141 PolarHBondContact O-N 3.29Å; F137-Y142 HydrophobicContact CE1-CD2 4.22Å; F137-Y142 AromaticContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE2-CE2 4.46Å; F137-Y142 HydrophobicContact CZ-CD2 4.28Å; F137-Y142 AromaticContact CZ-CE2 3.61Å; F137-Y142 HydrophobicContact CZ-CE2 3.61Å; F137-C223 HydrophobicContact CB-CB 3.93Å; F137-C223 HydrophobicContact CG-CB 4.38Å; F137-V226 HydrophobicContact CD2-CB 4.13Å; F137-V226 HydrophobicContact CD2-CG1 4.19Å; F137-V226 HydrophobicContact CE2-CB 3.93Å; F137-V226 HydrophobicContact CE2-CG1 3.71Å; F137-V226 HydrophobicContact CE2-CG2 4.47Å; F137-V227 VanDerWaalsContact CA-CG2 3.44Å; F137-V227 HydrophobicContact CB-CG2 3.9Å; F137-V227 HydrophobicContact CD2-CG2 4.3Å
138L91.4Very high89.6Confident34 Ų3452.9 Ų52.918%0.17825%0.248CC..Hα-helixtrans-61.7-41179.2-69.8175.9000111.9V134 D135 I140 Y142 S146 I149 R150V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.33Å; V134-L138 WeakPolarHBondContact O-CG 3.32Å; V134-L138 PolarHBondContact O-N 3.39Å; D135-L138 PolarHBondContact O-N 3.13Å; L138-I140 VanDerWaalsContact C-N 3.33Å; L138-I140 PolarHBondContact O-N 3.46Å; L138-Y142 HydrophobicContact CD2-CD2 4.37Å; L138-Y142 CarbonylContact O-C 3.23Å; L138-Y142 VanDerWaalsContact O-C 3.23Å; L138-Y142 WeakPolarHBondContact O-CA 3.09Å; L138-Y142 PolarHBondContact O-N 3.27Å; L138-Y142 VanDerWaalsContact O-N 3.13Å; L138-S146 WeakPolarHBondContact O-CB 3.45Å; L138-S146 PolarHBondContact O-OG 3.45Å; L138-S146 VanDerWaalsContact O-OG 3.09Å; L138-I149 HydrophobicContact CD1-CG2 4.36Å; L138-R150 HydrophobicContact CB-CG 4.24Å; L138-R150 HydrophobicContact CD1-CG 4.33Å
139A88.3Confident89.4Confident22 Ų2257.2 Ų57.218%0.18227%0.271CS..Hα-helixtrans-58.2-42.217800000113.6D135 R136 F137D135-A139 WeakPolarHBondContact O-CB 3.3Å; D135-A139 PolarHBondContact O-N 3.34Å; R136-A139 WeakPolarHBondContact O-CB 3.3Å; R136-A139 PolarHBondContact O-N 2.85Å; F137-A139 VanDerWaalsContact C-N 3.32Å; F137-A139 PolarHBondContact O-N 3.07Å
140I86.6Confident89.4Confident25 Ų2559.5 Ų59.513%0.12828%0.279CS..Hα-helixtrans-95.8-40.1-168.1-65.6163000111.3R136 F137 L138 V227 T230 L231 I240 V247R136-I140 WeakPolarHBondContact O-CD1 3.34Å; R136-I140 WeakPolarHBondContact O-CG1 3.29Å; R136-I140 PolarHBondContact O-N 2.78Å; R136-I140 VanDerWaalsContact O-N 3.15Å; F137-I140 PolarHBondContact O-N 2.89Å; L138-I140 VanDerWaalsContact C-N 3.33Å; L138-I140 PolarHBondContact O-N 3.46Å; I140-V227 HydrophobicContact CB-CG1 4.47Å; I140-V227 HydrophobicContact CD1-CG1 3.46Å; I140-V227 VanDerWaalsContact CD1-CG1 3.46Å; I140-V227 HydrophobicContact CG2-CG1 4.32Å; I140-T230 HydrophobicContact CG2-CG2 4.06Å; I140-L231 HydrophobicContact CG2-CD2 4.19Å; I140-L231 HydrophobicContact CG2-CG 4.49Å; I140-I240 HydrophobicContact CG2-CD1 4.37Å; I140-V247 HydrophobicContact CD1-CG1 3.53Å
141V88.1Confident89.3Confident33 Ų3361.2 Ų61.220%0.229%0.289CS..Hα-helixtrans-85-33-175.4-175.30000111.2F137 P143 V226 V227F137-V141 HydrophobicContact CD2-CB 4.22Å; F137-V141 HydrophobicContact CD2-CG2 3.61Å; F137-V141 HydrophobicContact CE2-CB 4.04Å; F137-V141 HydrophobicContact CE2-CG1 4.13Å; F137-V141 HydrophobicContact CE2-CG2 3.74Å; F137-V141 HydrophobicContact CG-CG2 4.45Å; F137-V141 HydrophobicContact CZ-CG1 4.46Å; F137-V141 VanDerWaalsContact O-CB 3.3Å; F137-V141 WeakPolarHBondContact O-CB 3.41Å; F137-V141 WeakPolarHBondContact O-CG2 3.24Å; F137-V141 PolarHBondContact O-N 3.29Å; V141-P143 VanDerWaalsContact C-CD 3.5Å; V141-V226 HydrophobicContact CG1-CG1 4.49Å; V141-V226 HydrophobicContact CG2-CG1 3.97Å; V141-V227 HydrophobicContact CG2-CG2 4.5Å
142Y87.4Confident89.1Confident116 Ų11666.1 Ų66.146%0.45531%0.305SS..  trans-130.759.4-177.4-57.8-70.9000112.4F137 L138 F144 R145 S146F137-Y142 HydrophobicContact CE1-CD2 4.22Å; F137-Y142 AromaticContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE2-CE2 4.46Å; F137-Y142 HydrophobicContact CZ-CD2 4.28Å; F137-Y142 AromaticContact CZ-CE2 3.61Å; F137-Y142 HydrophobicContact CZ-CE2 3.61Å; L138-Y142 HydrophobicContact CD2-CD2 4.37Å; L138-Y142 CarbonylContact O-C 3.23Å; L138-Y142 VanDerWaalsContact O-C 3.23Å; L138-Y142 WeakPolarHBondContact O-CA 3.09Å; L138-Y142 PolarHBondContact O-N 3.27Å; L138-Y142 VanDerWaalsContact O-N 3.13Å; Y142-F144 VanDerWaalsContact C-N 3.29Å; Y142-F144 PolarHBondContact O-N 2.94Å; Y142-F144 VanDerWaalsContact O-N 3.17Å; Y142-R145 PolarHBondContact O-N 3.49Å; Y142-S146 WeakPolarHBondContact O-CB 3.45Å; Y142-S146 PolarHBondContact O-N 3.43Å; Y142-S146 PolarHBondContact O-OG 3.28Å
143P82.8Confident89.2Confident50 Ų5075.3 Ų75.333%0.32534%0.34SS..THydrogen-bonded Turntrans-60.7-31-169.923.4-34.6000114.7V141V141-P143 VanDerWaalsContact C-CD 3.5Å
144F84.9Confident89.3Confident154 Ų15477.8 Ų77.868%0.67535%0.352SS*.THydrogen-bonded Turntrans-87-49.8179-58.2-69.9000112.3Y142 S146 R147Y142-F144 VanDerWaalsContact C-N 3.29Å; Y142-F144 PolarHBondContact O-N 2.94Å; Y142-F144 VanDerWaalsContact O-N 3.17Å; F144-S146 VanDerWaalsContact C-N 3.31Å; F144-S146 PolarHBondContact O-N 3.28Å; F144-R147 PolarHBondContact O-N 3.45Å
145R86.3Confident89.4Confident201 Ų20175.9 Ų75.976%0.75834%0.341SS*.G310 helixtrans-68.3-29.2-177.9-168.9175.4-178.5170.11112.7Y142 R147 T148Y142-R145 PolarHBondContact O-N 3.49Å; R145-R147 VanDerWaalsContact C-N 3.3Å; R145-R147 PolarHBondContact O-N 2.87Å; R145-T148 PolarHBondContact O-OG1 2.89Å
146S88Confident89.5Confident3 Ų377.8 Ų77.82%0.02136%0.358CS..G310 helixtrans-75.3-14.1-178.766.80000114.2L138 Y142 F144 T148 I149 R150L138-S146 WeakPolarHBondContact O-CB 3.45Å; L138-S146 PolarHBondContact O-OG 3.45Å; L138-S146 VanDerWaalsContact O-OG 3.09Å; Y142-S146 WeakPolarHBondContact O-CB 3.45Å; Y142-S146 PolarHBondContact O-N 3.43Å; Y142-S146 PolarHBondContact O-OG 3.28Å; F144-S146 VanDerWaalsContact C-N 3.31Å; F144-S146 PolarHBondContact O-N 3.28Å; S146-T148 VanDerWaalsContact C-N 3.26Å; S146-T148 PolarHBondContact O-N 3.48Å; S146-I149 PolarHBondContact O-N 2.93Å; S146-I149 VanDerWaalsContact O-N 3.07Å; S146-R150 VanDerWaalsContact O-CB 3.32Å; S146-R150 WeakPolarHBondContact O-CB 3.39Å; S146-R150 WeakPolarHBondContact O-CG 3.5Å; S146-R150 PolarHBondContact O-N 2.9Å
147R85.3Confident89.9Confident185 Ų18580.1 Ų80.170%0.69837%0.373SS*.G310 helixtrans-58.5-34.9-178.5-75-177.1176.2-169.8-2.5113.6F144 R145F144-R147 PolarHBondContact O-N 3.45Å; R145-R147 VanDerWaalsContact C-N 3.3Å; R145-R147 PolarHBondContact O-N 2.87Å
148T88.6Confident90.2Very high109 Ų10981.4 Ų81.467%0.66938%0.384SS*.G310 helixtrans-78.6-24.7178.953.10000112.9R145 S146 T151 N154R145-T148 PolarHBondContact O-OG1 2.89Å; S146-T148 VanDerWaalsContact C-N 3.26Å; S146-T148 PolarHBondContact O-N 3.48Å; T148-T151 WeakPolarHBondContact O-CG2 3.32Å; T148-N154 PolarHBondContact O-ND2 3.3Å
149I90.3Very high90.5Very high91 Ų9180 Ų8047%0.46738%0.376SS..THydrogen-bonded Turntrans-88.4-45.5180-59.2175000110.3L138 S146 T151 N154L138-I149 HydrophobicContact CD1-CG2 4.36Å; S146-I149 PolarHBondContact O-N 2.93Å; S146-I149 VanDerWaalsContact O-N 3.07Å; I149-T151 PolarHBondContact O-N 3.21Å; I149-N154 VanDerWaalsContact O-CB 3.3Å; I149-N154 WeakPolarHBondContact O-CB 3.39Å; I149-N154 PolarHBondContact O-ND2 2.84Å
150R91.8Very high90.9Very high48 Ų4881.2 Ų81.218%0.18139%0.387CS..SBendtrans-80.967-178.7-61.7178.971.4-135.5-3.4110.1E73 D135 L138 S146E73-R150 HydrophobicContact CG-CB 4.39Å; E73-R150 VanDerWaalsContact CG-O 3.32Å; E73-R150 WeakPolarHBondContact CG-O 3.45Å; D135-R150 VanDerWaalsContact CG-NH2 3.27Å; D135-R150 PolarHBondContact O-NE 3.25Å; D135-R150 IonicContact OD1-CZ 3.87Å; D135-R150 VanDerWaalsContact OD1-CZ 3.26Å; D135-R150 IonicContact OD1-NE 2.66Å; D135-R150 PolarHBondContact OD1-NE 3Å; D135-R150 IonicContact OD1-NH2 2.93Å; D135-R150 PolarHBondContact OD1-NH2 3.45Å; D135-R150 IonicContact OD2-CZ 2.71Å; D135-R150 IonicContact OD2-NE 2.74Å; D135-R150 IonicContact OD2-NH2 3.26Å; D135-R150 PolarHBondContact OD2-NH2 3.25Å; L138-R150 HydrophobicContact CB-CG 4.24Å; L138-R150 HydrophobicContact CD1-CG 4.33Å; S146-R150 VanDerWaalsContact O-CB 3.32Å; S146-R150 WeakPolarHBondContact O-CB 3.39Å; S146-R150 WeakPolarHBondContact O-CG 3.5Å; S146-R150 PolarHBondContact O-N 2.9Å
151T91.8Very high91.5Very high44 Ų4481.9 Ų81.927%0.2740%0.4SS..  trans-108.3156.617270.20000109.7T148 I149 R153 N154 S155T148-T151 WeakPolarHBondContact O-CG2 3.32Å; I149-T151 PolarHBondContact O-N 3.21Å; T151-R153 VanDerWaalsContact C-N 3.27Å; T151-R153 PolarHBondContact O-N 3.16Å; T151-N154 PolarHBondContact O-N 3.21Å; T151-N154 WeakPolarHBondContact OG1-CB 3.23Å; T151-N154 PolarHBondContact OG1-N 2.88Å; T151-N154 PolarHBondContact OG1-ND2 3.1Å; T151-N154 PolarHBondContact OG1-OD1 3.39Å; T151-S155 WeakPolarHBondContact O-CB 3.41Å; T151-S155 PolarHBondContact O-N 3.46Å; T151-S155 PolarHBondContact O-OG 2.96Å
152R90.9Very high91.9Very high125 Ų12580.9 Ų80.947%0.47239%0.394SS..Hα-helixtrans-59.9-39.8175.3-64.8-169.3-167.3155.311.8112.2M70 R71 I76 S155 A156M70-R152 VanDerWaalsContact O-CZ 3.22Å; M70-R152 PolarHBondContact O-NE 2.96Å; M70-R152 PolarHBondContact O-NH1 3.41Å; R71-R152 VanDerWaalsContact CA-NH2 3.31Å; R71-R152 PolarHBondContact O-NE 2.7Å; R71-R152 PolarHBondContact O-NH2 3.25Å; I76-R152 HydrophobicContact CD1-CB 3.78Å; I76-R152 HydrophobicContact CD1-CG 4.01Å; R152-S155 PolarHBondContact O-N 3.29Å; R152-A156 WeakPolarHBondContact O-CB 3.44Å; R152-A156 PolarHBondContact O-N 2.98Å
153R92.9Very high92.4Very high194 Ų19477.2 Ų77.273%0.73238%0.379SS*.Hα-helixtrans-58.6-50.8176.6-177.7-179.9177.6-176.2-0.4110.8T151 S155 A156 I157T151-R153 VanDerWaalsContact C-N 3.27Å; T151-R153 PolarHBondContact O-N 3.16Å; R153-S155 VanDerWaalsContact C-N 3.33Å; R153-S155 PolarHBondContact O-N 3.45Å; R153-A156 PolarHBondContact O-N 3.44Å; R153-I157 HydrophobicContact CG-CD1 3.92Å; R153-I157 VanDerWaalsContact O-CG1 3.29Å; R153-I157 WeakPolarHBondContact O-CG1 3.48Å; R153-I157 PolarHBondContact O-N 3.04Å
154N94.8Very high93.1Very high60 Ų6080.5 Ų80.532%0.32139%0.393SS..Hα-helixtrans-65-39.9-180-66.2-6.4000111.4T148 I149 T151 A156 I157 V158T148-N154 PolarHBondContact O-ND2 3.3Å; I149-N154 VanDerWaalsContact O-CB 3.3Å; I149-N154 WeakPolarHBondContact O-CB 3.39Å; I149-N154 PolarHBondContact O-ND2 2.84Å; T151-N154 PolarHBondContact O-N 3.21Å; T151-N154 WeakPolarHBondContact OG1-CB 3.23Å; T151-N154 PolarHBondContact OG1-N 2.88Å; T151-N154 PolarHBondContact OG1-ND2 3.1Å; T151-N154 PolarHBondContact OG1-OD1 3.39Å; N154-A156 VanDerWaalsContact C-N 3.34Å; N154-A156 PolarHBondContact O-N 3.33Å; N154-I157 PolarHBondContact O-N 3.1Å; N154-V158 VanDerWaalsContact O-CG2 3.3Å; N154-V158 WeakPolarHBondContact O-CG2 3.29Å; N154-V158 PolarHBondContact O-N 3.22Å
155S94.7Very high93.6Very high5 Ų578.2 Ų78.24%0.03539%0.387CS..Hα-helixtrans-62.2-41.2176.5-53.20000111.9T151 R152 R153 V158 C159T151-S155 WeakPolarHBondContact O-CB 3.41Å; T151-S155 PolarHBondContact O-N 3.46Å; T151-S155 PolarHBondContact O-OG 2.96Å; R152-S155 PolarHBondContact O-N 3.29Å; R153-S155 VanDerWaalsContact C-N 3.33Å; R153-S155 PolarHBondContact O-N 3.45Å; S155-V158 PolarHBondContact O-N 3.24Å; S155-C159 PolarHBondContact O-N 3.32Å; S155-C159 PolarHBondContact O-SG 3.34Å
156A94.8Very high94Very high47 Ų4769 Ų6939%0.38835%0.353SS..Hα-helixtrans-66.7-41175.200000112.3R152 R153 N154 C159 A160R152-A156 WeakPolarHBondContact O-CB 3.44Å; R152-A156 PolarHBondContact O-N 2.98Å; R153-A156 PolarHBondContact O-N 3.44Å; N154-A156 VanDerWaalsContact C-N 3.34Å; N154-A156 PolarHBondContact O-N 3.33Å; A156-C159 PolarHBondContact O-N 3.22Å; A156-A160 PolarHBondContact O-N 2.94Å
157I97.1Very high94.3Very high98 Ų9872.1 Ų72.150%0.50337%0.369SS..Hα-helixtrans-61-45.1174.4-69.1166.2000110.5R153 N154 C159 A160 G161R153-I157 HydrophobicContact CG-CD1 3.92Å; R153-I157 VanDerWaalsContact O-CG1 3.29Å; R153-I157 WeakPolarHBondContact O-CG1 3.48Å; R153-I157 PolarHBondContact O-N 3.04Å; N154-I157 PolarHBondContact O-N 3.1Å; I157-C159 VanDerWaalsContact C-N 3.35Å; I157-C159 PolarHBondContact O-N 3.29Å; I157-A160 PolarHBondContact O-N 2.9Å; I157-G161 PolarHBondContact O-N 3.43Å
158V97.4Very high94.6Very high66 Ų6666 Ų6640%0.436%0.355SS..Hα-helixtrans-61-44.7176171.60000110.6F77 N154 S155 A160 G161 V162F77-V158 HydrophobicContact CE1-CB 4.13Å; F77-V158 HydrophobicContact CE1-CG1 3.87Å; F77-V158 HydrophobicContact CZ-CG1 4.4Å; N154-V158 VanDerWaalsContact O-CG2 3.3Å; N154-V158 WeakPolarHBondContact O-CG2 3.29Å; N154-V158 PolarHBondContact O-N 3.22Å; S155-V158 PolarHBondContact O-N 3.24Å; V158-A160 PolarHBondContact O-N 3.45Å; V158-G161 PolarHBondContact O-N 2.93Å; V158-V162 WeakPolarHBondContact O-CG2 3.26Å; V158-V162 PolarHBondContact O-N 3.38Å
159C97.5Very high94.5Very high3 Ų362.3 Ų62.32%0.0234%0.338CS..Hα-helixtrans-60.5-44.2176.4-67.10000112.1F77 F128 S155 A156 I157 G161 V162 W163F77-C159 WeakPolarHBondContact CD1-SG 3.36Å; F128-C159 HydrophobicContact CE1-CB 4.1Å; S155-C159 PolarHBondContact O-N 3.32Å; S155-C159 PolarHBondContact O-SG 3.34Å; A156-C159 PolarHBondContact O-N 3.22Å; I157-C159 VanDerWaalsContact C-N 3.35Å; I157-C159 PolarHBondContact O-N 3.29Å; C159-G161 VanDerWaalsContact C-N 3.31Å; C159-G161 PolarHBondContact O-N 3.28Å; C159-V162 PolarHBondContact O-N 2.75Å; C159-W163 PolarHBondContact O-N 3.49Å
160A98.1Very high94.4Very high49 Ų4958 Ų5841%0.40532%0.317SS..Hα-helixtrans-60.3-42.2175.900000111.5A156 I157 V158 W163 I164A156-A160 PolarHBondContact O-N 2.94Å; I157-A160 PolarHBondContact O-N 2.9Å; V158-A160 PolarHBondContact O-N 3.45Å; A160-W163 PolarHBondContact O-N 3.31Å; A160-I164 VanDerWaalsContact O-CG1 3.27Å; A160-I164 WeakPolarHBondContact O-CG1 3.39Å; A160-I164 PolarHBondContact O-N 3.22Å
161G98.1Very high94.3Very high39 Ų3959.9 Ų59.940%0.40233%0.329SS..Hα-helixtrans-60.8-43.9174.100000113I157 V158 C159 I164 L165I157-G161 PolarHBondContact O-N 3.43Å; V158-G161 PolarHBondContact O-N 2.93Å; C159-G161 VanDerWaalsContact C-N 3.31Å; C159-G161 PolarHBondContact O-N 3.28Å; G161-I164 PolarHBondContact O-N 2.88Å; G161-L165 WeakPolarHBondContact O-CB 3.43Å; G161-L165 PolarHBondContact O-N 2.95Å
162V97.4Very high94Very high12 Ų1260.6 Ų60.67%0.07334%0.336CS..Hα-helixtrans-59.6-49.8174.6170.90000110.4L127 F128 V158 C159 I164 L165 V166L127-V162 HydrophobicContact CB-CG1 3.82Å; L127-V162 HydrophobicContact CB-CG2 4.17Å; L127-V162 HydrophobicContact CD1-CG1 4.02Å; F128-V162 HydrophobicContact CD1-CG1 4.32Å; F128-V162 HydrophobicContact CE1-CB 4.01Å; F128-V162 HydrophobicContact CE1-CG1 3.82Å; F128-V162 HydrophobicContact CE1-CG2 4.47Å; F128-V162 HydrophobicContact CE2-CG1 4.02Å; F128-V162 HydrophobicContact CZ-CB 4.13Å; F128-V162 HydrophobicContact CZ-CG1 3.63Å; V158-V162 WeakPolarHBondContact O-CG2 3.26Å; V158-V162 PolarHBondContact O-N 3.38Å; C159-V162 PolarHBondContact O-N 2.75Å; V162-I164 PolarHBondContact O-N 2.87Å; V162-L165 WeakPolarHBondContact O-CB 3.35Å; V162-L165 PolarHBondContact O-N 2.87Å; V162-V166 HydrophobicContact CG1-CG1 4.39Å; V162-V166 WeakPolarHBondContact O-CG2 3.29Å; V162-V166 PolarHBondContact O-N 3.44Å
163W98.1Very high93.4Very high38 Ų3856 Ų5614%0.14432%0.324CS..Hα-helixtrans-57.1-48.4178-82.8113.9000112.7N80 L83 L87 T120 F128 C159 A160 L165 V166 L167N80-W163 PolarHBondContact OD1-NE1 2.93Å; L83-W163 HydrophobicContact CB-CZ2 4.43Å; L83-W163 HydrophobicContact CD2-CZ2 4.05Å; L83-W163 HydrophobicContact CG-CZ2 4.19Å; L87-W163 HydrophobicContact CD1-CH2 3.81Å; L87-W163 HydrophobicContact CD1-CZ3 4.11Å; T120-W163 HydrophobicContact CG2-CE3 4.17Å; T120-W163 HydrophobicContact CG2-CH2 4.48Å; T120-W163 HydrophobicContact CG2-CZ3 3.57Å; F128-W163 HydrophobicContact CE2-CZ2 4.45Å; F128-W163 AromaticContact CZ-NE1 3.75Å; C159-W163 PolarHBondContact O-N 3.49Å; A160-W163 PolarHBondContact O-N 3.31Å; W163-L165 VanDerWaalsContact C-N 3.29Å; W163-L165 PolarHBondContact O-N 2.96Å; W163-V166 HydrophobicContact CE3-CG2 4.42Å; W163-V166 PolarHBondContact O-N 3.46Å; W163-L167 HydrophobicContact CB-CD1 4.44Å; W163-L167 HydrophobicContact CE3-CD1 3.94Å; W163-L167 HydrophobicContact CE3-CG 4.1Å; W163-L167 WeakPolarHBondContact O-CB 3.18Å; W163-L167 VanDerWaalsContact O-CG 3.27Å; W163-L167 WeakPolarHBondContact O-CG 3.28Å; W163-L167 PolarHBondContact O-N 3Å
164I97.6Very high92.8Very high119 Ų11946.8 Ų46.861%0.6129%0.29SS*.Hα-helixtrans-58.4-45.5178.1-69.9165.3000110.2A160 G161 V162 S168A160-I164 VanDerWaalsContact O-CG1 3.27Å; A160-I164 WeakPolarHBondContact O-CG1 3.39Å; A160-I164 PolarHBondContact O-N 3.22Å; G161-I164 PolarHBondContact O-N 2.88Å; V162-I164 PolarHBondContact O-N 2.87Å; I164-S168 WeakPolarHBondContact O-CB 3.43Å; I164-S168 PolarHBondContact O-N 3.08Å; I164-S168 PolarHBondContact O-OG 3.21Å
165L94.4Very high92Very high106 Ų10649.1 Ų49.156%0.55530%0.302SS*.Hα-helixtrans-62.3-50.7-179.8-179.963.6000112L127 G161 V162 W163 S168 G169L127-L165 HydrophobicContact CD1-CD2 3.98Å; G161-L165 WeakPolarHBondContact O-CB 3.43Å; G161-L165 PolarHBondContact O-N 2.95Å; V162-L165 WeakPolarHBondContact O-CB 3.35Å; V162-L165 PolarHBondContact O-N 2.87Å; W163-L165 VanDerWaalsContact C-N 3.29Å; W163-L165 PolarHBondContact O-N 2.96Å; L165-S168 PolarHBondContact O-OG 3.43Å; L165-G169 PolarHBondContact O-N 3.44Å
166V94.5Very high90.8Very high9 Ų954.1 Ų54.16%0.05532%0.323CS..Hα-helixtrans-75.1-34.5-174.6-57.80000112.6T120 L127 V162 W163 G170T120-V166 HydrophobicContact CG2-CG2 3.82Å; L127-V166 HydrophobicContact CD1-CG1 3.78Å; V162-V166 HydrophobicContact CG1-CG1 4.39Å; V162-V166 WeakPolarHBondContact O-CG2 3.29Å; V162-V166 PolarHBondContact O-N 3.44Å; W163-V166 HydrophobicContact CE3-CG2 4.42Å; W163-V166 PolarHBondContact O-N 3.46Å; V166-G170 PolarHBondContact O-N 3.38Å
167L94.8Very high89.5Confident68 Ų6851.9 Ų51.936%0.35631%0.305SS..Hα-helixtrans-69.4-47175.2-73.2168.6000111.1T120 W163 G169 G170 I171T120-L167 HydrophobicContact CG2-CD2 4.12Å; W163-L167 HydrophobicContact CB-CD1 4.44Å; W163-L167 HydrophobicContact CE3-CD1 3.94Å; W163-L167 HydrophobicContact CE3-CG 4.1Å; W163-L167 WeakPolarHBondContact O-CB 3.18Å; W163-L167 VanDerWaalsContact O-CG 3.27Å; W163-L167 WeakPolarHBondContact O-CG 3.28Å; W163-L167 PolarHBondContact O-N 3Å; L167-G169 VanDerWaalsContact C-N 3.32Å; L167-G169 PolarHBondContact O-N 2.99Å; L167-G170 PolarHBondContact O-N 3.36Å; L167-I171 VanDerWaalsContact O-CB 3.31Å; L167-I171 WeakPolarHBondContact O-CB 3.35Å; L167-I171 WeakPolarHBondContact O-CD1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.43Å; L167-I171 PolarHBondContact O-N 2.77Å
168S91.3Very high87.9Confident57 Ų5751.2 Ų51.240%0.39931%0.305SS..Hα-helixtrans-60.8-43.1177.960.40000111.5I164 L165 S172I164-S168 WeakPolarHBondContact O-CB 3.43Å; I164-S168 PolarHBondContact O-N 3.08Å; I164-S168 PolarHBondContact O-OG 3.21Å; L165-S168 PolarHBondContact O-OG 3.43Å; S168-S172 VanDerWaalsContact O-CB 3.22Å; S168-S172 WeakPolarHBondContact O-CB 3.3Å; S168-S172 PolarHBondContact O-N 3.21Å; S168-S172 PolarHBondContact O-OG 3.41Å
169G87.3Confident86.7Confident30 Ų3049.6 Ų49.631%0.30930%0.295SS..Hα-helixtrans-63.1-48.1174.200000112.9L165 L167 S172 A173L165-G169 PolarHBondContact O-N 3.44Å; L167-G169 VanDerWaalsContact C-N 3.32Å; L167-G169 PolarHBondContact O-N 2.99Å; G169-S172 PolarHBondContact O-N 3.34Å; G169-A173 WeakPolarHBondContact O-CB 3.46Å; G169-A173 PolarHBondContact O-N 2.77Å
170G88Confident85.5Confident2 Ų252.3 Ų52.32%0.02131%0.31CS..Hα-helixtrans-63.2-43.3-179.700000113.3T116 V166 L167 S174T116-G170 PolarHBondContact OG1-O 2.88Å; V166-G170 PolarHBondContact O-N 3.38Å; L167-G170 PolarHBondContact O-N 3.36Å; G170-S174 VanDerWaalsContact O-CB 3.27Å; G170-S174 WeakPolarHBondContact O-CB 3.49Å; G170-S174 PolarHBondContact O-N 3.22Å; G170-S174 PolarHBondContact O-OG 3.21Å
171I88.4Confident84.3Confident86 Ų8655 Ų5544%0.44132%0.321SS..Hα-helixtrans-64.4-49.7175.2-67.9166.8000109.4T116 L167 A173 S174 L175T116-I171 HydrophobicContact CG2-CG1 3.79Å; L167-I171 VanDerWaalsContact O-CB 3.31Å; L167-I171 WeakPolarHBondContact O-CB 3.35Å; L167-I171 WeakPolarHBondContact O-CD1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.43Å; L167-I171 PolarHBondContact O-N 2.77Å; I171-A173 VanDerWaalsContact C-N 3.33Å; I171-A173 PolarHBondContact O-N 3.26Å; I171-S174 CarbonylContact O-C 3.56Å; I171-S174 PolarHBondContact O-N 2.91Å; I171-S174 VanDerWaalsContact O-N 3.09Å; I171-L175 HydrophobicContact CG2-CD1 4.27Å; I171-L175 HydrophobicContact CG2-CG 4.33Å; I171-L175 WeakPolarHBondContact O-CG 3.36Å; I171-L175 PolarHBondContact O-N 3.39Å
172S85.4Confident83Confident60 Ų6057.5 Ų57.542%0.4233%0.325SS..Hα-helixtrans-57.8-46-179.6-60.40000111.7S168 G169 S174 L175 F176S168-S172 VanDerWaalsContact O-CB 3.22Å; S168-S172 WeakPolarHBondContact O-CB 3.3Å; S168-S172 PolarHBondContact O-N 3.21Å; S168-S172 PolarHBondContact O-OG 3.41Å; G169-S172 PolarHBondContact O-N 3.34Å; S172-S174 PolarHBondContact O-N 2.71Å; S172-L175 PolarHBondContact O-N 3.01Å; S172-F176 WeakPolarHBondContact O-CD2 3.42Å
173A79.6Confident81.3Confident27 Ų2765.8 Ų65.822%0.22337%0.369CS..Hα-helixtrans-63.7-40.5176.100000112.3L119 G169 I171 L175 F176L119-A173 HydrophobicContact CD1-CB 3.55Å; G169-A173 WeakPolarHBondContact O-CB 3.46Å; G169-A173 PolarHBondContact O-N 2.77Å; I171-A173 VanDerWaalsContact C-N 3.33Å; I171-A173 PolarHBondContact O-N 3.26Å; A173-L175 VanDerWaalsContact C-N 3.35Å; A173-L175 PolarHBondContact O-N 3.19Å; A173-F176 PolarHBondContact O-N 3.29Å
174S79.6Confident80Confident2 Ų268.4 Ų68.41%0.01440%0.399CS..Hα-helixtrans-72-25.7179.6-59.70000113.2K112 T116 G170 I171 S172 F176 S177K112-S174 PolarHBondContact O-OG 3.12Å; T116-S174 PolarHBondContact N-OG 3.35Å; T116-S174 WeakPolarHBondContact OG1-CB 3.29Å; T116-S174 PolarHBondContact OG1-OG 3.14Å; G170-S174 VanDerWaalsContact O-CB 3.27Å; G170-S174 WeakPolarHBondContact O-CB 3.49Å; G170-S174 PolarHBondContact O-N 3.22Å; G170-S174 PolarHBondContact O-OG 3.21Å; I171-S174 CarbonylContact O-C 3.56Å; I171-S174 PolarHBondContact O-N 2.91Å; I171-S174 VanDerWaalsContact O-N 3.09Å; S172-S174 PolarHBondContact O-N 2.71Å; S174-F176 VanDerWaalsContact C-N 3.25Å; S174-F176 PolarHBondContact O-N 2.94Å; S174-S177 CarbonylContact O-C 3.58Å; S174-S177 WeakPolarHBondContact O-CA 3.33Å; S174-S177 WeakPolarHBondContact O-CB 3.45Å; S174-S177 PolarHBondContact O-N 3.16Å
175L77.4Confident79.1Confident109 Ų10965.3 Ų65.357%0.57139%0.385SS*.Hα-helixtrans-62.8-33.9172.7-74.1173.4000112.1I171 S172 A173 S177I171-L175 HydrophobicContact CG2-CD1 4.27Å; I171-L175 HydrophobicContact CG2-CG 4.33Å; I171-L175 WeakPolarHBondContact O-CG 3.36Å; I171-L175 PolarHBondContact O-N 3.39Å; S172-L175 PolarHBondContact O-N 3.01Å; A173-L175 VanDerWaalsContact C-N 3.35Å; A173-L175 PolarHBondContact O-N 3.19Å; L175-S177 PolarHBondContact O-N 3.34Å
176F70.3Confident78.4Confident110 Ų11061.4 Ų61.448%0.48237%0.366SS..THydrogen-bonded Turntrans-78.4-9.8173.9-63.4-70.4000113.3S172 A173 S174 F192 L201S172-F176 WeakPolarHBondContact O-CD2 3.42Å; A173-F176 PolarHBondContact O-N 3.29Å; S174-F176 VanDerWaalsContact C-N 3.25Å; S174-F176 PolarHBondContact O-N 2.94Å; F176-F192 WeakPolarHBondContact O-CE1 3.32Å; F176-L201 HydrophobicContact CB-CD2 3.87Å; F176-L201 HydrophobicContact CG-CD2 4.34Å
177S67.8Low77.8Confident0 Ų062 Ų620%037%0.37CS..  trans-95117.7174-174.90000110.6K112 S174 L175 F189K112-S177 WeakPolarHBondContact CE-O 3.25Å; S174-S177 CarbonylContact O-C 3.58Å; S174-S177 WeakPolarHBondContact O-CA 3.33Å; S174-S177 WeakPolarHBondContact O-CB 3.45Å; S174-S177 PolarHBondContact O-N 3.16Å; L175-S177 PolarHBondContact O-N 3.34Å; S177-F189 VanDerWaalsContact CB-CE2 3.48Å; S177-F189 WeakPolarHBondContact OG-CD2 3.47Å
178T64.1Low77.1Confident83 Ų8358.8 Ų58.851%0.50935%0.353SS..  trans-114.8151.9169.753.30000110.1D108 N180D108-T178 WeakPolarHBondContact OD1-CA 3.38Å; T178-N180 PolarHBondContact O-N 3.42Å
179T70.9Confident76.1Confident32 Ų3258.7 Ų58.720%0.19635%0.346CS..  trans-59.3131.1166.748.50000109.8D108 C111 T186 T187D108-T179 HydrophobicContact CB-CG2 4.32Å; D108-T179 PolarHBondContact OD1-N 2.98Å; D108-T179 VanDerWaalsContact OD1-N 3.07Å; C111-T179 HydrophobicContact CB-CG2 3.84Å; T179-T186 HydrophobicContact CG2-CG2 4.2Å; T179-T187 VanDerWaalsContact CA-O 3.32Å; T179-T187 WeakPolarHBondContact CA-O 3.43Å
180N71.6Confident75.1Confident61 Ų6159.6 Ų59.633%0.32634%0.342SS..EExtended strand (participates in β ladder)trans-99.4115.7175.9-157.4-83.2000108.6T178 N182 T186 T187T178-N180 PolarHBondContact O-N 3.42Å; N180-N182 PolarHBondContact OD1-OD1 2.73Å; N180-T186 WeakPolarHBondContact O-CA 3.04Å; N180-T187 WeakPolarHBondContact CB-OG1 3.47Å; N180-T187 PolarHBondContact N-O 3.47Å; N180-T187 PolarHBondContact O-N 3.35Å
181V73.3Confident73.7Confident105 Ų10562 Ų6264%0.63637%0.367SS*.EExtended strand (participates in β ladder)trans-96.1110.8179-176.40000107.9T186V181-T186 HydrophobicContact CG2-CG2 4.26Å
182N70.6Confident72.6Confident91 Ų9159.7 Ų59.749%0.48735%0.354SS..EExtended strand (participates in β ladder)trans-99.9159.2164.7-72.3-24.2000109N180 A184 T185N180-N182 PolarHBondContact OD1-OD1 2.73Å; N182-A184 PolarHBondContact O-N 3.01Å; N182-T185 PolarHBondContact N-O 3.38Å; N182-T185 PolarHBondContact O-N 2.79Å; N182-T185 VanDerWaalsContact O-N 3.1Å
183N62.4Low71.4Confident186 Ų18660.2 Ų60.2100%0.99536%0.357SS*.THydrogen-bonded Turntrans-52-11.8-173.6-67.8-9000116.4
184A71.2Confident70.8Confident93 Ų9367.4 Ų67.477%0.76938%0.384SS*.THydrogen-bonded Turntrans-128-18177.600000115N182N182-A184 PolarHBondContact O-N 3.01Å
185T78.1Confident70Confident54 Ų5476.9 Ų76.933%0.33142%0.419SS..EExtended strand (participates in β ladder)trans-152139.8-170.856.90000112.4N182N182-T185 PolarHBondContact N-O 3.38Å; N182-T185 PolarHBondContact O-N 2.79Å; N182-T185 VanDerWaalsContact O-N 3.1Å
186T80.8Confident69.6Low25 Ų2574.5 Ų74.515%0.15341%0.409CS..EExtended strand (participates in β ladder)trans-97121170.2-54.20000109.5H103 W104 T179 N180 V181H103-T186 PolarHBondContact ND1-N 2.76Å; W104-T186 HydrophobicContact CB-CG2 4.34Å; W104-T186 WeakPolarHBondContact CB-O 3.37Å; W104-T186 PolarHBondContact N-O 2.93Å; W104-T186 WeakPolarHBondContact O-CB 3.33Å; W104-T186 WeakPolarHBondContact O-CG2 3.2Å; T179-T186 HydrophobicContact CG2-CG2 4.2Å; N180-T186 WeakPolarHBondContact O-CA 3.04Å; V181-T186 HydrophobicContact CG2-CG2 4.26Å
187T81.4Confident69.6Low21 Ų2170.5 Ų70.513%0.12939%0.391CS..EExtended strand (participates in β ladder)trans-99.4146.7172.863.50000111T179 N180 E190T179-T187 VanDerWaalsContact CA-O 3.32Å; T179-T187 WeakPolarHBondContact CA-O 3.43Å; N180-T187 WeakPolarHBondContact CB-OG1 3.47Å; N180-T187 PolarHBondContact N-O 3.47Å; N180-T187 PolarHBondContact O-N 3.35Å; T187-E190 PolarHBondContact OG1-O 2.94Å
188C80.3Confident69.8Low1 Ų176.2 Ų76.21%0.00742%0.415CS..SBendtrans-120.9126.1177.8164.70000110.2W104 C111 E190W104-C188 HydrophobicContact CB-CB 3.93Å; W104-C188 HydrophobicContact CD2-CB 3.48Å; W104-C188 VanDerWaalsContact CD2-CB 3.48Å; W104-C188 HydrophobicContact CE3-CB 3.73Å; W104-C188 HydrophobicContact CG-CB 3.54Å; C111-C188 WeakPolarHBondContact CA-SG 3.34Å; C111-C188 HydrophobicContact CB-CB 3.88Å; C111-C188 WeakPolarHBondContact CB-SG 3.36Å; C111-C188 WeakPolarHBondContact SG-CA 3.49Å; C111-C188 WeakPolarHBondContact SG-CB 3.3Å; C111-C188 CovalentContact SG-SG 2.03Å; C111-C188 PolarHBondContact SG-SG 3.44Å; C188-E190 PolarHBondContact O-N 2.82Å
189F70.7Confident69.9Low54 Ų5475.2 Ų75.224%0.23741%0.409CS..SBendtrans61.422.3179.2-130-92.4000113.5L119 S177L119-F189 HydrophobicContact CD1-CZ 4.25Å; S177-F189 VanDerWaalsContact CB-CE2 3.48Å; S177-F189 WeakPolarHBondContact OG-CD2 3.47Å
190E65.9Low69.9Low50 Ų5080.5 Ų80.523%0.23443%0.427CS..  trans-134.9152177.3-75.1-176.2-129.900109.1K38 Y39 Y98 T187 C188K38-E190 IonicContact NZ-OE2 3.99Å; K38-E190 PolarHBondContact NZ-OE2 2.95Å; Y39-E190 PolarHBondContact OH-OE2 3.42Å; Y98-E190 VanDerWaalsContact CE1-OE1 3.31Å; Y98-E190 WeakPolarHBondContact CE1-OE1 3.45Å; Y98-E190 PolarHBondContact OH-OE1 2.89Å; T187-E190 PolarHBondContact OG1-O 2.94Å; C188-E190 PolarHBondContact O-N 2.82Å
191G58.8Low70Confident53 Ų5378.4 Ų78.455%0.54642%0.415SS..  trans88.519.6173.300000115.8S193G191-S193 PolarHBondContact O-N 3.21Å
192F63.7Low70.1Confident37 Ų3773.6 Ų73.616%0.16239%0.386CS..  trans-53.5128.5172.5-61.9-85000111.6F176 K194 W197 L201 R276F176-F192 WeakPolarHBondContact O-CE1 3.32Å; F192-K194 PolarHBondContact O-N 3.46Å; F192-W197 HydrophobicContact CB-CE3 3.97Å; F192-W197 HydrophobicContact CD2-CE3 4.05Å; F192-W197 AromaticContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CE2-CZ3 4.37Å; F192-W197 HydrophobicContact CG-CE3 4.12Å; F192-W197 HydrophobicContact CG-CZ3 4.4Å; F192-L201 HydrophobicContact CB-CD1 4.12Å; F192-L201 HydrophobicContact CD1-CD1 3.45Å; F192-L201 VanDerWaalsContact CD1-CD1 3.45Å; F192-L201 HydrophobicContact CE1-CD1 3.88Å; F192-L201 HydrophobicContact CG-CD1 3.79Å; F192-R276 PolarHBondContact O-NH2 3.5Å
193S62Low70.5Confident71 Ų7176.3 Ų76.350%0.49739%0.394SS..  trans-52.2137.3175.9172.60000110.9G191 R195 V196 W197G191-S193 PolarHBondContact O-N 3.21Å; S193-R195 PolarHBondContact O-N 3.22Å; S193-R195 VanDerWaalsContact O-N 3.09Å; S193-R195 PolarHBondContact OG-N 2.83Å; S193-V196 PolarHBondContact O-N 2.91Å; S193-V196 VanDerWaalsContact O-N 3.09Å; S193-W197 PolarHBondContact O-N 3.38Å
194K64.9Low71.3Confident178 Ų17870.7 Ų70.777%0.77436%0.363SS*.Hα-helixtrans-52-35.1178.1-68.3-177.1-179.6179.40111.9F192 K198F192-K194 PolarHBondContact O-N 3.46Å; K194-K198 WeakPolarHBondContact O-CB 3.15Å; K194-K198 PolarHBondContact O-N 3.25Å
195R63.8Low71.7Confident200 Ų20067.5 Ų67.576%0.75533%0.334SS*.Hα-helixtrans-68.2-50178.3-172.1-176.2-67.1-170.1-0.5111.9S193 W197 K198 T199S193-R195 PolarHBondContact O-N 3.22Å; S193-R195 VanDerWaalsContact O-N 3.09Å; S193-R195 PolarHBondContact OG-N 2.83Å; R195-W197 VanDerWaalsContact C-N 3.3Å; R195-W197 PolarHBondContact O-N 3Å; R195-K198 PolarHBondContact O-N 2.83Å; R195-T199 WeakPolarHBondContact O-CB 3.37Å; R195-T199 PolarHBondContact O-N 3.45Å; R195-T199 PolarHBondContact O-OG1 2.87Å; R195-T199 VanDerWaalsContact O-OG1 3.04Å
196V68Low71.9Confident59 Ų5967.1 Ų67.136%0.35833%0.329SS..Hα-helixtrans-62.1-42178.8176.60000110.5S193 Y200 L201S193-V196 PolarHBondContact O-N 2.91Å; S193-V196 VanDerWaalsContact O-N 3.09Å; V196-Y200 PolarHBondContact O-N 3.44Å; V196-Y200 VanDerWaalsContact O-N 3.12Å; V196-L201 HydrophobicContact CG1-CD1 4.02Å; V196-L201 HydrophobicContact CG1-CG 4.22Å; V196-L201 PolarHBondContact O-N 3.16Å
197W71.2Confident72.1Confident27 Ų2772.5 Ų72.510%0.10235%0.351CS..Iπ-helixtrans-62.9-48176.8-167.8-82.6000112.3F192 S193 R195 L201 S202 Y272 R276F192-W197 HydrophobicContact CB-CE3 3.97Å; F192-W197 HydrophobicContact CD2-CE3 4.05Å; F192-W197 AromaticContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CE2-CZ3 4.37Å; F192-W197 HydrophobicContact CG-CE3 4.12Å; F192-W197 HydrophobicContact CG-CZ3 4.4Å; S193-W197 PolarHBondContact O-N 3.38Å; R195-W197 VanDerWaalsContact C-N 3.3Å; R195-W197 PolarHBondContact O-N 3Å; W197-L201 HydrophobicContact CD2-CB 4.22Å; W197-L201 HydrophobicContact CD2-CD1 4.46Å; W197-L201 HydrophobicContact CE3-CB 4.03Å; W197-L201 HydrophobicContact CE3-CD1 3.64Å; W197-L201 HydrophobicContact CE3-CG 4.5Å; W197-L201 HydrophobicContact CZ3-CB 4.49Å; W197-L201 HydrophobicContact CZ3-CD1 4.17Å; W197-L201 PolarHBondContact O-N 3.5Å; W197-S202 VanDerWaalsContact O-CB 3.23Å; W197-S202 WeakPolarHBondContact O-CB 3.41Å; W197-S202 PolarHBondContact O-N 3.3Å; W197-Y272 HydrophobicContact CH2-CE1 4.35Å; W197-Y272 HydrophobicContact CZ2-CD1 4.18Å; W197-Y272 HydrophobicContact CZ2-CE1 4.03Å; W197-R276 VanDerWaalsContact CD1-CG 3.43Å; W197-R276 HydrophobicContact CD2-CG 4.4Å; W197-R276 HydrophobicContact CG-CG 3.98Å
198K70.9Confident72.1Confident119 Ų11973.9 Ų73.952%0.51736%0.357SS..Iπ-helixtrans-67.8-41.9-178.1-173.5174.7-177.7178.10112.8K194 R195 S277K194-K198 WeakPolarHBondContact O-CB 3.15Å; K194-K198 PolarHBondContact O-N 3.25Å; R195-K198 PolarHBondContact O-N 2.83Å; K198-S277 WeakPolarHBondContact CE-O 3.06Å
199T67.1Low72.3Confident62 Ų6274 Ų7438%0.3836%0.357SS..Iπ-helixtrans-79.9-39.8-172.3-54.90000112.8R195R195-T199 WeakPolarHBondContact O-CB 3.37Å; R195-T199 PolarHBondContact O-N 3.45Å; R195-T199 PolarHBondContact O-OG1 2.87Å; R195-T199 VanDerWaalsContact O-OG1 3.04Å
200Y70.8Confident72.8Confident144 Ų14474.7 Ų74.757%0.56537%0.366SS*.Iπ-helixtrans-122-59-170.4-61.1-78.2000112.7V196 S202 K203 I204V196-Y200 PolarHBondContact O-N 3.44Å; V196-Y200 VanDerWaalsContact O-N 3.12Å; Y200-S202 PolarHBondContact O-N 3.49Å; Y200-K203 PolarHBondContact O-N 2.88Å; Y200-I204 WeakPolarHBondContact O-CG1 3.17Å; Y200-I204 PolarHBondContact O-N 2.83Å
201L74.6Confident73.7Confident16 Ų1675.2 Ų75.28%0.08437%0.372CS..Iπ-helixtrans-64.4-40.1-169.4-59.2171.7000112.4F176 F192 V196 W197 K203 I204 T205F176-L201 HydrophobicContact CB-CD2 3.87Å; F176-L201 HydrophobicContact CG-CD2 4.34Å; F192-L201 HydrophobicContact CB-CD1 4.12Å; F192-L201 HydrophobicContact CD1-CD1 3.45Å; F192-L201 VanDerWaalsContact CD1-CD1 3.45Å; F192-L201 HydrophobicContact CE1-CD1 3.88Å; F192-L201 HydrophobicContact CG-CD1 3.79Å; V196-L201 HydrophobicContact CG1-CD1 4.02Å; V196-L201 HydrophobicContact CG1-CG 4.22Å; V196-L201 PolarHBondContact O-N 3.16Å; W197-L201 HydrophobicContact CD2-CB 4.22Å; W197-L201 HydrophobicContact CD2-CD1 4.46Å; W197-L201 HydrophobicContact CE3-CB 4.03Å; W197-L201 HydrophobicContact CE3-CD1 3.64Å; W197-L201 HydrophobicContact CE3-CG 4.5Å; W197-L201 HydrophobicContact CZ3-CB 4.49Å; W197-L201 HydrophobicContact CZ3-CD1 4.17Å; W197-L201 PolarHBondContact O-N 3.5Å; L201-K203 VanDerWaalsContact C-N 3.33Å; L201-K203 PolarHBondContact O-N 3.44Å; L201-I204 PolarHBondContact O-N 2.88Å; L201-T205 VanDerWaalsContact O-CB 3.28Å; L201-T205 WeakPolarHBondContact O-CB 3.27Å; L201-T205 PolarHBondContact O-N 2.84Å; L201-T205 PolarHBondContact O-OG1 3.44Å
202S75.1Confident74.8Confident4 Ų473.6 Ų73.63%0.02836%0.356CS..Hα-helixtrans-61.5-39.8179.8-176.20000112.7W197 Y200 I206 A273 S277W197-S202 VanDerWaalsContact O-CB 3.23Å; W197-S202 WeakPolarHBondContact O-CB 3.41Å; W197-S202 PolarHBondContact O-N 3.3Å; Y200-S202 PolarHBondContact O-N 3.49Å; S202-I206 VanDerWaalsContact O-CB 3.31Å; S202-I206 WeakPolarHBondContact O-CB 3.19Å; S202-I206 WeakPolarHBondContact O-CD1 3.27Å; S202-I206 WeakPolarHBondContact O-CG1 3.5Å; S202-I206 PolarHBondContact O-N 2.94Å; S202-A273 PolarHBondContact OG-O 2.98Å; S202-S277 VanDerWaalsContact OG-CB 3.3Å; S202-S277 WeakPolarHBondContact OG-CB 3.4Å; S202-S277 PolarHBondContact OG-OG 2.96Å
203K79.1Confident76Confident149 Ų14972.3 Ų72.365%0.64835%0.35SS*.Hα-helixtrans-69.8-42.7180-65.8-178.6-178.5178.30110.8Y200 L201 I206 F207Y200-K203 PolarHBondContact O-N 2.88Å; L201-K203 VanDerWaalsContact C-N 3.33Å; L201-K203 PolarHBondContact O-N 3.44Å; K203-I206 PolarHBondContact O-N 3.45Å; K203-F207 WeakPolarHBondContact O-CB 3.35Å; K203-F207 PolarHBondContact O-N 3.34Å
204I78.9Confident77.3Confident67 Ų6772.3 Ų72.334%0.34434%0.344SS..Hα-helixtrans-64-49176.8-66.3170.2000110.2Y200 L201 I206 F207 I208Y200-I204 WeakPolarHBondContact O-CG1 3.17Å; Y200-I204 PolarHBondContact O-N 2.83Å; L201-I204 PolarHBondContact O-N 2.88Å; I204-I206 PolarHBondContact O-N 2.89Å; I204-F207 PolarHBondContact O-N 3.41Å; I204-I208 HydrophobicContact CG2-CD1 3.62Å; I204-I208 HydrophobicContact CG2-CG1 4.33Å; I204-I208 WeakPolarHBondContact O-CB 3.14Å; I204-I208 VanDerWaalsContact O-CG1 3.28Å; I204-I208 WeakPolarHBondContact O-CG1 3.24Å; I204-I208 PolarHBondContact O-N 2.91Å
205T80.1Confident78.5Confident26 Ų2668 Ų6816%0.1633%0.328CS..Hα-helixtrans-57.8-48.8176.1-61.20000110.5L201 F207 I208 E209 L269 A273L201-T205 VanDerWaalsContact O-CB 3.28Å; L201-T205 WeakPolarHBondContact O-CB 3.27Å; L201-T205 PolarHBondContact O-N 2.84Å; L201-T205 PolarHBondContact O-OG1 3.44Å; T205-F207 VanDerWaalsContact C-N 3.33Å; T205-F207 PolarHBondContact O-N 3.4Å; T205-I208 PolarHBondContact O-N 3.2Å; T205-E209 HydrophobicContact CG2-CG 4.14Å; T205-E209 WeakPolarHBondContact O-CB 3.22Å; T205-E209 VanDerWaalsContact O-CG 3.23Å; T205-E209 WeakPolarHBondContact O-CG 3.28Å; T205-E209 PolarHBondContact O-N 2.94Å; T205-L269 HydrophobicContact CG2-CD1 4.17Å; T205-L269 HydrophobicContact CG2-CG 4.17Å; T205-A273 HydrophobicContact CG2-CB 4.16Å
206I81.8Confident79.8Confident47 Ų4758.5 Ų58.524%0.24129%0.293CS..Hα-helixtrans-59-44.3177.8-73.9165.3000111.5S202 K203 I204 E209 V210 F270 A273 L274S202-I206 VanDerWaalsContact O-CB 3.31Å; S202-I206 WeakPolarHBondContact O-CB 3.19Å; S202-I206 WeakPolarHBondContact O-CD1 3.27Å; S202-I206 WeakPolarHBondContact O-CG1 3.5Å; S202-I206 PolarHBondContact O-N 2.94Å; K203-I206 PolarHBondContact O-N 3.45Å; I204-I206 PolarHBondContact O-N 2.89Å; I206-E209 PolarHBondContact O-N 3.23Å; I206-V210 HydrophobicContact CG2-CG2 4.38Å; I206-V210 WeakPolarHBondContact O-CB 3.49Å; I206-V210 VanDerWaalsContact O-CG2 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.43Å; I206-V210 PolarHBondContact O-N 3.44Å; I206-F270 HydrophobicContact CG1-CD2 4.47Å; I206-F270 HydrophobicContact CG1-CE2 4.31Å; I206-F270 HydrophobicContact CG2-CE2 4.09Å; I206-A273 HydrophobicContact CG1-CB 4.21Å; I206-L274 HydrophobicContact CD1-CD2 3.95Å
207F84.6Confident81Confident138 Ų13857.6 Ų57.661%0.60529%0.286SS*.Hα-helixtrans-62.2-46.2177.5176.9-96.3000112.1K203 I204 T205 E209 V210 V211K203-F207 WeakPolarHBondContact O-CB 3.35Å; K203-F207 PolarHBondContact O-N 3.34Å; I204-F207 PolarHBondContact O-N 3.41Å; T205-F207 VanDerWaalsContact C-N 3.33Å; T205-F207 PolarHBondContact O-N 3.4Å; F207-E209 VanDerWaalsContact C-N 3.35Å; F207-V210 PolarHBondContact O-N 3.21Å; F207-V211 HydrophobicContact CD2-CG2 4.12Å; F207-V211 HydrophobicContact CE1-CG2 4.27Å; F207-V211 HydrophobicContact CE2-CG2 3.76Å; F207-V211 HydrophobicContact CZ-CG2 3.84Å; F207-V211 WeakPolarHBondContact O-CB 3.4Å; F207-V211 WeakPolarHBondContact O-CG2 3.47Å; F207-V211 PolarHBondContact O-N 2.93Å
208I82.5Confident82Confident49 Ų4961.2 Ų61.225%0.25131%0.306SS..Hα-helixtrans-64.7-39.2178.1-66.1170.9000110.9Y123 I204 T205 G212Y123-I208 HydrophobicContact CE1-CG2 3.83Å; Y123-I208 HydrophobicContact CE2-CG2 3.97Å; Y123-I208 WeakPolarHBondContact OH-CG2 3.39Å; I204-I208 HydrophobicContact CG2-CD1 3.62Å; I204-I208 HydrophobicContact CG2-CG1 4.33Å; I204-I208 WeakPolarHBondContact O-CB 3.14Å; I204-I208 VanDerWaalsContact O-CG1 3.28Å; I204-I208 WeakPolarHBondContact O-CG1 3.24Å; I204-I208 PolarHBondContact O-N 2.91Å; T205-I208 PolarHBondContact O-N 3.2Å; I208-G212 WeakPolarHBondContact O-CA 3.17Å; I208-G212 PolarHBondContact O-N 2.84Å
209E83.6Confident83.1Confident3 Ų358.9 Ų58.91%0.01430%0.299CS..Hα-helixtrans-65.9-44.9176-72.5-57.5118.500111.4Y123 T205 I206 F207 F213 I214 N266 L269 F270Y123-E209 PolarHBondContact OH-OE1 3.41Å; T205-E209 HydrophobicContact CG2-CG 4.14Å; T205-E209 WeakPolarHBondContact O-CB 3.22Å; T205-E209 VanDerWaalsContact O-CG 3.23Å; T205-E209 WeakPolarHBondContact O-CG 3.28Å; T205-E209 PolarHBondContact O-N 2.94Å; I206-E209 PolarHBondContact O-N 3.23Å; F207-E209 VanDerWaalsContact C-N 3.35Å; E209-F213 VanDerWaalsContact O-CB 3.26Å; E209-F213 WeakPolarHBondContact O-CB 3.41Å; E209-F213 PolarHBondContact O-N 3.42Å; E209-I214 PolarHBondContact O-N 2.9Å; E209-N266 PolarHBondContact OE1-OD1 3.05Å; E209-N266 VanDerWaalsContact OE2-CA 3.22Å; E209-N266 WeakPolarHBondContact OE2-CA 3.26Å; E209-N266 WeakPolarHBondContact OE2-CB 3.14Å; E209-N266 PolarHBondContact OE2-OD1 2.69Å; E209-N266 VanDerWaalsContact OE2-OD1 3.08Å; E209-L269 HydrophobicContact CG-CD2 4.5Å; E209-L269 HydrophobicContact CG-CG 4.41Å; E209-L269 WeakPolarHBondContact OE1-CD2 3.49Å; E209-F270 HydrophobicContact CB-CD2 4.26Å
210V81.5Confident84.2Confident69 Ų6956 Ų5642%0.41828%0.281SS..Iπ-helixtrans-65.4-49.8179.2171.90000110.6I206 F207 I214 F270I206-V210 HydrophobicContact CG2-CG2 4.38Å; I206-V210 WeakPolarHBondContact O-CB 3.49Å; I206-V210 VanDerWaalsContact O-CG2 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.43Å; I206-V210 PolarHBondContact O-N 3.44Å; F207-V210 PolarHBondContact O-N 3.21Å; V210-I214 WeakPolarHBondContact O-CB 3.34Å; V210-I214 PolarHBondContact O-N 3.3Å; V210-F270 HydrophobicContact CG2-CE2 4.3Å
211V84.7Confident85.2Confident61 Ų6151.8 Ų51.837%0.3727%0.27SS..Iπ-helixtrans-79.1-47.5-175.9178.50000111.2F207 I215F207-V211 HydrophobicContact CD2-CG2 4.12Å; F207-V211 HydrophobicContact CE1-CG2 4.27Å; F207-V211 HydrophobicContact CE2-CG2 3.76Å; F207-V211 HydrophobicContact CZ-CG2 3.84Å; F207-V211 WeakPolarHBondContact O-CB 3.4Å; F207-V211 WeakPolarHBondContact O-CG2 3.47Å; F207-V211 PolarHBondContact O-N 2.93Å; V211-I215 HydrophobicContact CB-CD1 4.47Å; V211-I215 HydrophobicContact CG1-CD1 3.85Å; V211-I215 WeakPolarHBondContact O-CB 3.36Å; V211-I215 WeakPolarHBondContact O-CG1 3.21Å
212G82.8Confident86.1Confident20 Ų2053.4 Ų53.421%0.20628%0.283CS..Iπ-helixtrans-80.7-15.8-172.800000115.2I208 P216I208-G212 WeakPolarHBondContact O-CA 3.17Å; I208-G212 PolarHBondContact O-N 2.84Å; G212-P216 WeakPolarHBondContact O-CD 3.29Å; G212-P216 VanDerWaalsContact O-CG 3.25Å; G212-P216 WeakPolarHBondContact O-CG 3.14Å
213F88.1Confident87Confident10 Ų1053.6 Ų53.64%0.04428%0.284CS..Iπ-helixtrans-115.4-45.8174.6164.4-106.4000113.6M126 E209 I215 P216 L217 F258 V263 N266M126-F213 HydrophobicContact SD-CD2 3.96Å; E209-F213 VanDerWaalsContact O-CB 3.26Å; E209-F213 WeakPolarHBondContact O-CB 3.41Å; E209-F213 PolarHBondContact O-N 3.42Å; F213-I215 PolarHBondContact O-N 3.46Å; F213-P216 WeakPolarHBondContact O-CD 3.41Å; F213-L217 HydrophobicContact CE1-CD2 4.24Å; F213-L217 HydrophobicContact CE2-CB 4.43Å; F213-L217 HydrophobicContact CZ-CD2 3.91Å; F213-L217 VanDerWaalsContact O-CB 3.28Å; F213-L217 WeakPolarHBondContact O-CB 3.4Å; F213-L217 PolarHBondContact O-N 3.42Å; F213-F258 HydrophobicContact CE2-CE1 4.34Å; F213-V263 HydrophobicContact CE2-CB 4.41Å; F213-V263 HydrophobicContact CE2-CG2 3.92Å; F213-V263 HydrophobicContact CZ-CB 4.17Å; F213-V263 HydrophobicContact CZ-CG1 4.21Å; F213-V263 HydrophobicContact CZ-CG2 3.9Å; F213-N266 HydrophobicContact CB-CB 4.03Å; F213-N266 HydrophobicContact CD1-CB 3.61Å; F213-N266 HydrophobicContact CD2-CB 3.64Å; F213-N266 HydrophobicContact CE1-CB 3.9Å; F213-N266 HydrophobicContact CE2-CB 3.93Å; F213-N266 HydrophobicContact CG-CB 3.47Å; F213-N266 VanDerWaalsContact CG-CB 3.47Å; F213-N266 HydrophobicContact CZ-CB 4.05Å
214I89.4Confident87.5Confident70 Ų7047 Ų4736%0.35926%0.257SS..Iπ-helixtrans-66.5-40.4-176.9-54.8-65.1000111.6E209 V210 L217 I218E209-I214 PolarHBondContact O-N 2.9Å; V210-I214 WeakPolarHBondContact O-CB 3.34Å; V210-I214 PolarHBondContact O-N 3.3Å; I214-L217 PolarHBondContact O-N 3.22Å; I214-I218 HydrophobicContact CG2-CD1 3.64Å; I214-I218 HydrophobicContact CG2-CG1 4.18Å; I214-I218 VanDerWaalsContact O-CG1 3.3Å; I214-I218 WeakPolarHBondContact O-CG1 3.48Å; I214-I218 PolarHBondContact O-N 3.32Å
215I90.4Very high88Confident87 Ų8746.2 Ų46.245%0.44626%0.257SS..Hα-helixtrans-64-52178.2-59.7174.8000110.7V211 F213 L217 I218 L219V211-I215 HydrophobicContact CB-CD1 4.47Å; V211-I215 HydrophobicContact CG1-CD1 3.85Å; V211-I215 WeakPolarHBondContact O-CB 3.36Å; V211-I215 WeakPolarHBondContact O-CG1 3.21Å; F213-I215 PolarHBondContact O-N 3.46Å; I215-L217 VanDerWaalsContact C-N 3.31Å; I215-L217 PolarHBondContact O-N 2.84Å; I215-I218 PolarHBondContact O-N 3.03Å; I215-L219 HydrophobicContact CG2-CD1 3.91Å; I215-L219 HydrophobicContact CG2-CG 4.39Å; I215-L219 WeakPolarHBondContact O-CB 3.37Å; I215-L219 WeakPolarHBondContact O-CG 3.16Å; I215-L219 PolarHBondContact O-N 3.43Å
216P91.3Very high88.6Confident2 Ų247.5 Ų47.51%0.01327%0.265CS..Hα-helixtrans-54.9-41.6172.2-34.943.7000114.2L127 T130 G212 F213 L219 N220 F258L127-P216 HydrophobicContact CD2-CG 3.85Å; T130-P216 WeakPolarHBondContact OG1-CB 3.23Å; G212-P216 WeakPolarHBondContact O-CD 3.29Å; G212-P216 VanDerWaalsContact O-CG 3.25Å; G212-P216 WeakPolarHBondContact O-CG 3.14Å; F213-P216 WeakPolarHBondContact O-CD 3.41Å; P216-L219 PolarHBondContact O-N 2.94Å; P216-N220 WeakPolarHBondContact O-CB 3.39Å; P216-N220 PolarHBondContact O-N 3.46Å; P216-N220 PolarHBondContact O-ND2 3.18Å; P216-F258 HydrophobicContact CB-CE2 4.25Å; P216-F258 HydrophobicContact CB-CZ 4.07Å
217L92.1Very high88.8Confident40 Ų4045.3 Ų45.321%0.20925%0.254CS..Hα-helixtrans-61.5-51.2178.4176.365.6000111.3F213 I214 I215 L219 N220 V221 F258 V263F213-L217 HydrophobicContact CE1-CD2 4.24Å; F213-L217 HydrophobicContact CE2-CB 4.43Å; F213-L217 HydrophobicContact CZ-CD2 3.91Å; F213-L217 VanDerWaalsContact O-CB 3.28Å; F213-L217 WeakPolarHBondContact O-CB 3.4Å; F213-L217 PolarHBondContact O-N 3.42Å; I214-L217 PolarHBondContact O-N 3.22Å; I215-L217 VanDerWaalsContact C-N 3.31Å; I215-L217 PolarHBondContact O-N 2.84Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 3.06Å; L217-N220 PolarHBondContact O-N 3.03Å; L217-V221 HydrophobicContact CD1-CG2 3.93Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.41Å; L217-V221 WeakPolarHBondContact O-CG2 3.11Å; L217-V221 PolarHBondContact O-N 2.73Å; L217-F258 HydrophobicContact CB-CE1 4.02Å; L217-F258 HydrophobicContact CB-CZ 4.32Å; L217-F258 HydrophobicContact CD1-CD1 4.23Å; L217-F258 HydrophobicContact CD1-CE1 3.66Å; L217-F258 HydrophobicContact CG-CE1 4.46Å; L217-V263 HydrophobicContact CD1-CG2 4.03Å
218I93.1Very high88.9Confident103 Ų10341 Ų4153%0.52824%0.237SC..Hα-helixtrans-60.2-44.7179.3-69.3171000110.5I214 I215 S222I214-I218 HydrophobicContact CG2-CD1 3.64Å; I214-I218 HydrophobicContact CG2-CG1 4.18Å; I214-I218 VanDerWaalsContact O-CG1 3.3Å; I214-I218 WeakPolarHBondContact O-CG1 3.48Å; I214-I218 PolarHBondContact O-N 3.32Å; I215-I218 PolarHBondContact O-N 3.03Å; I218-S222 WeakPolarHBondContact O-CB 3.43Å; I218-S222 PolarHBondContact O-N 3.47Å; I218-S222 PolarHBondContact O-OG 3.3Å
219L93.2Very high89.2Confident70 Ų7047 Ų4737%0.36626%0.256SS..Hα-helixtrans-62.8-46178.6-73.3175.1000111.8T130 I215 P216 L217 S222 C223T130-L219 HydrophobicContact CG2-CB 3.63Å; T130-L219 HydrophobicContact CG2-CD1 3.86Å; T130-L219 HydrophobicContact CG2-CG 4.42Å; I215-L219 HydrophobicContact CG2-CD1 3.91Å; I215-L219 HydrophobicContact CG2-CG 4.39Å; I215-L219 WeakPolarHBondContact O-CB 3.37Å; I215-L219 WeakPolarHBondContact O-CG 3.16Å; I215-L219 PolarHBondContact O-N 3.43Å; P216-L219 PolarHBondContact O-N 2.94Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 3.06Å; L219-S222 PolarHBondContact O-OG 2.88Å; L219-S222 VanDerWaalsContact O-OG 3.14Å; L219-C223 WeakPolarHBondContact O-CB 3.42Å; L219-C223 PolarHBondContact O-N 3.16Å; L219-C223 PolarHBondContact O-SG 3.32Å
220N91.2Very high89.2Confident0 Ų047.9 Ų47.90%026%0.262CS..Hα-helixtrans-62.7-47.5177.8-83.4-75000112.1T130 S133 P216 L217 S224T130-N220 PolarHBondContact OG1-ND2 3.38Å; S133-N220 VanDerWaalsContact CB-OD1 3.29Å; S133-N220 WeakPolarHBondContact CB-OD1 3.48Å; S133-N220 PolarHBondContact OG-OD1 3.09Å; P216-N220 WeakPolarHBondContact O-CB 3.39Å; P216-N220 PolarHBondContact O-N 3.46Å; P216-N220 PolarHBondContact O-ND2 3.18Å; L217-N220 PolarHBondContact O-N 3.03Å; N220-S224 WeakPolarHBondContact O-CB 3.19Å; N220-S224 PolarHBondContact O-N 2.89Å; N220-S224 PolarHBondContact O-OG 2.7Å
221V92.1Very high89.2Confident56 Ų5644.9 Ų44.934%0.33924%0.243SC..Hα-helixtrans-62.2-49.3180174.90000110.4L217 S225 M255L217-V221 HydrophobicContact CD1-CG2 3.93Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.41Å; L217-V221 WeakPolarHBondContact O-CG2 3.11Å; L217-V221 PolarHBondContact O-N 2.73Å; V221-S225 WeakPolarHBondContact O-CB 3.29Å; V221-S225 PolarHBondContact O-N 3.04Å; V221-S225 PolarHBondContact O-OG 2.9Å; V221-M255 HydrophobicContact CB-CE 4.26Å; V221-M255 HydrophobicContact CG2-CE 3.57Å
222S93.8Very high89.1Confident50 Ų5050.9 Ų50.935%0.3526%0.259SS..Hα-helixtrans-66.7-49.7-177.459.10000111.9I218 L219 S224 S225 V226I218-S222 WeakPolarHBondContact O-CB 3.43Å; I218-S222 PolarHBondContact O-N 3.47Å; I218-S222 PolarHBondContact O-OG 3.3Å; L219-S222 PolarHBondContact O-OG 2.88Å; L219-S222 VanDerWaalsContact O-OG 3.14Å; S222-S224 PolarHBondContact O-N 2.98Å; S222-S225 PolarHBondContact O-N 2.91Å; S222-V226 WeakPolarHBondContact O-CG2 3.2Å; S222-V226 PolarHBondContact O-N 3.34Å
223C92.4Very high89Confident9 Ų956 Ų566%0.06128%0.276CS..Hα-helixtrans-58.7-49.4178.2-69.80000110.9F137 L219 S225 V226 V227F137-C223 HydrophobicContact CB-CB 3.93Å; F137-C223 HydrophobicContact CG-CB 4.38Å; L219-C223 WeakPolarHBondContact O-CB 3.42Å; L219-C223 PolarHBondContact O-N 3.16Å; L219-C223 PolarHBondContact O-SG 3.32Å; C223-S225 VanDerWaalsContact C-N 3.34Å; C223-S225 PolarHBondContact O-N 2.96Å; C223-V226 PolarHBondContact O-N 3.26Å; C223-V227 VanDerWaalsContact O-CG2 3.28Å; C223-V227 WeakPolarHBondContact O-CG2 3.48Å; C223-V227 PolarHBondContact O-N 3.43Å
224S89.7Confident88.1Confident10 Ų1060.8 Ų60.87%0.0731%0.308CS..Hα-helixtrans-60.9-44.2178.8-60.60000111.3N220 S222 V226 V227 L228N220-S224 WeakPolarHBondContact O-CB 3.19Å; N220-S224 PolarHBondContact O-N 2.89Å; N220-S224 PolarHBondContact O-OG 2.7Å; S222-S224 PolarHBondContact O-N 2.98Å; S224-V226 PolarHBondContact O-N 3.45Å; S224-V227 PolarHBondContact O-N 2.82Å; S224-L228 WeakPolarHBondContact O-CB 3.46Å; S224-L228 WeakPolarHBondContact O-CD1 3.49Å; S224-L228 PolarHBondContact O-N 3.08Å
225S90.9Very high87.1Confident50 Ų5061.2 Ų61.235%0.3532%0.322SS..Hα-helixtrans-61.1-44.7178.8-64.40000112.4V221 S222 C223 L228 R229V221-S225 WeakPolarHBondContact O-CB 3.29Å; V221-S225 PolarHBondContact O-N 3.04Å; V221-S225 PolarHBondContact O-OG 2.9Å; S222-S225 PolarHBondContact O-N 2.91Å; C223-S225 VanDerWaalsContact C-N 3.34Å; C223-S225 PolarHBondContact O-N 2.96Å; S225-L228 PolarHBondContact O-N 3.46Å; S225-R229 WeakPolarHBondContact O-CB 3.46Å; S225-R229 VanDerWaalsContact O-CG 3.28Å; S225-R229 WeakPolarHBondContact O-CG 3.41Å; S225-R229 PolarHBondContact O-N 3.35Å
226V90.8Very high86Confident54 Ų5458.4 Ų58.433%0.32731%0.309SS..Hα-helixtrans-67.5-41.4178.6-179.20000110.8F137 V141 S222 C223 S224 L228 R229 T230F137-V226 HydrophobicContact CD2-CB 4.13Å; F137-V226 HydrophobicContact CD2-CG1 4.19Å; F137-V226 HydrophobicContact CE2-CB 3.93Å; F137-V226 HydrophobicContact CE2-CG1 3.71Å; F137-V226 HydrophobicContact CE2-CG2 4.47Å; V141-V226 HydrophobicContact CG1-CG1 4.49Å; V141-V226 HydrophobicContact CG2-CG1 3.97Å; S222-V226 WeakPolarHBondContact O-CG2 3.2Å; S222-V226 PolarHBondContact O-N 3.34Å; C223-V226 PolarHBondContact O-N 3.26Å; S224-V226 PolarHBondContact O-N 3.45Å; V226-L228 PolarHBondContact O-N 2.9Å; V226-R229 PolarHBondContact O-N 2.74Å; V226-T230 WeakPolarHBondContact O-CB 3.14Å; V226-T230 PolarHBondContact O-N 2.79Å; V226-T230 PolarHBondContact O-OG1 2.89Å
227V86.9Confident84.5Confident1 Ų162.1 Ų62.11%0.00633%0.328CS..Hα-helixtrans-61.4-46.4175.9177.10000111.1F137 I140 V141 C223 S224 R229 T230 L231 I251F137-V227 VanDerWaalsContact CA-CG2 3.44Å; F137-V227 HydrophobicContact CB-CG2 3.9Å; F137-V227 HydrophobicContact CD2-CG2 4.3Å; I140-V227 HydrophobicContact CB-CG1 4.47Å; I140-V227 HydrophobicContact CD1-CG1 3.46Å; I140-V227 VanDerWaalsContact CD1-CG1 3.46Å; I140-V227 HydrophobicContact CG2-CG1 4.32Å; V141-V227 HydrophobicContact CG2-CG2 4.5Å; C223-V227 VanDerWaalsContact O-CG2 3.28Å; C223-V227 WeakPolarHBondContact O-CG2 3.48Å; C223-V227 PolarHBondContact O-N 3.43Å; S224-V227 PolarHBondContact O-N 2.82Å; V227-R229 VanDerWaalsContact C-N 3.32Å; V227-R229 PolarHBondContact O-N 3.05Å; V227-T230 PolarHBondContact O-N 2.79Å; V227-L231 HydrophobicContact CG1-CD1 3.81Å; V227-L231 HydrophobicContact CG1-CG 4.16Å; V227-L231 WeakPolarHBondContact O-CB 3.24Å; V227-L231 VanDerWaalsContact O-CG 3.29Å; V227-L231 WeakPolarHBondContact O-CG 3.09Å; V227-L231 PolarHBondContact O-N 2.89Å; V227-I251 HydrophobicContact CB-CD1 3.95Å; V227-I251 HydrophobicContact CG1-CD1 3.23Å
228L86.6Confident82.8Confident46 Ų4665.4 Ų65.424%0.24136%0.355CS..Hα-helixtrans-59-43.2176.9-94.574.1000111.7S224 S225 V226 L231 R232 L248 I251S224-L228 WeakPolarHBondContact O-CB 3.46Å; S224-L228 WeakPolarHBondContact O-CD1 3.49Å; S224-L228 PolarHBondContact O-N 3.08Å; S225-L228 PolarHBondContact O-N 3.46Å; V226-L228 PolarHBondContact O-N 2.9Å; L228-L231 PolarHBondContact O-N 2.93Å; L228-R232 WeakPolarHBondContact O-CG 3.44Å; L228-R232 PolarHBondContact O-N 3.32Å; L228-L248 HydrophobicContact CD1-CD1 4.24Å; L228-L248 HydrophobicContact CD2-CD1 4.28Å; L228-L248 HydrophobicContact CG-CD1 3.89Å; L228-I251 HydrophobicContact CD1-CB 4.22Å; L228-I251 HydrophobicContact CD1-CD1 4.22Å; L228-I251 HydrophobicContact CD1-CG2 3.5Å
229R87.9Confident81.5Confident177 Ų17767.2 Ų67.267%0.66836%0.361SS*.Hα-helixtrans-63.1-43.8176.3-73.7174.9-176.7-173.61.5111.8S225 V226 V227 R232S225-R229 WeakPolarHBondContact O-CB 3.46Å; S225-R229 VanDerWaalsContact O-CG 3.28Å; S225-R229 WeakPolarHBondContact O-CG 3.41Å; S225-R229 PolarHBondContact O-N 3.35Å; V226-R229 PolarHBondContact O-N 2.74Å; V227-R229 VanDerWaalsContact C-N 3.32Å; V227-R229 PolarHBondContact O-N 3.05Å; R229-R232 PolarHBondContact O-N 3.14Å
230T84.4Confident80.1Confident20 Ų2065.8 Ų65.812%0.12335%0.353CS..Hα-helixtrans-65.1-41178.6-60.70000111.4I140 V226 V227 R232 K233 T236I140-T230 HydrophobicContact CG2-CG2 4.06Å; V226-T230 WeakPolarHBondContact O-CB 3.14Å; V226-T230 PolarHBondContact O-N 2.79Å; V226-T230 PolarHBondContact O-OG1 2.89Å; V227-T230 PolarHBondContact O-N 2.79Å; T230-R232 PolarHBondContact O-N 3.13Å; T230-K233 WeakPolarHBondContact O-CB 3.38Å; T230-K233 PolarHBondContact O-N 3.44Å; T230-K233 VanDerWaalsContact O-N 3.1Å; T230-T236 HydrophobicContact CG2-CG2 4.27Å
231L81.6Confident78.9Confident6 Ų667.7 Ų67.73%0.03137%0.372CS..Hα-helixtrans-67.1-18.9176.2-69.7175.3000113.8I140 V227 L228 I240 K244 V247 I251I140-L231 HydrophobicContact CG2-CD2 4.19Å; I140-L231 HydrophobicContact CG2-CG 4.49Å; V227-L231 HydrophobicContact CG1-CD1 3.81Å; V227-L231 HydrophobicContact CG1-CG 4.16Å; V227-L231 WeakPolarHBondContact O-CB 3.24Å; V227-L231 VanDerWaalsContact O-CG 3.29Å; V227-L231 WeakPolarHBondContact O-CG 3.09Å; V227-L231 PolarHBondContact O-N 2.89Å; L228-L231 PolarHBondContact O-N 2.93Å; L231-I240 HydrophobicContact CD2-CD1 3.58Å; L231-K244 WeakPolarHBondContact O-CE 3.45Å; L231-K244 PolarHBondContact O-NZ 3.45Å; L231-V247 HydrophobicContact CD1-CB 4.43Å; L231-V247 HydrophobicContact CD1-CG1 3.77Å; L231-I251 HydrophobicContact CD1-CD1 4.41Å
232R82.2Confident77.4Confident188 Ų18871.3 Ų71.371%0.70940%0.395SS*.THydrogen-bonded Turntrans-79.1-16.3173.8-72.7174.1-173-178.22113L228 R229 T230L228-R232 WeakPolarHBondContact O-CG 3.44Å; L228-R232 PolarHBondContact O-N 3.32Å; R229-R232 PolarHBondContact O-N 3.14Å; T230-R232 PolarHBondContact O-N 3.13Å
233K81.8Confident76.3Confident128 Ų12872.7 Ų72.756%0.55740%0.398SS*.SBendtrans-73.3135.1-179.9-64.6-174.5178.1-1760111.4T230 A235 T236 L237T230-K233 WeakPolarHBondContact O-CB 3.38Å; T230-K233 PolarHBondContact O-N 3.44Å; T230-K233 VanDerWaalsContact O-N 3.1Å; K233-A235 PolarHBondContact O-N 2.9Å; K233-T236 PolarHBondContact O-N 2.9Å; K233-L237 PolarHBondContact O-N 2.99Å
234P69.3Low75.6Confident109 Ų10974.9 Ų74.971%0.70841%0.407SS*.Hα-helixtrans-62.5-36.8-178-21.931.5000114T236 L237P234-T236 VanDerWaalsContact C-N 3.32Å; P234-T236 PolarHBondContact O-N 3.29Å; P234-L237 WeakPolarHBondContact O-CB 3.4Å; P234-L237 PolarHBondContact O-N 3.1Å
235A68.6Low75Confident80 Ų8083 Ų8366%0.66144%0.441SS*.Hα-helixtrans-64.5-34.1-179.300000113.1K233 L237K233-A235 PolarHBondContact O-N 2.9Å; A235-L237 VanDerWaalsContact C-N 3.28Å
236T66.8Low74.4Confident27 Ų2782.6 Ų82.617%0.16643%0.433CS..Hα-helixtrans-78.9-16.4176.3-38.70000111.8T230 K233 P234 I240T230-T236 HydrophobicContact CG2-CG2 4.27Å; K233-T236 PolarHBondContact O-N 2.9Å; P234-T236 VanDerWaalsContact C-N 3.32Å; P234-T236 PolarHBondContact O-N 3.29Å; T236-I240 HydrophobicContact CG2-CD1 3.76Å; T236-I240 HydrophobicContact CG2-CG1 4.4Å; T236-I240 PolarHBondContact O-N 3.23Å
237L58.3Low73.9Confident81 Ų8181.2 Ų81.242%0.42443%0.425SS..Hα-helixtrans-69.7-38.7179.5-167.163.5000112.1K233 P234 A235 Q239 G241 K244K233-L237 PolarHBondContact O-N 2.99Å; P234-L237 WeakPolarHBondContact O-CB 3.4Å; P234-L237 PolarHBondContact O-N 3.1Å; A235-L237 VanDerWaalsContact C-N 3.28Å; L237-Q239 VanDerWaalsContact C-N 3.34Å; L237-G241 PolarHBondContact O-N 2.99Å; L237-G241 VanDerWaalsContact O-N 3.12Å; L237-K244 HydrophobicContact CD1-CD 3.24Å
238S57.2Low73.6Confident109 Ų10984.5 Ų84.576%0.76244%0.441SS*.Hα-helixtrans-71.4-30.7178.177.60000112.3
239Q65.1Low73.5Confident141 Ų14187.6 Ų87.666%0.65945%0.453SS*.Hα-helixtrans-80.4-29.5-176.1-153.61782.200113.7L237L237-Q239 VanDerWaalsContact C-N 3.34Å
240I64.9Low73.3Confident40 Ų4079.3 Ų79.321%0.20542%0.422CS..Hα-helixtrans-99.3-23.4-178.8-64.1176.1000112.1I140 L231 T236 T242 N243 K244I140-I240 HydrophobicContact CG2-CD1 4.37Å; L231-I240 HydrophobicContact CD2-CD1 3.58Å; T236-I240 HydrophobicContact CG2-CD1 3.76Å; T236-I240 HydrophobicContact CG2-CG1 4.4Å; T236-I240 PolarHBondContact O-N 3.23Å; I240-T242 PolarHBondContact O-N 2.68Å; I240-N243 HydrophobicContact CG2-CB 4.06Å; I240-N243 WeakPolarHBondContact O-CB 3.41Å; I240-N243 PolarHBondContact O-N 2.84Å; I240-K244 HydrophobicContact CG2-CB 4.2Å
241G66.8Low73.3Confident39 Ų3978.9 Ų78.940%0.40242%0.419SS..THydrogen-bonded Turntrans54.8-136.5174.800000114L237 N243 K244L237-G241 PolarHBondContact O-N 2.99Å; L237-G241 VanDerWaalsContact O-N 3.12Å; G241-N243 PolarHBondContact O-N 2.03Å; G241-N243 VanDerWaalsContact O-N 3.13Å; G241-K244 PolarHBondContact O-N 2.93Å
242T59.7Low73.5Confident133 Ų13382.3 Ų82.382%0.81644%0.44SS*.THydrogen-bonded Turntrans-61.5-18.5-178.447.40000114.1I240 K244I240-T242 PolarHBondContact O-N 2.68Å; T242-K244 VanDerWaalsContact C-N 3.26Å; T242-K244 PolarHBondContact O-N 3.48Å
243N71.4Confident73.7Confident78 Ų7874.8 Ų74.842%0.41742%0.415SS..Hα-helixtrans-74.9-11179.9-68.5-32.4000113.8I240 G241 K245 K246 V247I240-N243 HydrophobicContact CG2-CB 4.06Å; I240-N243 WeakPolarHBondContact O-CB 3.41Å; I240-N243 PolarHBondContact O-N 2.84Å; G241-N243 PolarHBondContact O-N 2.03Å; G241-N243 VanDerWaalsContact O-N 3.13Å; N243-K245 PolarHBondContact O-N 2.91Å; N243-K246 WeakPolarHBondContact O-CB 3.44Å; N243-K246 PolarHBondContact O-N 2.84Å; N243-V247 WeakPolarHBondContact O-CG2 3.49Å; N243-V247 PolarHBondContact O-N 2.87Å
244K76.2Confident73.8Confident55 Ų5568.9 Ų68.924%0.23939%0.389CS..Hα-helixtrans-59-45.5179.2174.5175.9168.5173.90112.5L231 L237 I240 G241 T242 K246 V247 L248L231-K244 WeakPolarHBondContact O-CE 3.45Å; L231-K244 PolarHBondContact O-NZ 3.45Å; L237-K244 HydrophobicContact CD1-CD 3.24Å; I240-K244 HydrophobicContact CG2-CB 4.2Å; G241-K244 PolarHBondContact O-N 2.93Å; T242-K244 VanDerWaalsContact C-N 3.26Å; T242-K244 PolarHBondContact O-N 3.48Å; K244-K246 PolarHBondContact O-N 3.04Å; K244-V247 PolarHBondContact O-N 2.82Å; K244-L248 WeakPolarHBondContact O-CB 3.31Å; K244-L248 PolarHBondContact O-N 3.43Å
245K77.1Confident74.8Confident181 Ų18166 Ų6679%0.78737%0.367SS*.Hα-helixtrans-60.9-38.6179.2-73.3-175.8179.31790111.1N243 K249N243-K245 PolarHBondContact O-N 2.91Å; K245-K249 WeakPolarHBondContact O-CB 3.46Å; K245-K249 PolarHBondContact O-N 3.19Å
246K77.9Confident75.8Confident42 Ų4264.5 Ų64.518%0.18336%0.355CS..Hα-helixtrans-65.9-49.5178.2-175.9173-175.1158.90112N243 K244 L248 K249 M250 E316N243-K246 WeakPolarHBondContact O-CB 3.44Å; N243-K246 PolarHBondContact O-N 2.84Å; K244-K246 PolarHBondContact O-N 3.04Å; K246-L248 VanDerWaalsContact C-N 3.33Å; K246-L248 PolarHBondContact O-N 3.4Å; K246-K249 PolarHBondContact O-N 3.43Å; K246-M250 WeakPolarHBondContact O-CB 3.38Å; K246-M250 PolarHBondContact O-N 3.01Å; K246-E316 WeakPolarHBondContact CD-OE1 3.24Å; K246-E316 WeakPolarHBondContact CE-OE1 3.43Å; K246-E316 IonicContact NZ-OE1 3Å; K246-E316 PolarHBondContact NZ-OE1 3.2Å
247V80.4Confident76.9Confident25 Ų2563.8 Ų63.815%0.15235%0.35CS..Hα-helixtrans-61.1-42.7177.41750000111.2I140 L231 N243 K244 M250 I251I140-V247 HydrophobicContact CD1-CG1 3.53Å; L231-V247 HydrophobicContact CD1-CB 4.43Å; L231-V247 HydrophobicContact CD1-CG1 3.77Å; N243-V247 WeakPolarHBondContact O-CG2 3.49Å; N243-V247 PolarHBondContact O-N 2.87Å; K244-V247 PolarHBondContact O-N 2.82Å; V247-M250 HydrophobicContact CG1-CE 4.21Å; V247-M250 WeakPolarHBondContact O-CB 3.43Å; V247-M250 PolarHBondContact O-N 2.95Å; V247-I251 HydrophobicContact CG1-CD1 3.87Å; V247-I251 WeakPolarHBondContact O-CG1 3.34Å; V247-I251 PolarHBondContact O-N 3.13Å
248L82.2Confident78.5Confident69 Ų6959.9 Ų59.936%0.36133%0.33SS..Hα-helixtrans-62.2-47.6177.1-174.766000111.2L228 K244 K246 M250 I251 T252L228-L248 HydrophobicContact CD1-CD1 4.24Å; L228-L248 HydrophobicContact CD2-CD1 4.28Å; L228-L248 HydrophobicContact CG-CD1 3.89Å; K244-L248 WeakPolarHBondContact O-CB 3.31Å; K244-L248 PolarHBondContact O-N 3.43Å; K246-L248 VanDerWaalsContact C-N 3.33Å; K246-L248 PolarHBondContact O-N 3.4Å; L248-M250 VanDerWaalsContact C-N 3.32Å; L248-M250 PolarHBondContact O-N 3.25Å; L248-I251 PolarHBondContact O-N 3.37Å; L248-T252 WeakPolarHBondContact O-CB 3.47Å; L248-T252 PolarHBondContact O-N 3.48Å; L248-T252 PolarHBondContact O-OG1 3.24Å; L248-T252 VanDerWaalsContact O-OG1 3.05Å
249K83.1Confident80.1Confident111 Ų11157.6 Ų57.648%0.48331%0.311SS..Hα-helixtrans-59.8-43178.4-169.7170.4-172.4-1750111.8K245 K246 T252 V253 F313K245-K249 WeakPolarHBondContact O-CB 3.46Å; K245-K249 PolarHBondContact O-N 3.19Å; K246-K249 PolarHBondContact O-N 3.43Å; K249-T252 PolarHBondContact O-N 3.33Å; K249-V253 WeakPolarHBondContact O-CB 3.35Å; K249-V253 VanDerWaalsContact O-CG2 3.27Å; K249-V253 WeakPolarHBondContact O-CG2 3.3Å; K249-V253 PolarHBondContact O-N 2.78Å; K249-F313 HydrophobicContact CD-CD1 3.54Å; K249-F313 HydrophobicContact CD-CE1 3.35Å; K249-F313 HydrophobicContact CD-CG 4.31Å; K249-F313 HydrophobicContact CD-CZ 3.96Å; K249-F313 HydrophobicContact CG-CD1 3.83Å; K249-F313 HydrophobicContact CG-CE1 4.04Å; K249-F313 HydrophobicContact CG-CG 4.13Å; K249-F313 HydrophobicContact CG-CZ 4.48Å; K249-F313 VanDerWaalsContact NZ-CZ 3.27Å
250M83.9Confident81.4Confident4 Ų454.2 Ų54.22%0.0230%0.3CS..Hα-helixtrans-57.8-51.8175176-163.771.400111.7R136 K246 V247 L248 T252 V253 H254 F313 T314R136-M250 HydrophobicContact CB-CE 4.23Å; R136-M250 HydrophobicContact CG-CE 3.47Å; R136-M250 VanDerWaalsContact CG-CE 3.47Å; R136-M250 HydrophobicContact CG-SD 4.29Å; R136-M250 PolarHBondContact NE-SD 3.43Å; R136-M250 VanDerWaalsContact NE-SD 3.38Å; K246-M250 WeakPolarHBondContact O-CB 3.38Å; K246-M250 PolarHBondContact O-N 3.01Å; V247-M250 HydrophobicContact CG1-CE 4.21Å; V247-M250 WeakPolarHBondContact O-CB 3.43Å; V247-M250 PolarHBondContact O-N 2.95Å; L248-M250 VanDerWaalsContact C-N 3.32Å; L248-M250 PolarHBondContact O-N 3.25Å; M250-T252 PolarHBondContact O-N 3.39Å; M250-V253 PolarHBondContact O-N 2.98Å; M250-H254 WeakPolarHBondContact CG-CE1 3.46Å; M250-H254 PolarHBondContact O-CD2 3.31Å; M250-H254 PolarHBondContact O-N 3Å; M250-F313 HydrophobicContact CB-CB 4.12Å; M250-T314 HydrophobicContact CG-CG2 4.37Å; M250-T314 VanDerWaalsContact CG-OG1 3.32Å; M250-T314 WeakPolarHBondContact CG-OG1 2.96Å; M250-T314 HydrophobicContact SD-CG2 3.66Å
251I84.7Confident82.7Confident10 Ų1052.3 Ų52.35%0.05129%0.29CS..Hα-helixtrans-63.3-42.9-179.8-64162.4000111.1V227 L228 L231 V247 L248 V253 H254 M255V227-I251 HydrophobicContact CB-CD1 3.95Å; V227-I251 HydrophobicContact CG1-CD1 3.23Å; L228-I251 HydrophobicContact CD1-CB 4.22Å; L228-I251 HydrophobicContact CD1-CD1 4.22Å; L228-I251 HydrophobicContact CD1-CG2 3.5Å; L231-I251 HydrophobicContact CD1-CD1 4.41Å; V247-I251 HydrophobicContact CG1-CD1 3.87Å; V247-I251 WeakPolarHBondContact O-CG1 3.34Å; V247-I251 PolarHBondContact O-N 3.13Å; L248-I251 PolarHBondContact O-N 3.37Å; I251-V253 VanDerWaalsContact C-N 3.34Å; I251-V253 PolarHBondContact O-N 3.44Å; I251-H254 PolarHBondContact O-N 2.84Å; I251-M255 VanDerWaalsContact O-CB 3.29Å; I251-M255 WeakPolarHBondContact O-CB 3.28Å; I251-M255 PolarHBondContact O-N 3.42Å
252T85.8Confident84Confident79 Ų7950.5 Ų50.549%0.48527%0.271SS..Hα-helixtrans-60.1-44.5177.1-61.70000111.4L248 K249 M250 A256L248-T252 WeakPolarHBondContact O-CB 3.47Å; L248-T252 PolarHBondContact O-N 3.48Å; L248-T252 PolarHBondContact O-OG1 3.24Å; L248-T252 VanDerWaalsContact O-OG1 3.05Å; K249-T252 PolarHBondContact O-N 3.33Å; M250-T252 PolarHBondContact O-N 3.39Å; T252-A256 VanDerWaalsContact O-CB 3.24Å; T252-A256 WeakPolarHBondContact O-CB 3.48Å; T252-A256 PolarHBondContact O-N 2.96Å
253V87.4Confident85.6Confident29 Ų2945.9 Ų45.918%0.17624%0.243CC..Hα-helixtrans-65.8-45.2178.4170.20000111.1K249 M250 I251 M255 A256 V257 F309 I310 F313K249-V253 WeakPolarHBondContact O-CB 3.35Å; K249-V253 VanDerWaalsContact O-CG2 3.27Å; K249-V253 WeakPolarHBondContact O-CG2 3.3Å; K249-V253 PolarHBondContact O-N 2.78Å; M250-V253 PolarHBondContact O-N 2.98Å; I251-V253 VanDerWaalsContact C-N 3.34Å; I251-V253 PolarHBondContact O-N 3.44Å; V253-M255 VanDerWaalsContact C-N 3.34Å; V253-M255 PolarHBondContact O-N 3.45Å; V253-A256 PolarHBondContact O-N 3.05Å; V253-V257 HydrophobicContact CG1-CG2 4.45Å; V253-V257 WeakPolarHBondContact O-CG2 3.17Å; V253-V257 PolarHBondContact O-N 3.22Å; V253-F309 HydrophobicContact CG1-CB 4.17Å; V253-I310 HydrophobicContact CG1-CG1 4.21Å; V253-F313 HydrophobicContact CB-CD2 4.21Å; V253-F313 HydrophobicContact CG1-CD2 4.2Å; V253-F313 HydrophobicContact CG2-CD2 3.7Å; V253-F313 HydrophobicContact CG2-CE2 3.97Å
254H84.4Confident86.8Confident4 Ų444 Ų442%0.01924%0.235CC..Hα-helixtrans-62-44.3179.3-64.2-178.8000111.7M250 I251 V257 F258 I310 T314M250-H254 WeakPolarHBondContact CG-CE1 3.46Å; M250-H254 PolarHBondContact O-CD2 3.31Å; M250-H254 PolarHBondContact O-N 3Å; I251-H254 PolarHBondContact O-N 2.84Å; H254-V257 PolarHBondContact O-N 3.31Å; H254-F258 WeakPolarHBondContact O-CB 3.43Å; H254-F258 PolarHBondContact O-N 3.13Å; H254-I310 VanDerWaalsContact CD2-CG2 3.46Å; H254-I310 WeakPolarHBondContact CD2-CG2 3.3Å; H254-I310 WeakPolarHBondContact NE2-CG2 3.36Å; H254-T314 PolarHBondContact CE1-OG1 3.37Å; H254-T314 PolarHBondContact NE2-OG1 2.84Å
255M88.3Confident87.6Confident49 Ų4941.7 Ų41.724%0.24123%0.225CC..Hα-helixtrans-63.8-42.9176.9-170.769.3174.900111.3V221 I251 V253 F258 V259V221-M255 HydrophobicContact CB-CE 4.26Å; V221-M255 HydrophobicContact CG2-CE 3.57Å; I251-M255 VanDerWaalsContact O-CB 3.29Å; I251-M255 WeakPolarHBondContact O-CB 3.28Å; I251-M255 PolarHBondContact O-N 3.42Å; V253-M255 VanDerWaalsContact C-N 3.34Å; V253-M255 PolarHBondContact O-N 3.45Å; M255-F258 PolarHBondContact O-N 3.21Å; M255-V259 HydrophobicContact CE-CG2 4.02Å; M255-V259 HydrophobicContact CG-CG2 4.35Å; M255-V259 WeakPolarHBondContact O-CB 3.39Å; M255-V259 VanDerWaalsContact O-CG2 3.29Å; M255-V259 WeakPolarHBondContact O-CG2 3.49Å; M255-V259 PolarHBondContact O-N 3.22Å; M255-V259 HydrophobicContact SD-CG2 4.39Å
256A90Very high88.3Confident49 Ų4933 Ų3341%0.40519%0.187SC..Hα-helixtrans-62.2-46.8178.100000111.3T252 V253 F258 V259 V260T252-A256 VanDerWaalsContact O-CB 3.24Å; T252-A256 WeakPolarHBondContact O-CB 3.48Å; T252-A256 PolarHBondContact O-N 2.96Å; V253-A256 PolarHBondContact O-N 3.05Å; A256-F258 VanDerWaalsContact C-N 3.34Å; A256-F258 PolarHBondContact O-N 3.01Å; A256-V259 PolarHBondContact O-N 3.01Å; A256-V260 VanDerWaalsContact O-CB 3.24Å; A256-V260 WeakPolarHBondContact O-CB 3.41Å; A256-V260 VanDerWaalsContact O-CG2 3.22Å; A256-V260 WeakPolarHBondContact O-CG2 3.3Å; A256-V260 PolarHBondContact O-N 2.69Å
257V90.7Very high89Confident11 Ų1133.7 Ų33.77%0.06720%0.197CC..Hα-helixtrans-61-44.9176.2174.50000110.6V253 H254 V259 C261 F306 I310V253-V257 HydrophobicContact CG1-CG2 4.45Å; V253-V257 WeakPolarHBondContact O-CG2 3.17Å; V253-V257 PolarHBondContact O-N 3.22Å; H254-V257 PolarHBondContact O-N 3.31Å; V257-V259 PolarHBondContact O-N 3.03Å; V257-C261 VanDerWaalsContact O-CB 3.23Å; V257-C261 WeakPolarHBondContact O-CB 3.12Å; V257-C261 PolarHBondContact O-N 3.39Å; V257-C261 PolarHBondContact O-SG 3.12Å; V257-F306 HydrophobicContact CG1-CB 4.26Å; V257-F306 HydrophobicContact CG2-CB 3.75Å; V257-F306 HydrophobicContact CG2-CG 4.46Å; V257-I310 HydrophobicContact CB-CD1 4.15Å; V257-I310 HydrophobicContact CG1-CD1 4.1Å; V257-I310 HydrophobicContact CG2-CD1 4.14Å; V257-I310 HydrophobicContact CG2-CG1 4.32Å
258F90.8Very high89.6Confident0 Ų033.1 Ų33.10%019%0.193CC..Iπ-helixtrans-61-48.2-179.9-171.7-82.1000112.1M126 L129 F213 P216 L217 H254 M255 A256 F262 V263M126-F258 HydrophobicContact CB-CE2 4.04Å; M126-F258 HydrophobicContact CG-CE2 3.89Å; M126-F258 HydrophobicContact CG-CZ 4.43Å; L129-F258 HydrophobicContact CB-CD2 4.5Å; L129-F258 HydrophobicContact CD1-CD2 4.41Å; F213-F258 HydrophobicContact CE2-CE1 4.34Å; P216-F258 HydrophobicContact CB-CE2 4.25Å; P216-F258 HydrophobicContact CB-CZ 4.07Å; L217-F258 HydrophobicContact CB-CE1 4.02Å; L217-F258 HydrophobicContact CB-CZ 4.32Å; L217-F258 HydrophobicContact CD1-CD1 4.23Å; L217-F258 HydrophobicContact CD1-CE1 3.66Å; L217-F258 HydrophobicContact CG-CE1 4.46Å; H254-F258 WeakPolarHBondContact O-CB 3.43Å; H254-F258 PolarHBondContact O-N 3.13Å; M255-F258 PolarHBondContact O-N 3.21Å; A256-F258 VanDerWaalsContact C-N 3.34Å; A256-F258 PolarHBondContact O-N 3.01Å; F258-F262 HydrophobicContact CB-CD2 4.4Å; F258-F262 AromaticContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CE2 4.41Å; F258-F262 HydrophobicContact CE2-CD2 4.31Å; F258-F262 HydrophobicContact CG-CD2 4.13Å; F258-F262 WeakPolarHBondContact O-CB 3.31Å; F258-F262 PolarHBondContact O-N 2.9Å; F258-V263 HydrophobicContact CD1-CG2 4.46Å; F258-V263 HydrophobicContact CE1-CG2 4.42Å
259V91.9Very high89.9Confident61 Ų6130.4 Ų30.437%0.3718%0.179SC..Iπ-helixtrans-68.9-44.2-178.6172.70000111.3M255 A256 V257 V263 P264M255-V259 HydrophobicContact CE-CG2 4.02Å; M255-V259 HydrophobicContact CG-CG2 4.35Å; M255-V259 WeakPolarHBondContact O-CB 3.39Å; M255-V259 VanDerWaalsContact O-CG2 3.29Å; M255-V259 WeakPolarHBondContact O-CG2 3.49Å; M255-V259 PolarHBondContact O-N 3.22Å; M255-V259 HydrophobicContact SD-CG2 4.39Å; A256-V259 PolarHBondContact O-N 3.01Å; V257-V259 PolarHBondContact O-N 3.03Å; V259-V263 HydrophobicContact CB-CG2 4.49Å; V259-V263 WeakPolarHBondContact O-CB 3.17Å; V259-P264 WeakPolarHBondContact O-CD 3.49Å
260V92.3Very high90.3Very high70 Ų7028.9 Ų28.942%0.42417%0.173SC..Iπ-helixtrans-72-43-176.8172.10000111.2A256 P264 L299A256-V260 VanDerWaalsContact O-CB 3.24Å; A256-V260 WeakPolarHBondContact O-CB 3.41Å; A256-V260 VanDerWaalsContact O-CG2 3.22Å; A256-V260 WeakPolarHBondContact O-CG2 3.3Å; A256-V260 PolarHBondContact O-N 2.69Å; V260-P264 WeakPolarHBondContact O-CD 3.07Å; V260-P264 WeakPolarHBondContact O-CG 3.42Å; V260-L299 HydrophobicContact CG1-CD1 3.95Å; V260-L299 HydrophobicContact CG1-CD2 4.45Å; V260-L299 HydrophobicContact CG1-CG 4.43Å; V260-L299 WeakPolarHBondContact O-CD2 3.33Å; V260-L299 WeakPolarHBondContact O-CG 3.19Å
261C93.3Very high90.5Very high0 Ų030.2 Ų30.20%018%0.18CC..Iπ-helixtrans-85.4-42.2-172.3-550000112.4V257 A300 N303 F306V257-C261 VanDerWaalsContact O-CB 3.23Å; V257-C261 WeakPolarHBondContact O-CB 3.12Å; V257-C261 PolarHBondContact O-N 3.39Å; V257-C261 PolarHBondContact O-SG 3.12Å; C261-A300 WeakPolarHBondContact O-CA 3.21Å; C261-A300 WeakPolarHBondContact O-CB 3.14Å; C261-N303 HydrophobicContact CB-CB 3.98Å; C261-F306 VanDerWaalsContact SG-CD2 3.56Å
262F93.2Very high90.6Very high0 Ų031.8 Ų31.80%019%0.185CC..Iπ-helixtrans-99.7-38.6-169.4-53.9-62.3000113.6M126 L129 F258 Y265 N266 N303M126-F262 HydrophobicContact CE-CB 4.17Å; M126-F262 HydrophobicContact CE-CD1 3.8Å; M126-F262 HydrophobicContact CE-CG 4.14Å; M126-F262 HydrophobicContact CG-CB 3.94Å; M126-F262 HydrophobicContact CG-CD1 3.66Å; M126-F262 HydrophobicContact CG-CD2 3.61Å; M126-F262 HydrophobicContact CG-CE1 4.04Å; M126-F262 HydrophobicContact CG-CE2 4.06Å; M126-F262 HydrophobicContact CG-CG 3.43Å; M126-F262 VanDerWaalsContact CG-CG 3.43Å; M126-F262 HydrophobicContact CG-CZ 4.24Å; M126-F262 HydrophobicContact SD-CB 3.8Å; M126-F262 HydrophobicContact SD-CD1 4.19Å; M126-F262 HydrophobicContact SD-CG 3.94Å; L129-F262 HydrophobicContact CD1-CE2 3.59Å; L129-F262 HydrophobicContact CD1-CZ 4.34Å; F258-F262 HydrophobicContact CB-CD2 4.4Å; F258-F262 AromaticContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CE2 4.41Å; F258-F262 HydrophobicContact CE2-CD2 4.31Å; F258-F262 HydrophobicContact CG-CD2 4.13Å; F258-F262 WeakPolarHBondContact O-CB 3.31Å; F258-F262 PolarHBondContact O-N 2.9Å; F262-Y265 PolarHBondContact O-N 3.11Å; F262-N266 PolarHBondContact O-N 3.45Å; F262-N266 PolarHBondContact O-ND2 3.32Å; F262-N303 HydrophobicContact CE1-CB 4.05Å; F262-N303 HydrophobicContact CE2-CB 4.47Å; F262-N303 HydrophobicContact CZ-CB 3.64Å
263V93.6Very high90.6Very high37 Ų3728 Ų2822%0.22416%0.162CC..Hα-helixtrans-61.3-46-174.8176.20000112.6F213 L217 F258 V259 Y265 S267F213-V263 HydrophobicContact CE2-CB 4.41Å; F213-V263 HydrophobicContact CE2-CG2 3.92Å; F213-V263 HydrophobicContact CZ-CB 4.17Å; F213-V263 HydrophobicContact CZ-CG1 4.21Å; F213-V263 HydrophobicContact CZ-CG2 3.9Å; L217-V263 HydrophobicContact CD1-CG2 4.03Å; F258-V263 HydrophobicContact CD1-CG2 4.46Å; F258-V263 HydrophobicContact CE1-CG2 4.42Å; V259-V263 HydrophobicContact CB-CG2 4.49Å; V259-V263 WeakPolarHBondContact O-CB 3.17Å; V263-Y265 PolarHBondContact O-N 2.84Å; V263-S267 WeakPolarHBondContact O-CB 3.44Å; V263-S267 PolarHBondContact O-N 3.31Å; V263-S267 PolarHBondContact O-OG 3.49Å
264P95.3Very high90.6Very high39 Ų3928.3 Ų28.325%0.25316%0.163SC..Hα-helixtrans-61.7-42.9178.2-25.935.7000112.6V259 V260 V268 T296 L299V259-P264 WeakPolarHBondContact O-CD 3.49Å; V260-P264 WeakPolarHBondContact O-CD 3.07Å; V260-P264 WeakPolarHBondContact O-CG 3.42Å; P264-V268 WeakPolarHBondContact O-CB 3.42Å; P264-V268 VanDerWaalsContact O-CG2 3.26Å; P264-V268 WeakPolarHBondContact O-CG2 3.31Å; P264-V268 PolarHBondContact O-N 2.75Å; P264-T296 HydrophobicContact CB-CG2 3.66Å; P264-L299 HydrophobicContact CB-CD2 4.25Å; P264-L299 HydrophobicContact CG-CD2 4Å
265Y93.9Very high90.6Very high5 Ų528.3 Ų28.32%0.0216%0.163CC..Hα-helixtrans-64.5-55-178.5173.9-108.3000112.1I122 F262 V263 S267 V268 L269 Y293 L297 A300I122-Y265 HydrophobicContact CD1-CD1 3.85Å; I122-Y265 HydrophobicContact CD1-CE1 3.54Å; I122-Y265 HydrophobicContact CG2-CD1 4.44Å; I122-Y265 HydrophobicContact CG2-CE1 4.19Å; F262-Y265 PolarHBondContact O-N 3.11Å; V263-Y265 PolarHBondContact O-N 2.84Å; Y265-S267 VanDerWaalsContact C-N 3.32Å; Y265-S267 PolarHBondContact O-N 3.08Å; Y265-V268 PolarHBondContact O-N 3.04Å; Y265-L269 HydrophobicContact CE1-CD2 3.91Å; Y265-L269 VanDerWaalsContact O-CB 3.3Å; Y265-L269 WeakPolarHBondContact O-CB 3.49Å; Y265-L269 PolarHBondContact O-N 3.34Å; Y265-Y293 HydrophobicContact CE2-CD2 4.4Å; Y265-Y293 AromaticContact CE2-CE2 3.74Å; Y265-Y293 HydrophobicContact CE2-CE2 3.74Å; Y265-L297 HydrophobicContact CD2-CB 4.12Å; Y265-L297 HydrophobicContact CD2-CD1 4.31Å; Y265-L297 HydrophobicContact CE2-CB 4.03Å; Y265-L297 HydrophobicContact CE2-CD1 3.66Å; Y265-L297 HydrophobicContact CE2-CG 4.46Å; Y265-A300 HydrophobicContact CD1-CB 4.3Å; Y265-A300 HydrophobicContact CD2-CB 4.47Å; Y265-A300 HydrophobicContact CG-CB 3.93Å
266N91.9Very high90.3Very high0 Ų029.8 Ų29.80%017%0.166CC..Hα-helixtrans-64.2-38.4-177.5-69.5-82.3000111.3M126 E209 F213 F262 V268 L269 F270M126-N266 VanDerWaalsContact CE-ND2 3.26Å; M126-N266 WeakPolarHBondContact CE-ND2 3.3Å; E209-N266 PolarHBondContact OE1-OD1 3.05Å; E209-N266 VanDerWaalsContact OE2-CA 3.22Å; E209-N266 WeakPolarHBondContact OE2-CA 3.26Å; E209-N266 WeakPolarHBondContact OE2-CB 3.14Å; E209-N266 PolarHBondContact OE2-OD1 2.69Å; E209-N266 VanDerWaalsContact OE2-OD1 3.08Å; F213-N266 HydrophobicContact CB-CB 4.03Å; F213-N266 HydrophobicContact CD1-CB 3.61Å; F213-N266 HydrophobicContact CD2-CB 3.64Å; F213-N266 HydrophobicContact CE1-CB 3.9Å; F213-N266 HydrophobicContact CE2-CB 3.93Å; F213-N266 HydrophobicContact CG-CB 3.47Å; F213-N266 VanDerWaalsContact CG-CB 3.47Å; F213-N266 HydrophobicContact CZ-CB 4.05Å; F262-N266 PolarHBondContact O-N 3.45Å; F262-N266 PolarHBondContact O-ND2 3.32Å; N266-V268 PolarHBondContact O-N 2.91Å; N266-L269 PolarHBondContact O-N 2.91Å; N266-F270 WeakPolarHBondContact O-CB 3.28Å; N266-F270 PolarHBondContact O-N 3.35Å
267S92.3Very high89.8Confident56 Ų5628.1 Ų28.139%0.39215%0.151SC..Hα-helixtrans-63.1-44176.2-57.50000112.2V263 Y265 L271V263-S267 WeakPolarHBondContact O-CB 3.44Å; V263-S267 PolarHBondContact O-N 3.31Å; V263-S267 PolarHBondContact O-OG 3.49Å; Y265-S267 VanDerWaalsContact C-N 3.32Å; Y265-S267 PolarHBondContact O-N 3.08Å; S267-L271 PolarHBondContact O-N 3.41Å; S267-L271 VanDerWaalsContact O-N 3.11Å
268V92.7Very high89.3Confident12 Ų1232.6 Ų32.67%0.07317%0.172CC..Hα-helixtrans-71.8-36.5177.5172.60000111.5P264 Y265 N266 L271 Y272 M292 T296P264-V268 WeakPolarHBondContact O-CB 3.42Å; P264-V268 VanDerWaalsContact O-CG2 3.26Å; P264-V268 WeakPolarHBondContact O-CG2 3.31Å; P264-V268 PolarHBondContact O-N 2.75Å; Y265-V268 PolarHBondContact O-N 3.04Å; N266-V268 PolarHBondContact O-N 2.91Å; V268-L271 PolarHBondContact O-N 3.33Å; V268-Y272 WeakPolarHBondContact O-CB 3.22Å; V268-Y272 PolarHBondContact O-N 3.42Å; V268-M292 HydrophobicContact CG1-CB 4.01Å; V268-M292 HydrophobicContact CG2-CB 4.04Å; V268-T296 HydrophobicContact CB-CG2 4.5Å; V268-T296 HydrophobicContact CG2-CG2 3.95Å
269L89.9Confident88.8Confident12 Ų1235.9 Ų35.96%0.06320%0.199CC..Hα-helixtrans-64.8-43.1176.1176.954.2000111.5T205 E209 Y265 N266 Y272 A273 Y293T205-L269 HydrophobicContact CG2-CD1 4.17Å; T205-L269 HydrophobicContact CG2-CG 4.17Å; E209-L269 HydrophobicContact CG-CD2 4.5Å; E209-L269 HydrophobicContact CG-CG 4.41Å; E209-L269 WeakPolarHBondContact OE1-CD2 3.49Å; Y265-L269 HydrophobicContact CE1-CD2 3.91Å; Y265-L269 VanDerWaalsContact O-CB 3.3Å; Y265-L269 WeakPolarHBondContact O-CB 3.49Å; Y265-L269 PolarHBondContact O-N 3.34Å; N266-L269 PolarHBondContact O-N 2.91Å; L269-Y272 PolarHBondContact O-N 3.1Å; L269-A273 WeakPolarHBondContact O-CB 3.26Å; L269-A273 PolarHBondContact O-N 2.61Å; L269-Y293 HydrophobicContact CD1-CE2 3.97Å
270F89.6Confident88.3Confident79 Ų7935.9 Ų35.935%0.34620%0.196SC..Hα-helixtrans-59.3-48.6173-178.8-99.7000111.6I206 E209 V210 N266 Y272 A273 L274I206-F270 HydrophobicContact CG1-CD2 4.47Å; I206-F270 HydrophobicContact CG1-CE2 4.31Å; I206-F270 HydrophobicContact CG2-CE2 4.09Å; E209-F270 HydrophobicContact CB-CD2 4.26Å; V210-F270 HydrophobicContact CG2-CE2 4.3Å; N266-F270 WeakPolarHBondContact O-CB 3.28Å; N266-F270 PolarHBondContact O-N 3.35Å; F270-Y272 VanDerWaalsContact C-N 3.34Å; F270-Y272 PolarHBondContact O-N 3.38Å; F270-A273 PolarHBondContact O-N 3.05Å; F270-L274 HydrophobicContact CD1-CD1 3.94Å; F270-L274 HydrophobicContact CE1-CD1 3.44Å; F270-L274 VanDerWaalsContact CE1-CD1 3.44Å; F270-L274 HydrophobicContact CE1-CG 4.24Å; F270-L274 HydrophobicContact CZ-CD1 3.92Å; F270-L274 HydrophobicContact CZ-CG 4.41Å; F270-L274 WeakPolarHBondContact O-CG 3.25Å; F270-L274 PolarHBondContact O-N 3.44Å; F270-L274 VanDerWaalsContact O-N 3.08Å
271L90.1Very high87.8Confident33 Ų3338.1 Ų38.117%0.17321%0.21CC..Hα-helixtrans-59.9-44.2175.4178.962.4000111.8S267 V268 A273 L274 V275 L285 F288 A289S267-L271 PolarHBondContact O-N 3.41Å; S267-L271 VanDerWaalsContact O-N 3.11Å; V268-L271 PolarHBondContact O-N 3.33Å; L271-A273 VanDerWaalsContact C-N 3.32Å; L271-A273 PolarHBondContact O-N 2.92Å; L271-L274 PolarHBondContact O-N 2.98Å; L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CG2 3.33Å; L271-V275 PolarHBondContact O-N 2.69Å; L271-L285 HydrophobicContact CD1-CD2 3.97Å; L271-L285 HydrophobicContact CD1-CG 4.38Å; L271-F288 HydrophobicContact CD2-CD1 3.83Å; L271-F288 HydrophobicContact CD2-CE1 4.14Å; L271-A289 HydrophobicContact CD2-CB 4.3Å; L271-A289 HydrophobicContact CG-CB 4.25Å
272Y86.8Confident87.5Confident42 Ų4241.5 Ų41.517%0.16523%0.228CC..Hα-helixtrans-61.4-40.2178.3-177.8-101.2000111.5W197 V268 L269 F270 R276 A289 K290W197-Y272 HydrophobicContact CH2-CE1 4.35Å; W197-Y272 HydrophobicContact CZ2-CD1 4.18Å; W197-Y272 HydrophobicContact CZ2-CE1 4.03Å; V268-Y272 WeakPolarHBondContact O-CB 3.22Å; V268-Y272 PolarHBondContact O-N 3.42Å; L269-Y272 PolarHBondContact O-N 3.1Å; F270-Y272 VanDerWaalsContact C-N 3.34Å; F270-Y272 PolarHBondContact O-N 3.38Å; Y272-R276 WeakPolarHBondContact O-CB 3.41Å; Y272-R276 PolarHBondContact O-N 2.69Å; Y272-R276 PolarHBondContact OH-NH1 3.21Å; Y272-A289 HydrophobicContact CD2-CB 4.16Å; Y272-K290 HydrophobicContact CE2-CG 4.24Å
273A85.4Confident87.2Confident0 Ų043.7 Ų43.70%024%0.243CC..Hα-helixtrans-63-43.3174.600000112.1S202 T205 I206 L269 F270 L271 S277S202-A273 PolarHBondContact OG-O 2.98Å; T205-A273 HydrophobicContact CG2-CB 4.16Å; I206-A273 HydrophobicContact CG1-CB 4.21Å; L269-A273 WeakPolarHBondContact O-CB 3.26Å; L269-A273 PolarHBondContact O-N 2.61Å; F270-A273 PolarHBondContact O-N 3.05Å; L271-A273 VanDerWaalsContact C-N 3.32Å; L271-A273 PolarHBondContact O-N 2.92Å; A273-S277 VanDerWaalsContact O-CB 3.3Å; A273-S277 WeakPolarHBondContact O-CB 3.32Å; A273-S277 PolarHBondContact O-N 3.09Å; A273-S277 PolarHBondContact O-OG 3.31Å
274L85.9Confident87Confident36 Ų3649.2 Ų49.219%0.18826%0.264CS..Hα-helixtrans-64.6-43.7177.8-69.8177.9000113I206 F270 L271 S277 Q278 A279 I280I206-L274 HydrophobicContact CD1-CD2 3.95Å; F270-L274 HydrophobicContact CD1-CD1 3.94Å; F270-L274 HydrophobicContact CE1-CD1 3.44Å; F270-L274 VanDerWaalsContact CE1-CD1 3.44Å; F270-L274 HydrophobicContact CE1-CG 4.24Å; F270-L274 HydrophobicContact CZ-CD1 3.92Å; F270-L274 HydrophobicContact CZ-CG 4.41Å; F270-L274 WeakPolarHBondContact O-CG 3.25Å; F270-L274 PolarHBondContact O-N 3.44Å; F270-L274 VanDerWaalsContact O-N 3.08Å; L271-L274 PolarHBondContact O-N 2.98Å; L274-S277 PolarHBondContact O-OG 2.68Å; L274-Q278 PolarHBondContact O-N 3.07Å; L274-A279 HydrophobicContact CD2-CB 4.24Å; L274-A279 WeakPolarHBondContact O-CB 3.01Å; L274-A279 PolarHBondContact O-N 3.5Å; L274-I280 HydrophobicContact CB-CD1 4.09Å; L274-I280 HydrophobicContact CB-CG1 4.37Å; L274-I280 HydrophobicContact CD1-CD1 3.9Å; L274-I280 PolarHBondContact O-N 3.38Å
275V85.9Confident86.8Confident4 Ų449.6 Ų49.62%0.02426%0.264CS..Hα-helixtrans-71.9-42179.8178.90000111L271 S277 Q278 L285 E286L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CG2 3.33Å; L271-V275 PolarHBondContact O-N 2.69Å; V275-S277 VanDerWaalsContact C-N 3.31Å; V275-S277 PolarHBondContact O-N 2.84Å; V275-Q278 PolarHBondContact O-N 2.79Å; V275-Q278 PolarHBondContact O-NE2 3.01Å; V275-L285 HydrophobicContact CG2-CB 4.18Å; V275-E286 HydrophobicContact CG1-CB 3.5Å; V275-E286 HydrophobicContact CG1-CG 3.64Å
276R80.6Confident86.5Confident80 Ų8051.4 Ų51.430%0.30227%0.272SS..Hα-helixtrans-69.7-27-179.8-168.9171.1174.4104.44.7113.2F192 W197 Y272 Q278F192-R276 PolarHBondContact O-NH2 3.5Å; W197-R276 VanDerWaalsContact CD1-CG 3.43Å; W197-R276 HydrophobicContact CD2-CG 4.4Å; W197-R276 HydrophobicContact CG-CG 3.98Å; Y272-R276 WeakPolarHBondContact O-CB 3.41Å; Y272-R276 PolarHBondContact O-N 2.69Å; Y272-R276 PolarHBondContact OH-NH1 3.21Å; R276-Q278 PolarHBondContact O-N 3.39Å
277S80Confident86.4Confident13 Ų1356.9 Ų56.99%0.09129%0.293CS..THydrogen-bonded Turntrans-78.3-4.7171.656.80000114.1K198 S202 A273 L274 V275 A279K198-S277 WeakPolarHBondContact CE-O 3.06Å; S202-S277 VanDerWaalsContact OG-CB 3.3Å; S202-S277 WeakPolarHBondContact OG-CB 3.4Å; S202-S277 PolarHBondContact OG-OG 2.96Å; A273-S277 VanDerWaalsContact O-CB 3.3Å; A273-S277 WeakPolarHBondContact O-CB 3.32Å; A273-S277 PolarHBondContact O-N 3.09Å; A273-S277 PolarHBondContact O-OG 3.31Å; L274-S277 PolarHBondContact O-OG 2.68Å; V275-S277 VanDerWaalsContact C-N 3.31Å; V275-S277 PolarHBondContact O-N 2.84Å; S277-A279 PolarHBondContact O-N 3.37Å
278Q80.3Confident86.4Confident106 Ų10658.7 Ų58.750%0.49529%0.294SS..THydrogen-bonded Turntrans61.624.1-172.5-55.1-75-71.300112.7L274 V275 R276 I280 T281L274-Q278 PolarHBondContact O-N 3.07Å; V275-Q278 PolarHBondContact O-N 2.79Å; V275-Q278 PolarHBondContact O-NE2 3.01Å; R276-Q278 PolarHBondContact O-N 3.39Å; Q278-I280 VanDerWaalsContact C-N 3.31Å; Q278-T281 HydrophobicContact CB-CG2 4.48Å
279A79.5Confident86.3Confident69 Ų6958.2 Ų58.257%0.5729%0.291SS*.SBendtrans-71.9-30.9169.400000111L274 S277L274-A279 HydrophobicContact CD2-CB 4.24Å; L274-A279 WeakPolarHBondContact O-CB 3.01Å; L274-A279 PolarHBondContact O-N 3.5Å; S277-A279 PolarHBondContact O-N 3.37Å
280I81.6Confident86.3Confident61 Ų6160.4 Ų60.431%0.31330%0.3SS..SBendtrans-124.1119.1170.8-60.2176.1000108.5L274 Q278 N282 L285L274-I280 HydrophobicContact CB-CD1 4.09Å; L274-I280 HydrophobicContact CB-CG1 4.37Å; L274-I280 HydrophobicContact CD1-CD1 3.9Å; L274-I280 PolarHBondContact O-N 3.38Å; Q278-I280 VanDerWaalsContact C-N 3.31Å; I280-N282 HydrophobicContact CG2-CB 4.19Å; I280-L285 HydrophobicContact CG2-CD2 3.94Å
281T82.4Confident86.3Confident116 Ų11659.9 Ų59.971%0.71230%0.3SS*.  trans-103.880.6177.645.50000110.1Q278Q278-T281 HydrophobicContact CB-CG2 4.48Å
282N86.8Confident86.6Confident72 Ų7261 Ų6139%0.38531%0.305SS..  trans-137.2118.1176.3-176.5-49.4000110.5I280 F284 L285 E286I280-N282 HydrophobicContact CG2-CB 4.19Å; N282-F284 VanDerWaalsContact C-N 3.32Å; N282-F284 PolarHBondContact O-N 2.67Å; N282-F284 WeakPolarHBondContact OD1-CB 3.44Å; N282-F284 PolarHBondContact OD1-N 2.67Å; N282-L285 HydrophobicContact CB-CB 4.16Å; N282-L285 HydrophobicContact CB-CD1 4.32Å; N282-L285 PolarHBondContact O-N 2.99Å; N282-L285 PolarHBondContact OD1-N 3.26Å; N282-E286 PolarHBondContact O-N 2.98Å
283C87.9Confident86.8Confident45 Ų4562 Ų6230%0.30431%0.309SS..Hα-helixtrans-63.6-36.2-174.7-157.70000113C31 E286 R287C31-C283 WeakPolarHBondContact CA-SG 3.42Å; C31-C283 HydrophobicContact CB-CB 4.3Å; C31-C283 WeakPolarHBondContact CB-SG 3.13Å; C31-C283 WeakPolarHBondContact SG-CA 3.39Å; C31-C283 WeakPolarHBondContact SG-CB 3.08Å; C31-C283 CovalentContact SG-SG 2.04Å; C31-C283 PolarHBondContact SG-SG 2.97Å; C283-E286 PolarHBondContact O-N 2.91Å; C283-R287 WeakPolarHBondContact O-CB 3.48Å; C283-R287 VanDerWaalsContact O-CG 3.26Å; C283-R287 WeakPolarHBondContact O-CG 3.27Å; C283-R287 PolarHBondContact O-N 3.36Å
284F89.3Confident87.1Confident153 Ų15362.3 Ų62.367%0.67131%0.311SS*.Hα-helixtrans-65.4-46.9177.4174.5-101.3000110.8N282 E286 R287 F288N282-F284 VanDerWaalsContact C-N 3.32Å; N282-F284 PolarHBondContact O-N 2.67Å; N282-F284 WeakPolarHBondContact OD1-CB 3.44Å; N282-F284 PolarHBondContact OD1-N 2.67Å; F284-E286 VanDerWaalsContact C-N 3.33Å; F284-E286 PolarHBondContact O-N 3.15Å; F284-R287 PolarHBondContact O-N 2.79Å; F284-F288 WeakPolarHBondContact O-CB 3.38Å; F284-F288 PolarHBondContact O-N 3.24Å
285L89.4Confident87.5Confident48 Ų4863.9 Ų63.925%0.25132%0.319SS..Hα-helixtrans-62.5-39.1174.8-89.765.1000111.9L271 V275 I280 N282 F288 A289L271-L285 HydrophobicContact CD1-CD2 3.97Å; L271-L285 HydrophobicContact CD1-CG 4.38Å; V275-L285 HydrophobicContact CG2-CB 4.18Å; I280-L285 HydrophobicContact CG2-CD2 3.94Å; N282-L285 HydrophobicContact CB-CB 4.16Å; N282-L285 HydrophobicContact CB-CD1 4.32Å; N282-L285 PolarHBondContact O-N 2.99Å; N282-L285 PolarHBondContact OD1-N 3.26Å; L285-F288 PolarHBondContact O-N 3.11Å; L285-A289 WeakPolarHBondContact O-CB 3.08Å; L285-A289 PolarHBondContact O-N 3.02Å
286E88.8Confident88Confident43 Ų4364 Ų6420%0.20132%0.32CS..Hα-helixtrans-62.3-47176.9-170.1173.616400112.1C31 V275 N282 C283 F284 A289 K290C31-E286 HydrophobicContact CB-CG 4.45Å; V275-E286 HydrophobicContact CG1-CB 3.5Å; V275-E286 HydrophobicContact CG1-CG 3.64Å; N282-E286 PolarHBondContact O-N 2.98Å; C283-E286 PolarHBondContact O-N 2.91Å; F284-E286 VanDerWaalsContact C-N 3.33Å; F284-E286 PolarHBondContact O-N 3.15Å; E286-A289 PolarHBondContact O-N 3Å; E286-K290 HydrophobicContact CG-CD 4.31Å; E286-K290 WeakPolarHBondContact O-CB 3.35Å; E286-K290 WeakPolarHBondContact O-CG 3.1Å; E286-K290 PolarHBondContact O-N 2.74Å; E286-K290 WeakPolarHBondContact OE1-CE 3.22Å; E286-K290 IonicContact OE1-NZ 2.67Å; E286-K290 PolarHBondContact OE1-NZ 2.78Å
287R89.5Confident88.7Confident114 Ų11460.9 Ų60.943%0.4331%0.309SS..Hα-helixtrans-62.5-47.1177.2-69.8-176.9173.6178.21.6110.9V33 C283 F284 A289 K290 I291V33-R287 HydrophobicContact CG2-CB 3.93Å; V33-R287 HydrophobicContact CG2-CG 3.54Å; C283-R287 WeakPolarHBondContact O-CB 3.48Å; C283-R287 VanDerWaalsContact O-CG 3.26Å; C283-R287 WeakPolarHBondContact O-CG 3.27Å; C283-R287 PolarHBondContact O-N 3.36Å; F284-R287 PolarHBondContact O-N 2.79Å; R287-A289 PolarHBondContact O-N 2.88Å; R287-K290 PolarHBondContact O-N 3.06Å; R287-I291 VanDerWaalsContact O-CG1 3.31Å; R287-I291 WeakPolarHBondContact O-CG1 3.3Å; R287-I291 PolarHBondContact O-N 3.47Å
288F92.1Very high89.4Confident95 Ų9560.5 Ų60.542%0.41731%0.306SS..Hα-helixtrans-56.9-49.9177.1177.8-95.8000111.7L271 F284 L285 K290 I291 M292L271-F288 HydrophobicContact CD2-CD1 3.83Å; L271-F288 HydrophobicContact CD2-CE1 4.14Å; F284-F288 WeakPolarHBondContact O-CB 3.38Å; F284-F288 PolarHBondContact O-N 3.24Å; L285-F288 PolarHBondContact O-N 3.11Å; F288-K290 PolarHBondContact O-N 3.35Å; F288-I291 PolarHBondContact O-N 3.38Å; F288-M292 HydrophobicContact CD1-CG 4.31Å; F288-M292 HydrophobicContact CD2-CG 3.88Å; F288-M292 HydrophobicContact CE1-CB 4.5Å; F288-M292 HydrophobicContact CE1-CG 4.04Å; F288-M292 HydrophobicContact CE2-CG 3.58Å; F288-M292 HydrophobicContact CE2-SD 4.34Å; F288-M292 HydrophobicContact CG-CG 4.25Å; F288-M292 HydrophobicContact CZ-CG 3.67Å; F288-M292 VanDerWaalsContact O-CB 3.31Å; F288-M292 WeakPolarHBondContact O-CB 3.31Å; F288-M292 VanDerWaalsContact O-CG 3.3Å; F288-M292 WeakPolarHBondContact O-CG 3.09Å; F288-M292 PolarHBondContact O-N 2.87Å
289A91.4Very high90.1Very high1 Ų157.9 Ų57.91%0.00830%0.295CS..Hα-helixtrans-62.6-42-179.700000112.3L271 Y272 L285 E286 R287 Y293L271-A289 HydrophobicContact CD2-CB 4.3Å; L271-A289 HydrophobicContact CG-CB 4.25Å; Y272-A289 HydrophobicContact CD2-CB 4.16Å; L285-A289 WeakPolarHBondContact O-CB 3.08Å; L285-A289 PolarHBondContact O-N 3.02Å; E286-A289 PolarHBondContact O-N 3Å; R287-A289 PolarHBondContact O-N 2.88Å; A289-Y293 WeakPolarHBondContact O-CB 3.31Å; A289-Y293 PolarHBondContact O-N 3.39Å
290K88.4Confident90.9Very high58 Ų5854.6 Ų54.625%0.25227%0.268SS..Hα-helixtrans-63.8-39.5177.6-74.9176.9-174.9171.10113C31 V33 Y272 E286 R287 F288 P294C31-K290 PolarHBondContact O-NZ 2.79Å; V33-K290 HydrophobicContact CB-CD 4.35Å; V33-K290 HydrophobicContact CG2-CD 4.28Å; Y272-K290 HydrophobicContact CE2-CG 4.24Å; E286-K290 HydrophobicContact CG-CD 4.31Å; E286-K290 WeakPolarHBondContact O-CB 3.35Å; E286-K290 WeakPolarHBondContact O-CG 3.1Å; E286-K290 PolarHBondContact O-N 2.74Å; E286-K290 WeakPolarHBondContact OE1-CE 3.22Å; E286-K290 IonicContact OE1-NZ 2.67Å; E286-K290 PolarHBondContact OE1-NZ 2.78Å; R287-K290 PolarHBondContact O-N 3.06Å; F288-K290 PolarHBondContact O-N 3.35Å; K290-P294 WeakPolarHBondContact O-CD 3.15Å
291I91.3Very high91.5Very high69 Ų6951.7 Ų51.735%0.35425%0.253SS..Hα-helixtrans-74.6-45.3179.7-66.5167.9000110.7V33 F37 R287 F288 P294 I295V33-I291 HydrophobicContact CG1-CD1 4.27Å; V33-I291 HydrophobicContact CG1-CG1 3.86Å; F37-I291 HydrophobicContact CZ-CG2 4.33Å; R287-I291 VanDerWaalsContact O-CG1 3.31Å; R287-I291 WeakPolarHBondContact O-CG1 3.3Å; R287-I291 PolarHBondContact O-N 3.47Å; F288-I291 PolarHBondContact O-N 3.38Å; I291-P294 WeakPolarHBondContact O-CD 3.41Å; I291-P294 WeakPolarHBondContact O-CG 3.34Å; I291-I295 HydrophobicContact CG2-CD1 4.28Å; I291-I295 WeakPolarHBondContact O-CD1 3.39Å
292M94.4Very high92.1Very high56 Ų5648.3 Ų48.328%0.27623%0.23SC..Hα-helixtrans-76.3-29.7-173.8-67.5-57.9-65.200113V268 F288 I295 T296V268-M292 HydrophobicContact CG1-CB 4.01Å; V268-M292 HydrophobicContact CG2-CB 4.04Å; F288-M292 HydrophobicContact CD1-CG 4.31Å; F288-M292 HydrophobicContact CD2-CG 3.88Å; F288-M292 HydrophobicContact CE1-CB 4.5Å; F288-M292 HydrophobicContact CE1-CG 4.04Å; F288-M292 HydrophobicContact CE2-CG 3.58Å; F288-M292 HydrophobicContact CE2-SD 4.34Å; F288-M292 HydrophobicContact CG-CG 4.25Å; F288-M292 HydrophobicContact CZ-CG 3.67Å; F288-M292 VanDerWaalsContact O-CB 3.31Å; F288-M292 WeakPolarHBondContact O-CB 3.31Å; F288-M292 VanDerWaalsContact O-CG 3.3Å; F288-M292 WeakPolarHBondContact O-CG 3.09Å; F288-M292 PolarHBondContact O-N 2.87Å; M292-I295 WeakPolarHBondContact O-CB 3.26Å; M292-I295 PolarHBondContact O-N 2.91Å; M292-I295 VanDerWaalsContact O-N 3.12Å; M292-I295 HydrophobicContact SD-CD1 4.2Å; M292-T296 HydrophobicContact CE-CG2 4.32Å; M292-T296 PolarHBondContact O-N 3.42Å; M292-T296 PolarHBondContact O-OG1 3.31Å; M292-T296 VanDerWaalsContact O-OG1 3.11Å
293Y91.9Very high92.4Very high64 Ų6444.9 Ų44.925%0.25121%0.212SC..Hα-helixtrans-53.4-52.9-177.8176.2-102.7000114.1Y265 L269 A289 I295 T296 L297Y265-Y293 HydrophobicContact CE2-CD2 4.4Å; Y265-Y293 AromaticContact CE2-CE2 3.74Å; Y265-Y293 HydrophobicContact CE2-CE2 3.74Å; L269-Y293 HydrophobicContact CD1-CE2 3.97Å; A289-Y293 WeakPolarHBondContact O-CB 3.31Å; A289-Y293 PolarHBondContact O-N 3.39Å; Y293-I295 VanDerWaalsContact C-N 3.29Å; Y293-I295 PolarHBondContact O-N 3.37Å; Y293-T296 PolarHBondContact O-OG1 2.81Å; Y293-L297 HydrophobicContact CE1-CD2 4.39Å; Y293-L297 WeakPolarHBondContact O-CB 3.21Å; Y293-L297 PolarHBondContact O-N 3.4Å
294P91.9Very high92.6Very high5 Ų542.7 Ų42.73%0.03220%0.198CC..Hα-helixtrans-65.7-31.2177.626.1-35.5000113.1F37 K38 K290 I291 C298F37-P294 HydrophobicContact CE2-CG 3.93Å; F37-P294 HydrophobicContact CZ-CG 3.65Å; K38-P294 HydrophobicContact CB-CB 3.66Å; K38-P294 HydrophobicContact CB-CG 3.94Å; K290-P294 WeakPolarHBondContact O-CD 3.15Å; I291-P294 WeakPolarHBondContact O-CD 3.41Å; I291-P294 WeakPolarHBondContact O-CG 3.34Å; P294-C298 PolarHBondContact O-N 3.05Å; P294-C298 PolarHBondContact O-SG 2.93Å
295I95.2Very high92.7Very high70 Ų7036.1 Ų36.136%0.35917%0.171SC..Hα-helixtrans-68.6-50.1178.4-60.5171.6000110.4F37 L41 I291 M292 Y293 L297 C298 L299F37-I295 HydrophobicContact CE2-CG1 4.29Å; L41-I295 HydrophobicContact CD2-CG1 3.86Å; I291-I295 HydrophobicContact CG2-CD1 4.28Å; I291-I295 WeakPolarHBondContact O-CD1 3.39Å; M292-I295 WeakPolarHBondContact O-CB 3.26Å; M292-I295 PolarHBondContact O-N 2.91Å; M292-I295 VanDerWaalsContact O-N 3.12Å; M292-I295 HydrophobicContact SD-CD1 4.2Å; Y293-I295 VanDerWaalsContact C-N 3.29Å; Y293-I295 PolarHBondContact O-N 3.37Å; I295-L297 VanDerWaalsContact C-N 3.31Å; I295-L297 PolarHBondContact O-N 2.76Å; I295-C298 WeakPolarHBondContact O-CB 3.43Å; I295-C298 PolarHBondContact O-N 3.28Å; I295-L299 PolarHBondContact O-N 3.24Å
296T96.1Very high92.6Very high6 Ų637.1 Ų37.14%0.03717%0.173CC..Hα-helixtrans-71.5-28.7179.559.40000112P264 V268 M292 Y293 L299 A300P264-T296 HydrophobicContact CB-CG2 3.66Å; V268-T296 HydrophobicContact CB-CG2 4.5Å; V268-T296 HydrophobicContact CG2-CG2 3.95Å; M292-T296 HydrophobicContact CE-CG2 4.32Å; M292-T296 PolarHBondContact O-N 3.42Å; M292-T296 PolarHBondContact O-OG1 3.31Å; M292-T296 VanDerWaalsContact O-OG1 3.11Å; Y293-T296 PolarHBondContact O-OG1 2.81Å; T296-L299 WeakPolarHBondContact O-CB 3.3Å; T296-L299 PolarHBondContact O-N 2.88Å; T296-A300 PolarHBondContact O-N 3.23Å
297L94.1Very high92.3Very high14 Ų1435 Ų357%0.07316%0.163CC..Hα-helixtrans-59.7-50.3168.6175.165.2000111.4Y46 F118 Y265 Y293 I295 L299 A300 T301Y46-L297 WeakPolarHBondContact OH-CD2 3.47Å; F118-L297 HydrophobicContact CE1-CD1 4.2Å; F118-L297 HydrophobicContact CE2-CD1 3.38Å; F118-L297 HydrophobicContact CZ-CD1 3.13Å; Y265-L297 HydrophobicContact CD2-CB 4.12Å; Y265-L297 HydrophobicContact CD2-CD1 4.31Å; Y265-L297 HydrophobicContact CE2-CB 4.03Å; Y265-L297 HydrophobicContact CE2-CD1 3.66Å; Y265-L297 HydrophobicContact CE2-CG 4.46Å; Y293-L297 HydrophobicContact CE1-CD2 4.39Å; Y293-L297 WeakPolarHBondContact O-CB 3.21Å; Y293-L297 PolarHBondContact O-N 3.4Å; I295-L297 VanDerWaalsContact C-N 3.31Å; I295-L297 PolarHBondContact O-N 2.76Å; L297-L299 VanDerWaalsContact C-N 3.28Å; L297-L299 PolarHBondContact O-N 3.37Å; L297-A300 WeakPolarHBondContact O-CB 3.22Å; L297-A300 PolarHBondContact O-N 3.46Å; L297-A300 VanDerWaalsContact O-N 3.16Å; L297-T301 WeakPolarHBondContact O-CG2 3.35Å; L297-T301 PolarHBondContact O-N 3.49Å
298C95.4Very high91.7Very high6 Ų630.8 Ų30.84%0.04115%0.15CC..Hα-helixtrans-56-44.7174-77.90000111.4N42 V45 P294 I295 A300 T301 L302N42-C298 PolarHBondContact OD1-SG 3.42Å; V45-C298 HydrophobicContact CB-CB 4.16Å; V45-C298 HydrophobicContact CG1-CB 3.88Å; V45-C298 HydrophobicContact CG2-CB 4.06Å; P294-C298 PolarHBondContact O-N 3.05Å; P294-C298 PolarHBondContact O-SG 2.93Å; I295-C298 WeakPolarHBondContact O-CB 3.43Å; I295-C298 PolarHBondContact O-N 3.28Å; C298-A300 VanDerWaalsContact C-N 3.33Å; C298-A300 PolarHBondContact O-N 2.89Å; C298-T301 PolarHBondContact O-N 3.34Å; C298-T301 PolarHBondContact O-OG1 3.38Å; C298-L302 PolarHBondContact O-N 2.93Å
299L95.7Very high91Very high50 Ų5031.8 Ų31.826%0.26216%0.155SC..Hα-helixtrans-61.4-39.6177.2-172.758.9000112.7V260 P264 I295 T296 L297 L302V260-L299 HydrophobicContact CG1-CD1 3.95Å; V260-L299 HydrophobicContact CG1-CD2 4.45Å; V260-L299 HydrophobicContact CG1-CG 4.43Å; V260-L299 WeakPolarHBondContact O-CD2 3.33Å; V260-L299 WeakPolarHBondContact O-CG 3.19Å; P264-L299 HydrophobicContact CB-CD2 4.25Å; P264-L299 HydrophobicContact CG-CD2 4Å; I295-L299 PolarHBondContact O-N 3.24Å; T296-L299 WeakPolarHBondContact O-CB 3.3Å; T296-L299 PolarHBondContact O-N 2.88Å; L297-L299 VanDerWaalsContact C-N 3.28Å; L297-L299 PolarHBondContact O-N 3.37Å; L299-L302 HydrophobicContact CD1-CD1 4.22Å; L299-L302 WeakPolarHBondContact O-CB 3.23Å; L299-L302 PolarHBondContact O-N 3.46Å
300A95.2Very high90.3Very high0 Ų031.7 Ų31.70%015%0.154CC..Hα-helixtrans-63.8-40.6174.500000112.1I122 C261 Y265 T296 L297 C298 L302 N303I122-A300 HydrophobicContact CD1-CB 3.78Å; C261-A300 WeakPolarHBondContact O-CA 3.21Å; C261-A300 WeakPolarHBondContact O-CB 3.14Å; Y265-A300 HydrophobicContact CD1-CB 4.3Å; Y265-A300 HydrophobicContact CD2-CB 4.47Å; Y265-A300 HydrophobicContact CG-CB 3.93Å; T296-A300 PolarHBondContact O-N 3.23Å; L297-A300 WeakPolarHBondContact O-CB 3.22Å; L297-A300 PolarHBondContact O-N 3.46Å; L297-A300 VanDerWaalsContact O-N 3.16Å; C298-A300 VanDerWaalsContact C-N 3.33Å; C298-A300 PolarHBondContact O-N 2.89Å; A300-L302 PolarHBondContact O-N 3.04Å; A300-N303 VanDerWaalsContact O-CB 3.29Å; A300-N303 WeakPolarHBondContact O-CB 3.44Å; A300-N303 PolarHBondContact O-N 3.47Å; A300-N303 VanDerWaalsContact O-N 3.1Å; A300-N303 PolarHBondContact O-ND2 3.03Å
301T94.7Very high89.9Confident0 Ų029 Ų290%014%0.142CC..Hα-helixtrans-68.2-20178.661.20000114.1Y46 V49 F88 F118 L297 C298 N303Y46-T301 HydrophobicContact CD1-CG2 4.45Å; Y46-T301 HydrophobicContact CE1-CG2 3.75Å; V49-T301 WeakPolarHBondContact CG1-O 3.33Å; F88-T301 HydrophobicContact CE1-CG2 3.99Å; F88-T301 HydrophobicContact CZ-CG2 3.63Å; F118-T301 HydrophobicContact CE2-CG2 4.14Å; L297-T301 WeakPolarHBondContact O-CG2 3.35Å; L297-T301 PolarHBondContact O-N 3.49Å; C298-T301 PolarHBondContact O-N 3.34Å; C298-T301 PolarHBondContact O-OG1 3.38Å; T301-N303 PolarHBondContact O-N 3.33Å
302L94.3Very high89.2Confident45 Ų4529.5 Ų29.524%0.23614%0.14CC..THydrogen-bonded Turntrans-67.8-10.8172.5-70.7168.6000112.9V45 V49 C298 L299 A300 C304 C305 F306V45-L302 HydrophobicContact CG1-CD2 4.47Å; V45-L302 HydrophobicContact CG1-CG 4.49Å; V49-L302 HydrophobicContact CG2-CD2 3.82Å; V49-L302 HydrophobicContact CG2-CG 4.41Å; C298-L302 PolarHBondContact O-N 2.93Å; L299-L302 HydrophobicContact CD1-CD1 4.22Å; L299-L302 WeakPolarHBondContact O-CB 3.23Å; L299-L302 PolarHBondContact O-N 3.46Å; A300-L302 PolarHBondContact O-N 3.04Å; L302-C304 PolarHBondContact O-N 3.34Å; L302-C305 WeakPolarHBondContact O-CB 3.42Å; L302-C305 PolarHBondContact O-N 3.43Å; L302-F306 HydrophobicContact CB-CD2 4.38Å; L302-F306 HydrophobicContact CB-CE2 3.74Å; L302-F306 HydrophobicContact CB-CZ 4.21Å; L302-F306 VanDerWaalsContact O-CD2 3.23Å; L302-F306 WeakPolarHBondContact O-CD2 3.38Å; L302-F306 PolarHBondContact O-N 3.26Å
303N93.4Very high88.3Confident0 Ų028 Ų280%013%0.132CC..Hα-helixtrans-51-45.1174.886.184000111.5D85 N121 S125 C261 F262 A300 T301 C305 F306 D307D85-N303 PolarHBondContact OD1-OD1 3.46Å; N121-N303 PolarHBondContact OD1-ND2 3.44Å; S125-N303 PolarHBondContact OG-OD1 2.88Å; C261-N303 HydrophobicContact CB-CB 3.98Å; F262-N303 HydrophobicContact CE1-CB 4.05Å; F262-N303 HydrophobicContact CE2-CB 4.47Å; F262-N303 HydrophobicContact CZ-CB 3.64Å; A300-N303 VanDerWaalsContact O-CB 3.29Å; A300-N303 WeakPolarHBondContact O-CB 3.44Å; A300-N303 PolarHBondContact O-N 3.47Å; A300-N303 VanDerWaalsContact O-N 3.1Å; A300-N303 PolarHBondContact O-ND2 3.03Å; T301-N303 PolarHBondContact O-N 3.33Å; N303-C305 PolarHBondContact O-N 2.87Å; N303-F306 PolarHBondContact O-N 2.92Å; N303-D307 PolarHBondContact O-N 3.44Å
304C92.6Very high87.3Confident0 Ų025.3 Ų25.30%012%0.123CC..Hα-helixtrans-59-23.2179.4-54.10000113.9V49 N57 D85 V89 L302 D307V49-C304 HydrophobicContact CG1-CB 4.34Å; N57-C304 PolarHBondContact ND2-O 3.33Å; D85-C304 HydrophobicContact CB-CB 4.08Å; D85-C304 PolarHBondContact OD1-SG 2.93Å; V89-C304 HydrophobicContact CG2-CB 4.28Å; L302-C304 PolarHBondContact O-N 3.34Å; C304-D307 VanDerWaalsContact CA-OD2 3.24Å; C304-D307 WeakPolarHBondContact CA-OD2 3.17Å
305C90.3Very high86.3Confident15 Ų1525.3 Ų25.310%0.10112%0.122CC..Hα-helixtrans-88.2-21.5177.6-59.50000112.3L302 N303 P308L302-C305 WeakPolarHBondContact O-CB 3.42Å; L302-C305 PolarHBondContact O-N 3.43Å; N303-C305 PolarHBondContact O-N 2.87Å; C305-P308 WeakPolarHBondContact O-CD 3.5Å
306F87.6Confident85Confident68 Ų6826.1 Ų26.130%0.29813%0.125SC..Hα-helixtrans-93.4-18.5-178.1-60.2-45.9000113.4V257 C261 L302 N303 P308 F309 I310V257-F306 HydrophobicContact CG1-CB 4.26Å; V257-F306 HydrophobicContact CG2-CB 3.75Å; V257-F306 HydrophobicContact CG2-CG 4.46Å; C261-F306 VanDerWaalsContact SG-CD2 3.56Å; L302-F306 HydrophobicContact CB-CD2 4.38Å; L302-F306 HydrophobicContact CB-CE2 3.74Å; L302-F306 HydrophobicContact CB-CZ 4.21Å; L302-F306 VanDerWaalsContact O-CD2 3.23Å; L302-F306 WeakPolarHBondContact O-CD2 3.38Å; L302-F306 PolarHBondContact O-N 3.26Å; N303-F306 PolarHBondContact O-N 2.92Å; F306-P308 VanDerWaalsContact C-N 3.33Å; F306-F309 WeakPolarHBondContact O-CB 3.46Å; F306-F309 PolarHBondContact O-N 2.98Å; F306-I310 PolarHBondContact O-N 3.29Å
307D83Confident83.3Confident0 Ų029.1 Ų29.10%015%0.146CC..Hα-helixtrans-56.6-32.6178.5-61.5-50.6000115.5N303 C304 F309 I310 Y311N303-D307 PolarHBondContact O-N 3.44Å; C304-D307 VanDerWaalsContact CA-OD2 3.24Å; C304-D307 WeakPolarHBondContact CA-OD2 3.17Å; D307-F309 PolarHBondContact O-N 3.22Å; D307-I310 CarbonylContact O-C 3.57Å; D307-I310 WeakPolarHBondContact O-CA 3.42Å; D307-I310 WeakPolarHBondContact O-CB 3.41Å; D307-I310 PolarHBondContact O-N 3Å; D307-I310 WeakPolarHBondContact OD1-CD1 3.28Å; D307-Y311 HydrophobicContact CB-CE1 3.85Å; D307-Y311 HydrophobicContact CB-CE2 4.13Å; D307-Y311 WeakPolarHBondContact CB-OH 3.46Å; D307-Y311 WeakPolarHBondContact O-CD1 3.35Å; D307-Y311 WeakPolarHBondContact O-CD2 3.5Å; D307-Y311 WeakPolarHBondContact O-CE1 3.32Å; D307-Y311 PolarHBondContact O-N 3.45Å
308P76.7Confident81.8Confident25 Ų2528.7 Ų28.716%0.16214%0.143CC..Hα-helixtrans-59.3-31.4172.8-25.836.1000113.6T56 C305 F306 Y311 Y312T56-P308 HydrophobicContact CG2-CG 3.91Å; T56-P308 WeakPolarHBondContact OG1-CG 3.28Å; C305-P308 WeakPolarHBondContact O-CD 3.5Å; F306-P308 VanDerWaalsContact C-N 3.33Å; P308-Y311 PolarHBondContact O-N 3.35Å; P308-Y312 WeakPolarHBondContact O-CB 3.47Å; P308-Y312 PolarHBondContact O-N 3.31Å
309F77Confident80.4Confident115 Ų11530.1 Ų30.150%0.50415%0.15SC..Hα-helixtrans-68.4-42172.6-65-83.5000110.9V253 F306 D307 Y311 Y312 F313V253-F309 HydrophobicContact CG1-CB 4.17Å; F306-F309 WeakPolarHBondContact O-CB 3.46Å; F306-F309 PolarHBondContact O-N 2.98Å; D307-F309 PolarHBondContact O-N 3.22Å; F309-Y311 VanDerWaalsContact C-N 3.28Å; F309-Y311 PolarHBondContact O-N 3.25Å; F309-Y312 PolarHBondContact O-N 2.96Å; F309-F313 HydrophobicContact CB-CD2 4.47Å; F309-F313 HydrophobicContact CB-CE2 4.27Å; F309-F313 HydrophobicContact CD1-CE2 4.35Å; F309-F313 WeakPolarHBondContact O-CD2 3.14Å; F309-F313 PolarHBondContact O-N 3.08Å
310I76.4Confident79Confident0 Ų034.2 Ų34.20%017%0.165CC..Hα-helixtrans-56.2-47173.5-59.2-171.4000109.4L129 V253 H254 V257 F306 D307 F313 T314L129-I310 HydrophobicContact CD2-CD1 3.51Å; L129-I310 HydrophobicContact CD2-CG2 4.38Å; V253-I310 HydrophobicContact CG1-CG1 4.21Å; H254-I310 VanDerWaalsContact CD2-CG2 3.46Å; H254-I310 WeakPolarHBondContact CD2-CG2 3.3Å; H254-I310 WeakPolarHBondContact NE2-CG2 3.36Å; V257-I310 HydrophobicContact CB-CD1 4.15Å; V257-I310 HydrophobicContact CG1-CD1 4.1Å; V257-I310 HydrophobicContact CG2-CD1 4.14Å; V257-I310 HydrophobicContact CG2-CG1 4.32Å; F306-I310 PolarHBondContact O-N 3.29Å; D307-I310 CarbonylContact O-C 3.57Å; D307-I310 WeakPolarHBondContact O-CA 3.42Å; D307-I310 WeakPolarHBondContact O-CB 3.41Å; D307-I310 PolarHBondContact O-N 3Å; D307-I310 WeakPolarHBondContact OD1-CD1 3.28Å; I310-F313 PolarHBondContact O-N 3.47Å; I310-T314 WeakPolarHBondContact O-CB 3.31Å; I310-T314 PolarHBondContact O-N 3.19Å; I310-T314 PolarHBondContact O-OG1 3.26Å
311Y80.1Confident77.4Confident0 Ų034.9 Ų34.90%017%0.17CC..Hα-helixtrans-65.2-46-179.3-54.8-14.7000111.9N57 S60 F64 I78 L81 A82 D307 P308 F309 F313 T314 L315 F318N57-Y311 PolarHBondContact OD1-OH 3.34Å; S60-Y311 VanDerWaalsContact OG-CD2 3.31Å; S60-Y311 WeakPolarHBondContact OG-CD2 3.17Å; F64-Y311 AromaticContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CE2 4.04Å; F64-Y311 HydrophobicContact CE2-CG 4.17Å; F64-Y311 HydrophobicContact CZ-CD1 4.31Å; F64-Y311 AromaticContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CE2 4.31Å; F64-Y311 AromaticContact CZ-CG 3.7Å; F64-Y311 HydrophobicContact CZ-CG 3.7Å; I78-Y311 HydrophobicContact CB-CD1 4.36Å; I78-Y311 HydrophobicContact CB-CE1 4.41Å; I78-Y311 HydrophobicContact CG1-CD1 4.32Å; I78-Y311 HydrophobicContact CG2-CD1 3.33Å; I78-Y311 HydrophobicContact CG2-CE1 3.53Å; I78-Y311 HydrophobicContact CG2-CG 4Å; L81-Y311 HydrophobicContact CD2-CE1 4.19Å; A82-Y311 WeakPolarHBondContact CA-OH 3.12Å; A82-Y311 HydrophobicContact CB-CE2 4.21Å; A82-Y311 VanDerWaalsContact CB-OH 3.27Å; A82-Y311 WeakPolarHBondContact CB-OH 3.42Å; A82-Y311 PolarHBondContact N-OH 2.76Å; D307-Y311 HydrophobicContact CB-CE1 3.85Å; D307-Y311 HydrophobicContact CB-CE2 4.13Å; D307-Y311 WeakPolarHBondContact CB-OH 3.46Å; D307-Y311 WeakPolarHBondContact O-CD1 3.35Å; D307-Y311 WeakPolarHBondContact O-CD2 3.5Å; D307-Y311 WeakPolarHBondContact O-CE1 3.32Å; D307-Y311 PolarHBondContact O-N 3.45Å; P308-Y311 PolarHBondContact O-N 3.35Å; F309-Y311 VanDerWaalsContact C-N 3.28Å; F309-Y311 PolarHBondContact O-N 3.25Å; Y311-F313 VanDerWaalsContact C-N 3.34Å; Y311-F313 PolarHBondContact O-N 2.93Å; Y311-T314 PolarHBondContact O-N 3.12Å; Y311-L315 WeakPolarHBondContact O-CB 3.36Å; Y311-L315 PolarHBondContact O-N 2.8Å; Y311-F318 HydrophobicContact CD2-CZ 4.4Å
312Y77.6Confident75.9Confident81 Ų8139.4 Ų39.432%0.31819%0.19SC..Hα-helixtrans-59.9-41.2178-178-94.5000112.4P308 F309 Q319P308-Y312 WeakPolarHBondContact O-CB 3.47Å; P308-Y312 PolarHBondContact O-N 3.31Å; F309-Y312 PolarHBondContact O-N 2.96Å; Y312-Q319 HydrophobicContact CD2-CG 3.9Å; Y312-Q319 HydrophobicContact CE2-CB 4.3Å; Y312-Q319 HydrophobicContact CE2-CG 3.8Å; Y312-Q319 HydrophobicContact CG-CG 4.36Å; Y312-Q319 WeakPolarHBondContact O-CG 3.45Å; Y312-Q319 PolarHBondContact O-NE2 2.87Å
313F74.9Confident74.2Confident23 Ų2343.8 Ų43.810%0.10120%0.204CC..Hα-helixtrans-82.2-22.6179.3-63.9-56.9000113.8K249 M250 V253 F309 I310 Y311K249-F313 HydrophobicContact CD-CD1 3.54Å; K249-F313 HydrophobicContact CD-CE1 3.35Å; K249-F313 HydrophobicContact CD-CG 4.31Å; K249-F313 HydrophobicContact CD-CZ 3.96Å; K249-F313 HydrophobicContact CG-CD1 3.83Å; K249-F313 HydrophobicContact CG-CE1 4.04Å; K249-F313 HydrophobicContact CG-CG 4.13Å; K249-F313 HydrophobicContact CG-CZ 4.48Å; K249-F313 VanDerWaalsContact NZ-CZ 3.27Å; M250-F313 HydrophobicContact CB-CB 4.12Å; V253-F313 HydrophobicContact CB-CD2 4.21Å; V253-F313 HydrophobicContact CG1-CD2 4.2Å; V253-F313 HydrophobicContact CG2-CD2 3.7Å; V253-F313 HydrophobicContact CG2-CE2 3.97Å; F309-F313 HydrophobicContact CB-CD2 4.47Å; F309-F313 HydrophobicContact CB-CE2 4.27Å; F309-F313 HydrophobicContact CD1-CE2 4.35Å; F309-F313 WeakPolarHBondContact O-CD2 3.14Å; F309-F313 PolarHBondContact O-N 3.08Å; I310-F313 PolarHBondContact O-N 3.47Å; Y311-F313 VanDerWaalsContact C-N 3.34Å; Y311-F313 PolarHBondContact O-N 2.93Å
314T71.4Confident72.5Confident8 Ų847.5 Ų47.55%0.04923%0.227CC..Hα-helixtrans-90.8-33.8-177-54.10000114.3T74 I78 R136 M250 H254 I310 Y311T74-T314 HydrophobicContact CG2-CG2 3.7Å; I78-T314 HydrophobicContact CD1-CG2 3.45Å; I78-T314 VanDerWaalsContact CD1-CG2 3.45Å; R136-T314 PolarHBondContact NH2-O 3.22Å; M250-T314 HydrophobicContact CG-CG2 4.37Å; M250-T314 VanDerWaalsContact CG-OG1 3.32Å; M250-T314 WeakPolarHBondContact CG-OG1 2.96Å; M250-T314 HydrophobicContact SD-CG2 3.66Å; H254-T314 PolarHBondContact CE1-OG1 3.37Å; H254-T314 PolarHBondContact NE2-OG1 2.84Å; I310-T314 WeakPolarHBondContact O-CB 3.31Å; I310-T314 PolarHBondContact O-N 3.19Å; I310-T314 PolarHBondContact O-OG1 3.26Å; Y311-T314 PolarHBondContact O-N 3.12Å
315L71.1Confident70.6Confident6 Ų651.3 Ų51.33%0.03125%0.247CC..  trans-115.7108.4-170.3-64.3172.2000111.2F64 M68 A75 I78 Y311 S317 F318 Q319F64-L315 HydrophobicContact CD1-CD1 4.06Å; F64-L315 HydrophobicContact CE1-CD1 3.33Å; F64-L315 HydrophobicContact CZ-CD1 3.72Å; M68-L315 HydrophobicContact CE-CD1 4.04Å; M68-L315 HydrophobicContact CE-CD2 4.28Å; A75-L315 HydrophobicContact CB-CD2 4.04Å; I78-L315 HydrophobicContact CB-CD1 4.46Å; I78-L315 HydrophobicContact CD1-CD1 3.83Å; I78-L315 HydrophobicContact CD1-CD2 4.18Å; I78-L315 HydrophobicContact CD1-CG 3.81Å; I78-L315 HydrophobicContact CG2-CD1 3.85Å; Y311-L315 WeakPolarHBondContact O-CB 3.36Å; Y311-L315 PolarHBondContact O-N 2.8Å; L315-S317 VanDerWaalsContact C-N 3.25Å; L315-S317 PolarHBondContact O-N 3.45Å; L315-F318 HydrophobicContact CB-CB 3.62Å; L315-F318 WeakPolarHBondContact O-CB 3.31Å; L315-F318 PolarHBondContact O-N 2.96Å; L315-F318 VanDerWaalsContact O-N 3.13Å; L315-Q319 PolarHBondContact O-N 3.02Å
316E67.8Low68.7Low86 Ų8654.7 Ų54.740%0.40227%0.267SS..Hα-helixtrans-62.9-35.3175.5-30.3-149.8116.400112.4K246 F318 Q319 K320K246-E316 WeakPolarHBondContact CD-OE1 3.24Å; K246-E316 WeakPolarHBondContact CE-OE1 3.43Å; K246-E316 IonicContact NZ-OE1 3Å; K246-E316 PolarHBondContact NZ-OE1 3.2Å; E316-F318 VanDerWaalsContact C-N 3.26Å; E316-F318 PolarHBondContact O-N 3.4Å; E316-Q319 WeakPolarHBondContact O-CB 3.43Å; E316-Q319 PolarHBondContact O-N 2.66Å; E316-K320 WeakPolarHBondContact O-CG 3.26Å; E316-K320 PolarHBondContact O-N 2.92Å
317S59.6Low66.7Low69 Ų6957.8 Ų57.848%0.48328%0.282SS..Hα-helixtrans-64.4-33176.3-530000112L315 S321L315-S317 VanDerWaalsContact C-N 3.25Å; L315-S317 PolarHBondContact O-N 3.45Å; S317-S321 PolarHBondContact O-N 3.05Å
318F63.2Low65.2Low5 Ų561.7 Ų61.72%0.02231%0.306CS..Hα-helixtrans-67.6-46174.9-168.7-112000110.3V63 F64 M68 Y311 L315 E316 K320 S321 F322V63-F318 HydrophobicContact CB-CD2 4.19Å; V63-F318 HydrophobicContact CB-CE2 4.09Å; V63-F318 HydrophobicContact CG1-CD2 3.67Å; V63-F318 HydrophobicContact CG1-CE2 4.08Å; V63-F318 HydrophobicContact CG2-CE2 4.44Å; F64-F318 HydrophobicContact CD1-CD2 4.2Å; F64-F318 HydrophobicContact CE1-CB 4.34Å; F64-F318 AromaticContact CE1-CD2 3.37Å; F64-F318 HydrophobicContact CE1-CD2 3.37Å; F64-F318 AromaticContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CG 4.03Å; F64-F318 AromaticContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CE2 4.01Å; M68-F318 HydrophobicContact SD-CB 4.24Å; Y311-F318 HydrophobicContact CD2-CZ 4.4Å; L315-F318 HydrophobicContact CB-CB 3.62Å; L315-F318 WeakPolarHBondContact O-CB 3.31Å; L315-F318 PolarHBondContact O-N 2.96Å; L315-F318 VanDerWaalsContact O-N 3.13Å; E316-F318 VanDerWaalsContact C-N 3.26Å; E316-F318 PolarHBondContact O-N 3.4Å; F318-K320 PolarHBondContact O-N 3.27Å; F318-S321 PolarHBondContact O-N 3.39Å; F318-F322 HydrophobicContact CD1-CD2 4.39Å; F318-F322 AromaticContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD2-CE2 4.24Å; F318-F322 HydrophobicContact CE1-CD2 4.37Å; F318-F322 AromaticContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CE2 3.42Å; F318-F322 VanDerWaalsContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CZ 4.15Å; F318-F322 AromaticContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CZ 4.39Å; F318-F322 HydrophobicContact CG-CE2 4.24Å; F318-F322 AromaticContact CZ-CE2 3.45Å; F318-F322 HydrophobicContact CZ-CE2 3.45Å; F318-F322 VanDerWaalsContact CZ-CE2 3.45Å; F318-F322 AromaticContact CZ-CZ 3.87Å; F318-F322 HydrophobicContact CZ-CZ 3.87Å; F318-F322 VanDerWaalsContact O-CD2 3.29Å; F318-F322 WeakPolarHBondContact O-CD2 3.5Å; F318-F322 PolarHBondContact O-N 3.06Å
319Q66.1Low63.8Low37 Ų3769.3 Ų69.317%0.17333%0.332CS..Hα-helixtrans-53.6-52.5173.2-60.7178.1-24.500111Y312 L315 E316 S321 F322 Y323Y312-Q319 HydrophobicContact CD2-CG 3.9Å; Y312-Q319 HydrophobicContact CE2-CB 4.3Å; Y312-Q319 HydrophobicContact CE2-CG 3.8Å; Y312-Q319 HydrophobicContact CG-CG 4.36Å; Y312-Q319 WeakPolarHBondContact O-CG 3.45Å; Y312-Q319 PolarHBondContact O-NE2 2.87Å; L315-Q319 PolarHBondContact O-N 3.02Å; E316-Q319 WeakPolarHBondContact O-CB 3.43Å; E316-Q319 PolarHBondContact O-N 2.66Å; Q319-S321 VanDerWaalsContact C-N 3.3Å; Q319-S321 PolarHBondContact O-N 3.34Å; Q319-F322 PolarHBondContact O-N 3.5Å; Q319-Y323 WeakPolarHBondContact O-CD2 3.35Å; Q319-Y323 PolarHBondContact O-N 2.98Å
320K66.4Low62.2Low135 Ų13569.4 Ų69.459%0.58734%0.335SS*.Hα-helixtrans-60.9-34.3-179-71.8176.8178.4179.30113.2E316 F318 F322 Y323 V324E316-K320 WeakPolarHBondContact O-CG 3.26Å; E316-K320 PolarHBondContact O-N 2.92Å; F318-K320 PolarHBondContact O-N 3.27Å; K320-F322 VanDerWaalsContact C-N 3.31Å; K320-F322 PolarHBondContact O-N 3.3Å; K320-Y323 PolarHBondContact O-N 3.48Å; K320-V324 WeakPolarHBondContact O-CG2 3.19Å; K320-V324 PolarHBondContact O-N 2.79Å
321S61.3Low60.9Low15 Ų1575.2 Ų75.211%0.10536%0.362CS..Hα-helixtrans-64.6-32.5177.9-167.80000113.1S317 F318 Q319 N325S317-S321 PolarHBondContact O-N 3.05Å; F318-S321 PolarHBondContact O-N 3.39Å; Q319-S321 VanDerWaalsContact C-N 3.3Å; Q319-S321 PolarHBondContact O-N 3.34Å; S321-N325 PolarHBondContact O-N 2.99Å
322F63.3Low59.4Low95 Ų9578.2 Ų78.242%0.41738%0.383SS..Hα-helixtrans-71-39.2174-77-81.5000112.2V59 F318 Q319 K320 T326V59-F322 HydrophobicContact CG1-CZ 4.44Å; F318-F322 HydrophobicContact CD1-CD2 4.39Å; F318-F322 AromaticContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD2-CE2 4.24Å; F318-F322 HydrophobicContact CE1-CD2 4.37Å; F318-F322 AromaticContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CE2 3.42Å; F318-F322 VanDerWaalsContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CZ 4.15Å; F318-F322 AromaticContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CZ 4.39Å; F318-F322 HydrophobicContact CG-CE2 4.24Å; F318-F322 AromaticContact CZ-CE2 3.45Å; F318-F322 HydrophobicContact CZ-CE2 3.45Å; F318-F322 VanDerWaalsContact CZ-CE2 3.45Å; F318-F322 AromaticContact CZ-CZ 3.87Å; F318-F322 HydrophobicContact CZ-CZ 3.87Å; F318-F322 VanDerWaalsContact O-CD2 3.29Å; F318-F322 WeakPolarHBondContact O-CD2 3.5Å; F318-F322 PolarHBondContact O-N 3.06Å; Q319-F322 PolarHBondContact O-N 3.5Å; K320-F322 VanDerWaalsContact C-N 3.31Å; K320-F322 PolarHBondContact O-N 3.3Å; F322-T326 PolarHBondContact O-N 3.36Å; F322-T326 PolarHBondContact O-OG1 3.09Å
323Y58.8Low58.1Low137 Ų13780 Ų8054%0.53740%0.398SS..Hα-helixtrans-66.8-40.4176.7-71.9-75.6000112.6Q319 K320 T326 H327Q319-Y323 WeakPolarHBondContact O-CD2 3.35Å; Q319-Y323 PolarHBondContact O-N 2.98Å; K320-Y323 PolarHBondContact O-N 3.48Å; Y323-T326 WeakPolarHBondContact CA-OG1 3.5Å; Y323-T326 PolarHBondContact O-N 3.44Å; Y323-T326 PolarHBondContact O-OG1 2.94Å; Y323-T326 VanDerWaalsContact O-OG1 3.05Å; Y323-H327 PolarHBondContact O-N 2.93Å
324V56.8Low56.7Low77 Ų7786 Ų8647%0.46742%0.424SS..Hα-helixtrans-68.1-40.4177.7174.40000111.3K320 T326 H327 V328K320-V324 WeakPolarHBondContact O-CG2 3.19Å; K320-V324 PolarHBondContact O-N 2.79Å; V324-T326 VanDerWaalsContact C-N 3.35Å; V324-T326 PolarHBondContact O-N 3.49Å; V324-H327 PolarHBondContact O-N 2.96Å; V324-V328 HydrophobicContact CG1-CG2 4.31Å; V324-V328 WeakPolarHBondContact O-CB 3.3Å; V324-V328 VanDerWaalsContact O-CG2 3.3Å; V324-V328 WeakPolarHBondContact O-CG2 3.3Å; V324-V328 PolarHBondContact O-N 3.43Å
325N53.1Low55.6Low81 Ų8193.8 Ų93.843%0.43346%0.457SS..Hα-helixtrans-68.9-31.1176.8-85.3-2.1000113S321 R329S321-N325 PolarHBondContact O-N 2.99Å; N325-R329 WeakPolarHBondContact O-CB 3.34Å; N325-R329 PolarHBondContact O-N 3.48Å; N325-R329 VanDerWaalsContact O-N 3.14Å
326T50.8Low54.4Low86 Ų8699.1 Ų99.153%0.52849%0.49SS..Hα-helixtrans-72.8-41173.631.20000111.6F322 Y323 V324 R329 M330F322-T326 PolarHBondContact O-N 3.36Å; F322-T326 PolarHBondContact O-OG1 3.09Å; Y323-T326 WeakPolarHBondContact CA-OG1 3.5Å; Y323-T326 PolarHBondContact O-N 3.44Å; Y323-T326 PolarHBondContact O-OG1 2.94Å; Y323-T326 VanDerWaalsContact O-OG1 3.05Å; V324-T326 VanDerWaalsContact C-N 3.35Å; V324-T326 PolarHBondContact O-N 3.49Å; T326-R329 PolarHBondContact O-N 3.09Å; T326-M330 VanDerWaalsContact O-CB 3.3Å; T326-M330 WeakPolarHBondContact O-CB 3.22Å; T326-M330 PolarHBondContact O-N 2.77Å
327H46Very low53.4Low132 Ų132103 Ų10361%0.61151%0.508SS*.Hα-helixtrans-66.1-41.9175.1-95.8-75000113.6Y323 V324 R329 M330 E331Y323-H327 PolarHBondContact O-N 2.93Å; V324-H327 PolarHBondContact O-N 2.96Å; H327-R329 VanDerWaalsContact C-N 3.32Å; H327-R329 PolarHBondContact O-N 3.33Å; H327-M330 PolarHBondContact O-N 2.04Å; H327-E331 PolarHBondContact O-N 3.37Å
328V51.4Low52.4Low82 Ų82105.6 Ų105.650%0.49752%0.521SS..Hα-helixtrans-65.7-37.2176.1172.50000111.2V324 S332V324-V328 HydrophobicContact CG1-CG2 4.31Å; V324-V328 WeakPolarHBondContact O-CB 3.3Å; V324-V328 VanDerWaalsContact O-CG2 3.3Å; V324-V328 WeakPolarHBondContact O-CG2 3.3Å; V324-V328 PolarHBondContact O-N 3.43Å; V328-S332 WeakPolarHBondContact O-CB 3.23Å; V328-S332 PolarHBondContact O-N 2.94Å; V328-S332 PolarHBondContact O-OG 2.78Å
329R46.1Very low51.5Low186 Ų186111 Ų11170%0.70256%0.557SS**Hα-helixtrans-71.1-31175.8-167.8152.1178.2152.3-3.4112.5N325 T326 H327 S332 L333N325-R329 WeakPolarHBondContact O-CB 3.34Å; N325-R329 PolarHBondContact O-N 3.48Å; N325-R329 VanDerWaalsContact O-N 3.14Å; T326-R329 PolarHBondContact O-N 3.09Å; H327-R329 VanDerWaalsContact C-N 3.32Å; H327-R329 PolarHBondContact O-N 3.33Å; R329-S332 WeakPolarHBondContact CA-OG 3.39Å; R329-S332 PolarHBondContact O-OG 3.04Å; R329-L333 HydrophobicContact CG-CD1 4.49Å; R329-L333 WeakPolarHBondContact O-CB 3.05Å; R329-L333 WeakPolarHBondContact O-CD1 2.94Å; R329-L333 VanDerWaalsContact O-CG 3.23Å; R329-L333 WeakPolarHBondContact O-CG 3.49Å; R329-L333 PolarHBondContact O-N 2.85Å
330M43.2Very low50.4Low116 Ų116117.6 Ų117.657%0.57159%0.593SS**Hα-helixtrans-75-40.5174.6-154.4129.9164.200111.4T326 H327 S332 L333 F334T326-M330 VanDerWaalsContact O-CB 3.3Å; T326-M330 WeakPolarHBondContact O-CB 3.22Å; T326-M330 PolarHBondContact O-N 2.77Å; H327-M330 PolarHBondContact O-N 2.04Å; M330-S332 PolarHBondContact O-N 3.38Å; M330-L333 PolarHBondContact O-N 2.87Å; M330-F334 HydrophobicContact CE-CE2 4.43Å; M330-F334 HydrophobicContact CG-CD2 4.16Å; M330-F334 HydrophobicContact CG-CE2 4.24Å; M330-F334 WeakPolarHBondContact O-CD2 3.4Å; M330-F334 PolarHBondContact O-N 2.96Å
331E49.6Very low48.9Very low123 Ų123117.9 Ų117.958%0.57561%0.606SS**Hα-helixtrans-64.4-37172.1-82.5-170.2158.100112.7H327 L333 F334 K335H327-E331 PolarHBondContact O-N 3.37Å; E331-L333 VanDerWaalsContact C-N 3.32Å; E331-F334 PolarHBondContact O-N 3.1Å; E331-K335 WeakPolarHBondContact O-CB 3.33Å; E331-K335 PolarHBondContact O-N 2.74Å
332S48.2Very low47.8Very low63 Ų63123.6 Ų123.644%0.44164%0.64SS.*Hα-helixtrans-69.5-30.717563.80000112.8V328 R329 M330 T336V328-S332 WeakPolarHBondContact O-CB 3.23Å; V328-S332 PolarHBondContact O-N 2.94Å; V328-S332 PolarHBondContact O-OG 2.78Å; R329-S332 WeakPolarHBondContact CA-OG 3.39Å; R329-S332 PolarHBondContact O-OG 3.04Å; M330-S332 PolarHBondContact O-N 3.38Å; S332-T336 PolarHBondContact O-OG1 2.96Å
333L50.1Low46.3Very low118 Ų118128.7 Ų128.762%0.61866%0.662SS**Hα-helixtrans-74-39.7174.1-75.1165.7000111.2R329 M330 E331 T336R329-L333 HydrophobicContact CG-CD1 4.49Å; R329-L333 WeakPolarHBondContact O-CB 3.05Å; R329-L333 WeakPolarHBondContact O-CD1 2.94Å; R329-L333 VanDerWaalsContact O-CG 3.23Å; R329-L333 WeakPolarHBondContact O-CG 3.49Å; R329-L333 PolarHBondContact O-N 2.85Å; M330-L333 PolarHBondContact O-N 2.87Å; E331-L333 VanDerWaalsContact C-N 3.32Å; L333-T336 PolarHBondContact O-N 3.06Å
334F47.1Very low45.2Very low149 Ų149128.1 Ų128.165%0.65468%0.675SS**Hα-helixtrans-73-23.6175.4-91.1-81.6000114.2M330 E331 T336M330-F334 HydrophobicContact CE-CE2 4.43Å; M330-F334 HydrophobicContact CG-CD2 4.16Å; M330-F334 HydrophobicContact CG-CE2 4.24Å; M330-F334 WeakPolarHBondContact O-CD2 3.4Å; M330-F334 PolarHBondContact O-N 2.96Å; E331-F334 PolarHBondContact O-N 3.1Å; F334-T336 VanDerWaalsContact C-N 3.26Å; F334-T336 PolarHBondContact O-N 3.37Å
335K48Very low44.1Very low171 Ų171130 Ų13074%0.74369%0.692SS**THydrogen-bonded Turntrans-76-8.1172.6-89.2-180176.2173.50114.4E331E331-K335 WeakPolarHBondContact O-CB 3.33Å; E331-K335 PolarHBondContact O-N 2.74Å
336T45.9Very low43.1Very low118 Ų118134.2 Ų134.272%0.72471%0.714SS**THydrogen-bonded Turntrans-88.9-6.6179.2-48.80000112.4S332 L333 F334S332-T336 PolarHBondContact O-OG1 2.96Å; L333-T336 PolarHBondContact O-N 3.06Å; F334-T336 VanDerWaalsContact C-N 3.26Å; F334-T336 PolarHBondContact O-N 3.37Å
337E45.4Very low42.6Very low167 Ų167135.7 Ų135.778%0.7872%0.724SS**  trans-122.582175.6-72.3-178.2168.700111.3
338T39.8Very low42.1Very low124 Ų124134.1 Ų134.176%0.76174%0.735SS**  trans-131.4122.215423.90000108.9
339P43.2Very low41.2Very low119 Ų119138.3 Ų138.377%0.77375%0.752SS**  trans-75.2151.8178.7-3.720000111.3T341P339-T341 PolarHBondContact O-N 3.45Å
340L44.4Very low40.6Very low176 Ų176138.1 Ų138.192%0.92176%0.759SS**  trans-46.5124.3170.1-96.281.1000111.5
341T34.7Very low40.1Very low140 Ų140141.2 Ų141.286%0.85977%0.773SS**  trans-126.6124.9156.2-0.90000110.5P339P339-T341 PolarHBondContact O-N 3.45Å
342T37.2Very low39.1Very low136 Ų136143.1 Ų143.183%0.83478%0.781SS**PPolyproline II helixtrans-61135.9-172.7-27.40000112.4
343K32.9Very low38.3Very low202 Ų202145.7 Ų145.788%0.87879%0.794SS**PPolyproline II helixtrans-69.8142.3166.6-87.6-179.9172.2179.50110.7
344P35.7Very low37.2Very low124 Ų124145 Ų14581%0.80580%0.799SS**PPolyproline II helixtrans-92.1129.3154.416.21000110.5
345S33.8Very low36.4Very low118 Ų118144.5 Ų144.583%0.82580%0.803SS**PPolyproline II helixtrans-83.4134171.246.60000111.2
346L32Very low35.6Very low169 Ų169143.7 Ų143.789%0.88580%0.802SS**PPolyproline II helixtrans-94.6151.1163.1-114.594.6000110.5
347P40.5Very low34.9Very low116 Ų116143.2 Ų143.275%0.75380%0.799SS**PPolyproline II helixtrans-91.8155.5-169.635.9-32000113.7
348A33.8Very low34.2Very low100 Ų100141.4 Ų141.483%0.82680%0.8SS**PPolyproline II helixtrans-90.5140169.300000110.6
349I33Very low33.8Very low169 Ų169141.6 Ų141.687%0.86780%0.796SS**  trans-133.7135.3160.6-64.7-179.1000108
350Q33.8Very low33.3Very low183 Ų183142.6 Ų142.686%0.85580%0.795SS**  trans-86.8166.1-177.7-107.3154.1-69.300113.6
351E31.9Very low32.5Very low181 Ų181138 Ų13885%0.84679%0.79SS**  trans121148.1159.1-77179.9176.600112.6
352E29.3Very low32.4Very low163 Ų163134.8 Ų134.876%0.76279%0.785SS**  cis-160.5149.1-27.8-118.2-168.2162.500105.1
353V30.8Very low32.2Very low117 Ų117136.7 Ų136.771%0.70978%0.784SS**  trans58.7139.5138.3-176.50000122.8
354S28.6Very low32.3Very low103 Ų103133.3 Ų133.372%0.7278%0.775SS**  trans83.3103.9150.554.90000122.1
355D30.2Very low32.3Very low138 Ų138134.4 Ų134.474%0.73877%0.771SS**  87.2140.9108.4-138.817.4000121
356Q30.8Very low32.3Very low154 Ų154134.7 Ų134.772%0.7276%0.763SS**  trans82.5102.1153.4-81175.332.600122.6
357T30.4Very low32.3Very low109 Ų109133.9 Ų133.967%0.66976%0.755SS**  68.1141.9119.313.20000122.9
358T31.2Very low31.8Very low129 Ų129132.5 Ų132.579%0.79175%0.747SS**  trans73.5147.6150.755.10000117.8
359N31.6Very low32.1Very low127 Ų127133.2 Ų133.268%0.67974%0.742SS**  cis-176.5158.2-22.5-163.810.9000103.8
360N32.4Very low32.6Very low141 Ų141138.1 Ų138.175%0.75476%0.757SS**  trans66.6115.7157.2-69.5-14.1000120
361G28.7Very low32.5Very low79 Ų79135.9 Ų135.981%0.81475%0.752SS**  114138.183.300000117
362G31.2Very low32.5Very low73 Ų73133.5 Ų133.575%0.75375%0.748SS**  trans92.594.9161.900000113.4
363E33.3Very low32.7Very low176 Ų176131.8 Ų131.882%0.82275%0.747SS**  73.213452.9-146.3-171.1159.600114.3
364L35.8Very low32.8Very low130 Ų130132.7 Ų132.768%0.68175%0.749SS**  trans77.9142.2165.9-69.2124.6000118.2
365M34.8Very low33.1Very low147 Ų147134.6 Ų134.672%0.72475%0.751SS**  cis157.7160.5-16.6-104-98-84.100105.4
366L34.6Very low33.3Very low125 Ų125134.3 Ų134.365%0.65475%0.752SS**  trans71.4147.3163.2-59125.2000115.2
367E30.9Very low33.4Very low152 Ų152132.9 Ų132.971%0.7175%0.754SS**  cis-166.3135.1-1.7-122.5176.6126.800105.1
368S31.2Very low33.7Very low86 Ų86134.8 Ų134.860%0.60176%0.76SS**  64130.9101.689.10000117.1
369T38.8Very low33.9Very low116 Ų116135.3 Ų135.371%0.71276%0.758SS**  trans80.8102.2148.2-11.90000118.8
370F43.6Very low34.1Very low271 Ų271136 Ų136100%1.18977%0.765SS**  -162.4095.5-116.5-86.1000111.8

Retrieved 370 of 370 residues in 260.9 ms (Link to these results)