A0A087X495_POEFO Loading...

STARD3 N-terminal like

AlphaFold DB , UniProt , Accession A0A087X495, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 230 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
1M37Very low34.2Very low241 Ų241156 Ų156100%1.18785%0.849SS**  0126.60-79.5167.1106.600107.4
2D36.7Very low34.7Very low152 Ų152157 Ų15781%0.81385%0.852SS**  trans-66.9152.2-157-52-81.6000114.8
3S33.8Very low34.7Very low113 Ų113156.2 Ų156.279%0.7986%0.856SS**  -172.4108.3122-84.50000113.7
4R35.2Very low35.1Very low240 Ų240150.7 Ų150.791%0.90685%0.853SS**  trans43.6105.6131.5-67.2180177.5176.2-0.7118.2
5C29.8Very low35.2Very low142 Ų142157 Ų15796%0.95986%0.858SS**  trans-96.5120.9154.5-145.30000108.5
6S36.2Very low35.7Very low112 Ų112151.6 Ų151.678%0.78385%0.85SS**  trans-100.5131.1175.351.60000110.8
7S34.3Very low35.9Very low108 Ų108150.4 Ų150.476%0.75585%0.85SS**  trans-19.2140.9162.3-165.10000117.6
8V35.8Very low35.7Very low135 Ų135145.8 Ų145.882%0.81884%0.842SS**  -178.5135.8102.1160.80000110.9
9D33.4Very low35.7Very low141 Ų141144.2 Ų144.275%0.75484%0.84SS**  trans-41.7154.6175.2-128.5-48.7000118
10S32.4Very low36Very low101 Ų101144.3 Ų144.371%0.70684%0.842SS**  170.4129.7120.3-67.90000113.5
11R31.7Very low35.9Very low231 Ų231142.2 Ų142.287%0.87284%0.835SS**  trans103.188.8151.8-53.6-165.5-174-161.1-0.4118.5
12L40Very low36.5Very low168 Ų168135.5 Ų135.588%0.8881%0.812SS**  12.6119.6119.8-83.7148.2000116.8
13T35.1Very low36.9Very low147 Ų147133 Ų13390%0.90280%0.803SS**  -162.9132.2125.920.80000109.1
14G40.4Very low37.3Very low79 Ų79132.8 Ų132.881%0.81480%0.798SS**  trans-72.5156.6-16600000115.5
15R35.8Very low37.8Very low245 Ų245127.7 Ų127.793%0.92579%0.788SS**  trans-159.5119.1150.7-154168.7-173.7177.50.8107.4
16G44.1Very low38.4Very low71 Ų71124 Ų12473%0.73276%0.764SS**  trans-63.8152.2-173.500000113.5
17P38.6Very low38.6Very low131 Ų131121.8 Ų121.885%0.85175%0.753SS**  trans-87.1140.4151.734.7-25000107.2
18G32.4Very low39Very low68 Ų68124.7 Ų124.770%0.70175%0.747SS**  cis121.4126.536.800000106.4
19S35.1Very low39.2Very low115 Ų115121.8 Ų121.880%0.80473%0.729SS**  trans52.298.4151.8-174.30000116.9S21S19-S21 PolarHBondContact O-N 3.22Å
20V41.7Very low39.4Very low145 Ų145121 Ų12188%0.87972%0.722SS**  trans-48.2100.8159.9-174.40000109.1S22V20-S22 PolarHBondContact O-N 2.87Å; V20-S22 VanDerWaalsContact O-N 3.12Å
21S35.1Very low39.6Very low101 Ų101119.8 Ų119.871%0.70671%0.713SS**  trans-71.7101.4165.259.40000107.3S19S19-S21 PolarHBondContact O-N 3.22Å
22S48Very low40.1Very low101 Ų101115.3 Ų115.371%0.70670%0.697SS**  trans-51.113915738.40000109.9V20V20-S22 PolarHBondContact O-N 2.87Å; V20-S22 VanDerWaalsContact O-N 3.12Å
23T45.1Very low40Very low100 Ų100114.1 Ų114.161%0.61369%0.687SS**  trans83.4118175-0.80000116.1
24P43.4Very low40Very low107 Ų107111 Ų11170%0.69568%0.676SS**  -139.170.783.639.3-23.3000112.7A27P24-A27 HydrophobicContact CB-CB 4.31Å
25L44.6Very low40.1Very low134 Ų134110.1 Ų110.170%0.70267%0.667SS**SBendtrans-82.3-22.6158.8-102.6164.6000111.3R28 V29L25-R28 PolarHBondContact O-N 3.01Å; L25-V29 WeakPolarHBondContact O-CG2 3.4Å; L25-V29 PolarHBondContact O-N 2.5Å; L25-V29 VanDerWaalsContact O-N 3.12Å
26S42.9Very low40.4Very low63 Ų63105.7 Ų105.744%0.44166%0.656SS.*Hα-helixtrans-64.9-39.5176.1-160.70000112.8R28 V29 E30S26-R28 VanDerWaalsContact C-N 3.25Å; S26-R28 PolarHBondContact O-N 2.88Å; S26-V29 PolarHBondContact O-N 3.16Å; S26-E30 WeakPolarHBondContact O-CB 3.34Å; S26-E30 PolarHBondContact O-N 3.09Å
27A40Very low40.2Very low67 Ų67111 Ų11155%0.55466%0.66SS**Hα-helixtrans-69.5-23.5-179.400000113.3P24P24-A27 HydrophobicContact CB-CB 4.31Å
28R42.9Very low40.7Very low168 Ų168113.7 Ų113.763%0.63466%0.658SS**Hα-helixtrans-83.6-36.5174.3-161.9175173.3112.5-4.8110.3L25 S26 S31 Y32L25-R28 PolarHBondContact O-N 3.01Å; S26-R28 VanDerWaalsContact C-N 3.25Å; S26-R28 PolarHBondContact O-N 2.88Å; R28-S31 PolarHBondContact O-N 2.87Å; R28-S31 PolarHBondContact O-OG 2.67Å; R28-Y32 HydrophobicContact CG-CE2 4.12Å; R28-Y32 WeakPolarHBondContact CG-OH 3.32Å; R28-Y32 PolarHBondContact NE-OH 3.33Å; R28-Y32 WeakPolarHBondContact O-CD2 3.35Å; R28-Y32 WeakPolarHBondContact O-CE2 3.2Å; R28-Y32 VanDerWaalsContact O-CZ 3.26Å
29V41.5Very low41.4Very low74 Ų74115.1 Ų115.145%0.44866%0.656SS.*Hα-helixtrans-71-36.6176.3177.20000113.1L25 S26 S31 Y32 E33L25-V29 WeakPolarHBondContact O-CG2 3.4Å; L25-V29 PolarHBondContact O-N 2.5Å; L25-V29 VanDerWaalsContact O-N 3.12Å; S26-V29 PolarHBondContact O-N 3.16Å; V29-S31 PolarHBondContact O-N 3.02Å; V29-Y32 PolarHBondContact O-N 3.36Å; V29-E33 PolarHBondContact O-N 3.16Å
30E35.7Very low42.3Very low126 Ų126113 Ų11359%0.58964%0.635SS**THydrogen-bonded Turntrans-66.8-18.2175.1-83.3175.6129.900113.5S26 Y32S26-E30 WeakPolarHBondContact O-CB 3.34Å; S26-E30 PolarHBondContact O-N 3.09Å; E30-Y32 VanDerWaalsContact C-N 3.27Å
31S37.7Very low43.4Very low74 Ų74107.5 Ų107.552%0.51760%0.603SS.*THydrogen-bonded Turntrans-79.2-9.3172.568.90000113.9R28 V29R28-S31 PolarHBondContact O-N 2.87Å; R28-S31 PolarHBondContact O-OG 2.67Å; V29-S31 PolarHBondContact O-N 3.02Å
32Y42.7Very low44.9Very low137 Ų137108.7 Ų108.754%0.53760%0.601SS.*THydrogen-bonded Turntrans-98.9-22.2173.2-43.3-55.8000112.4R28 V29 E30R28-Y32 HydrophobicContact CG-CE2 4.12Å; R28-Y32 WeakPolarHBondContact CG-OH 3.32Å; R28-Y32 PolarHBondContact NE-OH 3.33Å; R28-Y32 WeakPolarHBondContact O-CD2 3.35Å; R28-Y32 WeakPolarHBondContact O-CE2 3.2Å; R28-Y32 VanDerWaalsContact O-CZ 3.26Å; V29-Y32 PolarHBondContact O-N 3.36Å; E30-Y32 VanDerWaalsContact C-N 3.27Å
33E37.9Very low45.9Very low143 Ų143104.7 Ų104.767%0.66857%0.572SS**G310 helixtrans-88.83.5172.9-80.1-168.7118.200113.9V29 G35V29-E33 PolarHBondContact O-N 3.16Å; E33-G35 PolarHBondContact O-N 2.89Å
34A34.8Very low47.3Very low82 Ų82103.2 Ų103.268%0.67856%0.556SS**G310 helixtrans-78.31.7164.700000113.1
35G42.5Very low48.9Very low60 Ų60104.6 Ų104.662%0.61955%0.547SS*.G310 helixtrans-92.5-2.9-177.800000116.1E33E33-G35 PolarHBondContact O-N 2.89Å
36E41.3Very low50.4Low152 Ų152102.2 Ų102.271%0.7154%0.538SS*.  trans-108.116.9-174.8-81.7-155.5110.700115.4K38E36-K38 PolarHBondContact O-N 3.45Å
37K41Very low52.1Low184 Ų184100.4 Ų100.480%0.852%0.522SS*.SBendtrans-69.195.4144-65.7-177.3-173.9174.70104.4C39K37-C39 PolarHBondContact O-N 3.04Å
38K49.1Very low53.8Low187 Ų18799.8 Ų99.881%0.81351%0.514SS*.  trans-5478.5163.2-77.6175.8178.6169.50107.3E36 I40E36-K38 PolarHBondContact O-N 3.45Å; K38-I40 PolarHBondContact O-N 3.5Å
39C47.2Very low55.7Low97 Ų9797.4 Ų97.466%0.65551%0.513SS*.  trans-65.492165.5-81.20000102.9K37 S41K37-C39 PolarHBondContact O-N 3.04Å; C39-S41 PolarHBondContact O-N 2.63Å
40I53.5Low57.6Low71 Ų7196 Ų9636%0.36450%0.501SS..  trans-39.8118.7162.7-172.8170.1000106.1K38 D42 R44 R45K38-I40 PolarHBondContact O-N 3.5Å; I40-D42 PolarHBondContact O-N 3.3Å; I40-R44 HydrophobicContact CD1-CB 4.4Å; I40-R44 HydrophobicContact CG1-CB 3.88Å; I40-R45 HydrophobicContact CG2-CG 3.79Å; I40-R45 VanDerWaalsContact CG2-CZ 3.45Å
41S63.8Low59.8Low30 Ų3090 Ų9021%0.2147%0.473CS..  trans-53.7138.3-17055.60000108.7C39 V43 R44 R45C39-S41 PolarHBondContact O-N 2.63Å; S41-V43 PolarHBondContact O-N 3.24Å; S41-R44 WeakPolarHBondContact O-CB 3.3Å; S41-R44 PolarHBondContact O-N 3.25Å; S41-R44 WeakPolarHBondContact OG-CD 3.36Å; S41-R44 VanDerWaalsContact OG-CG 3.29Å; S41-R44 WeakPolarHBondContact OG-CG 3.33Å; S41-R45 PolarHBondContact O-N 3.17Å
42D66.4Low62.2Low125 Ų12589 Ų8967%0.66846%0.463SS*.Hα-helixtrans-54.3-26.2-177.2-76.1-32.6000112.1I40 R45 T46I40-D42 PolarHBondContact O-N 3.3Å; D42-R45 PolarHBondContact O-N 3.04Å; D42-T46 WeakPolarHBondContact O-CB 3.49Å; D42-T46 PolarHBondContact O-N 3.45Å; D42-T46 PolarHBondContact O-OG1 2.91Å
43V70.4Confident64.3Low17 Ų1787.1 Ų87.110%0.10346%0.458CS..Hα-helixtrans-55.2-50.4169.9-178.50000112.4S41 T46 F47 V167 Q170S41-V43 PolarHBondContact O-N 3.24Å; V43-T46 PolarHBondContact O-N 3.09Å; V43-F47 WeakPolarHBondContact O-CB 3.24Å; V43-F47 PolarHBondContact O-N 3.36Å; V43-V167 HydrophobicContact CG1-CB 4.1Å; V43-V167 HydrophobicContact CG1-CG1 4.35Å; V43-V167 HydrophobicContact CG1-CG2 3.58Å; V43-Q170 HydrophobicContact CG2-CB 4.42Å; V43-Q170 HydrophobicContact CG2-CG 3.92Å; V43-Q170 VanDerWaalsContact CG2-NE2 3.27Å
44R73.1Confident66.7Low70 Ų7080.4 Ų80.426%0.26443%0.427SS..Hα-helixtrans-69.8-35.1-178.6-68.2172.8-179.4-146.85.3112.5I40 S41 C48 Y107 E171I40-R44 HydrophobicContact CD1-CB 4.4Å; I40-R44 HydrophobicContact CG1-CB 3.88Å; S41-R44 WeakPolarHBondContact O-CB 3.3Å; S41-R44 PolarHBondContact O-N 3.25Å; S41-R44 WeakPolarHBondContact OG-CD 3.36Å; S41-R44 VanDerWaalsContact OG-CG 3.29Å; S41-R44 WeakPolarHBondContact OG-CG 3.33Å; R44-C48 WeakPolarHBondContact O-CB 3.29Å; R44-C48 PolarHBondContact O-N 3.17Å; R44-Y107 HydrophobicContact CB-CE2 4.29Å; R44-Y107 HydrophobicContact CG-CE2 3.96Å; R44-E171 IonicContact CZ-OE1 3.53Å; R44-E171 IonicContact NE-OE1 3.17Å; R44-E171 PolarHBondContact NE-OE1 3.42Å; R44-E171 IonicContact NH2-OE1 2.55Å; R44-E171 PolarHBondContact NH2-OE1 3.35Å
45R77.1Confident69.3Low136 Ų13678.1 Ų78.151%0.51340%0.403SS..Hα-helixtrans-65.9-45.3173.9-66.1-172.3-154.2-135.21.5111I40 S41 D42 F47 C48 L49I40-R45 HydrophobicContact CG2-CG 3.79Å; I40-R45 VanDerWaalsContact CG2-CZ 3.45Å; S41-R45 PolarHBondContact O-N 3.17Å; D42-R45 PolarHBondContact O-N 3.04Å; R45-F47 VanDerWaalsContact C-N 3.32Å; R45-F47 PolarHBondContact O-N 3.21Å; R45-C48 PolarHBondContact O-N 2.9Å; R45-L49 VanDerWaalsContact O-CB 3.26Å; R45-L49 WeakPolarHBondContact O-CB 3.13Å; R45-L49 PolarHBondContact O-N 3.44Å
46T77.8Confident71.5Confident84 Ų8480.6 Ų80.652%0.51540%0.401SS..Hα-helixtrans-64.2-41.1179-53.80000110.7D42 V43 L49 F50D42-T46 WeakPolarHBondContact O-CB 3.49Å; D42-T46 PolarHBondContact O-N 3.45Å; D42-T46 PolarHBondContact O-OG1 2.91Å; V43-T46 PolarHBondContact O-N 3.09Å; T46-L49 PolarHBondContact O-N 3.23Å; T46-F50 WeakPolarHBondContact O-CB 3.44Å; T46-F50 PolarHBondContact O-N 3.46Å
47F78.1Confident73.8Confident24 Ų2476.6 Ų76.611%0.10538%0.382CS..Hα-helixtrans-60.1-52.4174.5172-109.5000112.4V43 R45 L49 F50 V51 L103 L163 V167V43-F47 WeakPolarHBondContact O-CB 3.24Å; V43-F47 PolarHBondContact O-N 3.36Å; R45-F47 VanDerWaalsContact C-N 3.32Å; R45-F47 PolarHBondContact O-N 3.21Å; F47-L49 VanDerWaalsContact C-N 3.3Å; F47-L49 PolarHBondContact O-N 3.09Å; F47-F50 PolarHBondContact O-N 3.13Å; F47-F50 VanDerWaalsContact O-N 3.14Å; F47-V51 HydrophobicContact CE1-CG2 4.4Å; F47-V51 HydrophobicContact CE2-CG2 3.8Å; F47-V51 HydrophobicContact CZ-CG2 3.76Å; F47-V51 PolarHBondContact O-N 2.82Å; F47-L103 HydrophobicContact CZ-CB 4.18Å; F47-L103 HydrophobicContact CZ-CD2 4.31Å; F47-L163 HydrophobicContact CD2-CD2 3.73Å; F47-L163 HydrophobicContact CD2-CG 4.1Å; F47-L163 HydrophobicContact CE2-CD1 3.94Å; F47-L163 HydrophobicContact CE2-CD2 3.16Å; F47-L163 HydrophobicContact CE2-CG 3.49Å; F47-L163 VanDerWaalsContact CE2-CG 3.49Å; F47-L163 HydrophobicContact CZ-CD1 4.47Å; F47-L163 HydrophobicContact CZ-CD2 3.64Å; F47-L163 HydrophobicContact CZ-CG 4.3Å; F47-V167 HydrophobicContact CB-CG2 4.22Å
48C76.3Confident76.1Confident55 Ų5568 Ų6837%0.37235%0.345SS..Hα-helixtrans-61.8-39.2178.9-173.80000111.9R44 R45 F50 V51 T52R44-C48 WeakPolarHBondContact O-CB 3.29Å; R44-C48 PolarHBondContact O-N 3.17Å; R45-C48 PolarHBondContact O-N 2.9Å; C48-F50 VanDerWaalsContact C-N 3.32Å; C48-F50 PolarHBondContact O-N 3.38Å; C48-V51 PolarHBondContact O-N 3.11Å; C48-T52 WeakPolarHBondContact O-CB 3.47Å; C48-T52 VanDerWaalsContact O-CG2 3.3Å; C48-T52 WeakPolarHBondContact O-CG2 3.22Å; C48-T52 PolarHBondContact O-N 2.84Å; C48-T52 PolarHBondContact O-OG1 2.77Å
49L82.1Confident78Confident117 Ų11760.4 Ų60.461%0.61331%0.314SS*.Hα-helixtrans-62-41.5175.1-168.6152000111.2R45 T46 F47 T52 F53R45-L49 VanDerWaalsContact O-CB 3.26Å; R45-L49 WeakPolarHBondContact O-CB 3.13Å; R45-L49 PolarHBondContact O-N 3.44Å; T46-L49 PolarHBondContact O-N 3.23Å; F47-L49 VanDerWaalsContact C-N 3.3Å; F47-L49 PolarHBondContact O-N 3.09Å; L49-T52 WeakPolarHBondContact CA-OG1 3.43Å; L49-T52 PolarHBondContact O-OG1 3.15Å; L49-F53 WeakPolarHBondContact O-CB 2.92Å; L49-F53 PolarHBondContact O-N 3.43Å
50F81.8Confident80.1Confident45 Ų4560.1 Ų60.120%0.19731%0.306CS..Hα-helixtrans-68.4-43.9178.3-163.6-101.1000112.5T46 F47 C48 T52 F53 D54 I158 E159 L162T46-F50 WeakPolarHBondContact O-CB 3.44Å; T46-F50 PolarHBondContact O-N 3.46Å; F47-F50 PolarHBondContact O-N 3.13Å; F47-F50 VanDerWaalsContact O-N 3.14Å; C48-F50 VanDerWaalsContact C-N 3.32Å; C48-F50 PolarHBondContact O-N 3.38Å; F50-T52 PolarHBondContact O-N 2.97Å; F50-F53 PolarHBondContact O-N 2.64Å; F50-D54 WeakPolarHBondContact O-CB 3.34Å; F50-D54 PolarHBondContact O-N 2.66Å; F50-I158 HydrophobicContact CE1-CB 4.45Å; F50-I158 HydrophobicContact CE1-CG2 3.9Å; F50-I158 HydrophobicContact CE2-CG2 4.25Å; F50-I158 HydrophobicContact CZ-CB 4.14Å; F50-I158 HydrophobicContact CZ-CG2 3.37Å; F50-E159 HydrophobicContact CD1-CB 4.48Å; F50-E159 HydrophobicContact CD1-CG 3.67Å; F50-E159 HydrophobicContact CE1-CB 4.14Å; F50-E159 HydrophobicContact CE1-CG 3.39Å; F50-L162 HydrophobicContact CD1-CD1 3.6Å; F50-L162 HydrophobicContact CD2-CD1 3.74Å; F50-L162 HydrophobicContact CE1-CD1 3.59Å; F50-L162 HydrophobicContact CE2-CD1 3.73Å; F50-L162 HydrophobicContact CG-CD1 3.69Å; F50-L162 HydrophobicContact CZ-CD1 3.68Å
51V82.1Confident81.8Confident1 Ų157.5 Ų57.51%0.00629%0.292CS..Hα-helixtrans-60.8-41.1175.8139.90000112.7F47 C48 L55 F100 L103 I104F47-V51 HydrophobicContact CE1-CG2 4.4Å; F47-V51 HydrophobicContact CE2-CG2 3.8Å; F47-V51 HydrophobicContact CZ-CG2 3.76Å; F47-V51 PolarHBondContact O-N 2.82Å; C48-V51 PolarHBondContact O-N 3.11Å; V51-L55 PolarHBondContact O-N 2.96Å; V51-F100 HydrophobicContact CG1-CD2 3.39Å; V51-F100 HydrophobicContact CG1-CE2 3.52Å; V51-F100 HydrophobicContact CG1-CG 4.48Å; V51-L103 HydrophobicContact CG2-CB 3.92Å; V51-L103 HydrophobicContact CG2-CD1 3.4Å; V51-L103 VanDerWaalsContact CG2-CD1 3.4Å; V51-L103 HydrophobicContact CG2-CG 4.24Å; V51-I104 HydrophobicContact CG1-CD1 4.2Å
52T86.3Confident82.8Confident51 Ų5156.9 Ų56.931%0.31329%0.285SS..Hα-helixtrans-72.6-41.2176.649.80000111.2C48 L49 F50 D54 L55 L56 F100C48-T52 WeakPolarHBondContact O-CB 3.47Å; C48-T52 VanDerWaalsContact O-CG2 3.3Å; C48-T52 WeakPolarHBondContact O-CG2 3.22Å; C48-T52 PolarHBondContact O-N 2.84Å; C48-T52 PolarHBondContact O-OG1 2.77Å; L49-T52 WeakPolarHBondContact CA-OG1 3.43Å; L49-T52 PolarHBondContact O-OG1 3.15Å; F50-T52 PolarHBondContact O-N 2.97Å; T52-D54 VanDerWaalsContact C-N 3.33Å; T52-D54 PolarHBondContact O-N 2.68Å; T52-L55 PolarHBondContact O-N 3.44Å; T52-L56 VanDerWaalsContact O-CG 3.28Å; T52-L56 WeakPolarHBondContact O-CG 3.27Å; T52-L56 PolarHBondContact O-N 3.22Å; T52-F100 HydrophobicContact CG2-CE2 3.76Å; T52-F100 HydrophobicContact CG2-CZ 4.43Å
53F87.5Confident83.7Confident99 Ų9954.5 Ų54.543%0.43427%0.272SS..Hα-helixtrans-59.2-43.6176.4171.8-101.3000112.1L49 F50 L56 F57L49-F53 WeakPolarHBondContact O-CB 2.92Å; L49-F53 PolarHBondContact O-N 3.43Å; F50-F53 PolarHBondContact O-N 2.64Å; F53-L56 PolarHBondContact O-N 2.98Å; F53-F57 HydrophobicContact CZ-CD2 4.2Å; F53-F57 HydrophobicContact CZ-CG 4.49Å; F53-F57 WeakPolarHBondContact O-CB 3.41Å; F53-F57 PolarHBondContact O-N 3.35Å
54D87.9Confident84.5Confident1 Ų156.5 Ų56.51%0.00528%0.281CS..Hα-helixtrans-57.1-52.1175.8167.586.3000112.4F50 T52 L56 F57 V58 R99 L155 E159F50-D54 WeakPolarHBondContact O-CB 3.34Å; F50-D54 PolarHBondContact O-N 2.66Å; T52-D54 VanDerWaalsContact C-N 3.33Å; T52-D54 PolarHBondContact O-N 2.68Å; D54-L56 VanDerWaalsContact C-N 3.27Å; D54-L56 PolarHBondContact O-N 3.26Å; D54-F57 PolarHBondContact O-N 2.9Å; D54-V58 WeakPolarHBondContact O-CG2 3.32Å; D54-V58 PolarHBondContact O-N 3.43Å; D54-R99 VanDerWaalsContact CG-CZ 3.44Å; D54-R99 IonicContact OD1-CZ 3.26Å; D54-R99 VanDerWaalsContact OD1-CZ 3.26Å; D54-R99 IonicContact OD1-NH1 3.28Å; D54-R99 PolarHBondContact OD1-NH1 3.22Å; D54-R99 IonicContact OD1-NH2 2.62Å; D54-R99 PolarHBondContact OD1-NH2 3.06Å; D54-R99 IonicContact OD2-CZ 2.66Å; D54-R99 IonicContact OD2-NE 3.66Å; D54-R99 IonicContact OD2-NH1 2.64Å; D54-R99 IonicContact OD2-NH2 3.7Å; D54-R99 PolarHBondContact OD2-NH2 3.3Å; D54-L155 WeakPolarHBondContact OD1-CB 3.37Å; D54-L155 WeakPolarHBondContact OD1-CD1 3.42Å; D54-E159 WeakPolarHBondContact CB-OE1 3.45Å
55L89.1Confident84.9Confident35 Ų3553.8 Ų53.818%0.18327%0.271CS..Hα-helixtrans-59-43.6179178139.8000110.5V51 T52 F57 T59 V97 F100V51-L55 PolarHBondContact O-N 2.96Å; T52-L55 PolarHBondContact O-N 3.44Å; L55-F57 VanDerWaalsContact C-N 3.32Å; L55-F57 PolarHBondContact O-N 2.81Å; L55-T59 VanDerWaalsContact O-CB 3.27Å; L55-T59 WeakPolarHBondContact O-CB 3.47Å; L55-T59 PolarHBondContact O-N 2.81Å; L55-T59 PolarHBondContact O-OG1 2.96Å; L55-V97 HydrophobicContact CD1-CG2 4.13Å; L55-F100 HydrophobicContact CB-CB 4.47Å; L55-F100 HydrophobicContact CB-CD2 4.34Å; L55-F100 HydrophobicContact CD1-CB 3.52Å; L55-F100 HydrophobicContact CD1-CD1 4.09Å; L55-F100 HydrophobicContact CD1-CD2 4.15Å; L55-F100 HydrophobicContact CD1-CG 3.66Å
56L90.5Very high85Confident111 Ų11147.3 Ų47.358%0.58125%0.247SC*.Hα-helixtrans-62.7-40.1176.6-69.7176.7000111.8T52 F53 D54 T59 L60T52-L56 VanDerWaalsContact O-CG 3.28Å; T52-L56 WeakPolarHBondContact O-CG 3.27Å; T52-L56 PolarHBondContact O-N 3.22Å; F53-L56 PolarHBondContact O-N 2.98Å; D54-L56 VanDerWaalsContact C-N 3.27Å; D54-L56 PolarHBondContact O-N 3.26Å; L56-T59 PolarHBondContact O-N 3.3Å; L56-L60 VanDerWaalsContact O-CB 3.23Å; L56-L60 WeakPolarHBondContact O-CB 3.5Å; L56-L60 PolarHBondContact O-N 3.43Å
57F89.6Confident85.3Confident68 Ų6848.1 Ų48.130%0.29825%0.248SC..Hα-helixtrans-70.4-43.7-178.7-166-107.9000112.3F53 D54 L55 T59 L60 L61 V151 L155F53-F57 HydrophobicContact CZ-CD2 4.2Å; F53-F57 HydrophobicContact CZ-CG 4.49Å; F53-F57 WeakPolarHBondContact O-CB 3.41Å; F53-F57 PolarHBondContact O-N 3.35Å; D54-F57 PolarHBondContact O-N 2.9Å; L55-F57 VanDerWaalsContact C-N 3.32Å; L55-F57 PolarHBondContact O-N 2.81Å; F57-T59 VanDerWaalsContact C-N 3.33Å; F57-L60 PolarHBondContact O-N 3.46Å; F57-L61 HydrophobicContact CD1-CD1 3.73Å; F57-L61 HydrophobicContact CD1-CG 4.41Å; F57-L61 HydrophobicContact CE1-CD1 3.59Å; F57-L61 HydrophobicContact CE1-CG 4.35Å; F57-L61 HydrophobicContact CZ-CD1 4.2Å; F57-L61 WeakPolarHBondContact O-CG 3.47Å; F57-L61 PolarHBondContact O-N 3.32Å; F57-V151 HydrophobicContact CD1-CG1 3.75Å; F57-V151 HydrophobicContact CE1-CG1 3.39Å; F57-L155 HydrophobicContact CB-CD1 4.45Å; F57-L155 HydrophobicContact CD1-CD1 3.6Å; F57-L155 HydrophobicContact CE1-CD1 4.3Å; F57-L155 HydrophobicContact CG-CD1 4.44Å
58V89Confident85.4Confident4 Ų451.4 Ų51.42%0.02427%0.27CS..Hα-helixtrans-63.1-42.3174.2176.30000110.5D54 L60 L61 W62 I92 A96 L155D54-V58 WeakPolarHBondContact O-CG2 3.32Å; D54-V58 PolarHBondContact O-N 3.43Å; V58-L60 PolarHBondContact O-N 2.87Å; V58-L61 PolarHBondContact O-N 2.86Å; V58-W62 WeakPolarHBondContact O-CB 3.45Å; V58-W62 PolarHBondContact O-N 3.36Å; V58-I92 HydrophobicContact CG1-CG2 4.15Å; V58-A96 HydrophobicContact CB-CB 3.89Å; V58-A96 HydrophobicContact CG1-CB 3.7Å; V58-A96 HydrophobicContact CG2-CB 4.19Å; V58-L155 HydrophobicContact CG2-CD1 4.27Å
59T89.6Confident85.2Confident28 Ų2851.3 Ų51.317%0.17227%0.27CS..Hα-helixtrans-61.9-43.6175.5-54.40000111.5L55 L56 F57 W62 I63 F93L55-T59 VanDerWaalsContact O-CB 3.27Å; L55-T59 WeakPolarHBondContact O-CB 3.47Å; L55-T59 PolarHBondContact O-N 2.81Å; L55-T59 PolarHBondContact O-OG1 2.96Å; L56-T59 PolarHBondContact O-N 3.3Å; F57-T59 VanDerWaalsContact C-N 3.33Å; T59-W62 PolarHBondContact O-N 3.38Å; T59-I63 HydrophobicContact CG2-CD1 3.91Å; T59-I63 VanDerWaalsContact O-CG1 3.29Å; T59-I63 WeakPolarHBondContact O-CG1 3.29Å; T59-I63 PolarHBondContact O-N 2.92Å; T59-F93 HydrophobicContact CG2-CD2 4.3Å; T59-F93 HydrophobicContact CG2-CE2 3.87Å; T59-F93 VanDerWaalsContact OG1-CE2 3.31Å; T59-F93 WeakPolarHBondContact OG1-CE2 3.37Å
60L90.6Very high84.7Confident91 Ų9149.1 Ų49.148%0.47628%0.275SS..Hα-helixtrans-62.8-47.5178.7-179.668.2000111.1L56 F57 V58 W62 I63 I64L56-L60 VanDerWaalsContact O-CB 3.23Å; L56-L60 WeakPolarHBondContact O-CB 3.5Å; L56-L60 PolarHBondContact O-N 3.43Å; F57-L60 PolarHBondContact O-N 3.46Å; V58-L60 PolarHBondContact O-N 2.87Å; L60-W62 VanDerWaalsContact C-N 3.32Å; L60-W62 PolarHBondContact O-N 3.42Å; L60-I63 PolarHBondContact O-N 3.25Å; L60-I64 HydrophobicContact CD1-CD1 4.15Å; L60-I64 HydrophobicContact CD1-CG1 4.49Å; L60-I64 HydrophobicContact CD2-CD1 4.45Å; L60-I64 HydrophobicContact CG-CD1 3.83Å; L60-I64 VanDerWaalsContact O-CG1 3.26Å; L60-I64 WeakPolarHBondContact O-CG1 3.27Å; L60-I64 PolarHBondContact O-N 3.2Å
61L87.9Confident84.4Confident15 Ų1548.2 Ų48.28%0.07928%0.279CS..Hα-helixtrans-60.7-43.7177.5-75.6173.3000111.4F57 V58 I64 E65 L147 L148 V151F57-L61 HydrophobicContact CD1-CD1 3.73Å; F57-L61 HydrophobicContact CD1-CG 4.41Å; F57-L61 HydrophobicContact CE1-CD1 3.59Å; F57-L61 HydrophobicContact CE1-CG 4.35Å; F57-L61 HydrophobicContact CZ-CD1 4.2Å; F57-L61 WeakPolarHBondContact O-CG 3.47Å; F57-L61 PolarHBondContact O-N 3.32Å; V58-L61 PolarHBondContact O-N 2.86Å; L61-I64 PolarHBondContact O-N 2.96Å; L61-E65 PolarHBondContact O-N 3.15Å; L61-L147 HydrophobicContact CD2-CD2 4.41Å; L61-L148 HydrophobicContact CB-CD1 3.84Å; L61-L148 HydrophobicContact CB-CG 4.14Å; L61-L148 WeakPolarHBondContact O-CD1 3.44Å; L61-V151 HydrophobicContact CD1-CB 3.97Å; L61-V151 HydrophobicContact CD1-CG1 3.54Å; L61-V151 HydrophobicContact CD1-CG2 4.28Å
62W86.6Confident84.2Confident18 Ų1850.4 Ų50.47%0.06829%0.292CS..Hα-helixtrans-58-48.1175.3177.450.8000111.7V58 T59 L60 I64 E65 L66 L76 E79 F90 F93 L148V58-W62 WeakPolarHBondContact O-CB 3.45Å; V58-W62 PolarHBondContact O-N 3.36Å; T59-W62 PolarHBondContact O-N 3.38Å; L60-W62 VanDerWaalsContact C-N 3.32Å; L60-W62 PolarHBondContact O-N 3.42Å; W62-I64 VanDerWaalsContact C-N 3.34Å; W62-I64 PolarHBondContact O-N 3.22Å; W62-E65 PolarHBondContact O-N 3.41Å; W62-L66 HydrophobicContact CD2-CD1 4.23Å; W62-L66 HydrophobicContact CH2-CD1 4.46Å; W62-L66 HydrophobicContact CZ2-CD1 3.84Å; W62-L66 WeakPolarHBondContact O-CG 3.28Å; W62-L66 PolarHBondContact O-N 3.5Å; W62-L76 HydrophobicContact CH2-CD1 4.22Å; W62-E79 PolarHBondContact NE1-OE2 3.18Å; W62-F90 HydrophobicContact CH2-CD2 4.45Å; W62-F90 HydrophobicContact CZ2-CD2 4.17Å; W62-F93 HydrophobicContact CD2-CB 4.02Å; W62-F93 HydrophobicContact CD2-CG 4.23Å; W62-F93 HydrophobicContact CE3-CB 4.12Å; W62-F93 HydrophobicContact CE3-CD1 4.33Å; W62-F93 AromaticContact CE3-CD2 3.82Å; W62-F93 HydrophobicContact CE3-CD2 3.82Å; W62-F93 HydrophobicContact CE3-CE2 4.34Å; W62-F93 AromaticContact CE3-CG 3.81Å; W62-F93 HydrophobicContact CE3-CG 3.81Å; W62-F93 HydrophobicContact CG-CB 4.29Å; W62-F93 HydrophobicContact CH2-CD1 4.42Å; W62-F93 HydrophobicContact CZ3-CD1 4.09Å; W62-F93 HydrophobicContact CZ3-CD2 4.19Å; W62-F93 HydrophobicContact CZ3-CE1 4.29Å; W62-F93 HydrophobicContact CZ3-CE2 4.38Å; W62-F93 HydrophobicContact CZ3-CG 4.04Å; W62-F93 HydrophobicContact CZ3-CZ 4.43Å; W62-L148 HydrophobicContact CB-CD2 4.18Å
63I85.4Confident83.6Confident74 Ų7456.2 Ų56.238%0.37932%0.316SS..Hα-helixtrans-63.1-38.4177.4-67.8168.9000112.1T59 L60 L66 N67T59-I63 HydrophobicContact CG2-CD1 3.91Å; T59-I63 VanDerWaalsContact O-CG1 3.29Å; T59-I63 WeakPolarHBondContact O-CG1 3.29Å; T59-I63 PolarHBondContact O-N 2.92Å; L60-I63 PolarHBondContact O-N 3.25Å; I63-L66 PolarHBondContact O-N 3.07Å; I63-N67 WeakPolarHBondContact O-CB 3.21Å; I63-N67 PolarHBondContact O-N 3.45Å
64I86.3Confident82.8Confident60 Ų6056 Ų5631%0.30832%0.322SS..Hα-helixtrans-65.9-41.5177.5-69.8166.6000110.8L60 L61 W62 L66 N67 V68 F144L60-I64 HydrophobicContact CD1-CD1 4.15Å; L60-I64 HydrophobicContact CD1-CG1 4.49Å; L60-I64 HydrophobicContact CD2-CD1 4.45Å; L60-I64 HydrophobicContact CG-CD1 3.83Å; L60-I64 VanDerWaalsContact O-CG1 3.26Å; L60-I64 WeakPolarHBondContact O-CG1 3.27Å; L60-I64 PolarHBondContact O-N 3.2Å; L61-I64 PolarHBondContact O-N 2.96Å; W62-I64 VanDerWaalsContact C-N 3.34Å; W62-I64 PolarHBondContact O-N 3.22Å; I64-L66 VanDerWaalsContact C-N 3.34Å; I64-N67 WeakPolarHBondContact O-CB 3.31Å; I64-N67 PolarHBondContact O-N 3.09Å; I64-N67 VanDerWaalsContact O-N 3.17Å; I64-V68 HydrophobicContact CG2-CG2 4.4Å; I64-V68 WeakPolarHBondContact O-CG2 3.37Å; I64-V68 PolarHBondContact O-N 2.92Å; I64-F144 HydrophobicContact CG2-CD1 4.45Å; I64-F144 HydrophobicContact CG2-CE1 3.85Å; I64-F144 HydrophobicContact CG2-CZ 4.3Å
65E81.3Confident82.1Confident12 Ų1258.7 Ų58.76%0.05634%0.335CS..Hα-helixtrans-60.2-46.2175-173.2-75.2143.900110.7L61 W62 N67 V68 S69 F89 L148L61-E65 PolarHBondContact O-N 3.15Å; W62-E65 PolarHBondContact O-N 3.41Å; E65-N67 PolarHBondContact O-N 3.14Å; E65-V68 PolarHBondContact O-N 3.35Å; E65-S69 WeakPolarHBondContact O-CB 3.3Å; E65-S69 PolarHBondContact O-N 3.36Å; E65-S69 PolarHBondContact O-OG 3.38Å; E65-S69 PolarHBondContact OE1-OG 2.96Å; E65-F89 HydrophobicContact CG-CD2 3.81Å; E65-F89 HydrophobicContact CG-CE2 3.6Å; E65-F89 WeakPolarHBondContact OE2-CD2 3.25Å; E65-L148 HydrophobicContact CB-CD1 3.78Å; E65-L148 HydrophobicContact CG-CD1 4.3Å
66L80.6Confident81.3Confident0 Ų060.1 Ų60.10%034%0.342CS..Hα-helixtrans-61.1-34.1175.1-65.9176.6000113.1W62 I63 I64 V72 Q75 L76 E79W62-L66 HydrophobicContact CD2-CD1 4.23Å; W62-L66 HydrophobicContact CH2-CD1 4.46Å; W62-L66 HydrophobicContact CZ2-CD1 3.84Å; W62-L66 WeakPolarHBondContact O-CG 3.28Å; W62-L66 PolarHBondContact O-N 3.5Å; I63-L66 PolarHBondContact O-N 3.07Å; I64-L66 VanDerWaalsContact C-N 3.34Å; L66-V72 HydrophobicContact CB-CG1 4.07Å; L66-V72 HydrophobicContact CD1-CG1 4.39Å; L66-Q75 HydrophobicContact CD2-CB 3.75Å; L66-Q75 HydrophobicContact CD2-CG 3.97Å; L66-L76 HydrophobicContact CD1-CB 4.35Å; L66-L76 HydrophobicContact CD1-CD1 4.18Å; L66-E79 HydrophobicContact CD2-CG 4.16Å; L66-E79 WeakPolarHBondContact CD2-OE2 3.49Å
67N83.8Confident80.6Confident101 Ų10161.1 Ų61.154%0.5434%0.344SS..Hα-helixtrans-69.4-43.6177-171.3-99.2000112I63 I64 E65 S69 V72I63-N67 WeakPolarHBondContact O-CB 3.21Å; I63-N67 PolarHBondContact O-N 3.45Å; I64-N67 WeakPolarHBondContact O-CB 3.31Å; I64-N67 PolarHBondContact O-N 3.09Å; I64-N67 VanDerWaalsContact O-N 3.17Å; E65-N67 PolarHBondContact O-N 3.14Å; N67-S69 VanDerWaalsContact C-N 3.33Å; N67-V72 HydrophobicContact CB-CG2 4.23Å
68V79.9Confident79.6Confident93 Ų9364.7 Ų64.756%0.56436%0.36SS*.Hα-helixtrans-69.6-31.8179.7171.20000111.9I64 E65 G70I64-V68 HydrophobicContact CG2-CG2 4.4Å; I64-V68 WeakPolarHBondContact O-CG2 3.37Å; I64-V68 PolarHBondContact O-N 2.92Å; E65-V68 PolarHBondContact O-N 3.35Å; V68-G70 PolarHBondContact O-N 3.48Å
69S72.6Confident78.8Confident54 Ų5465.2 Ų65.238%0.37836%0.362SS..THydrogen-bonded Turntrans-75.3-0.5-176.3-72.90000115.3E65 N67 Q75E65-S69 WeakPolarHBondContact O-CB 3.3Å; E65-S69 PolarHBondContact O-N 3.36Å; E65-S69 PolarHBondContact O-OG 3.38Å; E65-S69 PolarHBondContact OE1-OG 2.96Å; N67-S69 VanDerWaalsContact C-N 3.33Å; S69-Q75 PolarHBondContact O-NE2 2.96Å
70G71.2Confident78.1Confident70 Ų7067 Ų6772%0.72237%0.372SS*.THydrogen-bonded Turntrans123.73.7169.600000116.2V68V68-G70 PolarHBondContact O-N 3.48Å
71G75Confident76.9Confident26 Ų2669.1 Ų69.127%0.26838%0.383SS..  trans140.7125.1169.800000113.6Q73 V74 Q75G71-Q73 PolarHBondContact O-N 2.76Å; G71-V74 PolarHBondContact O-N 3.43Å; G71-Q75 WeakPolarHBondContact O-CB 3.23Å; G71-Q75 PolarHBondContact O-N 2.83Å; G71-Q75 VanDerWaalsContact O-N 3.15Å
72V77.6Confident75.8Confident48 Ų4875.6 Ų75.629%0.29141%0.413SS..Hα-helixtrans-57.3-42.4-168.8-151.80000113L66 N67 L76L66-V72 HydrophobicContact CB-CG1 4.07Å; L66-V72 HydrophobicContact CD1-CG1 4.39Å; N67-V72 HydrophobicContact CB-CG2 4.23Å; V72-L76 WeakPolarHBondContact O-CB 3.37Å; V72-L76 PolarHBondContact O-N 3.32Å
73Q73.3Confident74.9Confident173 Ų17379.5 Ų79.581%0.80843%0.429SS*.Hα-helixtrans-70.4-45.5-174.3-67.9-175.416.200113.2G71 L76 E77G71-Q73 PolarHBondContact O-N 2.76Å; Q73-L76 PolarHBondContact O-N 2.91Å; Q73-E77 PolarHBondContact O-N 2.79Å
74V72.2Confident74Confident93 Ų9380.2 Ų80.256%0.56443%0.433SS*.Hα-helixtrans-73.7-37-176.3-1760000110.9G71 K78G71-V74 PolarHBondContact O-N 3.43Å; V74-K78 PolarHBondContact O-N 2.85Å; V74-K78 VanDerWaalsContact O-N 3.13Å
75Q72.9Confident72.9Confident58 Ų5880.5 Ų80.527%0.27143%0.431SS..Hα-helixtrans-68.9-39.9174.6-126.481.47.300111.5L66 S69 G71 K78 E79L66-Q75 HydrophobicContact CD2-CB 3.75Å; L66-Q75 HydrophobicContact CD2-CG 3.97Å; S69-Q75 PolarHBondContact O-NE2 2.96Å; G71-Q75 WeakPolarHBondContact O-CB 3.23Å; G71-Q75 PolarHBondContact O-N 2.83Å; G71-Q75 VanDerWaalsContact O-N 3.15Å; Q75-K78 CarbonylContact O-C 3.59Å; Q75-K78 PolarHBondContact O-N 3.41Å; Q75-E79 WeakPolarHBondContact O-CB 3.16Å; Q75-E79 PolarHBondContact O-N 2.92Å
76L72.4Confident71.9Confident66 Ų6683.6 Ų83.635%0.34645%0.445SS..Hα-helixtrans-69.4-38.5179-167148.2000111.6W62 L66 V72 Q73 K78 E79 V80W62-L76 HydrophobicContact CH2-CD1 4.22Å; L66-L76 HydrophobicContact CD1-CB 4.35Å; L66-L76 HydrophobicContact CD1-CD1 4.18Å; V72-L76 WeakPolarHBondContact O-CB 3.37Å; V72-L76 PolarHBondContact O-N 3.32Å; Q73-L76 PolarHBondContact O-N 2.91Å; L76-K78 VanDerWaalsContact C-N 3.31Å; L76-K78 PolarHBondContact O-N 2.79Å; L76-E79 PolarHBondContact O-N 2.8Å; L76-V80 HydrophobicContact CD2-CG2 3.92Å; L76-V80 HydrophobicContact CG-CG2 3.98Å; L76-V80 WeakPolarHBondContact O-CB 3.31Å; L76-V80 VanDerWaalsContact O-CG2 3.29Å; L76-V80 WeakPolarHBondContact O-CG2 3.18Å; L76-V80 PolarHBondContact O-N 3.2Å
77E74.4Confident71.1Confident132 Ų13285.5 Ų85.562%0.61746%0.461SS*.Hα-helixtrans-60.9-41.6170.5-123-175.3177.100111.2Q73 L81Q73-E77 PolarHBondContact O-N 2.79Å; E77-L81 WeakPolarHBondContact O-CA 3.41Å; E77-L81 WeakPolarHBondContact O-CB 3.31Å; E77-L81 PolarHBondContact O-N 2.98Å
78K70.3Confident70.6Confident143 Ų14380.9 Ų80.962%0.62244%0.437SS*.Hα-helixtrans-66.9-46.7175.3-95.6178.5175.1171.20113.2V74 Q75 L76 H82V74-K78 PolarHBondContact O-N 2.85Å; V74-K78 VanDerWaalsContact O-N 3.13Å; Q75-K78 CarbonylContact O-C 3.59Å; Q75-K78 PolarHBondContact O-N 3.41Å; L76-K78 VanDerWaalsContact C-N 3.31Å; L76-K78 PolarHBondContact O-N 2.79Å; K78-H82 CarbonylContact O-C 3.01Å; K78-H82 WeakPolarHBondContact O-CA 3.29Å; K78-H82 WeakPolarHBondContact O-CB 2.96Å; K78-H82 PolarHBondContact O-N 3.23Å
79E71.6Confident70.5Confident15 Ų1576.6 Ų76.67%0.0741%0.41CS..Hα-helixtrans-68.3-41.6-178.6-85.2-152.7117.800113.2W62 L66 Q75 L76 Y83 S88 F89 F90W62-E79 PolarHBondContact NE1-OE2 3.18Å; L66-E79 HydrophobicContact CD2-CG 4.16Å; L66-E79 WeakPolarHBondContact CD2-OE2 3.49Å; Q75-E79 WeakPolarHBondContact O-CB 3.16Å; Q75-E79 PolarHBondContact O-N 2.92Å; L76-E79 PolarHBondContact O-N 2.8Å; E79-Y83 WeakPolarHBondContact O-CA 3.43Å; E79-S88 WeakPolarHBondContact CB-OG 2.84Å; E79-S88 VanDerWaalsContact CG-OG 3.27Å; E79-S88 WeakPolarHBondContact CG-OG 3.4Å; E79-S88 WeakPolarHBondContact OE1-CA 2.98Å; E79-S88 WeakPolarHBondContact OE1-CB 3.46Å; E79-S88 PolarHBondContact OE1-OG 3.07Å; E79-F89 PolarHBondContact OE1-N 3.31Å; E79-F90 PolarHBondContact OE1-N 2.82Å
80V73.8Confident70.9Confident65 Ų6576.2 Ų76.239%0.39440%0.402SS..Hα-helixtrans-87.4-40.4-174.7179.50000111.3L76 F90L76-V80 HydrophobicContact CD2-CG2 3.92Å; L76-V80 HydrophobicContact CG-CG2 3.98Å; L76-V80 WeakPolarHBondContact O-CB 3.31Å; L76-V80 VanDerWaalsContact O-CG2 3.29Å; L76-V80 WeakPolarHBondContact O-CG2 3.18Å; L76-V80 PolarHBondContact O-N 3.2Å; V80-F90 HydrophobicContact CG2-CD2 4.17Å; V80-F90 HydrophobicContact CG2-CE2 4.32Å
81L65.6Low71.5Confident135 Ų13573.2 Ų73.271%0.70737%0.369SS*.Hα-helixtrans-92.8-35.1-175.4-151.790.2000113E77E77-L81 WeakPolarHBondContact O-CA 3.41Å; E77-L81 WeakPolarHBondContact O-CB 3.31Å; E77-L81 PolarHBondContact O-N 2.98Å
82H64.8Low72Confident152 Ų15272.1 Ų72.170%0.70436%0.357SS*.SBendtrans-111.350.4176.2-102.375.1000110.7K78 D84K78-H82 CarbonylContact O-C 3.01Å; K78-H82 WeakPolarHBondContact O-CA 3.29Å; K78-H82 WeakPolarHBondContact O-CB 2.96Å; K78-H82 PolarHBondContact O-N 3.23Å; H82-D84 PolarHBondContact O-N 3.36Å; H82-D84 VanDerWaalsContact O-N 3.16Å
83Y67.8Low72.5Confident100 Ų10071.9 Ų71.939%0.39235%0.353SS..  trans-53.4120.1-175.5172.4-94.9000112.2E79 Y85 F90 D91E79-Y83 WeakPolarHBondContact O-CA 3.43Å; Y83-Y85 WeakPolarHBondContact OH-CD2 3.19Å; Y83-F90 HydrophobicContact CD2-CB 4.38Å; Y83-F90 AromaticContact CD2-CD1 3.88Å; Y83-F90 HydrophobicContact CD2-CD1 3.88Å; Y83-F90 HydrophobicContact CE2-CB 4.43Å; Y83-F90 AromaticContact CE2-CD1 3.9Å; Y83-F90 HydrophobicContact CE2-CD1 3.9Å; Y83-D91 VanDerWaalsContact CE2-OD1 3.27Å; Y83-D91 WeakPolarHBondContact CE2-OD1 3.24Å; Y83-D91 VanDerWaalsContact CZ-OD1 3.26Å; Y83-D91 PolarHBondContact OH-OD1 2.92Å; Y83-D91 PolarHBondContact OH-OD2 3.33Å
84D66.2Low73.2Confident88 Ų8868 Ų6847%0.47134%0.336SS..  trans-121.2115.8173.5-166.8-26.2000109.1H82 H86 A87 S88H82-D84 PolarHBondContact O-N 3.36Å; H82-D84 VanDerWaalsContact O-N 3.16Å; D84-H86 PolarHBondContact O-N 3.18Å; D84-H86 VanDerWaalsContact O-N 3.09Å; D84-H86 PolarHBondContact OD1-N 3.16Å; D84-A87 HydrophobicContact CB-CB 4.33Å; D84-A87 PolarHBondContact O-N 3.49Å; D84-A87 VanDerWaalsContact O-N 3.16Å; D84-S88 WeakPolarHBondContact O-CB 3.46Å; D84-S88 PolarHBondContact O-N 3.43Å
85Y64.1Low73.9Confident66 Ų6664.3 Ų64.326%0.25931%0.314SS..THydrogen-bonded Turntrans-58.5-23.9-176.1-173.8-93.5000113Y83 D91 F128 K132 L135Y83-Y85 WeakPolarHBondContact OH-CD2 3.19Å; Y85-D91 VanDerWaalsContact CD2-OD2 3.3Å; Y85-D91 WeakPolarHBondContact CD2-OD2 3.44Å; Y85-D91 WeakPolarHBondContact CE2-OD2 3.3Å; Y85-F128 HydrophobicContact CE2-CZ 4.32Å; Y85-K132 HydrophobicContact CE1-CD 4.46Å; Y85-K132 PolarHBondContact O-NZ 3.46Å; Y85-L135 HydrophobicContact CE1-CD1 3.97Å
86H60.9Low74.6Confident77 Ų7761.6 Ų61.636%0.35630%0.301SS..THydrogen-bonded Turntrans-93.2-17-178.2-69.7-77000114.5D84 L135 K137D84-H86 PolarHBondContact O-N 3.18Å; D84-H86 VanDerWaalsContact O-N 3.09Å; D84-H86 PolarHBondContact OD1-N 3.16Å; H86-L135 PolarHBondContact ND1-O 3.42Å; H86-K137 PolarHBondContact O-N 3.44Å; H86-K137 VanDerWaalsContact O-N 3.17Å
87A63.4Low75.4Confident41 Ų4161.3 Ų61.334%0.33930%0.302SS..THydrogen-bonded Turntrans-120.7-16.3-172.100000113.4D84 L138D84-A87 HydrophobicContact CB-CB 4.33Å; D84-A87 PolarHBondContact O-N 3.49Å; D84-A87 VanDerWaalsContact O-N 3.16Å; A87-L138 HydrophobicContact CB-CD1 3.71Å; A87-L138 VanDerWaalsContact O-CD1 3.31Å; A87-L138 WeakPolarHBondContact O-CD1 3.17Å; A87-L138 VanDerWaalsContact O-CD2 3.29Å; A87-L138 WeakPolarHBondContact O-CD2 3.47Å
88S73.3Confident76Confident4 Ų460 Ų603%0.02830%0.295CS..  trans-99.4133.9-179.2-1740000113E79 D84 F90 K132E79-S88 WeakPolarHBondContact CB-OG 2.84Å; E79-S88 VanDerWaalsContact CG-OG 3.27Å; E79-S88 WeakPolarHBondContact CG-OG 3.4Å; E79-S88 WeakPolarHBondContact OE1-CA 2.98Å; E79-S88 WeakPolarHBondContact OE1-CB 3.46Å; E79-S88 PolarHBondContact OE1-OG 3.07Å; D84-S88 WeakPolarHBondContact O-CB 3.46Å; D84-S88 PolarHBondContact O-N 3.43Å; S88-F90 VanDerWaalsContact C-N 3.27Å; S88-F90 WeakPolarHBondContact OG-CB 3.4Å; S88-F90 PolarHBondContact OG-N 3.39Å; S88-F90 VanDerWaalsContact OG-N 3.15Å; S88-K132 WeakPolarHBondContact O-CE 3.31Å; S88-K132 PolarHBondContact O-NZ 3.38Å
89F76.4Confident76.8Confident2 Ų253.6 Ų53.61%0.00927%0.266CS..THydrogen-bonded Turntrans-81-2.7168.2-66-61.3000113.7E65 E79 D91 I92 F93 L138 L148E65-F89 HydrophobicContact CG-CD2 3.81Å; E65-F89 HydrophobicContact CG-CE2 3.6Å; E65-F89 WeakPolarHBondContact OE2-CD2 3.25Å; E79-F89 PolarHBondContact OE1-N 3.31Å; F89-D91 PolarHBondContact O-N 2.81Å; F89-D91 VanDerWaalsContact O-N 3.11Å; F89-I92 HydrophobicContact CD1-CD1 3.74Å; F89-I92 HydrophobicContact CE1-CD1 4.41Å; F89-I92 WeakPolarHBondContact O-CB 3.34Å; F89-I92 PolarHBondContact O-N 3.49Å; F89-F93 PolarHBondContact O-N 3.29Å; F89-L138 HydrophobicContact CD2-CD2 3.9Å; F89-L138 HydrophobicContact CE2-CD2 3.18Å; F89-L138 HydrophobicContact CE2-CG 4.4Å; F89-L138 HydrophobicContact CZ-CB 4.12Å; F89-L138 HydrophobicContact CZ-CD2 3.59Å; F89-L138 HydrophobicContact CZ-CG 4.41Å; F89-L148 HydrophobicContact CB-CD2 3.78Å; F89-L148 HydrophobicContact CD1-CB 4.45Å; F89-L148 HydrophobicContact CD1-CD2 4Å; F89-L148 HydrophobicContact CG-CD2 3.89Å
90F81.4Confident77.6Confident46 Ų4655.8 Ų55.820%0.20228%0.276CS..Hα-helixtrans-51.8-34.9174.7-178.8-110000112.4W62 E79 V80 Y83 S88 I92 F93 L94W62-F90 HydrophobicContact CH2-CD2 4.45Å; W62-F90 HydrophobicContact CZ2-CD2 4.17Å; E79-F90 PolarHBondContact OE1-N 2.82Å; V80-F90 HydrophobicContact CG2-CD2 4.17Å; V80-F90 HydrophobicContact CG2-CE2 4.32Å; Y83-F90 HydrophobicContact CD2-CB 4.38Å; Y83-F90 AromaticContact CD2-CD1 3.88Å; Y83-F90 HydrophobicContact CD2-CD1 3.88Å; Y83-F90 HydrophobicContact CE2-CB 4.43Å; Y83-F90 AromaticContact CE2-CD1 3.9Å; Y83-F90 HydrophobicContact CE2-CD1 3.9Å; S88-F90 VanDerWaalsContact C-N 3.27Å; S88-F90 WeakPolarHBondContact OG-CB 3.4Å; S88-F90 PolarHBondContact OG-N 3.39Å; S88-F90 VanDerWaalsContact OG-N 3.15Å; F90-I92 VanDerWaalsContact C-N 3.32Å; F90-I92 PolarHBondContact O-N 3.44Å; F90-F93 HydrophobicContact CD2-CD1 4.28Å; F90-F93 HydrophobicContact CE2-CD1 4.15Å; F90-F93 PolarHBondContact O-N 3.21Å; F90-L94 HydrophobicContact CE1-CD1 3.67Å; F90-L94 HydrophobicContact CZ-CD1 3.76Å; F90-L94 VanDerWaalsContact O-CB 3.31Å; F90-L94 WeakPolarHBondContact O-CB 3.32Å; F90-L94 PolarHBondContact O-N 2.87Å
91D85.3Confident78.2Confident8 Ų855.2 Ų55.24%0.04328%0.278CS..Hα-helixtrans-62.8-34.6175.9-70.9-31.3000114.2Y83 Y85 F89 L95 F128 K132Y83-D91 VanDerWaalsContact CE2-OD1 3.27Å; Y83-D91 WeakPolarHBondContact CE2-OD1 3.24Å; Y83-D91 VanDerWaalsContact CZ-OD1 3.26Å; Y83-D91 PolarHBondContact OH-OD1 2.92Å; Y83-D91 PolarHBondContact OH-OD2 3.33Å; Y85-D91 VanDerWaalsContact CD2-OD2 3.3Å; Y85-D91 WeakPolarHBondContact CD2-OD2 3.44Å; Y85-D91 WeakPolarHBondContact CE2-OD2 3.3Å; F89-D91 PolarHBondContact O-N 2.81Å; F89-D91 VanDerWaalsContact O-N 3.11Å; D91-L95 WeakPolarHBondContact O-CB 3.35Å; D91-L95 PolarHBondContact O-N 3.41Å; D91-F128 HydrophobicContact CB-CE1 4.18Å; D91-F128 HydrophobicContact CB-CZ 4.26Å; D91-K132 HydrophobicContact CB-CD 4.21Å; D91-K132 IonicContact OD2-NZ 2.64Å; D91-K132 PolarHBondContact OD2-NZ 2.82Å
92I85.4Confident79.1Confident2 Ų249.5 Ų49.51%0.0125%0.25CS..Hα-helixtrans-71.6-41.9179.5-56.2-175.4000109.1V58 F89 F90 L95 A96 L129 L148 P149V58-I92 HydrophobicContact CG1-CG2 4.15Å; F89-I92 HydrophobicContact CD1-CD1 3.74Å; F89-I92 HydrophobicContact CE1-CD1 4.41Å; F89-I92 WeakPolarHBondContact O-CB 3.34Å; F89-I92 PolarHBondContact O-N 3.49Å; F90-I92 VanDerWaalsContact C-N 3.32Å; F90-I92 PolarHBondContact O-N 3.44Å; I92-L95 PolarHBondContact O-N 2.8Å; I92-A96 PolarHBondContact O-N 3.39Å; I92-L129 HydrophobicContact CG2-CD2 4.48Å; I92-L148 HydrophobicContact CD1-CB 4.4Å; I92-L148 HydrophobicContact CD1-CD2 4.36Å; I92-P149 HydrophobicContact CD1-CB 3.98Å; I92-P149 HydrophobicContact CD1-CG 4.23Å
93F86.8Confident80Confident44 Ų4442.5 Ų42.519%0.19322%0.218CC..Hα-helixtrans-62.2-48.1172.5169.8-102.7000111.5T59 W62 F89 F90 L95 A96 V97T59-F93 HydrophobicContact CG2-CD2 4.3Å; T59-F93 HydrophobicContact CG2-CE2 3.87Å; T59-F93 VanDerWaalsContact OG1-CE2 3.31Å; T59-F93 WeakPolarHBondContact OG1-CE2 3.37Å; W62-F93 HydrophobicContact CD2-CB 4.02Å; W62-F93 HydrophobicContact CD2-CG 4.23Å; W62-F93 HydrophobicContact CE3-CB 4.12Å; W62-F93 HydrophobicContact CE3-CD1 4.33Å; W62-F93 AromaticContact CE3-CD2 3.82Å; W62-F93 HydrophobicContact CE3-CD2 3.82Å; W62-F93 HydrophobicContact CE3-CE2 4.34Å; W62-F93 AromaticContact CE3-CG 3.81Å; W62-F93 HydrophobicContact CE3-CG 3.81Å; W62-F93 HydrophobicContact CG-CB 4.29Å; W62-F93 HydrophobicContact CH2-CD1 4.42Å; W62-F93 HydrophobicContact CZ3-CD1 4.09Å; W62-F93 HydrophobicContact CZ3-CD2 4.19Å; W62-F93 HydrophobicContact CZ3-CE1 4.29Å; W62-F93 HydrophobicContact CZ3-CE2 4.38Å; W62-F93 HydrophobicContact CZ3-CG 4.04Å; W62-F93 HydrophobicContact CZ3-CZ 4.43Å; F89-F93 PolarHBondContact O-N 3.29Å; F90-F93 HydrophobicContact CD2-CD1 4.28Å; F90-F93 HydrophobicContact CE2-CD1 4.15Å; F90-F93 PolarHBondContact O-N 3.21Å; F93-L95 VanDerWaalsContact C-N 3.28Å; F93-L95 PolarHBondContact O-N 2.9Å; F93-A96 WeakPolarHBondContact O-CB 3.32Å; F93-A96 PolarHBondContact O-N 3.37Å; F93-A96 VanDerWaalsContact O-N 3.07Å; F93-V97 HydrophobicContact CE1-CG2 4.04Å; F93-V97 HydrophobicContact CE2-CG2 4.05Å; F93-V97 HydrophobicContact CZ-CG2 3.77Å; F93-V97 WeakPolarHBondContact O-CG2 3.37Å; F93-V97 PolarHBondContact O-N 3.3Å
94L87.6Confident80.6Confident90 Ų9040.4 Ų40.447%0.47121%0.213SC..Hα-helixtrans-61.6-38.2178.5-166.9120000111.5F90 V97 F98F90-L94 HydrophobicContact CE1-CD1 3.67Å; F90-L94 HydrophobicContact CZ-CD1 3.76Å; F90-L94 VanDerWaalsContact O-CB 3.31Å; F90-L94 WeakPolarHBondContact O-CB 3.32Å; F90-L94 PolarHBondContact O-N 2.87Å; L94-V97 PolarHBondContact O-N 2.89Å; L94-F98 WeakPolarHBondContact O-CB 3.28Å; L94-F98 PolarHBondContact O-N 3.46Å
95L87.9Confident81.3Confident16 Ų1640.9 Ų40.98%0.08422%0.215CC..Hα-helixtrans-64.9-40.2173.3-171.774.9000112D91 I92 F93 V97 F98 R99 F128 L129D91-L95 WeakPolarHBondContact O-CB 3.35Å; D91-L95 PolarHBondContact O-N 3.41Å; I92-L95 PolarHBondContact O-N 2.8Å; F93-L95 VanDerWaalsContact C-N 3.28Å; F93-L95 PolarHBondContact O-N 2.9Å; L95-V97 VanDerWaalsContact C-N 3.34Å; L95-F98 HydrophobicContact CD1-CD1 4.37Å; L95-F98 PolarHBondContact O-N 2.97Å; L95-R99 VanDerWaalsContact O-CB 3.3Å; L95-R99 WeakPolarHBondContact O-CB 3.06Å; L95-R99 PolarHBondContact O-N 3.07Å; L95-F128 HydrophobicContact CD1-CB 4.4Å; L95-F128 HydrophobicContact CD1-CD1 3.83Å; L95-F128 HydrophobicContact CD1-CE1 4.41Å; L95-F128 HydrophobicContact CD1-CG 4.27Å; L95-F128 HydrophobicContact CD2-CD1 3.9Å; L95-F128 HydrophobicContact CG-CD1 4.31Å; L95-L129 HydrophobicContact CD2-CD1 4.12Å; L95-L129 HydrophobicContact CD2-CD2 3.36Å; L95-L129 HydrophobicContact CD2-CG 3.38Å
96A87.8Confident81.9Confident1 Ų138.4 Ų38.41%0.00821%0.208CC..Hα-helixtrans-63.1-40.5175.100000111.8V58 I92 F93 R99 F100V58-A96 HydrophobicContact CB-CB 3.89Å; V58-A96 HydrophobicContact CG1-CB 3.7Å; V58-A96 HydrophobicContact CG2-CB 4.19Å; I92-A96 PolarHBondContact O-N 3.39Å; F93-A96 WeakPolarHBondContact O-CB 3.32Å; F93-A96 PolarHBondContact O-N 3.37Å; F93-A96 VanDerWaalsContact O-N 3.07Å; A96-R99 PolarHBondContact O-N 3.36Å; A96-F100 WeakPolarHBondContact O-CB 3.43Å; A96-F100 PolarHBondContact O-N 2.84Å
97V88.5Confident82.5Confident60 Ų6038.3 Ų38.336%0.36421%0.205SC..Hα-helixtrans-63.4-45.7172.7176.10000111.4L55 F93 L94 L95 R99 F100 A101L55-V97 HydrophobicContact CD1-CG2 4.13Å; F93-V97 HydrophobicContact CE1-CG2 4.04Å; F93-V97 HydrophobicContact CE2-CG2 4.05Å; F93-V97 HydrophobicContact CZ-CG2 3.77Å; F93-V97 WeakPolarHBondContact O-CG2 3.37Å; F93-V97 PolarHBondContact O-N 3.3Å; L94-V97 PolarHBondContact O-N 2.89Å; L95-V97 VanDerWaalsContact C-N 3.34Å; V97-R99 VanDerWaalsContact C-N 3.33Å; V97-R99 PolarHBondContact O-N 3.23Å; V97-F100 PolarHBondContact O-N 3.02Å; V97-A101 WeakPolarHBondContact O-CB 3.28Å; V97-A101 PolarHBondContact O-N 3.12Å
98F88.3Confident82.9Confident105 Ų10539.9 Ų39.946%0.46122%0.218SC..Hα-helixtrans-59.8-44.7176.6171.7-99.2000111.5L94 L95 A101 A102L94-F98 WeakPolarHBondContact O-CB 3.28Å; L94-F98 PolarHBondContact O-N 3.46Å; L95-F98 HydrophobicContact CD1-CD1 4.37Å; L95-F98 PolarHBondContact O-N 2.97Å; F98-A101 PolarHBondContact O-N 3.47Å; F98-A102 WeakPolarHBondContact O-CB 3.38Å; F98-A102 PolarHBondContact O-N 2.95Å
99R86.6Confident82.8Confident8 Ų845.4 Ų45.43%0.0325%0.246CC..Hα-helixtrans-64.5-45.5177.8-175.4179.757.3162.6-21.9111.4D54 L95 A96 V97 A101 A102 L103 A156 E159D54-R99 VanDerWaalsContact CG-CZ 3.44Å; D54-R99 IonicContact OD1-CZ 3.26Å; D54-R99 VanDerWaalsContact OD1-CZ 3.26Å; D54-R99 IonicContact OD1-NH1 3.28Å; D54-R99 PolarHBondContact OD1-NH1 3.22Å; D54-R99 IonicContact OD1-NH2 2.62Å; D54-R99 PolarHBondContact OD1-NH2 3.06Å; D54-R99 IonicContact OD2-CZ 2.66Å; D54-R99 IonicContact OD2-NE 3.66Å; D54-R99 IonicContact OD2-NH1 2.64Å; D54-R99 IonicContact OD2-NH2 3.7Å; D54-R99 PolarHBondContact OD2-NH2 3.3Å; L95-R99 VanDerWaalsContact O-CB 3.3Å; L95-R99 WeakPolarHBondContact O-CB 3.06Å; L95-R99 PolarHBondContact O-N 3.07Å; A96-R99 PolarHBondContact O-N 3.36Å; V97-R99 VanDerWaalsContact C-N 3.33Å; V97-R99 PolarHBondContact O-N 3.23Å; R99-A101 VanDerWaalsContact C-N 3.31Å; R99-A101 PolarHBondContact O-N 2.95Å; R99-A102 PolarHBondContact O-N 2.94Å; R99-L103 HydrophobicContact CG-CD1 3.85Å; R99-L103 HydrophobicContact CG-CG 4.35Å; R99-L103 WeakPolarHBondContact O-CB 3.12Å; R99-L103 VanDerWaalsContact O-CG 3.23Å; R99-L103 WeakPolarHBondContact O-CG 3.33Å; R99-L103 PolarHBondContact O-N 3.09Å; R99-A156 VanDerWaalsContact NH1-N 3.13Å; R99-E159 WeakPolarHBondContact CD-OE2 3.19Å; R99-E159 IonicContact CZ-OE1 2.67Å; R99-E159 IonicContact CZ-OE2 3.07Å; R99-E159 IonicContact NE-OE2 3.12Å; R99-E159 PolarHBondContact NE-OE2 3.18Å; R99-E159 VanDerWaalsContact NE-OE2 3.12Å; R99-E159 IonicContact NH1-OE1 3.79Å; R99-E159 IonicContact NH1-OE2 2.63Å; R99-E159 PolarHBondContact NH1-OE2 3.23Å
100F87.9Confident82.2Confident62 Ų6247.6 Ų47.627%0.27226%0.261SS..Hα-helixtrans-54.1-49.2172.4174.4-95.5000111V51 T52 L55 A96 V97 A102 L103 I104V51-F100 HydrophobicContact CG1-CD2 3.39Å; V51-F100 HydrophobicContact CG1-CE2 3.52Å; V51-F100 HydrophobicContact CG1-CG 4.48Å; T52-F100 HydrophobicContact CG2-CE2 3.76Å; T52-F100 HydrophobicContact CG2-CZ 4.43Å; L55-F100 HydrophobicContact CB-CB 4.47Å; L55-F100 HydrophobicContact CB-CD2 4.34Å; L55-F100 HydrophobicContact CD1-CB 3.52Å; L55-F100 HydrophobicContact CD1-CD1 4.09Å; L55-F100 HydrophobicContact CD1-CD2 4.15Å; L55-F100 HydrophobicContact CD1-CG 3.66Å; A96-F100 WeakPolarHBondContact O-CB 3.43Å; A96-F100 PolarHBondContact O-N 2.84Å; V97-F100 PolarHBondContact O-N 3.02Å; F100-A102 PolarHBondContact O-N 3.27Å; F100-L103 PolarHBondContact O-N 3.39Å; F100-I104 HydrophobicContact CD1-CG1 4.41Å; F100-I104 HydrophobicContact CD2-CG1 4.48Å; F100-I104 HydrophobicContact CE1-CG1 4.04Å; F100-I104 HydrophobicContact CE2-CD1 4.32Å; F100-I104 HydrophobicContact CE2-CG1 4.09Å; F100-I104 HydrophobicContact CZ-CD1 4.28Å; F100-I104 HydrophobicContact CZ-CG1 3.86Å; F100-I104 VanDerWaalsContact O-CG1 3.27Å; F100-I104 WeakPolarHBondContact O-CG1 3.31Å; F100-I104 PolarHBondContact O-N 3.04Å
101A87.2Confident81.2Confident52 Ų5251.2 Ų51.243%0.4328%0.277SS..Hα-helixtrans-62.1-44.5177.800000112.3V97 F98 R99 L103 I104 L105V97-A101 WeakPolarHBondContact O-CB 3.28Å; V97-A101 PolarHBondContact O-N 3.12Å; F98-A101 PolarHBondContact O-N 3.47Å; R99-A101 VanDerWaalsContact C-N 3.31Å; R99-A101 PolarHBondContact O-N 2.95Å; A101-L103 VanDerWaalsContact C-N 3.32Å; A101-L103 PolarHBondContact O-N 3.49Å; A101-I104 PolarHBondContact O-N 3.43Å; A101-L105 WeakPolarHBondContact O-CB 3.44Å; A101-L105 PolarHBondContact O-N 2.94Å
102A83.5Confident79.7Confident16 Ų1653 Ų5313%0.13229%0.286CS..Hα-helixtrans-62.2-39.3178.500000112.1F98 R99 F100 L105 A106 T121F98-A102 WeakPolarHBondContact O-CB 3.38Å; F98-A102 PolarHBondContact O-N 2.95Å; R99-A102 PolarHBondContact O-N 2.94Å; F100-A102 PolarHBondContact O-N 3.27Å; A102-L105 PolarHBondContact O-N 3.17Å; A102-A106 VanDerWaalsContact O-CB 3.28Å; A102-A106 WeakPolarHBondContact O-CB 3.23Å; A102-A106 PolarHBondContact O-N 3.26Å; A102-T121 HydrophobicContact CB-CG2 4.33Å
103L83.1Confident78.4Confident4 Ų462.4 Ų62.42%0.02132%0.322CS..Hα-helixtrans-70.4-41.9178.3-70.9173.4000112.1F47 V51 R99 F100 A101 L105 Y107 V118 E159 L163F47-L103 HydrophobicContact CZ-CB 4.18Å; F47-L103 HydrophobicContact CZ-CD2 4.31Å; V51-L103 HydrophobicContact CG2-CB 3.92Å; V51-L103 HydrophobicContact CG2-CD1 3.4Å; V51-L103 VanDerWaalsContact CG2-CD1 3.4Å; V51-L103 HydrophobicContact CG2-CG 4.24Å; R99-L103 HydrophobicContact CG-CD1 3.85Å; R99-L103 HydrophobicContact CG-CG 4.35Å; R99-L103 WeakPolarHBondContact O-CB 3.12Å; R99-L103 VanDerWaalsContact O-CG 3.23Å; R99-L103 WeakPolarHBondContact O-CG 3.33Å; R99-L103 PolarHBondContact O-N 3.09Å; F100-L103 PolarHBondContact O-N 3.39Å; A101-L103 VanDerWaalsContact C-N 3.32Å; A101-L103 PolarHBondContact O-N 3.49Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-Y107 WeakPolarHBondContact O-CB 3.39Å; L103-Y107 PolarHBondContact O-N 3.4Å; L103-V118 HydrophobicContact CD2-CG1 4.18Å; L103-E159 WeakPolarHBondContact CD1-OE2 3.49Å; L103-L163 HydrophobicContact CD2-CD1 3.38Å
104I81.8Confident77.4Confident56 Ų5666.3 Ų66.329%0.28734%0.34SS..Hα-helixtrans-66.1-37.2172.7-63.7-62.2000111.1V51 F100 A101 Y107 A108V51-I104 HydrophobicContact CG1-CD1 4.2Å; F100-I104 HydrophobicContact CD1-CG1 4.41Å; F100-I104 HydrophobicContact CD2-CG1 4.48Å; F100-I104 HydrophobicContact CE1-CG1 4.04Å; F100-I104 HydrophobicContact CE2-CD1 4.32Å; F100-I104 HydrophobicContact CE2-CG1 4.09Å; F100-I104 HydrophobicContact CZ-CD1 4.28Å; F100-I104 HydrophobicContact CZ-CG1 3.86Å; F100-I104 VanDerWaalsContact O-CG1 3.27Å; F100-I104 WeakPolarHBondContact O-CG1 3.31Å; F100-I104 PolarHBondContact O-N 3.04Å; A101-I104 PolarHBondContact O-N 3.43Å; I104-Y107 WeakPolarHBondContact O-CB 3.43Å; I104-Y107 PolarHBondContact O-N 3.38Å; I104-A108 VanDerWaalsContact O-CB 3.31Å; I104-A108 WeakPolarHBondContact O-CB 3.15Å; I104-A108 PolarHBondContact O-N 2.74Å
105L81.3Confident76.6Confident98 Ų9867.2 Ų67.251%0.51334%0.337SS..Hα-helixtrans-69.3-42.6177.9-163.970.5000111.7A101 A102 L103 Y107 A108 I109A101-L105 WeakPolarHBondContact O-CB 3.44Å; A101-L105 PolarHBondContact O-N 2.94Å; A102-L105 PolarHBondContact O-N 3.17Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L105-Y107 PolarHBondContact O-N 3.27Å; L105-A108 PolarHBondContact O-N 3.11Å; L105-I109 HydrophobicContact CD1-CD1 3.24Å; L105-I109 HydrophobicContact CD1-CG1 3.81Å; L105-I109 HydrophobicContact CD2-CD1 4.46Å; L105-I109 HydrophobicContact CG-CD1 3.76Å; L105-I109 HydrophobicContact CG-CG1 4.2Å; L105-I109 WeakPolarHBondContact O-CB 3.36Å; L105-I109 PolarHBondContact O-N 3.48Å
106A75.7Confident75.8Confident15 Ų1575.3 Ų75.312%0.12437%0.367CS..Hα-helixtrans-60.7-38.4172.800000111.2A102 C110 V118A102-A106 VanDerWaalsContact O-CB 3.28Å; A102-A106 WeakPolarHBondContact O-CB 3.23Å; A102-A106 PolarHBondContact O-N 3.26Å; A106-C110 VanDerWaalsContact O-CB 3.31Å; A106-C110 WeakPolarHBondContact O-CB 3.29Å; A106-C110 PolarHBondContact O-N 2.99Å; A106-V118 HydrophobicContact CB-CG2 3.73Å
107Y73.3Confident75.2Confident75 Ų7577 Ų7729%0.29438%0.381SS..Hα-helixtrans-65.1-47.6173.4176.2-97.7000112.6R44 L103 I104 L105R44-Y107 HydrophobicContact CB-CE2 4.29Å; R44-Y107 HydrophobicContact CG-CE2 3.96Å; L103-Y107 WeakPolarHBondContact O-CB 3.39Å; L103-Y107 PolarHBondContact O-N 3.4Å; I104-Y107 WeakPolarHBondContact O-CB 3.43Å; I104-Y107 PolarHBondContact O-N 3.38Å; L105-Y107 PolarHBondContact O-N 3.27Å
108A72.7Confident74.6Confident74 Ų7475.1 Ų75.161%0.61237%0.369SS*.Hα-helixtrans-77.6-42.9-173.400000113.8I104 L105I104-A108 VanDerWaalsContact O-CB 3.31Å; I104-A108 WeakPolarHBondContact O-CB 3.15Å; I104-A108 PolarHBondContact O-N 2.74Å; L105-A108 PolarHBondContact O-N 3.11Å
109I70.8Confident74.2Confident120 Ų12071.8 Ų71.862%0.61536%0.361SS*.Hα-helixtrans-96.7-44.4-172-58.9-171.3000111.6L105 K111L105-I109 HydrophobicContact CD1-CD1 3.24Å; L105-I109 HydrophobicContact CD1-CG1 3.81Å; L105-I109 HydrophobicContact CD2-CD1 4.46Å; L105-I109 HydrophobicContact CG-CD1 3.76Å; L105-I109 HydrophobicContact CG-CG1 4.2Å; L105-I109 WeakPolarHBondContact O-CB 3.36Å; L105-I109 PolarHBondContact O-N 3.48Å; I109-K111 VanDerWaalsContact C-N 3.33Å; I109-K111 PolarHBondContact O-N 3.28Å
110C63.2Low74Confident47 Ų4775.8 Ų75.832%0.31838%0.382SS..SBendtrans-86.1-4.7-169.1-61.70000113.7A106 L112 R113A106-C110 VanDerWaalsContact O-CB 3.31Å; A106-C110 WeakPolarHBondContact O-CB 3.29Å; A106-C110 PolarHBondContact O-N 2.99Å; C110-L112 PolarHBondContact O-N 2.63Å; C110-R113 PolarHBondContact O-N 2.62Å
111K61.6Low73.7Confident122 Ų12274.8 Ų74.853%0.5338%0.381SS..THydrogen-bonded Turntrans36.647.3179.3-155.1-160-179.2-140.50111.6I109 R113 E175I109-K111 VanDerWaalsContact C-N 3.33Å; I109-K111 PolarHBondContact O-N 3.28Å; K111-R113 PolarHBondContact O-N 3.46Å; K111-E175 IonicContact NZ-OE1 3.67Å; K111-E175 PolarHBondContact NZ-OE1 3.28Å
112L53.9Low73.4Confident46 Ų4672.6 Ų72.624%0.24136%0.363CS..THydrogen-bonded Turntrans50.63.5-176.4-60.1114000117.9C110 H114 V167 L168 E171C110-L112 PolarHBondContact O-N 2.63Å; L112-H114 VanDerWaalsContact C-N 3.27Å; L112-H114 PolarHBondContact O-N 2.93Å; L112-V167 HydrophobicContact CD2-CG1 3.51Å; L112-L168 HydrophobicContact CB-CD2 4.46Å; L112-L168 HydrophobicContact CD2-CD2 4.21Å; L112-E171 VanDerWaalsContact CD1-CD 3.47Å; L112-E171 WeakPolarHBondContact CD1-OE2 3.42Å; L112-E171 WeakPolarHBondContact CD2-OE2 3.21Å
113R56.8Low73.5Confident200 Ų20074.7 Ų74.776%0.75538%0.38SS*.  trans-73.8-19.9-167.8-167145.160.5106.5-0.5113.5C110 K111C110-R113 PolarHBondContact O-N 2.62Å; K111-R113 PolarHBondContact O-N 3.46Å
114H66.7Low73.6Confident125 Ų12578.7 Ų78.758%0.57941%0.405SS*.  trans-123.288.2174.4-68.2-61000110.6L112 W116 A117L112-H114 VanDerWaalsContact C-N 3.27Å; L112-H114 PolarHBondContact O-N 2.93Å; H114-W116 PolarHBondContact O-N 2.91Å; H114-A117 PolarHBondContact O-N 3.47Å; H114-A117 VanDerWaalsContact O-N 3.09Å
115W69.4Low73.8Confident110 Ų11076.2 Ų76.242%0.41739%0.392SS..Hα-helixtrans-51.9-35.2173.5176.547000113.2A117 V118 A119 D164 L168W115-A117 VanDerWaalsContact C-N 3.26Å; W115-A117 PolarHBondContact O-N 2.84Å; W115-V118 PolarHBondContact O-N 3.26Å; W115-A119 PolarHBondContact O-N 2.94Å; W115-D164 HydrophobicContact CZ2-CB 4.42Å; W115-D164 WeakPolarHBondContact CZ2-OD1 2.8Å; W115-D164 WeakPolarHBondContact CZ2-OD2 3.37Å; W115-D164 PolarHBondContact NE1-OD1 3.48Å; W115-L168 HydrophobicContact CB-CD1 4.35Å; W115-L168 HydrophobicContact CB-CD2 4.13Å; W115-L168 HydrophobicContact CD2-CD1 4.4Å; W115-L168 HydrophobicContact CG-CD1 3.68Å; W115-L168 HydrophobicContact CG-CD2 4.35Å
116W72.8Confident73.9Confident185 Ų18572.3 Ų72.370%0.70137%0.373SS*.Hα-helixtrans-59.4-30.6178.3-9270.8000114.3H114 V118 A119 I120H114-W116 PolarHBondContact O-N 2.91Å; W116-V118 VanDerWaalsContact C-N 3.35Å; W116-V118 PolarHBondContact O-N 3.2Å; W116-A119 PolarHBondContact O-N 3.08Å; W116-I120 HydrophobicContact CE3-CD1 4.19Å; W116-I120 HydrophobicContact CE3-CG1 4.41Å; W116-I120 WeakPolarHBondContact O-CB 2.88Å; W116-I120 WeakPolarHBondContact O-CD1 3.42Å; W116-I120 WeakPolarHBondContact O-CG1 3.4Å; W116-I120 PolarHBondContact O-N 2.86Å
117A74.4Confident74.5Confident36 Ų3674 Ų7430%0.29839%0.387SS..Hα-helixtrans-65.3-42.1179.900000111.3H114 W115 I120 T121H114-A117 PolarHBondContact O-N 3.47Å; H114-A117 VanDerWaalsContact O-N 3.09Å; W115-A117 VanDerWaalsContact C-N 3.26Å; W115-A117 PolarHBondContact O-N 2.84Å; A117-I120 PolarHBondContact O-N 3.21Å; A117-T121 PolarHBondContact O-N 3.4Å; A117-T121 PolarHBondContact O-OG1 3.21Å
118V75.6Confident75.1Confident21 Ų2173.8 Ų73.813%0.12739%0.388CS..Hα-helixtrans-64.8-47.8176.6178.80000110L103 A106 W115 W116 I120 T121 T122 L163L103-V118 HydrophobicContact CD2-CG1 4.18Å; A106-V118 HydrophobicContact CB-CG2 3.73Å; W115-V118 PolarHBondContact O-N 3.26Å; W116-V118 VanDerWaalsContact C-N 3.35Å; W116-V118 PolarHBondContact O-N 3.2Å; V118-I120 VanDerWaalsContact C-N 3.32Å; V118-I120 PolarHBondContact O-N 2.82Å; V118-T121 WeakPolarHBondContact CA-OG1 3.46Å; V118-T121 PolarHBondContact O-N 2.81Å; V118-T121 PolarHBondContact O-OG1 2.94Å; V118-T122 PolarHBondContact O-N 3.25Å; V118-T122 PolarHBondContact O-OG1 2.93Å; V118-T122 VanDerWaalsContact O-OG1 3.06Å; V118-L163 HydrophobicContact CG1-CD1 3.5Å; V118-L163 VanDerWaalsContact CG1-CD1 3.5Å; V118-L163 HydrophobicContact CG1-CG 4.43Å
119A80Confident75.7Confident35 Ų3570.5 Ų70.529%0.28936%0.36SS..Hα-helixtrans-58.3-42.2178.200000112.4W115 W116 T122 A123W115-A119 PolarHBondContact O-N 2.94Å; W116-A119 PolarHBondContact O-N 3.08Å; A119-T122 PolarHBondContact O-N 2.89Å; A119-A123 VanDerWaalsContact O-CB 3.25Å; A119-A123 WeakPolarHBondContact O-CB 3.42Å; A119-A123 PolarHBondContact O-N 3.43Å
120I81.8Confident76.4Confident92 Ų9268.9 Ų68.947%0.47235%0.351SS..Hα-helixtrans-65.1-48.1177.5-69.2163.8000110.8W116 A117 V118 T122 A123 V124W116-I120 HydrophobicContact CE3-CD1 4.19Å; W116-I120 HydrophobicContact CE3-CG1 4.41Å; W116-I120 WeakPolarHBondContact O-CB 2.88Å; W116-I120 WeakPolarHBondContact O-CD1 3.42Å; W116-I120 WeakPolarHBondContact O-CG1 3.4Å; W116-I120 PolarHBondContact O-N 2.86Å; A117-I120 PolarHBondContact O-N 3.21Å; V118-I120 VanDerWaalsContact C-N 3.32Å; V118-I120 PolarHBondContact O-N 2.82Å; I120-T122 VanDerWaalsContact C-N 3.28Å; I120-T122 PolarHBondContact O-N 3.28Å; I120-A123 PolarHBondContact O-N 2.83Å; I120-V124 HydrophobicContact CG2-CG2 4.38Å; I120-V124 WeakPolarHBondContact O-CG2 3.3Å; I120-V124 PolarHBondContact O-N 3.41Å
121T81.9Confident77.4Confident42 Ų4270 Ų7026%0.25836%0.357SS..Hα-helixtrans-62.1-36.6179.943.60000112.3A102 A117 V118 S125A102-T121 HydrophobicContact CB-CG2 4.33Å; A117-T121 PolarHBondContact O-N 3.4Å; A117-T121 PolarHBondContact O-OG1 3.21Å; V118-T121 WeakPolarHBondContact CA-OG1 3.46Å; V118-T121 PolarHBondContact O-N 2.81Å; V118-T121 PolarHBondContact O-OG1 2.94Å; T121-S125 WeakPolarHBondContact O-CB 3.38Å; T121-S125 PolarHBondContact O-N 3.4Å; T121-S125 VanDerWaalsContact O-N 3.09Å; T121-S125 PolarHBondContact O-OG 3.33Å
122T82.1Confident78.5Confident6 Ų664.3 Ų64.34%0.03733%0.332CS..Hα-helixtrans-73.1-40.4174.5-44.30000111.9V118 A119 I120 V124 S125 C126 T160V118-T122 PolarHBondContact O-N 3.25Å; V118-T122 PolarHBondContact O-OG1 2.93Å; V118-T122 VanDerWaalsContact O-OG1 3.06Å; A119-T122 PolarHBondContact O-N 2.89Å; I120-T122 VanDerWaalsContact C-N 3.28Å; I120-T122 PolarHBondContact O-N 3.28Å; T122-V124 VanDerWaalsContact C-N 3.31Å; T122-V124 PolarHBondContact O-N 2.97Å; T122-S125 PolarHBondContact O-N 3.36Å; T122-S125 VanDerWaalsContact O-N 3.14Å; T122-C126 WeakPolarHBondContact O-CB 3.35Å; T122-C126 PolarHBondContact O-N 2.77Å; T122-C126 PolarHBondContact O-SG 2.55Å; T122-C126 VanDerWaalsContact O-SG 3.41Å; T122-T160 WeakPolarHBondContact CG2-OG1 3.34Å
123A85.1Confident79.8Confident60 Ų6064.8 Ų64.850%0.49634%0.337SS..Hα-helixtrans-59.5-42.8176.900000111.8A119 I120 C126 A127A119-A123 VanDerWaalsContact O-CB 3.25Å; A119-A123 WeakPolarHBondContact O-CB 3.42Å; A119-A123 PolarHBondContact O-N 3.43Å; I120-A123 PolarHBondContact O-N 2.83Å; A123-C126 PolarHBondContact O-N 2.94Å; A123-A127 WeakPolarHBondContact O-CB 3.2Å; A123-A127 PolarHBondContact O-N 2.88Å
124V85.6Confident80.9Confident88 Ų8861.6 Ų61.653%0.53333%0.333SS..Hα-helixtrans-62.7-44.1174.5172.40000110.9I120 T122 A127 F128I120-V124 HydrophobicContact CG2-CG2 4.38Å; I120-V124 WeakPolarHBondContact O-CG2 3.3Å; I120-V124 PolarHBondContact O-N 3.41Å; T122-V124 VanDerWaalsContact C-N 3.31Å; T122-V124 PolarHBondContact O-N 2.97Å; V124-A127 PolarHBondContact O-N 2.97Å; V124-F128 WeakPolarHBondContact O-CB 3.48Å; V124-F128 PolarHBondContact O-N 3.35Å
125S84.9Confident81.2Confident3 Ų359.2 Ų59.22%0.02132%0.324CS..Hα-helixtrans-64.8-41.4178.4-56.10000112.1T121 T122 F128 L129T121-S125 WeakPolarHBondContact O-CB 3.38Å; T121-S125 PolarHBondContact O-N 3.4Å; T121-S125 VanDerWaalsContact O-N 3.09Å; T121-S125 PolarHBondContact O-OG 3.33Å; T122-S125 PolarHBondContact O-N 3.36Å; T122-S125 VanDerWaalsContact O-N 3.14Å; S125-F128 PolarHBondContact O-N 3.07Å; S125-L129 PolarHBondContact O-N 3.46Å
126C84.4Confident81.3Confident16 Ų1654.5 Ų54.511%0.10831%0.308CS..Hα-helixtrans-64.3-44.2174.8-75.80000112T122 A123 F128 L129 I130T122-C126 WeakPolarHBondContact O-CB 3.35Å; T122-C126 PolarHBondContact O-N 2.77Å; T122-C126 PolarHBondContact O-SG 2.55Å; T122-C126 VanDerWaalsContact O-SG 3.41Å; A123-C126 PolarHBondContact O-N 2.94Å; C126-F128 VanDerWaalsContact C-N 3.29Å; C126-F128 PolarHBondContact O-N 3.34Å; C126-L129 PolarHBondContact O-N 2.91Å; C126-I130 VanDerWaalsContact O-CG1 3.3Å; C126-I130 WeakPolarHBondContact O-CG1 3.29Å; C126-I130 PolarHBondContact O-N 2.62Å
127A88.1Confident80.9Confident52 Ų5253.5 Ų53.543%0.4331%0.309SS..Hα-helixtrans-60.3-42.2175.900000111.2A123 V124 I130 V131A123-A127 WeakPolarHBondContact O-CB 3.2Å; A123-A127 PolarHBondContact O-N 2.88Å; V124-A127 PolarHBondContact O-N 2.97Å; A127-I130 PolarHBondContact O-N 3.47Å; A127-V131 WeakPolarHBondContact O-CG2 3.31Å; A127-V131 PolarHBondContact O-N 2.82Å
128F86.2Confident80.3Confident70 Ų7053.6 Ų53.631%0.30730%0.304SS..Hα-helixtrans-61.2-44.4174.6-176.1-89.6000112.1Y85 D91 L95 V124 S125 C126 I130 V131 K132Y85-F128 HydrophobicContact CE2-CZ 4.32Å; D91-F128 HydrophobicContact CB-CE1 4.18Å; D91-F128 HydrophobicContact CB-CZ 4.26Å; L95-F128 HydrophobicContact CD1-CB 4.4Å; L95-F128 HydrophobicContact CD1-CD1 3.83Å; L95-F128 HydrophobicContact CD1-CE1 4.41Å; L95-F128 HydrophobicContact CD1-CG 4.27Å; L95-F128 HydrophobicContact CD2-CD1 3.9Å; L95-F128 HydrophobicContact CG-CD1 4.31Å; V124-F128 WeakPolarHBondContact O-CB 3.48Å; V124-F128 PolarHBondContact O-N 3.35Å; S125-F128 PolarHBondContact O-N 3.07Å; C126-F128 VanDerWaalsContact C-N 3.29Å; C126-F128 PolarHBondContact O-N 3.34Å; F128-I130 VanDerWaalsContact C-N 3.35Å; F128-I130 PolarHBondContact O-N 2.81Å; F128-V131 PolarHBondContact O-N 3.32Å; F128-K132 VanDerWaalsContact O-CB 3.28Å; F128-K132 WeakPolarHBondContact O-CB 3.41Å; F128-K132 PolarHBondContact O-N 2.85Å
129L85.1Confident79.5Confident4 Ų453.5 Ų53.52%0.02130%0.303CS..Hα-helixtrans-60.3-42.5174.9-76-177.1000112.5I92 L95 S125 C126 K132 V133 F153I92-L129 HydrophobicContact CG2-CD2 4.48Å; L95-L129 HydrophobicContact CD2-CD1 4.12Å; L95-L129 HydrophobicContact CD2-CD2 3.36Å; L95-L129 HydrophobicContact CD2-CG 3.38Å; S125-L129 PolarHBondContact O-N 3.46Å; C126-L129 PolarHBondContact O-N 2.91Å; L129-K132 PolarHBondContact O-N 3.33Å; L129-V133 WeakPolarHBondContact O-CB 3.21Å; L129-V133 VanDerWaalsContact O-CG2 3.23Å; L129-V133 WeakPolarHBondContact O-CG2 3.4Å; L129-V133 PolarHBondContact O-N 3.24Å; L129-F153 HydrophobicContact CD1-CB 4.23Å
130I84.8Confident78.6Confident86 Ų8659 Ų5944%0.44133%0.327SS..Hα-helixtrans-62-47.9179-68.2163.9000110.4C126 A127 F128 K132 V133 I134 F153C126-I130 VanDerWaalsContact O-CG1 3.3Å; C126-I130 WeakPolarHBondContact O-CG1 3.29Å; C126-I130 PolarHBondContact O-N 2.62Å; A127-I130 PolarHBondContact O-N 3.47Å; F128-I130 VanDerWaalsContact C-N 3.35Å; F128-I130 PolarHBondContact O-N 2.81Å; I130-K132 VanDerWaalsContact C-N 3.32Å; I130-K132 PolarHBondContact O-N 3.37Å; I130-V133 PolarHBondContact O-N 3.38Å; I130-I134 HydrophobicContact CG2-CD1 3.83Å; I130-I134 VanDerWaalsContact O-CG1 3.29Å; I130-I134 WeakPolarHBondContact O-CG1 3.36Å; I130-I134 PolarHBondContact O-N 2.92Å; I130-F153 HydrophobicContact CG1-CE2 4.5Å
131V84.9Confident77.8Confident71 Ų7162.6 Ų62.643%0.4334%0.341SS..Hα-helixtrans-60-45.8177.4171.30000110.6A127 F128 V133 I134 L135A127-V131 WeakPolarHBondContact O-CG2 3.31Å; A127-V131 PolarHBondContact O-N 2.82Å; F128-V131 PolarHBondContact O-N 3.32Å; V131-V133 PolarHBondContact O-N 3.03Å; V131-I134 PolarHBondContact O-N 3.3Å; V131-L135 HydrophobicContact CG1-CD1 3.73Å; V131-L135 HydrophobicContact CG1-CG 4.45Å; V131-L135 WeakPolarHBondContact O-CB 2.9Å; V131-L135 WeakPolarHBondContact O-CG 3.47Å; V131-L135 PolarHBondContact O-N 2.99Å
132K83.3Confident77.1Confident2 Ų262.2 Ų62.21%0.00935%0.346CS..Hα-helixtrans-61.5-45.3178.1-177.370.2179.9-173.20111.7Y85 S88 D91 F128 L129 I130 I134 L135 S136Y85-K132 HydrophobicContact CE1-CD 4.46Å; Y85-K132 PolarHBondContact O-NZ 3.46Å; S88-K132 WeakPolarHBondContact O-CE 3.31Å; S88-K132 PolarHBondContact O-NZ 3.38Å; D91-K132 HydrophobicContact CB-CD 4.21Å; D91-K132 IonicContact OD2-NZ 2.64Å; D91-K132 PolarHBondContact OD2-NZ 2.82Å; F128-K132 VanDerWaalsContact O-CB 3.28Å; F128-K132 WeakPolarHBondContact O-CB 3.41Å; F128-K132 PolarHBondContact O-N 2.85Å; L129-K132 PolarHBondContact O-N 3.33Å; I130-K132 VanDerWaalsContact C-N 3.32Å; I130-K132 PolarHBondContact O-N 3.37Å; K132-I134 VanDerWaalsContact C-N 3.32Å; K132-I134 PolarHBondContact O-N 2.88Å; K132-L135 PolarHBondContact O-N 3.37Å; K132-S136 WeakPolarHBondContact CE-OG 3.34Å; K132-S136 VanDerWaalsContact O-CB 3.24Å; K132-S136 WeakPolarHBondContact O-CB 3.49Å; K132-S136 PolarHBondContact O-N 2.82Å; K132-S136 PolarHBondContact O-OG 2.86Å
133V82.3Confident76.5Confident56 Ų5666 Ų6634%0.33938%0.378SS..Hα-helixtrans-58.1-43.5176.7164.60000111.4L129 I130 V131 L139 P149L129-V133 WeakPolarHBondContact O-CB 3.21Å; L129-V133 VanDerWaalsContact O-CG2 3.23Å; L129-V133 WeakPolarHBondContact O-CG2 3.4Å; L129-V133 PolarHBondContact O-N 3.24Å; I130-V133 PolarHBondContact O-N 3.38Å; V131-V133 PolarHBondContact O-N 3.03Å; V133-L139 HydrophobicContact CG1-CD1 4.05Å; V133-L139 WeakPolarHBondContact O-CD1 3.27Å; V133-P149 HydrophobicContact CG2-CB 3.47Å; V133-P149 VanDerWaalsContact CG2-CB 3.47Å; V133-P149 HydrophobicContact CG2-CG 4.31Å
134I79.6Confident75.8Confident133 Ų13367.2 Ų67.268%0.68237%0.372SS*.Hα-helixtrans-69.6-34.4-179.6-64.9165.1000111.7I130 V131 K132I130-I134 HydrophobicContact CG2-CD1 3.83Å; I130-I134 VanDerWaalsContact O-CG1 3.29Å; I130-I134 WeakPolarHBondContact O-CG1 3.36Å; I130-I134 PolarHBondContact O-N 2.92Å; V131-I134 PolarHBondContact O-N 3.3Å; K132-I134 VanDerWaalsContact C-N 3.32Å; K132-I134 PolarHBondContact O-N 2.88Å
135L73.5Confident75.4Confident75 Ų7563.3 Ų63.339%0.39335%0.35SS..Hα-helixtrans-90-16.5-175.5-68.3178.2000114.5Y85 H86 V131 K132 K137Y85-L135 HydrophobicContact CE1-CD1 3.97Å; H86-L135 PolarHBondContact ND1-O 3.42Å; V131-L135 HydrophobicContact CG1-CD1 3.73Å; V131-L135 HydrophobicContact CG1-CG 4.45Å; V131-L135 WeakPolarHBondContact O-CB 2.9Å; V131-L135 WeakPolarHBondContact O-CG 3.47Å; V131-L135 PolarHBondContact O-N 2.99Å; K132-L135 PolarHBondContact O-N 3.37Å; L135-K137 PolarHBondContact O-N 2.89Å
136S70.4Confident75.1Confident11 Ų1167.9 Ų67.98%0.07737%0.367CS..  trans-78.2108.9-173.7-65.90000110.8K132 L138 L139K132-S136 WeakPolarHBondContact CE-OG 3.34Å; K132-S136 VanDerWaalsContact O-CB 3.24Å; K132-S136 WeakPolarHBondContact O-CB 3.49Å; K132-S136 PolarHBondContact O-N 2.82Å; K132-S136 PolarHBondContact O-OG 2.86Å; S136-L138 PolarHBondContact O-N 3.3Å; S136-L139 WeakPolarHBondContact O-CG 3.27Å; S136-L139 PolarHBondContact O-N 3.36Å
137K65.8Low75Confident164 Ų16470.5 Ų70.571%0.71338%0.38SS*.G310 helixtrans-69.2-20.8173.8-70.4-170.6178.3174.60112.1H86 L135 L139 L140H86-K137 PolarHBondContact O-N 3.44Å; H86-K137 VanDerWaalsContact O-N 3.17Å; L135-K137 PolarHBondContact O-N 2.89Å; K137-L139 PolarHBondContact O-N 2.93Å; K137-L140 PolarHBondContact O-N 3.47Å; K137-L140 VanDerWaalsContact O-N 3.09Å
138L60.8Low74.7Confident38 Ų3868.1 Ų68.120%0.19936%0.36CS..G310 helixtrans-66.4-17.1179.8-131.285.3000114A87 F89 S136 L140 Q141A87-L138 HydrophobicContact CB-CD1 3.71Å; A87-L138 VanDerWaalsContact O-CD1 3.31Å; A87-L138 WeakPolarHBondContact O-CD1 3.17Å; A87-L138 VanDerWaalsContact O-CD2 3.29Å; A87-L138 WeakPolarHBondContact O-CD2 3.47Å; F89-L138 HydrophobicContact CD2-CD2 3.9Å; F89-L138 HydrophobicContact CE2-CD2 3.18Å; F89-L138 HydrophobicContact CE2-CG 4.4Å; F89-L138 HydrophobicContact CZ-CB 4.12Å; F89-L138 HydrophobicContact CZ-CD2 3.59Å; F89-L138 HydrophobicContact CZ-CG 4.41Å; S136-L138 PolarHBondContact O-N 3.3Å; L138-L140 PolarHBondContact O-N 3.14Å; L138-Q141 PolarHBondContact O-N 2.95Å; L138-Q141 VanDerWaalsContact O-N 3.17Å
139L59.7Low74.5Confident20 Ų2065 Ų6511%0.10535%0.347CS..G310 helixtrans-55.3-42.7169.4-67.2-168000110.7V133 S136 K137 Q141 G145 Y146 P149V133-L139 HydrophobicContact CG1-CD1 4.05Å; V133-L139 WeakPolarHBondContact O-CD1 3.27Å; S136-L139 WeakPolarHBondContact O-CG 3.27Å; S136-L139 PolarHBondContact O-N 3.36Å; K137-L139 PolarHBondContact O-N 2.93Å; L139-Q141 PolarHBondContact O-N 2.8Å; L139-Q141 VanDerWaalsContact O-N 3.09Å; L139-G145 WeakPolarHBondContact CD2-O 3.44Å; L139-Y146 VanDerWaalsContact C-CZ 3.41Å; L139-Y146 HydrophobicContact CB-CD1 3.91Å; L139-Y146 HydrophobicContact CB-CE1 3.57Å; L139-Y146 HydrophobicContact CD1-CD1 4.33Å; L139-Y146 HydrophobicContact CD1-CE1 4.46Å; L139-Y146 HydrophobicContact CD2-CD1 3.96Å; L139-Y146 HydrophobicContact CD2-CG 4.42Å; L139-Y146 HydrophobicContact CG-CD1 4.29Å; L139-Y146 HydrophobicContact CG-CE1 4.39Å; L139-Y146 WeakPolarHBondContact O-CE1 3.23Å; L139-Y146 WeakPolarHBondContact O-CE2 3.25Å; L139-Y146 PolarHBondContact O-OH 3.46Å; L139-P149 HydrophobicContact CD2-CG 3.74Å
140L60.4Low74.5Confident151 Ų15169.3 Ų69.379%0.79137%0.369SS*.G310 helixtrans-69.5-10.7-177.7-84.584.1000114.6K137 L138K137-L140 PolarHBondContact O-N 3.47Å; K137-L140 VanDerWaalsContact O-N 3.09Å; L138-L140 PolarHBondContact O-N 3.14Å
141Q64.3Low74.6Confident166 Ų16666.4 Ų66.478%0.77636%0.355SS*.G310 helixtrans-94.3-11.2-167.1-159.3133.4-22.800114.4L138 L139L138-Q141 PolarHBondContact O-N 2.95Å; L138-Q141 VanDerWaalsContact O-N 3.17Å; L139-Q141 PolarHBondContact O-N 2.8Å; L139-Q141 VanDerWaalsContact O-N 3.09Å
142G67.9Low74.6Confident34 Ų3463.1 Ų63.135%0.35134%0.335SS..  trans177.3161.3175.100000115.4F144 G145 Y146G142-F144 VanDerWaalsContact C-N 3.29Å; G142-F144 PolarHBondContact O-N 2.92Å; G142-G145 PolarHBondContact O-N 3.41Å; G142-Y146 VanDerWaalsContact O-CD2 3.31Å; G142-Y146 WeakPolarHBondContact O-CD2 3.31Å
143A69.2Low74.7Confident87 Ų8766.6 Ų66.672%0.71935%0.35SS*.Hα-helixtrans-61.1-33.8-17800000113.5G145A143-G145 VanDerWaalsContact C-N 3.3Å; A143-G145 PolarHBondContact O-N 2.97Å
144F71.6Confident74.9Confident85 Ų8568 Ų6837%0.37336%0.355SS..Hα-helixtrans-72.2-22.7176.4-101.3-89.8000113.4I64 G142 Y146 L147 L148I64-F144 HydrophobicContact CG2-CD1 4.45Å; I64-F144 HydrophobicContact CG2-CE1 3.85Å; I64-F144 HydrophobicContact CG2-CZ 4.3Å; G142-F144 VanDerWaalsContact C-N 3.29Å; G142-F144 PolarHBondContact O-N 2.92Å; F144-Y146 VanDerWaalsContact C-N 3.3Å; F144-Y146 PolarHBondContact O-N 3.39Å; F144-L147 HydrophobicContact CD1-CD2 3.99Å; F144-L147 HydrophobicContact CE1-CD2 3.76Å; F144-L147 HydrophobicContact CZ-CD2 4.25Å; F144-L147 PolarHBondContact O-N 2.89Å; F144-L148 PolarHBondContact O-N 2.95Å
145G75.4Confident75.1Confident6 Ų662.3 Ų62.36%0.06233%0.326CS..Hα-helixtrans-67.6-30.3178.500000113.2L139 G142 A143 P149L139-G145 WeakPolarHBondContact CD2-O 3.44Å; G142-G145 PolarHBondContact O-N 3.41Å; A143-G145 VanDerWaalsContact C-N 3.3Å; A143-G145 PolarHBondContact O-N 2.97Å; G145-P149 WeakPolarHBondContact O-CD 3.47Å; G145-P149 WeakPolarHBondContact O-CG 3.15Å
146Y78.7Confident75.5Confident98 Ų9858.9 Ų58.938%0.38431%0.308SS..Hα-helixtrans-79.5-29.6172.3-55-85.6000112.7L139 G142 F144 P149 I150L139-Y146 VanDerWaalsContact C-CZ 3.41Å; L139-Y146 HydrophobicContact CB-CD1 3.91Å; L139-Y146 HydrophobicContact CB-CE1 3.57Å; L139-Y146 HydrophobicContact CD1-CD1 4.33Å; L139-Y146 HydrophobicContact CD1-CE1 4.46Å; L139-Y146 HydrophobicContact CD2-CD1 3.96Å; L139-Y146 HydrophobicContact CD2-CG 4.42Å; L139-Y146 HydrophobicContact CG-CD1 4.29Å; L139-Y146 HydrophobicContact CG-CE1 4.39Å; L139-Y146 WeakPolarHBondContact O-CE1 3.23Å; L139-Y146 WeakPolarHBondContact O-CE2 3.25Å; L139-Y146 PolarHBondContact O-OH 3.46Å; G142-Y146 VanDerWaalsContact O-CD2 3.31Å; G142-Y146 WeakPolarHBondContact O-CD2 3.31Å; F144-Y146 VanDerWaalsContact C-N 3.3Å; F144-Y146 PolarHBondContact O-N 3.39Å; Y146-P149 WeakPolarHBondContact O-CD 3.26Å; Y146-I150 WeakPolarHBondContact O-CB 3.34Å; Y146-I150 VanDerWaalsContact O-CD1 3.28Å; Y146-I150 WeakPolarHBondContact O-CD1 3.39Å; Y146-I150 WeakPolarHBondContact O-CG1 3.16Å; Y146-I150 PolarHBondContact O-N 3.3Å; Y146-I150 VanDerWaalsContact O-N 3.16Å
147L83.5Confident76Confident71 Ų7165.9 Ų65.937%0.37233%0.333SS..Hα-helixtrans-66.1-44.5-173.5-169.865.6000111.6L61 F144 V151L61-L147 HydrophobicContact CD2-CD2 4.41Å; F144-L147 HydrophobicContact CD1-CD2 3.99Å; F144-L147 HydrophobicContact CE1-CD2 3.76Å; F144-L147 HydrophobicContact CZ-CD2 4.25Å; F144-L147 PolarHBondContact O-N 2.89Å; L147-V151 HydrophobicContact CD1-CG2 3.86Å; L147-V151 HydrophobicContact CG-CG2 4.11Å; L147-V151 WeakPolarHBondContact O-CB 3.22Å; L147-V151 WeakPolarHBondContact O-CG2 3.3Å; L147-V151 PolarHBondContact O-N 2.84Å
148L82.2Confident76.8Confident3 Ų361.3 Ų61.32%0.01632%0.316CS..Hα-helixtrans-54-58.1177.8-115.993.2000113.1L61 W62 E65 F89 I92 F144 S152L61-L148 HydrophobicContact CB-CD1 3.84Å; L61-L148 HydrophobicContact CB-CG 4.14Å; L61-L148 WeakPolarHBondContact O-CD1 3.44Å; W62-L148 HydrophobicContact CB-CD2 4.18Å; E65-L148 HydrophobicContact CB-CD1 3.78Å; E65-L148 HydrophobicContact CG-CD1 4.3Å; F89-L148 HydrophobicContact CB-CD2 3.78Å; F89-L148 HydrophobicContact CD1-CB 4.45Å; F89-L148 HydrophobicContact CD1-CD2 4Å; F89-L148 HydrophobicContact CG-CD2 3.89Å; I92-L148 HydrophobicContact CD1-CB 4.4Å; I92-L148 HydrophobicContact CD1-CD2 4.36Å; F144-L148 PolarHBondContact O-N 2.95Å; L148-S152 VanDerWaalsContact O-CB 3.24Å; L148-S152 WeakPolarHBondContact O-CB 3.36Å; L148-S152 PolarHBondContact O-N 3.43Å
149P81.6Confident77.5Confident5 Ų559.9 Ų59.93%0.03231%0.308CS..Hα-helixtrans-67.8-38.6-177.410.5-15000113.2I92 V133 L139 G145 Y146 S152 F153I92-P149 HydrophobicContact CD1-CB 3.98Å; I92-P149 HydrophobicContact CD1-CG 4.23Å; V133-P149 HydrophobicContact CG2-CB 3.47Å; V133-P149 VanDerWaalsContact CG2-CB 3.47Å; V133-P149 HydrophobicContact CG2-CG 4.31Å; L139-P149 HydrophobicContact CD2-CG 3.74Å; G145-P149 WeakPolarHBondContact O-CD 3.47Å; G145-P149 WeakPolarHBondContact O-CG 3.15Å; Y146-P149 WeakPolarHBondContact O-CD 3.26Å; P149-S152 PolarHBondContact O-N 3.07Å; P149-F153 WeakPolarHBondContact O-CB 3.37Å; P149-F153 PolarHBondContact O-N 2.65Å
150I84.9Confident78.3Confident94 Ų9460.8 Ų60.848%0.48231%0.314SS..Hα-helixtrans-63.2-47.5178.9-68.5168.7000110.2Y146 F153 I154Y146-I150 WeakPolarHBondContact O-CB 3.34Å; Y146-I150 VanDerWaalsContact O-CD1 3.28Å; Y146-I150 WeakPolarHBondContact O-CD1 3.39Å; Y146-I150 WeakPolarHBondContact O-CG1 3.16Å; Y146-I150 PolarHBondContact O-N 3.3Å; Y146-I150 VanDerWaalsContact O-N 3.16Å; I150-F153 PolarHBondContact O-N 2.67Å; I150-I154 HydrophobicContact CG2-CD1 3.79Å; I150-I154 VanDerWaalsContact O-CG1 3.29Å; I150-I154 WeakPolarHBondContact O-CG1 3.48Å; I150-I154 PolarHBondContact O-N 2.89Å
151V86Confident79.1Confident25 Ų2560.5 Ų60.515%0.15230%0.303CS..Hα-helixtrans-64.6-45.2177.9166.40000111.1F57 L61 L147 F153 I154 L155F57-V151 HydrophobicContact CD1-CG1 3.75Å; F57-V151 HydrophobicContact CE1-CG1 3.39Å; L61-V151 HydrophobicContact CD1-CB 3.97Å; L61-V151 HydrophobicContact CD1-CG1 3.54Å; L61-V151 HydrophobicContact CD1-CG2 4.28Å; L147-V151 HydrophobicContact CD1-CG2 3.86Å; L147-V151 HydrophobicContact CG-CG2 4.11Å; L147-V151 WeakPolarHBondContact O-CB 3.22Å; L147-V151 WeakPolarHBondContact O-CG2 3.3Å; L147-V151 PolarHBondContact O-N 2.84Å; V151-F153 PolarHBondContact O-N 2.97Å; V151-I154 PolarHBondContact O-N 3.3Å; V151-L155 HydrophobicContact CG1-CD1 3.76Å; V151-L155 HydrophobicContact CG1-CG 4.2Å; V151-L155 WeakPolarHBondContact O-CB 3.45Å; V151-L155 WeakPolarHBondContact O-CG 2.91Å; V151-L155 PolarHBondContact O-N 3Å
152S85.4Confident79.5Confident2 Ų254.5 Ų54.51%0.01428%0.276CS..Hα-helixtrans-58.3-39.8177.8-1800000111.4L148 P149 A156L148-S152 VanDerWaalsContact O-CB 3.24Å; L148-S152 WeakPolarHBondContact O-CB 3.36Å; L148-S152 PolarHBondContact O-N 3.43Å; P149-S152 PolarHBondContact O-N 3.07Å; S152-A156 WeakPolarHBondContact O-CB 3.32Å; S152-A156 PolarHBondContact O-N 3.21Å
153F85.2Confident79.7Confident74 Ų7453.5 Ų53.533%0.32526%0.262SS..Hα-helixtrans-66.6-45.9175.2179.4-101.2000112.8L129 I130 P149 I150 V151 L155 A156 W157L129-F153 HydrophobicContact CD1-CB 4.23Å; I130-F153 HydrophobicContact CG1-CE2 4.5Å; P149-F153 WeakPolarHBondContact O-CB 3.37Å; P149-F153 PolarHBondContact O-N 2.65Å; I150-F153 PolarHBondContact O-N 2.67Å; V151-F153 PolarHBondContact O-N 2.97Å; F153-L155 VanDerWaalsContact C-N 3.32Å; F153-L155 PolarHBondContact O-N 2.88Å; F153-A156 PolarHBondContact O-N 3.38Å; F153-W157 AromaticContact CE1-CD1 3.83Å; F153-W157 AromaticContact CE1-NE1 3.93Å; F153-W157 AromaticContact CE2-CD1 3.77Å; F153-W157 AromaticContact CE2-NE1 3.6Å; F153-W157 AromaticContact CZ-CD1 3.53Å; F153-W157 AromaticContact CZ-NE1 3.25Å; F153-W157 PolarHBondContact O-N 3.5Å; F153-W157 VanDerWaalsContact O-N 3.08Å
154I87.3Confident79.8Confident85 Ų8551.7 Ų51.744%0.43624%0.241SC..Hα-helixtrans-61.2-44177.4-70.4168.3000110.2I150 V151 A156 W157 I158I150-I154 HydrophobicContact CG2-CD1 3.79Å; I150-I154 VanDerWaalsContact O-CG1 3.29Å; I150-I154 WeakPolarHBondContact O-CG1 3.48Å; I150-I154 PolarHBondContact O-N 2.89Å; V151-I154 PolarHBondContact O-N 3.3Å; I154-A156 PolarHBondContact O-N 3.08Å; I154-W157 WeakPolarHBondContact O-CB 3.4Å; I154-W157 PolarHBondContact O-N 3.36Å; I154-I158 HydrophobicContact CG2-CD1 3.61Å; I154-I158 HydrophobicContact CG2-CG1 4.21Å; I154-I158 VanDerWaalsContact O-CG1 3.3Å; I154-I158 WeakPolarHBondContact O-CG1 3.1Å; I154-I158 PolarHBondContact O-N 3.48Å
155L83.7Confident79.4Confident15 Ų1553.7 Ų53.78%0.07925%0.249CC..Hα-helixtrans-65.1-38.3178-70172.5000112.3D54 F57 V58 V151 F153 W157 I158 E159D54-L155 WeakPolarHBondContact OD1-CB 3.37Å; D54-L155 WeakPolarHBondContact OD1-CD1 3.42Å; F57-L155 HydrophobicContact CB-CD1 4.45Å; F57-L155 HydrophobicContact CD1-CD1 3.6Å; F57-L155 HydrophobicContact CE1-CD1 4.3Å; F57-L155 HydrophobicContact CG-CD1 4.44Å; V58-L155 HydrophobicContact CG2-CD1 4.27Å; V151-L155 HydrophobicContact CG1-CD1 3.76Å; V151-L155 HydrophobicContact CG1-CG 4.2Å; V151-L155 WeakPolarHBondContact O-CB 3.45Å; V151-L155 WeakPolarHBondContact O-CG 2.91Å; V151-L155 PolarHBondContact O-N 3Å; F153-L155 VanDerWaalsContact C-N 3.32Å; F153-L155 PolarHBondContact O-N 2.88Å; L155-W157 VanDerWaalsContact C-N 3.27Å; L155-W157 PolarHBondContact O-N 3.01Å; L155-I158 PolarHBondContact O-N 3.21Å; L155-E159 WeakPolarHBondContact O-CB 3.28Å; L155-E159 VanDerWaalsContact O-CG 3.31Å; L155-E159 WeakPolarHBondContact O-CG 3.15Å; L155-E159 PolarHBondContact O-N 2.99Å
156A81.8Confident78.7Confident2 Ų259.4 Ų59.42%0.01727%0.273CS..Hα-helixtrans-59.4-39.2172.900000112.6R99 S152 F153 I154 T160R99-A156 VanDerWaalsContact NH1-N 3.13Å; S152-A156 WeakPolarHBondContact O-CB 3.32Å; S152-A156 PolarHBondContact O-N 3.21Å; F153-A156 PolarHBondContact O-N 3.38Å; I154-A156 PolarHBondContact O-N 3.08Å; A156-T160 WeakPolarHBondContact O-CB 3.33Å; A156-T160 PolarHBondContact O-N 2.89Å; A156-T160 VanDerWaalsContact O-N 3.11Å; A156-T160 PolarHBondContact O-OG1 3.42Å
157W81.3Confident77.9Confident159 Ų15955.3 Ų55.360%0.60226%0.258SS*.Hα-helixtrans-69.1-43.9173.9-93.978.3000112.9F153 I154 L155 T160 W161F153-W157 AromaticContact CE1-CD1 3.83Å; F153-W157 AromaticContact CE1-NE1 3.93Å; F153-W157 AromaticContact CE2-CD1 3.77Å; F153-W157 AromaticContact CE2-NE1 3.6Å; F153-W157 AromaticContact CZ-CD1 3.53Å; F153-W157 AromaticContact CZ-NE1 3.25Å; F153-W157 PolarHBondContact O-N 3.5Å; F153-W157 VanDerWaalsContact O-N 3.08Å; I154-W157 WeakPolarHBondContact O-CB 3.4Å; I154-W157 PolarHBondContact O-N 3.36Å; L155-W157 VanDerWaalsContact C-N 3.27Å; L155-W157 PolarHBondContact O-N 3.01Å; W157-T160 PolarHBondContact O-N 3.36Å; W157-W161 WeakPolarHBondContact O-CB 3.37Å; W157-W161 PolarHBondContact O-N 2.89Å
158I81.2Confident76.7Confident68 Ų6853.5 Ų53.535%0.34925%0.248SC..Hα-helixtrans-65.7-42179-63.6168.2000110.8F50 I154 L155 W161 L162F50-I158 HydrophobicContact CE1-CB 4.45Å; F50-I158 HydrophobicContact CE1-CG2 3.9Å; F50-I158 HydrophobicContact CE2-CG2 4.25Å; F50-I158 HydrophobicContact CZ-CB 4.14Å; F50-I158 HydrophobicContact CZ-CG2 3.37Å; I154-I158 HydrophobicContact CG2-CD1 3.61Å; I154-I158 HydrophobicContact CG2-CG1 4.21Å; I154-I158 VanDerWaalsContact O-CG1 3.3Å; I154-I158 WeakPolarHBondContact O-CG1 3.1Å; I154-I158 PolarHBondContact O-N 3.48Å; L155-I158 PolarHBondContact O-N 3.21Å; I158-W161 PolarHBondContact O-N 2.9Å; I158-L162 HydrophobicContact CG2-CD1 4.01Å; I158-L162 WeakPolarHBondContact O-CB 3.48Å; I158-L162 PolarHBondContact O-N 3.01Å
159E76.6Confident75.4Confident7 Ų755.8 Ų55.83%0.03326%0.263CS..Hα-helixtrans-59.8-46175.1-78.9-172.6165.400112F50 D54 R99 L103 L155 W161 L162 L163F50-E159 HydrophobicContact CD1-CB 4.48Å; F50-E159 HydrophobicContact CD1-CG 3.67Å; F50-E159 HydrophobicContact CE1-CB 4.14Å; F50-E159 HydrophobicContact CE1-CG 3.39Å; D54-E159 WeakPolarHBondContact CB-OE1 3.45Å; R99-E159 WeakPolarHBondContact CD-OE2 3.19Å; R99-E159 IonicContact CZ-OE1 2.67Å; R99-E159 IonicContact CZ-OE2 3.07Å; R99-E159 IonicContact NE-OE2 3.12Å; R99-E159 PolarHBondContact NE-OE2 3.18Å; R99-E159 VanDerWaalsContact NE-OE2 3.12Å; R99-E159 IonicContact NH1-OE1 3.79Å; R99-E159 IonicContact NH1-OE2 2.63Å; R99-E159 PolarHBondContact NH1-OE2 3.23Å; L103-E159 WeakPolarHBondContact CD1-OE2 3.49Å; L155-E159 WeakPolarHBondContact O-CB 3.28Å; L155-E159 VanDerWaalsContact O-CG 3.31Å; L155-E159 WeakPolarHBondContact O-CG 3.15Å; L155-E159 PolarHBondContact O-N 2.99Å; E159-W161 VanDerWaalsContact C-N 3.34Å; E159-L162 PolarHBondContact O-N 3.46Å; E159-L163 WeakPolarHBondContact O-CB 3.36Å; E159-L163 WeakPolarHBondContact O-CG 3.4Å; E159-L163 PolarHBondContact O-N 2.64Å
160T76.4Confident74.3Confident39 Ų3959.6 Ų59.624%0.23928%0.281CS..Hα-helixtrans-65-42.7178.6-56.80000110.8T122 A156 W157 L163 D164T122-T160 WeakPolarHBondContact CG2-OG1 3.34Å; A156-T160 WeakPolarHBondContact O-CB 3.33Å; A156-T160 PolarHBondContact O-N 2.89Å; A156-T160 VanDerWaalsContact O-N 3.11Å; A156-T160 PolarHBondContact O-OG1 3.42Å; W157-T160 PolarHBondContact O-N 3.36Å; T160-L163 WeakPolarHBondContact O-CB 3.22Å; T160-L163 PolarHBondContact O-N 2.82Å; T160-D164 WeakPolarHBondContact O-CB 3.32Å; T160-D164 PolarHBondContact O-N 2.82Å
161W77.9Confident73.2Confident145 Ų14556 Ų5655%0.54926%0.262SS..Hα-helixtrans-64.6-40.8177.6-170.687.8000111.8W157 I158 E159 D164 F165W157-W161 WeakPolarHBondContact O-CB 3.37Å; W157-W161 PolarHBondContact O-N 2.89Å; I158-W161 PolarHBondContact O-N 2.9Å; E159-W161 VanDerWaalsContact C-N 3.34Å; W161-D164 PolarHBondContact O-N 3.38Å; W161-F165 AromaticContact CD1-CD2 3.31Å; W161-F165 AromaticContact CD1-CE2 3.31Å; W161-F165 AromaticContact CD2-CD2 3.88Å; W161-F165 HydrophobicContact CD2-CD2 3.88Å; W161-F165 AromaticContact CE2-CD2 3.51Å; W161-F165 AromaticContact CE2-CE2 3.99Å; W161-F165 AromaticContact CG-CD2 3.76Å; W161-F165 HydrophobicContact CG-CD2 3.76Å; W161-F165 HydrophobicContact CG-CE2 4.19Å; W161-F165 HydrophobicContact CZ2-CB 4.47Å; W161-F165 HydrophobicContact CZ2-CD2 4.2Å; W161-F165 HydrophobicContact CZ2-CG 4.3Å; W161-F165 AromaticContact NE1-CD2 3.12Å; W161-F165 AromaticContact NE1-CE2 3.15Å; W161-F165 WeakPolarHBondContact O-CB 3.29Å; W161-F165 PolarHBondContact O-N 3.28Å
162L72.9Confident71.9Confident41 Ų4159.4 Ų59.422%0.21528%0.279CS..Hα-helixtrans-65.8-41.7174.9-92.2167.4000112.5F50 I158 E159 D164 K166F50-L162 HydrophobicContact CD1-CD1 3.6Å; F50-L162 HydrophobicContact CD2-CD1 3.74Å; F50-L162 HydrophobicContact CE1-CD1 3.59Å; F50-L162 HydrophobicContact CE2-CD1 3.73Å; F50-L162 HydrophobicContact CG-CD1 3.69Å; F50-L162 HydrophobicContact CZ-CD1 3.68Å; I158-L162 HydrophobicContact CG2-CD1 4.01Å; I158-L162 WeakPolarHBondContact O-CB 3.48Å; I158-L162 PolarHBondContact O-N 3.01Å; E159-L162 PolarHBondContact O-N 3.46Å; L162-D164 VanDerWaalsContact C-N 3.32Å; L162-K166 HydrophobicContact CD2-CB 4.41Å; L162-K166 HydrophobicContact CD2-CD 3.77Å; L162-K166 WeakPolarHBondContact O-CB 3.36Å; L162-K166 PolarHBondContact O-N 2.66Å
163L72.1Confident70.7Confident12 Ų1264.2 Ų64.26%0.06330%0.301CS..Iπ-helixtrans-59.3-45.2172.2-87164.2000111.4F47 L103 V118 E159 T160 L168F47-L163 HydrophobicContact CD2-CD2 3.73Å; F47-L163 HydrophobicContact CD2-CG 4.1Å; F47-L163 HydrophobicContact CE2-CD1 3.94Å; F47-L163 HydrophobicContact CE2-CD2 3.16Å; F47-L163 HydrophobicContact CE2-CG 3.49Å; F47-L163 VanDerWaalsContact CE2-CG 3.49Å; F47-L163 HydrophobicContact CZ-CD1 4.47Å; F47-L163 HydrophobicContact CZ-CD2 3.64Å; F47-L163 HydrophobicContact CZ-CG 4.3Å; L103-L163 HydrophobicContact CD2-CD1 3.38Å; V118-L163 HydrophobicContact CG1-CD1 3.5Å; V118-L163 VanDerWaalsContact CG1-CD1 3.5Å; V118-L163 HydrophobicContact CG1-CG 4.43Å; E159-L163 WeakPolarHBondContact O-CB 3.36Å; E159-L163 WeakPolarHBondContact O-CG 3.4Å; E159-L163 PolarHBondContact O-N 2.64Å; T160-L163 WeakPolarHBondContact O-CB 3.22Å; T160-L163 PolarHBondContact O-N 2.82Å; L163-L168 VanDerWaalsContact O-CD1 3.25Å; L163-L168 WeakPolarHBondContact O-CD1 3.44Å
164D70.6Confident69.5Low50 Ų5063.9 Ų63.927%0.26730%0.303SS..Iπ-helixtrans-75.3-52.6-171.3-163.325.5000113W115 T160 W161 L162W115-D164 HydrophobicContact CZ2-CB 4.42Å; W115-D164 WeakPolarHBondContact CZ2-OD1 2.8Å; W115-D164 WeakPolarHBondContact CZ2-OD2 3.37Å; W115-D164 PolarHBondContact NE1-OD1 3.48Å; T160-D164 WeakPolarHBondContact O-CB 3.32Å; T160-D164 PolarHBondContact O-N 2.82Å; W161-D164 PolarHBondContact O-N 3.38Å; L162-D164 VanDerWaalsContact C-N 3.32Å
165F62.4Low68.4Low126 Ų12664.5 Ų64.555%0.55330%0.304SS*.Iπ-helixtrans-86-19.6-172.8-76.8-80.1000114.9W161W161-F165 AromaticContact CD1-CD2 3.31Å; W161-F165 AromaticContact CD1-CE2 3.31Å; W161-F165 AromaticContact CD2-CD2 3.88Å; W161-F165 HydrophobicContact CD2-CD2 3.88Å; W161-F165 AromaticContact CE2-CD2 3.51Å; W161-F165 AromaticContact CE2-CE2 3.99Å; W161-F165 AromaticContact CG-CD2 3.76Å; W161-F165 HydrophobicContact CG-CD2 3.76Å; W161-F165 HydrophobicContact CG-CE2 4.19Å; W161-F165 HydrophobicContact CZ2-CB 4.47Å; W161-F165 HydrophobicContact CZ2-CD2 4.2Å; W161-F165 HydrophobicContact CZ2-CG 4.3Å; W161-F165 AromaticContact NE1-CD2 3.12Å; W161-F165 AromaticContact NE1-CE2 3.15Å; W161-F165 WeakPolarHBondContact O-CB 3.29Å; W161-F165 PolarHBondContact O-N 3.28Å
166K62.1Low67.4Low127 Ų12767 Ų6755%0.55232%0.323SS*.Iπ-helixtrans-122.6-24.2-165.9-146.4178.1171.273.20114.7L162L162-K166 HydrophobicContact CD2-CB 4.41Å; L162-K166 HydrophobicContact CD2-CD 3.77Å; L162-K166 WeakPolarHBondContact O-CB 3.36Å; L162-K166 PolarHBondContact O-N 2.66Å
167V60.6Low66.8Low11 Ų1173.9 Ų73.97%0.06735%0.348CS..Iπ-helixtrans-102-42.5-175.6162.70000112.1V43 F47 L112 E171V43-V167 HydrophobicContact CG1-CB 4.1Å; V43-V167 HydrophobicContact CG1-CG1 4.35Å; V43-V167 HydrophobicContact CG1-CG2 3.58Å; F47-V167 HydrophobicContact CB-CG2 4.22Å; L112-V167 HydrophobicContact CD2-CG1 3.51Å; V167-E171 WeakPolarHBondContact O-CB 3.26Å; V167-E171 WeakPolarHBondContact O-CG 3.46Å; V167-E171 PolarHBondContact O-N 3.35Å; V167-E171 VanDerWaalsContact O-N 3.08Å
168L58Low66.2Low33 Ų3374.2 Ų74.217%0.17335%0.351CS..Hα-helixtrans-77.1-35.9-175.1-64.2144.5000115.6L112 W115 L163 N172L112-L168 HydrophobicContact CB-CD2 4.46Å; L112-L168 HydrophobicContact CD2-CD2 4.21Å; W115-L168 HydrophobicContact CB-CD1 4.35Å; W115-L168 HydrophobicContact CB-CD2 4.13Å; W115-L168 HydrophobicContact CD2-CD1 4.4Å; W115-L168 HydrophobicContact CG-CD1 3.68Å; W115-L168 HydrophobicContact CG-CD2 4.35Å; L163-L168 VanDerWaalsContact O-CD1 3.25Å; L163-L168 WeakPolarHBondContact O-CD1 3.44Å; L168-N172 WeakPolarHBondContact O-CB 3.39Å; L168-N172 PolarHBondContact O-N 2.84Å; L168-N172 PolarHBondContact O-ND2 3.33Å
169P55.4Low65.7Low51 Ų5177.4 Ų77.433%0.33136%0.364SS..Hα-helixtrans-63.4-50.3172.8-19.532.1000109.9E171 N172 E173P169-E171 PolarHBondContact O-N 3.49Å; P169-N172 WeakPolarHBondContact CA-ND2 3.38Å; P169-N172 PolarHBondContact O-N 2.9Å; P169-N172 PolarHBondContact O-ND2 3.01Å; P169-N172 PolarHBondContact O-OD1 3.38Å; P169-E173 WeakPolarHBondContact O-CB 3.19Å; P169-E173 WeakPolarHBondContact O-CG 3.4Å; P169-E173 PolarHBondContact O-N 2.68Å
170Q57.9Low65.5Low85 Ų8580.1 Ų80.140%0.39738%0.384SS..Hα-helixtrans-66.9-37.6-172.7-165.7166.4-13.800112.9V43 D174V43-Q170 HydrophobicContact CG2-CB 4.42Å; V43-Q170 HydrophobicContact CG2-CG 3.92Å; V43-Q170 VanDerWaalsContact CG2-NE2 3.27Å; Q170-D174 WeakPolarHBondContact O-CB 3.42Å; Q170-D174 VanDerWaalsContact O-CG 3.26Å; Q170-D174 PolarHBondContact O-N 3.31Å
171E62.2Low65.3Low19 Ų1984.8 Ų84.89%0.08940%0.401CS..Hα-helixtrans-75.3-30.9175.4-69.4-157.891.700113.8R44 L112 V167 P169 E173 E175R44-E171 IonicContact CZ-OE1 3.53Å; R44-E171 IonicContact NE-OE1 3.17Å; R44-E171 PolarHBondContact NE-OE1 3.42Å; R44-E171 IonicContact NH2-OE1 2.55Å; R44-E171 PolarHBondContact NH2-OE1 3.35Å; L112-E171 VanDerWaalsContact CD1-CD 3.47Å; L112-E171 WeakPolarHBondContact CD1-OE2 3.42Å; L112-E171 WeakPolarHBondContact CD2-OE2 3.21Å; V167-E171 WeakPolarHBondContact O-CB 3.26Å; V167-E171 WeakPolarHBondContact O-CG 3.46Å; V167-E171 PolarHBondContact O-N 3.35Å; V167-E171 VanDerWaalsContact O-N 3.08Å; P169-E171 PolarHBondContact O-N 3.49Å; E171-E173 VanDerWaalsContact C-N 3.33Å; E171-E175 PolarHBondContact O-N 3.16Å
172N58.9Low64.9Low96 Ų9682.4 Ų82.451%0.51340%0.399SS..Hα-helixtrans-70.7-34.3172.98847.6000111.4L168 P169 S176L168-N172 WeakPolarHBondContact O-CB 3.39Å; L168-N172 PolarHBondContact O-N 2.84Å; L168-N172 PolarHBondContact O-ND2 3.33Å; P169-N172 WeakPolarHBondContact CA-ND2 3.38Å; P169-N172 PolarHBondContact O-N 2.9Å; P169-N172 PolarHBondContact O-ND2 3.01Å; P169-N172 PolarHBondContact O-OD1 3.38Å; N172-S176 VanDerWaalsContact O-CB 3.22Å; N172-S176 WeakPolarHBondContact O-CB 3.33Å; N172-S176 PolarHBondContact O-N 2.93Å; N172-S176 PolarHBondContact O-OG 2.93Å
173E59.3Low64.8Low103 Ų10383.6 Ų83.648%0.48141%0.405SS..Hα-helixtrans-70.5-38.5177.8-73.4175.1127.400110.7P169 E171 S176 R177P169-E173 WeakPolarHBondContact O-CB 3.19Å; P169-E173 WeakPolarHBondContact O-CG 3.4Å; P169-E173 PolarHBondContact O-N 2.68Å; E171-E173 VanDerWaalsContact C-N 3.33Å; E173-S176 WeakPolarHBondContact CA-OG 3.3Å; E173-S176 PolarHBondContact O-OG 2.97Å; E173-R177 WeakPolarHBondContact O-CB 3.21Å; E173-R177 PolarHBondContact O-N 2.76Å
174D61.2Low64.7Low67 Ų6785.9 Ų85.936%0.35843%0.426SS..Hα-helixtrans-71.4-42.6176.3-74-23000112.2Q170 Y178Q170-D174 WeakPolarHBondContact O-CB 3.42Å; Q170-D174 VanDerWaalsContact O-CG 3.26Å; Q170-D174 PolarHBondContact O-N 3.31Å; D174-Y178 WeakPolarHBondContact O-CB 3.41Å; D174-Y178 PolarHBondContact O-N 2.92Å
175E63.3Low64.5Low99 Ų9988.6 Ų88.646%0.46344%0.444SS..Hα-helixtrans-65.1-43.1173.4-87.3-167.6140.200111.4K111 E171 R177 Y178 Q179K111-E175 IonicContact NZ-OE1 3.67Å; K111-E175 PolarHBondContact NZ-OE1 3.28Å; E171-E175 PolarHBondContact O-N 3.16Å; E175-R177 PolarHBondContact O-N 2.87Å; E175-Y178 PolarHBondContact O-N 2.87Å; E175-Q179 WeakPolarHBondContact O-CB 3.37Å; E175-Q179 PolarHBondContact O-N 2.79Å
176S63.8Low64.4Low67 Ų6790.4 Ų90.447%0.46945%0.454SS..Hα-helixtrans-65.4-38.2178.161.70000112.5N172 E173 Q179 S180N172-S176 VanDerWaalsContact O-CB 3.22Å; N172-S176 WeakPolarHBondContact O-CB 3.33Å; N172-S176 PolarHBondContact O-N 2.93Å; N172-S176 PolarHBondContact O-OG 2.93Å; E173-S176 WeakPolarHBondContact CA-OG 3.3Å; E173-S176 PolarHBondContact O-OG 2.97Å; S176-Q179 PolarHBondContact O-N 2.81Å; S176-S180 WeakPolarHBondContact O-CB 3.32Å; S176-S180 PolarHBondContact O-N 3.25Å; S176-S180 PolarHBondContact O-OG 2.84Å
177R67.9Low64.3Low146 Ų14692.8 Ų92.855%0.55146%0.46SS*.Hα-helixtrans-63.7-49.9172.4-170.6179.2-60.8168.35.4110.3E173 E175 Q179 S180 F181E173-R177 WeakPolarHBondContact O-CB 3.21Å; E173-R177 PolarHBondContact O-N 2.76Å; E175-R177 PolarHBondContact O-N 2.87Å; R177-Q179 VanDerWaalsContact C-N 3.31Å; R177-Q179 PolarHBondContact O-N 2.92Å; R177-S180 WeakPolarHBondContact CA-OG 3.34Å; R177-S180 PolarHBondContact O-N 2.86Å; R177-S180 VanDerWaalsContact O-N 3.16Å; R177-S180 PolarHBondContact O-OG 3.38Å; R177-F181 HydrophobicContact CG-CD2 3.72Å; R177-F181 HydrophobicContact CG-CE2 3.69Å; R177-F181 VanDerWaalsContact O-CD2 3.3Å; R177-F181 WeakPolarHBondContact O-CD2 3.42Å; R177-F181 PolarHBondContact O-N 3.21Å
178Y69.8Low63.7Low167 Ų16794.9 Ų94.966%0.65548%0.478SS*.Hα-helixtrans-59.8-41.4178.4-147.9-92.8000112.3D174 E175 F181 L182D174-Y178 WeakPolarHBondContact O-CB 3.41Å; D174-Y178 PolarHBondContact O-N 2.92Å; E175-Y178 PolarHBondContact O-N 2.87Å; Y178-F181 PolarHBondContact O-N 3.36Å; Y178-L182 HydrophobicContact CD1-CD1 3.84Å; Y178-L182 HydrophobicContact CD1-CG 4.12Å; Y178-L182 HydrophobicContact CE1-CD1 4.01Å; Y178-L182 HydrophobicContact CE1-CG 4.25Å; Y178-L182 WeakPolarHBondContact O-CG 3.19Å; Y178-L182 PolarHBondContact O-N 3.48Å
179Q71Confident63.1Low135 Ų13598.8 Ų98.863%0.63151%0.505SS*.Hα-helixtrans-62.9-44.2175.2-152.393.528.500111.4E175 S176 R177 F181 L182 D183E175-Q179 WeakPolarHBondContact O-CB 3.37Å; E175-Q179 PolarHBondContact O-N 2.79Å; S176-Q179 PolarHBondContact O-N 2.81Å; R177-Q179 VanDerWaalsContact C-N 3.31Å; R177-Q179 PolarHBondContact O-N 2.92Å; Q179-F181 VanDerWaalsContact C-N 3.33Å; Q179-F181 PolarHBondContact O-N 2.88Å; Q179-L182 PolarHBondContact O-N 2.81Å; Q179-D183 WeakPolarHBondContact O-CB 3.4Å; Q179-D183 PolarHBondContact O-N 2.6Å
180S71.5Confident62.9Low63 Ų63104.9 Ų104.944%0.44153%0.534SS..Hα-helixtrans-65-34.8176.572.10000112.8S176 R177 A184S176-S180 WeakPolarHBondContact O-CB 3.32Å; S176-S180 PolarHBondContact O-N 3.25Å; S176-S180 PolarHBondContact O-OG 2.84Å; R177-S180 WeakPolarHBondContact CA-OG 3.34Å; R177-S180 PolarHBondContact O-N 2.86Å; R177-S180 VanDerWaalsContact O-N 3.16Å; R177-S180 PolarHBondContact O-OG 3.38Å; S180-A184 WeakPolarHBondContact O-CB 3.27Å; S180-A184 PolarHBondContact O-N 3.08Å
181F72.2Confident62.4Low138 Ų138109.6 Ų109.661%0.60556%0.558SS**Hα-helixtrans-70.1-44.4174.6-94.2-90.7000111.4R177 Y178 Q179 A184 V185R177-F181 HydrophobicContact CG-CD2 3.72Å; R177-F181 HydrophobicContact CG-CE2 3.69Å; R177-F181 VanDerWaalsContact O-CD2 3.3Å; R177-F181 WeakPolarHBondContact O-CD2 3.42Å; R177-F181 PolarHBondContact O-N 3.21Å; Y178-F181 PolarHBondContact O-N 3.36Å; Q179-F181 VanDerWaalsContact C-N 3.33Å; Q179-F181 PolarHBondContact O-N 2.88Å; F181-A184 PolarHBondContact O-N 3.16Å; F181-V185 WeakPolarHBondContact O-CB 3.14Å; F181-V185 VanDerWaalsContact O-CG2 3.23Å; F181-V185 WeakPolarHBondContact O-CG2 3.23Å; F181-V185 PolarHBondContact O-N 2.73Å
182L70.6Confident61.6Low95 Ų95111 Ų11150%0.49758%0.578SS.*Hα-helixtrans-63-43174.3-72.2178.4000111.5Y178 Q179 V185 E186Y178-L182 HydrophobicContact CD1-CD1 3.84Å; Y178-L182 HydrophobicContact CD1-CG 4.12Å; Y178-L182 HydrophobicContact CE1-CD1 4.01Å; Y178-L182 HydrophobicContact CE1-CG 4.25Å; Y178-L182 WeakPolarHBondContact O-CG 3.19Å; Y178-L182 PolarHBondContact O-N 3.48Å; Q179-L182 PolarHBondContact O-N 2.81Å; L182-V185 PolarHBondContact O-N 3.39Å; L182-E186 WeakPolarHBondContact O-CB 3.38Å; L182-E186 PolarHBondContact O-N 2.88Å
183D70.7Confident60.9Low66 Ų66113 Ų11335%0.35360%0.596SS.*Hα-helixtrans-66.4-36.8177.1-168.671.1000111.8Q179 E186 R187Q179-D183 WeakPolarHBondContact O-CB 3.4Å; Q179-D183 PolarHBondContact O-N 2.6Å; D183-E186 PolarHBondContact O-N 3.02Å; D183-R187 WeakPolarHBondContact O-CB 2.84Å; D183-R187 WeakPolarHBondContact O-CG 3.45Å; D183-R187 PolarHBondContact O-N 3.22Å; D183-R187 IonicContact OD1-CZ 2.84Å; D183-R187 IonicContact OD1-NH1 2.65Å; D183-R187 PolarHBondContact OD1-NH1 3.38Å; D183-R187 IonicContact OD2-CZ 3.87Å; D183-R187 IonicContact OD2-NH1 3.05Å; D183-R187 PolarHBondContact OD2-NH1 3.43Å
184A69.4Low60.3Low60 Ų60111 Ų11150%0.49660%0.603SS.*Hα-helixtrans-70.2-33172.500000112.9S180 F181 A188S180-A184 WeakPolarHBondContact O-CB 3.27Å; S180-A184 PolarHBondContact O-N 3.08Å; F181-A184 PolarHBondContact O-N 3.16Å; A184-A188 VanDerWaalsContact O-CB 3.27Å; A184-A188 WeakPolarHBondContact O-CB 3.23Å; A184-A188 PolarHBondContact O-N 3.01Å
185V66.1Low59.5Low107 Ų107113.7 Ų113.765%0.64862%0.624SS**Hα-helixtrans-72.6-37.7173.1167.90000111F181 L182F181-V185 WeakPolarHBondContact O-CB 3.14Å; F181-V185 VanDerWaalsContact O-CG2 3.23Å; F181-V185 WeakPolarHBondContact O-CG2 3.23Å; F181-V185 PolarHBondContact O-N 2.73Å; L182-V185 PolarHBondContact O-N 3.39Å
186E60.3Low58.9Low164 Ų164117.2 Ų117.277%0.76665%0.645SS**Hα-helixtrans-72.1-34.9175.8-168.7179.4171.800111.6L182 D183L182-E186 WeakPolarHBondContact O-CB 3.38Å; L182-E186 PolarHBondContact O-N 2.88Å; D183-E186 PolarHBondContact O-N 3.02Å
187R59.3Low58Low177 Ų177119.6 Ų119.667%0.66866%0.662SS**Hα-helixtrans-85.8-9.8174.5-72.3-169.8160.488.919.1114.4D183 P189D183-R187 WeakPolarHBondContact O-CB 2.84Å; D183-R187 WeakPolarHBondContact O-CG 3.45Å; D183-R187 PolarHBondContact O-N 3.22Å; D183-R187 IonicContact OD1-CZ 2.84Å; D183-R187 IonicContact OD1-NH1 2.65Å; D183-R187 PolarHBondContact OD1-NH1 3.38Å; D183-R187 IonicContact OD2-CZ 3.87Å; D183-R187 IonicContact OD2-NH1 3.05Å; D183-R187 PolarHBondContact OD2-NH1 3.43Å; R187-P189 VanDerWaalsContact O-CD 3.23Å; R187-P189 WeakPolarHBondContact O-CD 3.15Å
188A48.5Very low57.2Low55 Ų55120.5 Ų120.546%0.45568%0.677SS.*SBendtrans-66115171.400000108.4A184 L190A184-A188 VanDerWaalsContact O-CB 3.27Å; A184-A188 WeakPolarHBondContact O-CB 3.23Å; A184-A188 PolarHBondContact O-N 3.01Å; A188-L190 PolarHBondContact O-N 3.12Å; A188-L190 VanDerWaalsContact O-N 3.16Å
189P45.5Very low56.4Low115 Ų115115.2 Ų115.275%0.74767%0.674SS**  trans-61.1124.9177.4-15.829.2000108.2R187 M191R187-P189 VanDerWaalsContact O-CD 3.23Å; R187-P189 WeakPolarHBondContact O-CD 3.15Å; P189-M191 PolarHBondContact O-N 3.41Å
190L51.4Low55.7Low179 Ų179117 Ų11794%0.93768%0.683SS**  trans-61.582.3166.1-78.6169.9000108.7A188 G192A188-L190 PolarHBondContact O-N 3.12Å; A188-L190 VanDerWaalsContact O-N 3.16Å; L190-G192 PolarHBondContact O-N 3.38Å
191M48.3Very low54.4Low183 Ų183123.6 Ų123.690%0.90170%0.704SS**  trans-68.487.8159.7-78.9-174.483.600106.6P189P189-M191 PolarHBondContact O-N 3.41Å
192G44.3Very low53.6Low48 Ų48126.9 Ų126.950%0.49571%0.713SS.*  trans-55.7160.3157.400000109.8L190 G194L190-G192 PolarHBondContact O-N 3.38Å; G192-G194 VanDerWaalsContact C-N 3.31Å; G192-G194 PolarHBondContact O-N 2.84Å
193P45Very low53Low139 Ų139127.2 Ų127.290%0.90372%0.724SS**  trans-6695.1176.626.9-29.5000108.4
194G45.7Very low51.8Low60 Ų60129.6 Ų129.662%0.61974%0.743SS**  trans-67.7140.2174.300000109.9G192 L196G192-G194 VanDerWaalsContact C-N 3.31Å; G192-G194 PolarHBondContact O-N 2.84Å; G194-L196 PolarHBondContact O-N 3.2Å
195P45.1Very low50.6Low125 Ų125132.9 Ų132.981%0.81276%0.759SS**  trans-61.7139.5-179.325.5-31.3000110.2S197P195-S197 PolarHBondContact O-N 3.3Å
196L51Low49.5Very low173 Ų173136.6 Ų136.691%0.90677%0.77SS**  trans-37.3106.6176.2-61.2169.6000111.3G194G194-L196 PolarHBondContact O-N 3.2Å
197S45.6Very low48.7Very low116 Ų116134 Ų13481%0.81177%0.769SS**  trans-97.490.2167.2-171.10000107.6P195 G199P195-S197 PolarHBondContact O-N 3.3Å; S197-G199 PolarHBondContact O-N 2.78Å
198D50.6Low48.3Very low165 Ų165133.8 Ų133.888%0.88278%0.781SS**  trans-55.5115.3161-83.4-36.2000108.4
199G53.1Low48.3Very low57 Ų57134.5 Ų134.559%0.58879%0.787SS**  trans-179.860.2-173.500000114.9S197 F201S197-G199 PolarHBondContact O-N 2.78Å; G199-F201 PolarHBondContact O-N 2.7Å
200Q56.6Low48.5Very low173 Ų173135.9 Ų135.981%0.80879%0.787SS**  trans25.590.9142.3-137.9103.6-28.100116.9
201F43.7Very low48.2Very low200 Ų200133 Ų13388%0.87778%0.782SS**  trans-125.5104.8157.7-111-93000108.8G199 S203G199-F201 PolarHBondContact O-N 2.7Å; F201-S203 PolarHBondContact O-N 3.07Å
202Y55.5Low48.4Very low207 Ų207131.1 Ų131.181%0.81278%0.776SS**  trans-75.6114.4168.9-102.6-94.1000108.2
203S57.2Low48.5Very low103 Ų103137.2 Ų137.272%0.7279%0.792SS**PPolyproline II helixtrans-86.7126.4160.6-650000108.6F201F201-S203 PolarHBondContact O-N 3.07Å
204P45.1Very low48.5Very low116 Ų116137.7 Ų137.775%0.75379%0.787SS**PPolyproline II helixtrans-66.1152.3173.4-13.928.2000111.2
205P45Very low48.3Very low128 Ų128143.3 Ų143.383%0.83180%0.802SS**PPolyproline II helixtrans-69.3151.3176.629.4-32.4000111.9
206E43.7Very low48.2Very low186 Ų186146.3 Ų146.387%0.86981%0.805SS**PPolyproline II helixtrans-46.2129.7-171.8-59.7-174.9105.700115.3L208E206-L208 PolarHBondContact O-N 3.5Å
207S43.6Very low47.6Very low109 Ų109147.7 Ų147.776%0.76280%0.799SS**  trans-84.1101.1161.4174.70000108.7A209S207-A209 PolarHBondContact O-N 3.02Å
208L50.8Low47.5Very low173 Ų173151.2 Ų151.291%0.90680%0.8SS**  trans-62.697.9155.2-68.9171.3000107.9E206E206-L208 PolarHBondContact O-N 3.5Å
209A48.5Very low47Very low70 Ų70149.7 Ų149.758%0.57979%0.787SS**  trans-137.288.216900000108S207S207-A209 PolarHBondContact O-N 3.02Å
210D49.5Very low46.7Very low143 Ų143154.1 Ų154.177%0.76580%0.797SS**  22.3109.3126.8-155.230.5000115.6
211S44.4Very low46.2Very low119 Ų119149.7 Ų149.783%0.83278%0.784SS**  trans-143.375.2162.6-68.10000107.4E213S211-E213 PolarHBondContact O-N 3.21Å
212D52.4Low45.9Very low144 Ų144148.6 Ų148.677%0.7778%0.781SS**  trans-64.4105.6150.5-86.6-20.7000107.7
213E46.4Very low45.1Very low176 Ų176148.4 Ų148.482%0.82279%0.785SS**  trans-153101150-65.5-157.1157.500110.3S211S211-E213 PolarHBondContact O-N 3.21Å
214D44.3Very low44.2Very low149 Ų149148.2 Ų148.280%0.79778%0.783SS**  trans51.9105.6141.6-54.8-35.9000121.9
215L41.5Very low44.3Very low178 Ų178150.1 Ų150.193%0.93279%0.786SS**  trans-134.9101.2140.3-71.9179.6000110.6Y217L215-Y217 PolarHBondContact O-N 3.38Å; L215-Y217 VanDerWaalsContact O-N 3.08Å
216E44.3Very low44.4Very low187 Ų187151.8 Ų151.887%0.87479%0.787SS**  trans-58.1101.9174-171.4172.5146.700111.2K218E216-K218 PolarHBondContact O-N 3.47Å
217Y38.7Very low44.1Very low202 Ų202151.7 Ų151.779%0.79279%0.786SS**  trans-79.395.7173-163.5-94.4000109.3L215 H219L215-Y217 PolarHBondContact O-N 3.38Å; L215-Y217 VanDerWaalsContact O-N 3.08Å; Y217-H219 VanDerWaalsContact C-N 3.29Å; Y217-H219 HydrophobicContact CD1-CB 3.91Å; Y217-H219 HydrophobicContact CE1-CB 4.02Å; Y217-H219 PolarHBondContact O-N 3.42Å
218K43.7Very low43.9Very low190 Ų190156.4 Ų156.483%0.82679%0.793SS**  trans-71.985.9170.2-160.7170.4-177.2173.40109.4E216E216-K218 PolarHBondContact O-N 3.47Å
219H39.4Very low43.6Very low134 Ų134155.2 Ų155.262%0.6279%0.793SS**  trans-77.8116.1167.9-171.914.5000109Y217 P221Y217-H219 VanDerWaalsContact C-N 3.29Å; Y217-H219 HydrophobicContact CD1-CB 3.91Å; Y217-H219 HydrophobicContact CE1-CB 4.02Å; Y217-H219 PolarHBondContact O-N 3.42Å; H219-P221 WeakPolarHBondContact O-CD 3.17Å
220D47.1Very low43.2Very low149 Ų149160.4 Ų160.480%0.79782%0.824SS**  trans-91.7113.5162.1-131.2-39.3000107.6
221P45.2Very low42.9Very low80 Ų80161.3 Ų161.352%0.51983%0.827SS.*  trans-96.4116.1172.632.8-28000110.9H219 K223H219-P221 WeakPolarHBondContact O-CD 3.17Å; P221-K223 PolarHBondContact O-N 3.12Å
222E37.9Very low42.8Very low178 Ų178163.5 Ų163.583%0.83283%0.827SS**  trans20.396.6134.6-154.8-174.8131.700116
223K39.3Very low42.3Very low203 Ų203164.6 Ų164.688%0.88383%0.83SS**  trans-92.592.3152.6-76.9-165.9178.8-174.50108.7P221 L225P221-K223 PolarHBondContact O-N 3.12Å; K223-L225 PolarHBondContact O-N 2.89Å
224S38.6Very low42Very low98 Ų98163.9 Ų163.969%0.68583%0.831SS**  trans-42.4104.1153.642.90000110.2
225L45.1Very low41.9Very low156 Ų156164.8 Ų164.882%0.81783%0.833SS**  trans-62.4149.2155.1-75.9165.1000108.2K223K223-L225 PolarHBondContact O-N 2.89Å
226I47.3Very low41.9Very low164 Ų164163.9 Ų163.984%0.84183%0.826SS**  trans90.394.5167.3-44.8170.2000114.3
227Q38.8Very low41.7Very low184 Ų184162.3 Ų162.386%0.8682%0.823SS**  175.991.6112.4-170.6165.27.300111.1
228K38.6Very low42Very low208 Ų208159.2 Ų159.290%0.90483%0.825SS**  trans-146.575.2152.4-126.8179.2-174.8-176.90109.6
229V44.1Very low41.8Very low148 Ų148156.7 Ų156.790%0.89783%0.825SS**  trans-94.2102.6150.2168.90000105.1
230S40.4Very low42Very low178 Ų178158.7 Ų158.7100%1.24584%0.844SS**  trans176.20135.3-166.30000109.9

Retrieved 230 of 230 residues in 40 ms (Link to these results)