H9ZFL4_MACMU Loading...

Transmembrane protein 59

Acts as a regulator of autophagy in response to S.aureus infection by promoting activation of LC3 (MAP1LC3A, MAP1LC3B or MAP1LC3C). Acts by interacting with ATG16L1, leading to promote a functional complex between LC3 and ATG16L1 and promoting LC3 lipidation and subsequent activation of autophagy. Modulates the O-glycosylation and complex N-glycosylation steps occurring during the Golgi maturation of several proteins such as APP, BACE1, SEAP or PRNP. Inhibits APP transport to the cell surface and further shedding.

AlphaFold DB , UniProt , Accession H9ZFL4, Species MACMU (Macaca mulatta, Rhesus macaque), Gene TMEM59, Length 323 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
1M34Very low34.8Very low250 Ų250156.4 Ų156.4100%1.23286%0.856SS**  0131.30-61.3171.8-179.600107.3
2A34.1Very low34.6Very low100 Ų100154.3 Ų154.383%0.82685%0.851SS**  cis-164.6142.8-24.100000104
3A33.3Very low35.6Very low99 Ų99155.7 Ų155.782%0.81885%0.848SS**  trans-75.5163179.200000112.5
4P44.8Very low35.9Very low114 Ų114155.3 Ų155.374%0.7484%0.844SS**  trans-99.8148-17835.5-27.5000114.7
5K36.7Very low36.6Very low209 Ų209150.1 Ų150.191%0.90984%0.84SS**  trans69.598.6143.5-68.5173.5179.5177.90119.7
6A30.7Very low37Very low104 Ų104149.5 Ų149.586%0.8683%0.834SS**  trans-109.8126.6147.100000108.7
7S36.2Very low37.6Very low123 Ų123145.1 Ų145.186%0.8681%0.813SS**  trans-103.1113.5170.254.90000109.7
8L33.3Very low38.4Very low142 Ų142142.7 Ų142.774%0.74381%0.805SS**  trans-54.3134.9162.3-111.778.2000110.7V10L8-V10 HydrophobicContact CD2-CG2 3.71Å; L8-V10 HydrophobicContact CG-CG2 4.19Å
9W29.5Very low38.7Very low261 Ų261142.5 Ų142.599%0.98980%0.801SS**  trans-130.1124.5141.3-114.762.1000108.7
10V33.8Very low39.2Very low103 Ų103140.5 Ų140.562%0.62479%0.788SS**  trans-105.7141-170.9154.50000108.5L8L8-V10 HydrophobicContact CD2-CG2 3.71Å; L8-V10 HydrophobicContact CG-CG2 4.19Å
11R36.3Very low39.8Very low215 Ų215140.5 Ų140.581%0.81179%0.785SS**  trans81.9112.9153.1-132.8164.7-173.31630.5117.9
12T32.2Very low40.3Very low131 Ų131133.9 Ų133.980%0.80475%0.754SS**  -147.6102123-52.50000107.8
13Q48.3Very low41Very low173 Ų173133 Ų13381%0.80874%0.739SS**  trans-78.6112.6163.8-81.1-912400106.3
14L39.2Very low41.6Very low150 Ų150135.2 Ų135.279%0.78573%0.734SS**  trans-134119.2166.8-13976.3000107.6
15G46.6Very low41.6Very low77 Ų77133.6 Ų133.679%0.79473%0.73SS**PPolyproline II helixtrans-60.2133.6-163.300000114.7
16L43.5Very low41.8Very low141 Ų141130.5 Ų130.574%0.73872%0.723SS**PPolyproline II helixtrans-79.9141.2158.1-93.686.8000109.5L20L16-L20 HydrophobicContact CD2-CD1 4.26Å
17P46.4Very low42.3Very low74 Ų74129.4 Ų129.448%0.48171%0.714SS.*PPolyproline II helixtrans-73.1152.9-175.630.7-33.6000111.6L19 L20P17-L19 PolarHBondContact O-N 3.47Å; P17-L20 PolarHBondContact O-N 2.98Å
18P52.1Low42.5Very low103 Ų103127 Ų12767%0.66971%0.708SS**THydrogen-bonded Turntrans-63.2-11.3-177.4-17.129.6000114.7L20P18-L20 VanDerWaalsContact C-N 3.34Å; P18-L20 PolarHBondContact O-N 3.45Å
19L44.6Very low42.9Very low138 Ų138123.3 Ų123.372%0.72370%0.704SS**Hα-helixtrans-70.5-24.4-178.7-101.7121.6000113.9P17P17-L19 PolarHBondContact O-N 3.47Å
20L49.3Very low43.5Very low103 Ų103115.9 Ų115.954%0.53969%0.692SS.*Hα-helixtrans-82.6-16.2-177.8-113.8149.7000113.6L16 P17 P18 T23L16-L20 HydrophobicContact CD2-CD1 4.26Å; P17-L20 PolarHBondContact O-N 2.98Å; P18-L20 VanDerWaalsContact C-N 3.34Å; P18-L20 PolarHBondContact O-N 3.45Å; L20-T23 PolarHBondContact O-OG1 3.12Å; L20-T23 VanDerWaalsContact O-OG1 3.12Å
21L50.5Low43.8Very low140 Ų140114.1 Ų114.173%0.73370%0.695SS**Hα-helixtrans-86.8-27.1173.6-83.6153.8000112.1A25L21-A25 PolarHBondContact O-N 3.39Å
22L44.7Very low44Very low112 Ų112109.6 Ų109.659%0.58669%0.691SS**Hα-helixtrans-72.6-29.8175.6-98.8126000113A25 L26L22-A25 PolarHBondContact O-N 3.31Å; L22-L26 PolarHBondContact O-N 3.38Å
23T48.3Very low44.3Very low81 Ų81106.8 Ų106.850%0.49768%0.682SS.*Hα-helixtrans-71.1-30.1176.552.10000112.8L20 A27L20-T23 PolarHBondContact O-OG1 3.12Å; L20-T23 VanDerWaalsContact O-OG1 3.12Å; T23-A27 PolarHBondContact O-N 3.5Å
24M47.7Very low44Very low145 Ų145101.6 Ų101.671%0.71467%0.665SS**Hα-helixtrans-77.4-23.1175.2-64.1-61.9-78.800112.8
25A43.8Very low44.3Very low80 Ų8096.4 Ų96.466%0.66164%0.643SS**Hα-helixtrans-79.5-27175.200000113.2L21 L22L21-A25 PolarHBondContact O-N 3.39Å; L22-A25 PolarHBondContact O-N 3.31Å
26L40.8Very low44.4Very low145 Ų14599.8 Ų99.876%0.75964%0.638SS**Hα-helixtrans-86.6-12.9176.6-81149.6000113.8L22L22-L26 PolarHBondContact O-N 3.38Å
27A41.5Very low44.8Very low81 Ų8195.9 Ų95.967%0.66963%0.626SS**SBendtrans-94.9-5.7175.300000113.8T23T23-A27 PolarHBondContact O-N 3.5Å
28G40.6Very low45Very low72 Ų7297.9 Ų97.974%0.74263%0.628SS**SBendtrans-90.77-173.200000116.2
29G41.4Very low45.1Very low64 Ų6496 Ų9666%0.6661%0.612SS**SBendtrans-145.245-166.900000115.2
30S41.3Very low45.6Very low105 Ų10593.9 Ų93.973%0.73461%0.609SS**  trans-15056.6171.8-67.10000111.3
31G39.9Very low45.9Very low67 Ų6792.9 Ų92.969%0.69161%0.607SS**SBendtrans-93.6-12.5178.300000115.2
32T41.6Very low46.4Very low119 Ų11987.4 Ų87.473%0.7358%0.578SS**SBendtrans-117.7-17.6-166.956.30000114.9
33A39.4Very low47.4Very low73 Ų7382.3 Ų82.360%0.60355%0.552SS**Hα-helixtrans-86.2-24-177.900000114
34S40.8Very low48.5Very low64 Ų6484 Ų8445%0.44856%0.558SS.*Hα-helixtrans-78.4-27.6179.756.90000112.7A37 F38S34-A37 PolarHBondContact O-N 3.43Å; S34-F38 WeakPolarHBondContact O-CD2 3.21Å; S34-F38 PolarHBondContact O-N 3.43Å
35A46.3Very low50Low40 Ų4077.2 Ų77.233%0.33153%0.525SS..Hα-helixtrans-61.9-43.8176.600000111.4F38 D39A35-F38 PolarHBondContact O-N 3.38Å; A35-D39 PolarHBondContact O-N 3.48Å
36E47.5Very low51.9Low149 Ų14974.9 Ų74.970%0.69651%0.506SS*.Hα-helixtrans-70.5-35.7179.7-62.6-168.3151.900112.8F38 D39 S40E36-F38 VanDerWaalsContact C-N 3.32Å; E36-F38 PolarHBondContact O-N 3.42Å; E36-D39 PolarHBondContact O-N 3.12Å; E36-S40 PolarHBondContact O-N 3.32Å
37A52.2Low54.2Low59 Ų5969.9 Ų69.949%0.48848%0.483SS..Hα-helixtrans-62.6-39.8178.100000111.8S34 S40S34-A37 PolarHBondContact O-N 3.43Å; A37-S40 PolarHBondContact O-OG 3.24Å
38F50.9Low56.5Low116 Ų11666 Ų6651%0.50945%0.451SS..Hα-helixtrans-78.2-29.7176.1-68.9-67.2000113.1S34 A35 E36 S40 V41 L42S34-F38 WeakPolarHBondContact O-CD2 3.21Å; S34-F38 PolarHBondContact O-N 3.43Å; A35-F38 PolarHBondContact O-N 3.38Å; E36-F38 VanDerWaalsContact C-N 3.32Å; E36-F38 PolarHBondContact O-N 3.42Å; F38-S40 PolarHBondContact O-N 2.78Å; F38-V41 PolarHBondContact O-N 3.16Å; F38-V41 VanDerWaalsContact O-N 3.14Å; F38-L42 HydrophobicContact CB-CD1 3.94Å; F38-L42 VanDerWaalsContact O-CB 3.27Å; F38-L42 WeakPolarHBondContact O-CB 3.21Å; F38-L42 WeakPolarHBondContact O-CG 3.48Å; F38-L42 PolarHBondContact O-N 3.17Å
39D54.3Low58.8Low62 Ų6264.9 Ų64.933%0.33243%0.426SS..Hα-helixtrans-62.2-33.2174.5-92.1-26.7000112.2A35 E36 V41 G43A35-D39 PolarHBondContact O-N 3.48Å; E36-D39 PolarHBondContact O-N 3.12Å; D39-V41 PolarHBondContact O-N 2.96Å; D39-G43 PolarHBondContact O-N 2.96Å; D39-G43 VanDerWaalsContact O-N 3.11Å
40S55.4Low61.1Low94 Ų9469 Ų6966%0.65742%0.422SS*.Hα-helixtrans-62.4-30.4175.776.50000113.2E36 A37 F38E36-S40 PolarHBondContact O-N 3.32Å; A37-S40 PolarHBondContact O-OG 3.24Å; F38-S40 PolarHBondContact O-N 2.78Å
41V55.5Low63.4Low82 Ų8265.1 Ų65.150%0.49740%0.397SS..Hα-helixtrans-96.9-38-177.4177.60000112F38 D39 G43 F82F38-V41 PolarHBondContact O-N 3.16Å; F38-V41 VanDerWaalsContact O-N 3.14Å; D39-V41 PolarHBondContact O-N 2.96Å; V41-G43 VanDerWaalsContact C-N 3.3Å; V41-G43 PolarHBondContact O-N 2.93Å; V41-F82 HydrophobicContact CG1-CD2 4.31Å; V41-F82 HydrophobicContact CG1-CE2 3.89Å; V41-F82 HydrophobicContact CG1-CZ 4.3Å
42L61.3Low65.8Low25 Ų2562 Ų6213%0.13136%0.364CS..Hα-helixtrans-83-5.9-177.8-66.9170.6000113.2F38 S78 I79 F82F38-L42 HydrophobicContact CB-CD1 3.94Å; F38-L42 VanDerWaalsContact O-CB 3.27Å; F38-L42 WeakPolarHBondContact O-CB 3.21Å; F38-L42 WeakPolarHBondContact O-CG 3.48Å; F38-L42 PolarHBondContact O-N 3.17Å; L42-S78 WeakPolarHBondContact O-CB 3.48Å; L42-S78 PolarHBondContact O-OG 3.29Å; L42-I79 HydrophobicContact CD1-CG1 3.97Å; L42-I79 HydrophobicContact CD2-CB 4.35Å; L42-I79 HydrophobicContact CD2-CG1 3.69Å; L42-I79 HydrophobicContact CG-CG1 4.49Å; L42-F82 HydrophobicContact CD2-CB 4.37Å
43G64.2Low68.1Low5 Ų561.2 Ų61.25%0.05235%0.352CS..  trans82.1156.6-179.700000112.9D39 V41 T45D39-G43 PolarHBondContact O-N 2.96Å; D39-G43 VanDerWaalsContact O-N 3.11Å; V41-G43 VanDerWaalsContact C-N 3.3Å; V41-G43 PolarHBondContact O-N 2.93Å; G43-T45 PolarHBondContact O-N 2.95Å; G43-T45 VanDerWaalsContact O-N 3.09Å
44D71.4Confident70.4Confident116 Ų11664.7 Ų64.762%0.6236%0.359SS*.  trans-71.2105.6-170.9-163.1-2.6000111.3A46D44-A46 VanDerWaalsContact C-N 3.27Å; D44-A46 WeakPolarHBondContact OD1-CB 3.13Å; D44-A46 PolarHBondContact OD1-N 3.45Å
45T80.4Confident72.5Confident4 Ų465.1 Ų65.13%0.02536%0.359CS..THydrogen-bonded Turntrans-82.8-3.6178.954.90000112.8G43 S47 C48 H49G43-T45 PolarHBondContact O-N 2.95Å; G43-T45 VanDerWaalsContact O-N 3.09Å; T45-S47 PolarHBondContact O-N 3.25Å; T45-S47 VanDerWaalsContact O-N 3.14Å; T45-C48 PolarHBondContact O-N 3.38Å; T45-C48 VanDerWaalsContact O-N 3.11Å; T45-H49 PolarHBondContact O-N 3.46Å; T45-H49 PolarHBondContact OG1-CE1 2.71Å; T45-H49 VanDerWaalsContact OG1-CE1 3.31Å
46A84Confident74.3Confident31 Ų3163.9 Ų63.926%0.25635%0.347SS..Hα-helixtrans-58.5-32.4-175.900000113.4D44 R50D44-A46 VanDerWaalsContact C-N 3.27Å; D44-A46 WeakPolarHBondContact OD1-CB 3.13Å; D44-A46 PolarHBondContact OD1-N 3.45Å; A46-R50 WeakPolarHBondContact O-CG 2.96Å; A46-R50 PolarHBondContact O-N 2.94Å; A46-R50 VanDerWaalsContact O-N 3.09Å
47S87.6Confident75.6Confident39 Ų3958.2 Ų58.227%0.27332%0.323SS..Hα-helixtrans-66.4-46177.4-164.90000112.2T45 R50 A51 F123T45-S47 PolarHBondContact O-N 3.25Å; T45-S47 VanDerWaalsContact O-N 3.14Å; S47-R50 PolarHBondContact O-N 3.16Å; S47-A51 PolarHBondContact O-N 3.46Å; S47-A51 VanDerWaalsContact O-N 3.13Å; S47-F123 WeakPolarHBondContact OG-CE1 3.08Å; S47-F123 WeakPolarHBondContact OG-CZ 3.39Å
48C90Very high76.3Confident0 Ų060.2 Ų60.20%033%0.325CS..Hα-helixtrans-70.7-35.6177.3-175.70000112T45 R50 A51 C52 C74 G116T45-C48 PolarHBondContact O-N 3.38Å; T45-C48 VanDerWaalsContact O-N 3.11Å; C48-R50 VanDerWaalsContact C-N 3.31Å; C48-R50 PolarHBondContact O-N 3.05Å; C48-A51 WeakPolarHBondContact O-CA 2.91Å; C48-A51 WeakPolarHBondContact O-CB 3.22Å; C48-A51 PolarHBondContact O-N 3.12Å; C48-A51 VanDerWaalsContact O-N 3.09Å; C48-C52 PolarHBondContact O-N 3.46Å; C48-C74 HydrophobicContact CB-CB 3.7Å; C48-C74 WeakPolarHBondContact CB-SG 3.42Å; C48-C74 WeakPolarHBondContact SG-CB 3.35Å; C48-C74 CovalentContact SG-SG 2.04Å; C48-C74 PolarHBondContact SG-SG 2.96Å; C48-G116 PolarHBondContact SG-O 3.41Å; C48-G116 VanDerWaalsContact SG-O 3.42Å
49H90.4Very high77.1Confident48 Ų4862.5 Ų62.522%0.22234%0.336CS..Hα-helixtrans-59.9-40.4172.5-70.3173.6000112.4T45 C52 Q53 Q71T45-H49 PolarHBondContact O-N 3.46Å; T45-H49 PolarHBondContact OG1-CE1 2.71Å; T45-H49 VanDerWaalsContact OG1-CE1 3.31Å; H49-C52 PolarHBondContact O-N 3.33Å; H49-Q53 VanDerWaalsContact O-CG 3.32Å; H49-Q53 WeakPolarHBondContact O-CG 3.3Å; H49-Q53 PolarHBondContact O-N 3.39Å; H49-Q71 PolarHBondContact NE2-O 2.9Å
50R89.6Confident77.7Confident151 Ų15164 Ų6457%0.5735%0.348SS*.Hα-helixtrans-63.9-40.7172.8-72-173.4-144.61112.8111.8A46 S47 C48 Q53 L54A46-R50 WeakPolarHBondContact O-CG 2.96Å; A46-R50 PolarHBondContact O-N 2.94Å; A46-R50 VanDerWaalsContact O-N 3.09Å; S47-R50 PolarHBondContact O-N 3.16Å; C48-R50 VanDerWaalsContact C-N 3.31Å; C48-R50 PolarHBondContact O-N 3.05Å; R50-Q53 PolarHBondContact O-N 3.29Å; R50-L54 WeakPolarHBondContact O-CG 3.22Å; R50-L54 PolarHBondContact O-N 3.29Å
51A89.4Confident78.3Confident24 Ų2463.1 Ų63.120%0.19833%0.331CS..Hα-helixtrans-59.7-46.817500000111.2S47 C48 Q53 L54 T55S47-A51 PolarHBondContact O-N 3.46Å; S47-A51 VanDerWaalsContact O-N 3.13Å; C48-A51 WeakPolarHBondContact O-CA 2.91Å; C48-A51 WeakPolarHBondContact O-CB 3.22Å; C48-A51 PolarHBondContact O-N 3.12Å; C48-A51 VanDerWaalsContact O-N 3.09Å; A51-Q53 VanDerWaalsContact C-N 3.35Å; A51-Q53 PolarHBondContact O-N 3.23Å; A51-L54 PolarHBondContact O-N 3.42Å; A51-L54 VanDerWaalsContact O-N 3.16Å; A51-T55 PolarHBondContact O-N 3.1Å; A51-T55 PolarHBondContact O-OG1 3.04Å
52C90.5Very high78.7Confident0 Ų064.9 Ų64.90%034%0.344CS..Hα-helixtrans-59.2-41.5175.1-70.50000112.8C48 H49 L54 T55 Y56 C70 Q71C48-C52 PolarHBondContact O-N 3.46Å; H49-C52 PolarHBondContact O-N 3.33Å; C52-L54 VanDerWaalsContact C-N 3.31Å; C52-L54 PolarHBondContact O-N 3.31Å; C52-T55 PolarHBondContact O-N 3.16Å; C52-Y56 PolarHBondContact O-N 3.44Å; C52-C70 HydrophobicContact CB-CB 3.77Å; C52-C70 WeakPolarHBondContact CB-SG 3.24Å; C52-C70 WeakPolarHBondContact SG-CB 3.37Å; C52-C70 CovalentContact SG-SG 2.05Å; C52-C70 PolarHBondContact SG-SG 2.91Å; C52-Q71 HydrophobicContact CB-CG 4.29Å
53Q90Very high79.2Confident104 Ų10467.6 Ų67.649%0.48636%0.355SS..Hα-helixtrans-64.5-34.3177-73.2172.16.800112.9H49 R50 A51 L67H49-Q53 VanDerWaalsContact O-CG 3.32Å; H49-Q53 WeakPolarHBondContact O-CG 3.3Å; H49-Q53 PolarHBondContact O-N 3.39Å; R50-Q53 PolarHBondContact O-N 3.29Å; A51-Q53 VanDerWaalsContact C-N 3.35Å; A51-Q53 PolarHBondContact O-N 3.23Å; Q53-L67 HydrophobicContact CG-CD1 4.22Å
54L87.3Confident80Confident145 Ų14573.5 Ų73.576%0.75938%0.381SS*.Hα-helixtrans-74.5-33.6175.8-68.8171.9000112.1R50 A51 C52R50-L54 WeakPolarHBondContact O-CG 3.22Å; R50-L54 PolarHBondContact O-N 3.29Å; A51-L54 PolarHBondContact O-N 3.42Å; A51-L54 VanDerWaalsContact O-N 3.16Å; C52-L54 VanDerWaalsContact C-N 3.31Å; C52-L54 PolarHBondContact O-N 3.31Å
55T85.2Confident80.7Confident73 Ų7371.6 Ų71.645%0.44837%0.368SS..Hα-helixtrans-79.3-35.7179.1-48.50000113.1A51 C52 P57 L115A51-T55 PolarHBondContact O-N 3.1Å; A51-T55 PolarHBondContact O-OG1 3.04Å; C52-T55 PolarHBondContact O-N 3.16Å; T55-P57 WeakPolarHBondContact O-CD 3.06Å; T55-L115 HydrophobicContact CG2-CD2 3.54Å
56Y82.4Confident81Confident15 Ų1571.5 Ų71.56%0.05937%0.368CS..SBendtrans-115.764.9178-67.2-78.2000112C52 L58 Y61 E66 L67 C70 A112 L115C52-Y56 PolarHBondContact O-N 3.44Å; Y56-L58 PolarHBondContact O-N 3.29Å; Y56-Y61 HydrophobicContact CD1-CD2 4.03Å; Y56-Y61 HydrophobicContact CD1-CE2 4.4Å; Y56-Y61 HydrophobicContact CD1-CG 4.07Å; Y56-Y61 HydrophobicContact CE1-CD2 4.38Å; Y56-Y61 HydrophobicContact CE1-CE2 4.31Å; Y56-E66 HydrophobicContact CD1-CB 4.08Å; Y56-E66 HydrophobicContact CE1-CB 4.02Å; Y56-E66 WeakPolarHBondContact CE1-OE2 3.27Å; Y56-L67 WeakPolarHBondContact O-CD1 3.11Å; Y56-C70 HydrophobicContact CD2-CB 4.3Å; Y56-C70 HydrophobicContact CE2-CB 4.28Å; Y56-A112 HydrophobicContact CE2-CB 3.89Å; Y56-A112 WeakPolarHBondContact OH-CA 3.32Å; Y56-A112 WeakPolarHBondContact OH-CB 3.17Å; Y56-L115 HydrophobicContact CE2-CD2 3.71Å
57P75.4Confident81.3Confident30 Ų3071.4 Ų71.420%0.19536%0.362CS..  trans-74.4134.5179.733.6-36000109.9T55 H59 T60 Y61T55-P57 WeakPolarHBondContact O-CD 3.06Å; P57-H59 WeakPolarHBondContact CB-CE1 3.4Å; P57-H59 WeakPolarHBondContact CB-ND1 3.33Å; P57-H59 PolarHBondContact O-N 3.37Å; P57-T60 PolarHBondContact O-N 2.97Å; P57-Y61 PolarHBondContact O-N 3.39Å
58L67.6Low81.4Confident101 Ų10176.3 Ų76.353%0.52938%0.376SS..THydrogen-bonded Turntrans-53.3-23.6-177.5-101.472.6000114.6Y56 Y61 E64Y56-L58 PolarHBondContact O-N 3.29Å; L58-Y61 WeakPolarHBondContact CA-O 3.27Å; L58-E64 HydrophobicContact CD1-CG 4.33Å; L58-E64 HydrophobicContact CD2-CG 4.42Å; L58-E64 HydrophobicContact CG-CG 4.33Å
59H66.4Low81.5Confident163 Ų16376.4 Ų76.476%0.75538%0.377SS*.THydrogen-bonded Turntrans-77.5-26.2179.969.4-91.7000113.5P57P57-H59 WeakPolarHBondContact CB-CE1 3.4Å; P57-H59 WeakPolarHBondContact CB-ND1 3.33Å; P57-H59 PolarHBondContact O-N 3.37Å
60T67.3Low81.6Confident95 Ų9574.1 Ų74.158%0.58337%0.366SS*.THydrogen-bonded Turntrans-101.8-28.7178.9-50.40000110.8P57P57-T60 PolarHBondContact O-N 2.97Å
61Y68.8Low81.7Confident75 Ų7568.9 Ų68.929%0.29435%0.348SS..  trans-118.5103.7-178.5-130.6-78.6000110.2Y56 P57 L58 K63 E66Y56-Y61 HydrophobicContact CD1-CD2 4.03Å; Y56-Y61 HydrophobicContact CD1-CE2 4.4Å; Y56-Y61 HydrophobicContact CD1-CG 4.07Å; Y56-Y61 HydrophobicContact CE1-CD2 4.38Å; Y56-Y61 HydrophobicContact CE1-CE2 4.31Å; P57-Y61 PolarHBondContact O-N 3.39Å; L58-Y61 WeakPolarHBondContact CA-O 3.27Å; Y61-K63 HydrophobicContact CD1-CB 4.06Å; Y61-K63 HydrophobicContact CE1-CB 4.17Å; Y61-K63 HydrophobicContact CE1-CD 4.26Å; Y61-K63 PolarHBondContact O-N 3.07Å; Y61-E66 HydrophobicContact CE1-CG 4.09Å; Y61-E66 WeakPolarHBondContact CE1-OE1 3.43Å; Y61-E66 WeakPolarHBondContact CE1-OE2 3.42Å; Y61-E66 PolarHBondContact OH-OE1 3.47Å; Y61-E66 PolarHBondContact OH-OE2 2.88Å
62P62.7Low81.8Confident118 Ų11874.6 Ų74.677%0.76637%0.365SS*.  trans-73.7-8.8-175.829.3-34.5000113.4
63K73.6Confident82Confident82 Ų8274.6 Ų74.636%0.35737%0.365SS..  trans-100.6111-178.4-68.3170.4149.4-134.50110.2Y61 E65Y61-K63 HydrophobicContact CD1-CB 4.06Å; Y61-K63 HydrophobicContact CE1-CB 4.17Å; Y61-K63 HydrophobicContact CE1-CD 4.26Å; Y61-K63 PolarHBondContact O-N 3.07Å; K63-E65 HydrophobicContact CB-CG 4.04Å; K63-E65 WeakPolarHBondContact CD-OE1 3.41Å; K63-E65 WeakPolarHBondContact CE-OE1 3.49Å; K63-E65 IonicContact NZ-OE1 3.62Å; K63-E65 PolarHBondContact NZ-OE1 3.37Å; K63-E65 PolarHBondContact O-N 3.14Å
64E80.1Confident82.1Confident130 Ų13069.7 Ų69.761%0.60734%0.341SS*.Hα-helixtrans-71.6-16.5177.2-64.8178.6173.800113L58 E66 L67 Y68L58-E64 HydrophobicContact CD1-CG 4.33Å; L58-E64 HydrophobicContact CD2-CG 4.42Å; L58-E64 HydrophobicContact CG-CG 4.33Å; E64-E66 VanDerWaalsContact C-N 3.33Å; E64-E66 PolarHBondContact O-N 2.82Å; E64-L67 PolarHBondContact O-N 2.77Å; E64-Y68 PolarHBondContact O-N 3.42Å; E64-Y68 VanDerWaalsContact O-N 3.12Å
65E85.4Confident82.3Confident76 Ų7667.8 Ų67.836%0.35532%0.324SS..Hα-helixtrans-61.2-37.7-177.666.7-15317400112.7K63 Y68 A69 E109K63-E65 HydrophobicContact CB-CG 4.04Å; K63-E65 WeakPolarHBondContact CD-OE1 3.41Å; K63-E65 WeakPolarHBondContact CE-OE1 3.49Å; K63-E65 IonicContact NZ-OE1 3.62Å; K63-E65 PolarHBondContact NZ-OE1 3.37Å; K63-E65 PolarHBondContact O-N 3.14Å; E65-Y68 PolarHBondContact O-N 3.37Å; E65-A69 WeakPolarHBondContact O-CB 3.47Å; E65-A69 PolarHBondContact O-N 3.12Å; E65-E109 HydrophobicContact CG-CG 4.32Å
66E87.3Confident82.7Confident2 Ų266.6 Ų66.61%0.00932%0.315CS..Hα-helixtrans-72.6-38.8179-62-174.4-162.100112.7Y56 Y61 E64 Y68 A69 C70 D108 A112Y56-E66 HydrophobicContact CD1-CB 4.08Å; Y56-E66 HydrophobicContact CE1-CB 4.02Å; Y56-E66 WeakPolarHBondContact CE1-OE2 3.27Å; Y61-E66 HydrophobicContact CE1-CG 4.09Å; Y61-E66 WeakPolarHBondContact CE1-OE1 3.43Å; Y61-E66 WeakPolarHBondContact CE1-OE2 3.42Å; Y61-E66 PolarHBondContact OH-OE1 3.47Å; Y61-E66 PolarHBondContact OH-OE2 2.88Å; E64-E66 VanDerWaalsContact C-N 3.33Å; E64-E66 PolarHBondContact O-N 2.82Å; E66-Y68 VanDerWaalsContact C-N 3.31Å; E66-Y68 PolarHBondContact O-N 3.33Å; E66-A69 PolarHBondContact O-N 3.46Å; E66-C70 PolarHBondContact O-N 3.02Å; E66-D108 HydrophobicContact CG-CB 4.44Å; E66-D108 WeakPolarHBondContact OE1-CB 3.26Å; E66-A112 HydrophobicContact CB-CB 4.01Å; E66-A112 VanDerWaalsContact O-CB 3.27Å; E66-A112 WeakPolarHBondContact O-CB 3.13Å
67L89.8Confident83.1Confident28 Ų2865.9 Ų65.915%0.14731%0.312CS..Hα-helixtrans-63.3-41.4175.3178.5131.5000110.8Q53 Y56 E64 C70 Q71Q53-L67 HydrophobicContact CG-CD1 4.22Å; Y56-L67 WeakPolarHBondContact O-CD1 3.11Å; E64-L67 PolarHBondContact O-N 2.77Å; L67-C70 PolarHBondContact O-N 3.09Å; L67-Q71 WeakPolarHBondContact O-CG 3.3Å; L67-Q71 PolarHBondContact O-N 2.04Å; L67-Q71 VanDerWaalsContact O-N 3.12Å
68Y89.4Confident83.8Confident143 Ų14364.6 Ų64.656%0.56130%0.304SS*.Hα-helixtrans-66.6-39.7175.4-171.2-100.3000111.9E64 E65 E66 C70 Q71 R72E64-Y68 PolarHBondContact O-N 3.42Å; E64-Y68 VanDerWaalsContact O-N 3.12Å; E65-Y68 PolarHBondContact O-N 3.37Å; E66-Y68 VanDerWaalsContact C-N 3.31Å; E66-Y68 PolarHBondContact O-N 3.33Å; Y68-C70 VanDerWaalsContact C-N 3.34Å; Y68-C70 PolarHBondContact O-N 3.25Å; Y68-Q71 PolarHBondContact O-N 3.45Å; Y68-R72 WeakPolarHBondContact O-CB 3.44Å; Y68-R72 PolarHBondContact O-N 3.17Å
69A92.9Very high84.8Confident1 Ų163 Ų631%0.00830%0.295CS..Hα-helixtrans-61.2-41.317500000112.3E65 E66 R72 G73 Y104 E109 A112E65-A69 WeakPolarHBondContact O-CB 3.47Å; E65-A69 PolarHBondContact O-N 3.12Å; E66-A69 PolarHBondContact O-N 3.46Å; A69-R72 PolarHBondContact O-N 3.36Å; A69-G73 PolarHBondContact O-N 3.46Å; A69-Y104 HydrophobicContact CB-CE1 4.15Å; A69-Y104 HydrophobicContact CB-CE2 4.3Å; A69-E109 HydrophobicContact CB-CB 4.23Å; A69-A112 HydrophobicContact CB-CB 4.16Å
70C93.1Very high85.9Confident0 Ų056 Ų560%026%0.264CS..Hα-helixtrans-62.2-48175.3-173.30000112.5C52 Y56 E66 L67 Y68 R72 G73 C74 A112 G116C52-C70 HydrophobicContact CB-CB 3.77Å; C52-C70 WeakPolarHBondContact CB-SG 3.24Å; C52-C70 WeakPolarHBondContact SG-CB 3.37Å; C52-C70 CovalentContact SG-SG 2.05Å; C52-C70 PolarHBondContact SG-SG 2.91Å; Y56-C70 HydrophobicContact CD2-CB 4.3Å; Y56-C70 HydrophobicContact CE2-CB 4.28Å; E66-C70 PolarHBondContact O-N 3.02Å; L67-C70 PolarHBondContact O-N 3.09Å; Y68-C70 VanDerWaalsContact C-N 3.34Å; Y68-C70 PolarHBondContact O-N 3.25Å; C70-R72 VanDerWaalsContact C-N 3.27Å; C70-R72 PolarHBondContact O-N 3.33Å; C70-G73 WeakPolarHBondContact O-CA 3.1Å; C70-G73 PolarHBondContact O-N 3.42Å; C70-G73 VanDerWaalsContact O-N 3.09Å; C70-C74 PolarHBondContact O-N 2.94Å; C70-C74 PolarHBondContact O-SG 2.95Å; C70-A112 VanDerWaalsContact CA-O 3.26Å; C70-A112 WeakPolarHBondContact CA-O 3.42Å; C70-A112 HydrophobicContact CB-CB 4.39Å; C70-A112 WeakPolarHBondContact CB-O 3.07Å; C70-G116 WeakPolarHBondContact O-CA 3.46Å
71Q91.8Very high86.8Confident41 Ų4153 Ų5319%0.19224%0.244CC..Hα-helixtrans-60.9-39.3176.8-69.51763.900111.7H49 C52 L67 Y68 G73 C74 R75H49-Q71 PolarHBondContact NE2-O 2.9Å; C52-Q71 HydrophobicContact CB-CG 4.29Å; L67-Q71 WeakPolarHBondContact O-CG 3.3Å; L67-Q71 PolarHBondContact O-N 2.04Å; L67-Q71 VanDerWaalsContact O-N 3.12Å; Y68-Q71 PolarHBondContact O-N 3.45Å; Q71-G73 VanDerWaalsContact C-N 3.31Å; Q71-G73 PolarHBondContact O-N 3.42Å; Q71-C74 WeakPolarHBondContact O-CB 3.47Å; Q71-C74 PolarHBondContact O-N 3.25Å; Q71-R75 PolarHBondContact O-N 2.91Å
72R91.6Very high87.5Confident145 Ų14555.6 Ų55.655%0.54726%0.257SS..Hα-helixtrans-63.9-37.7175.3-155.9179-170.5175.6-1.9112Y68 A69 C70 R75 L76 Y104Y68-R72 WeakPolarHBondContact O-CB 3.44Å; Y68-R72 PolarHBondContact O-N 3.17Å; A69-R72 PolarHBondContact O-N 3.36Å; C70-R72 VanDerWaalsContact C-N 3.27Å; C70-R72 PolarHBondContact O-N 3.33Å; R72-R75 PolarHBondContact O-N 3.3Å; R72-L76 WeakPolarHBondContact O-CB 3.19Å; R72-L76 PolarHBondContact O-N 2.97Å; R72-Y104 VanDerWaalsContact CD-OH 3.24Å; R72-Y104 WeakPolarHBondContact CD-OH 3.42Å
73G93.3Very high88.6Confident0 Ų055.2 Ų55.20%025%0.252CS..Hα-helixtrans-60.8-44.217200000112.9A69 C70 Q71 R75 L76 F77A69-G73 PolarHBondContact O-N 3.46Å; C70-G73 WeakPolarHBondContact O-CA 3.1Å; C70-G73 PolarHBondContact O-N 3.42Å; C70-G73 VanDerWaalsContact O-N 3.09Å; Q71-G73 VanDerWaalsContact C-N 3.31Å; Q71-G73 PolarHBondContact O-N 3.42Å; G73-R75 VanDerWaalsContact C-N 3.31Å; G73-R75 PolarHBondContact O-N 2.92Å; G73-L76 PolarHBondContact O-N 3.23Å; G73-F77 PolarHBondContact O-N 3.4Å
74C92.7Very high89Confident0 Ų053 Ų530%024%0.244CC..Hα-helixtrans-56-46174.8-60.50000111.6C48 C70 Q71 S78C48-C74 HydrophobicContact CB-CB 3.7Å; C48-C74 WeakPolarHBondContact CB-SG 3.42Å; C48-C74 WeakPolarHBondContact SG-CB 3.35Å; C48-C74 CovalentContact SG-SG 2.04Å; C48-C74 PolarHBondContact SG-SG 2.96Å; C70-C74 PolarHBondContact O-N 2.94Å; C70-C74 PolarHBondContact O-SG 2.95Å; Q71-C74 WeakPolarHBondContact O-CB 3.47Å; Q71-C74 PolarHBondContact O-N 3.25Å; C74-S78 PolarHBondContact O-N 3.4Å
75R92Very high88.6Confident106 Ų10653.5 Ų53.540%0.425%0.251SS..Hα-helixtrans-68.6-38.1178.6-174.3177.2177173.52112.5Q71 R72 G73 F77 S78 I79Q71-R75 PolarHBondContact O-N 2.91Å; R72-R75 PolarHBondContact O-N 3.3Å; G73-R75 VanDerWaalsContact C-N 3.31Å; G73-R75 PolarHBondContact O-N 2.92Å; R75-F77 VanDerWaalsContact C-N 3.34Å; R75-S78 WeakPolarHBondContact O-CB 3.5Å; R75-S78 PolarHBondContact O-N 3.15Å; R75-I79 HydrophobicContact CG-CD1 4.32Å; R75-I79 WeakPolarHBondContact O-CG1 3.09Å; R75-I79 PolarHBondContact O-N 3.28Å
76L92.3Very high87.9Confident47 Ų4750.2 Ų50.225%0.24624%0.237CC..Hα-helixtrans-63.1-42.2178.9-175.262.4000111.4R72 G73 S78 I79 C80 A99R72-L76 WeakPolarHBondContact O-CB 3.19Å; R72-L76 PolarHBondContact O-N 2.97Å; G73-L76 PolarHBondContact O-N 3.23Å; L76-S78 VanDerWaalsContact C-N 3.35Å; L76-S78 PolarHBondContact O-N 3.15Å; L76-I79 WeakPolarHBondContact O-CB 3.39Å; L76-I79 PolarHBondContact O-N 3.27Å; L76-I79 VanDerWaalsContact O-N 3.09Å; L76-C80 PolarHBondContact O-N 3.49Å; L76-C80 PolarHBondContact O-SG 3.36Å; L76-A99 HydrophobicContact CD2-CB 3.79Å
77F92.2Very high87.4Confident0 Ų055.9 Ų55.90%027%0.267CS..Hα-helixtrans-57.9-46.5176.2-176.2-82.1000111.9G73 R75 I79 C80 Q81 L89 K93 C96 C117 Q120 L121 A124G73-F77 PolarHBondContact O-N 3.4Å; R75-F77 VanDerWaalsContact C-N 3.34Å; F77-I79 PolarHBondContact O-N 3.14Å; F77-C80 PolarHBondContact O-N 2.98Å; F77-Q81 HydrophobicContact CE1-CB 4.42Å; F77-Q81 WeakPolarHBondContact O-CB 3.12Å; F77-Q81 PolarHBondContact O-N 3.34Å; F77-L89 HydrophobicContact CE1-CD2 4.36Å; F77-L89 HydrophobicContact CZ-CD2 4.08Å; F77-K93 HydrophobicContact CE2-CB 4.02Å; F77-C96 HydrophobicContact CD2-CB 4.25Å; F77-C96 PolarHBondContact N-SG 2.98Å; F77-C117 HydrophobicContact CD2-CB 4.47Å; F77-Q120 HydrophobicContact CB-CB 3.97Å; F77-Q120 HydrophobicContact CB-CG 3.97Å; F77-Q120 HydrophobicContact CD1-CB 3.8Å; F77-Q120 HydrophobicContact CD1-CG 3.35Å; F77-Q120 HydrophobicContact CE1-CG 4.13Å; F77-Q120 HydrophobicContact CG-CB 3.86Å; F77-Q120 HydrophobicContact CG-CG 3.86Å; F77-L121 HydrophobicContact CE2-CD1 3.99Å; F77-L121 HydrophobicContact CZ-CB 4.47Å; F77-L121 HydrophobicContact CZ-CD1 3.79Å; F77-A124 HydrophobicContact CE1-CB 3.57Å; F77-A124 HydrophobicContact CZ-CB 4.23Å
78S89.3Confident87.2Confident3 Ų358.6 Ų58.62%0.02128%0.281CS..Hα-helixtrans-57.9-36.6175.6-79.30000113.1L42 C74 R75 L76 F82L42-S78 WeakPolarHBondContact O-CB 3.48Å; L42-S78 PolarHBondContact O-OG 3.29Å; C74-S78 PolarHBondContact O-N 3.4Å; R75-S78 WeakPolarHBondContact O-CB 3.5Å; R75-S78 PolarHBondContact O-N 3.15Å; L76-S78 VanDerWaalsContact C-N 3.35Å; L76-S78 PolarHBondContact O-N 3.15Å; S78-F82 PolarHBondContact O-N 3.09Å; S78-F82 VanDerWaalsContact O-N 3.12Å
79I88.6Confident87.2Confident67 Ų6752.6 Ų52.634%0.34426%0.259SS..Hα-helixtrans-69.2-46.5176.7-63.5163.8000110.3L42 R75 L76 F77 Q81 F82 V83L42-I79 HydrophobicContact CD1-CG1 3.97Å; L42-I79 HydrophobicContact CD2-CB 4.35Å; L42-I79 HydrophobicContact CD2-CG1 3.69Å; L42-I79 HydrophobicContact CG-CG1 4.49Å; R75-I79 HydrophobicContact CG-CD1 4.32Å; R75-I79 WeakPolarHBondContact O-CG1 3.09Å; R75-I79 PolarHBondContact O-N 3.28Å; L76-I79 WeakPolarHBondContact O-CB 3.39Å; L76-I79 PolarHBondContact O-N 3.27Å; L76-I79 VanDerWaalsContact O-N 3.09Å; F77-I79 PolarHBondContact O-N 3.14Å; I79-Q81 VanDerWaalsContact C-N 3.31Å; I79-Q81 PolarHBondContact O-N 2.94Å; I79-F82 PolarHBondContact O-N 3.38Å; I79-V83 WeakPolarHBondContact O-CG2 3.07Å; I79-V83 PolarHBondContact O-N 3.11Å; I79-V83 VanDerWaalsContact O-N 3.14Å
80C89Confident87.1Confident17 Ų1758.1 Ų58.112%0.11529%0.288CS..Hα-helixtrans-59.6-42.3176.4-66.60000111.5L76 F77 F82 V83 D84L76-C80 PolarHBondContact O-N 3.49Å; L76-C80 PolarHBondContact O-SG 3.36Å; F77-C80 PolarHBondContact O-N 2.98Å; C80-F82 VanDerWaalsContact C-N 3.31Å; C80-F82 PolarHBondContact O-N 3.35Å; C80-V83 PolarHBondContact O-N 2.86Å; C80-D84 PolarHBondContact O-N 3.09Å; C80-D84 VanDerWaalsContact O-N 3.08Å
81Q87.7Confident87.1Confident32 Ų3263.7 Ų63.715%0.1531%0.309CS..Hα-helixtrans-61.2-39.6176.5-173.9-179.31000112.5F77 I79 V83 G86 L89F77-Q81 HydrophobicContact CE1-CB 4.42Å; F77-Q81 WeakPolarHBondContact O-CB 3.12Å; F77-Q81 PolarHBondContact O-N 3.34Å; I79-Q81 VanDerWaalsContact C-N 3.31Å; I79-Q81 PolarHBondContact O-N 2.94Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-G86 PolarHBondContact O-N 3.09Å; Q81-G86 VanDerWaalsContact O-N 3.1Å; Q81-L89 HydrophobicContact CG-CD2 4.41Å
82F83.9Confident87.1Confident130 Ų13061.8 Ų61.857%0.5730%0.3SS*.Hα-helixtrans-68.1-32.1178-179.9-98.1000112.8V41 L42 S78 I79 C80V41-F82 HydrophobicContact CG1-CD2 4.31Å; V41-F82 HydrophobicContact CG1-CE2 3.89Å; V41-F82 HydrophobicContact CG1-CZ 4.3Å; L42-F82 HydrophobicContact CD2-CB 4.37Å; S78-F82 PolarHBondContact O-N 3.09Å; S78-F82 VanDerWaalsContact O-N 3.12Å; I79-F82 PolarHBondContact O-N 3.38Å; C80-F82 VanDerWaalsContact C-N 3.31Å; C80-F82 PolarHBondContact O-N 3.35Å
83V85.6Confident87.2Confident110 Ų11056.7 Ų56.767%0.66728%0.282SS*.Hα-helixtrans-81.8-34.7-178.21750000112.8I79 C80 Q81 D85I79-V83 WeakPolarHBondContact O-CG2 3.07Å; I79-V83 PolarHBondContact O-N 3.11Å; I79-V83 VanDerWaalsContact O-N 3.14Å; C80-V83 PolarHBondContact O-N 2.86Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; V83-D85 VanDerWaalsContact C-N 3.32Å; V83-D85 PolarHBondContact O-N 3.13Å
84D80.6Confident87.2Confident35 Ų3562 Ų6219%0.18731%0.31CS..THydrogen-bonded Turntrans-9318.8-177.9-163.442000113C80 G86 R91 T92C80-D84 PolarHBondContact O-N 3.09Å; C80-D84 VanDerWaalsContact O-N 3.08Å; D84-G86 PolarHBondContact O-N 3.03Å; D84-R91 IonicContact OD1-NH1 3.43Å; D84-R91 IonicContact OD2-NH1 3.39Å; D84-T92 HydrophobicContact CB-CG2 3.74Å
85D72.3Confident87.3Confident140 Ų14065.1 Ų65.175%0.74933%0.325SS*.THydrogen-bonded Turntrans56.59.7-177-63.3-39000115.2V83 I87V83-D85 VanDerWaalsContact C-N 3.32Å; V83-D85 PolarHBondContact O-N 3.13Å; D85-I87 HydrophobicContact CB-CD1 4.34Å; D85-I87 HydrophobicContact CB-CG1 4.22Å; D85-I87 PolarHBondContact O-N 3.29Å
86G71.5Confident87.4Confident7 Ų760.1 Ų60.17%0.07231%0.305CS..THydrogen-bonded Turntrans64.619.5177.300000115.1Q81 D84 Q128Q81-G86 PolarHBondContact O-N 3.09Å; Q81-G86 VanDerWaalsContact O-N 3.1Å; D84-G86 PolarHBondContact O-N 3.03Å; G86-Q128 PolarHBondContact O-NE2 2.96Å; G86-Q128 VanDerWaalsContact O-NE2 3.11Å; G86-Q128 PolarHBondContact O-OE1 3.48Å; G86-Q128 VanDerWaalsContact O-OE1 3.11Å
87I75.3Confident87.5Confident122 Ų12259.8 Ų59.863%0.62630%0.303SS*.SBendtrans-71.7-48.2-177-57.2175.1000110.5D85D85-I87 HydrophobicContact CB-CD1 4.34Å; D85-I87 HydrophobicContact CB-CG1 4.22Å; D85-I87 PolarHBondContact O-N 3.29Å
88D86.3Confident87.6Confident84 Ų8462.9 Ų62.945%0.44932%0.324SS..  trans-114.290-177.1-73.7-32.8000111.5N90 R91 T92D88-N90 PolarHBondContact O-N 3.11Å; D88-R91 HydrophobicContact CB-CB 3.86Å; D88-R91 PolarHBondContact O-N 2.93Å; D88-T92 PolarHBondContact O-N 3.36Å; D88-T92 PolarHBondContact O-OG1 3.42Å
89L88.8Confident87.9Confident18 Ų1864.1 Ų64.19%0.09434%0.335CS..Hα-helixtrans-59.5-30.4179-72.5169000113.8F77 Q81 T92 K93 L121 A124 E125 Q128F77-L89 HydrophobicContact CE1-CD2 4.36Å; F77-L89 HydrophobicContact CZ-CD2 4.08Å; Q81-L89 HydrophobicContact CG-CD2 4.41Å; L89-T92 VanDerWaalsContact CA-OG1 3.27Å; L89-T92 WeakPolarHBondContact CA-OG1 3.46Å; L89-T92 PolarHBondContact O-OG1 3.16Å; L89-K93 WeakPolarHBondContact O-CB 3.38Å; L89-K93 PolarHBondContact O-N 3.38Å; L89-L121 HydrophobicContact CB-CD1 3.76Å; L89-L121 WeakPolarHBondContact O-CD1 3.39Å; L89-A124 HydrophobicContact CD2-CB 3.69Å; L89-E125 HydrophobicContact CD1-CB 4.09Å; L89-E125 HydrophobicContact CD1-CG 3.35Å; L89-Q128 VanDerWaalsContact CD1-OE1 3.23Å
90N92.1Very high88.2Confident117 Ų11761 Ų6163%0.62632%0.319SS*.Hα-helixtrans-69.8-32173.9-78.6-33.9000113D88 L94D88-N90 PolarHBondContact O-N 3.11Å; N90-L94 PolarHBondContact O-N 3.4Å
91R91.9Very high88.5Confident117 Ų11763.5 Ų63.544%0.44233%0.334SS..Hα-helixtrans-74.7-47.2176.3-177.7123.27168.26.3110.6D84 D88 K93 L94 E95D84-R91 IonicContact OD1-NH1 3.43Å; D84-R91 IonicContact OD2-NH1 3.39Å; D88-R91 HydrophobicContact CB-CB 3.86Å; D88-R91 PolarHBondContact O-N 2.93Å; R91-K93 PolarHBondContact O-N 3.4Å; R91-L94 WeakPolarHBondContact O-CB 3.36Å; R91-L94 PolarHBondContact O-N 3.43Å; R91-E95 HydrophobicContact CG-CG 4.4Å; R91-E95 WeakPolarHBondContact CG-OE1 3.12Å; R91-E95 IonicContact NH1-OE1 3.61Å; R91-E95 PolarHBondContact NH1-OE1 3.06Å; R91-E95 WeakPolarHBondContact O-CG 3.44Å; R91-E95 PolarHBondContact O-N 3.37Å
92T92.1Very high88.8Confident0 Ų070.2 Ų70.20%037%0.365CS..Hα-helixtrans-56.6-35.3175.354.60000112.1D84 D88 L89 E95 C96D84-T92 HydrophobicContact CB-CG2 3.74Å; D88-T92 PolarHBondContact O-N 3.36Å; D88-T92 PolarHBondContact O-OG1 3.42Å; L89-T92 VanDerWaalsContact CA-OG1 3.27Å; L89-T92 WeakPolarHBondContact CA-OG1 3.46Å; L89-T92 PolarHBondContact O-OG1 3.16Å; T92-E95 PolarHBondContact O-N 3.45Å; T92-C96 WeakPolarHBondContact O-CB 3.1Å; T92-C96 PolarHBondContact O-N 2.87Å
93K93.6Very high89.2Confident39 Ų3967.4 Ų67.417%0.1737%0.366CS..Hα-helixtrans-59.7-51.3170.2-178.9-175.1165-175.50112.6F77 L89 R91 E95 C96 E97 L121F77-K93 HydrophobicContact CE2-CB 4.02Å; L89-K93 WeakPolarHBondContact O-CB 3.38Å; L89-K93 PolarHBondContact O-N 3.38Å; R91-K93 PolarHBondContact O-N 3.4Å; K93-E95 VanDerWaalsContact C-N 3.27Å; K93-E95 PolarHBondContact O-N 2.04Å; K93-C96 WeakPolarHBondContact O-CB 3.48Å; K93-C96 PolarHBondContact O-N 3.27Å; K93-E97 WeakPolarHBondContact CE-OE1 3.44Å; K93-E97 IonicContact NZ-OE1 2.78Å; K93-E97 WeakPolarHBondContact O-CG 3.5Å; K93-E97 PolarHBondContact O-N 3.23Å; K93-L121 HydrophobicContact CB-CD1 4.37Å; K93-L121 HydrophobicContact CD-CD2 4.29Å
94L93.6Very high89.5Confident110 Ų11063.3 Ų63.358%0.57634%0.338SS*.Hα-helixtrans-61.6-38.4179.9-79.5160.9000111.6N90 R91 E97 S98N90-L94 PolarHBondContact O-N 3.4Å; R91-L94 WeakPolarHBondContact O-CB 3.36Å; R91-L94 PolarHBondContact O-N 3.43Å; L94-E97 PolarHBondContact O-N 3.12Å; L94-S98 WeakPolarHBondContact O-CB 3.36Å; L94-S98 PolarHBondContact O-N 3.45Å; L94-S98 PolarHBondContact O-OG 3.01Å
95E93.8Very high89.9Confident67 Ų6767.6 Ų67.631%0.31337%0.371SS..Hα-helixtrans-64.6-44175.4-70.3176.4-170.400111.1R91 T92 K93 S98 A99R91-E95 HydrophobicContact CG-CG 4.4Å; R91-E95 WeakPolarHBondContact CG-OE1 3.12Å; R91-E95 IonicContact NH1-OE1 3.61Å; R91-E95 PolarHBondContact NH1-OE1 3.06Å; R91-E95 WeakPolarHBondContact O-CG 3.44Å; R91-E95 PolarHBondContact O-N 3.37Å; T92-E95 PolarHBondContact O-N 3.45Å; K93-E95 VanDerWaalsContact C-N 3.27Å; K93-E95 PolarHBondContact O-N 2.04Å; E95-S98 WeakPolarHBondContact CA-OG 3.42Å; E95-S98 PolarHBondContact O-N 3.09Å; E95-S98 PolarHBondContact O-OG 3.42Å; E95-A99 WeakPolarHBondContact O-CB 3.42Å; E95-A99 PolarHBondContact O-N 2.96Å
96C94.8Very high90.8Very high0 Ų065 Ų650%036%0.355CS..Hα-helixtrans-59.5-47.7173.6-171.50000112F77 T92 K93 S98 A99 C100 C117F77-C96 HydrophobicContact CD2-CB 4.25Å; F77-C96 PolarHBondContact N-SG 2.98Å; T92-C96 WeakPolarHBondContact O-CB 3.1Å; T92-C96 PolarHBondContact O-N 2.87Å; K93-C96 WeakPolarHBondContact O-CB 3.48Å; K93-C96 PolarHBondContact O-N 3.27Å; C96-S98 VanDerWaalsContact C-N 3.34Å; C96-S98 PolarHBondContact O-N 2.05Å; C96-A99 PolarHBondContact O-N 3.3Å; C96-C100 PolarHBondContact O-N 3.23Å; C96-C100 PolarHBondContact O-SG 3.09Å; C96-C100 VanDerWaalsContact O-SG 3.38Å; C96-C117 VanDerWaalsContact C-SG 3.54Å; C96-C117 HydrophobicContact CB-CB 3.79Å; C96-C117 WeakPolarHBondContact CB-SG 2.83Å; C96-C117 WeakPolarHBondContact SG-CB 3.46Å; C96-C117 CovalentContact SG-SG 2.04Å; C96-C117 PolarHBondContact SG-SG 3.1Å
97E95.1Very high91.6Very high40 Ų4068.5 Ų68.519%0.18738%0.378CS..Hα-helixtrans-61.3-42.3176.6-72.8179.5175.300111.4K93 L94 A99 C100 T101 H114 C117K93-E97 WeakPolarHBondContact CE-OE1 3.44Å; K93-E97 IonicContact NZ-OE1 2.78Å; K93-E97 WeakPolarHBondContact O-CG 3.5Å; K93-E97 PolarHBondContact O-N 3.23Å; L94-E97 PolarHBondContact O-N 3.12Å; E97-A99 VanDerWaalsContact C-N 3.35Å; E97-A99 PolarHBondContact O-N 3.42Å; E97-C100 WeakPolarHBondContact O-CB 3.38Å; E97-C100 PolarHBondContact O-N 3.06Å; E97-T101 WeakPolarHBondContact O-CG2 3.5Å; E97-T101 PolarHBondContact O-N 3.38Å; E97-H114 HydrophobicContact CG-CB 4.46Å; E97-H114 PolarHBondContact O-NE2 2.94Å; E97-C117 HydrophobicContact CG-CB 4.48Å
98S94.8Very high92.3Very high65 Ų6565.9 Ų65.946%0.45537%0.365SS..Hα-helixtrans-62-42176.975.10000112.1L94 E95 C96 C100 T101 E102L94-S98 WeakPolarHBondContact O-CB 3.36Å; L94-S98 PolarHBondContact O-N 3.45Å; L94-S98 PolarHBondContact O-OG 3.01Å; E95-S98 WeakPolarHBondContact CA-OG 3.42Å; E95-S98 PolarHBondContact O-N 3.09Å; E95-S98 PolarHBondContact O-OG 3.42Å; C96-S98 VanDerWaalsContact C-N 3.34Å; C96-S98 PolarHBondContact O-N 2.05Å; S98-C100 PolarHBondContact O-N 3.41Å; S98-T101 PolarHBondContact O-N 2.99Å; S98-T101 VanDerWaalsContact O-N 3.15Å; S98-T101 PolarHBondContact O-OG1 3.24Å; S98-E102 PolarHBondContact O-N 3.14Å; S98-E102 VanDerWaalsContact O-N 3.15Å
99A95.1Very high92.4Very high30 Ų3063.4 Ų63.425%0.24835%0.351CS..Hα-helixtrans-68.8-33.9176.700000112.2L76 E95 C96 E97 T101 E102 A103L76-A99 HydrophobicContact CD2-CB 3.79Å; E95-A99 WeakPolarHBondContact O-CB 3.42Å; E95-A99 PolarHBondContact O-N 2.96Å; C96-A99 PolarHBondContact O-N 3.3Å; E97-A99 VanDerWaalsContact C-N 3.35Å; E97-A99 PolarHBondContact O-N 3.42Å; A99-T101 VanDerWaalsContact C-N 3.34Å; A99-E102 PolarHBondContact O-N 3.21Å; A99-A103 VanDerWaalsContact O-CB 3.3Å; A99-A103 WeakPolarHBondContact O-CB 3.46Å; A99-A103 PolarHBondContact O-N 2.04Å
100C95.1Very high92.7Very high0 Ų065.2 Ų65.20%036%0.359CS..Hα-helixtrans-62.8-39.8169.7-71.70000111.9C96 E97 S98 E102 A103 Y104 C113 H114C96-C100 PolarHBondContact O-N 3.23Å; C96-C100 PolarHBondContact O-SG 3.09Å; C96-C100 VanDerWaalsContact O-SG 3.38Å; E97-C100 WeakPolarHBondContact O-CB 3.38Å; E97-C100 PolarHBondContact O-N 3.06Å; S98-C100 PolarHBondContact O-N 3.41Å; C100-E102 VanDerWaalsContact C-N 3.26Å; C100-E102 PolarHBondContact O-N 2.92Å; C100-A103 PolarHBondContact O-N 2.93Å; C100-Y104 PolarHBondContact O-N 3.43Å; C100-Y104 VanDerWaalsContact O-N 3.16Å; C100-C113 HydrophobicContact CB-CB 3.65Å; C100-C113 WeakPolarHBondContact CB-SG 3.05Å; C100-C113 WeakPolarHBondContact SG-CB 3.5Å; C100-C113 CovalentContact SG-SG 2.04Å; C100-C113 PolarHBondContact SG-SG 2.64Å; C100-H114 WeakPolarHBondContact CB-CD2 3.18Å
101T94.4Very high92.7Very high70 Ų7066.8 Ų66.843%0.42936%0.357SS..Hα-helixtrans-64.9-3017773.10000113.3E97 S98 A99 Q110 H114E97-T101 WeakPolarHBondContact O-CG2 3.5Å; E97-T101 PolarHBondContact O-N 3.38Å; S98-T101 PolarHBondContact O-N 2.99Å; S98-T101 VanDerWaalsContact O-N 3.15Å; S98-T101 PolarHBondContact O-OG1 3.24Å; A99-T101 VanDerWaalsContact C-N 3.34Å; T101-Q110 VanDerWaalsContact CB-NE2 3.33Å; T101-H114 WeakPolarHBondContact CG2-NE2 3.06Å
102E94.1Very high92.8Very high174 Ų17461.2 Ų61.281%0.81334%0.336SS*.Hα-helixtrans-80.5-36.9177.3-172.9180172.500111.8S98 A99 C100S98-E102 PolarHBondContact O-N 3.14Å; S98-E102 VanDerWaalsContact O-N 3.15Å; A99-E102 PolarHBondContact O-N 3.21Å; C100-E102 VanDerWaalsContact C-N 3.26Å; C100-E102 PolarHBondContact O-N 2.92Å
103A92.8Very high92.9Very high70 Ų7061.3 Ų61.358%0.57934%0.337SS*.Hα-helixtrans-76.2-32.7-174.600000113.9A99 C100A99-A103 VanDerWaalsContact O-CB 3.3Å; A99-A103 WeakPolarHBondContact O-CB 3.46Å; A99-A103 PolarHBondContact O-N 2.04Å; C100-A103 PolarHBondContact O-N 2.93Å
104Y91.8Very high93Very high24 Ų2461.4 Ų61.49%0.09434%0.338CS..  trans-118127.6-174.4-64.1-76.2000111.5A69 R72 C100 E109 C113A69-Y104 HydrophobicContact CB-CE1 4.15Å; A69-Y104 HydrophobicContact CB-CE2 4.3Å; R72-Y104 VanDerWaalsContact CD-OH 3.24Å; R72-Y104 WeakPolarHBondContact CD-OH 3.42Å; C100-Y104 PolarHBondContact O-N 3.43Å; C100-Y104 VanDerWaalsContact O-N 3.16Å; Y104-E109 HydrophobicContact CD1-CB 3.66Å; Y104-E109 HydrophobicContact CD1-CG 4.47Å; Y104-E109 VanDerWaalsContact CD1-OE2 3.3Å; Y104-E109 WeakPolarHBondContact CD1-OE2 3.38Å; Y104-E109 HydrophobicContact CE1-CB 4.22Å; Y104-E109 HydrophobicContact CG-CB 4.02Å; Y104-C113 HydrophobicContact CD2-CB 3.94Å; Y104-C113 HydrophobicContact CE2-CB 3.81Å
105S89.1Confident93Very high125 Ų12557.3 Ų57.387%0.87432%0.317SS*.  trans-91.7-18.4175.958.30000113.3
106Q91.1Very high93Very high86 Ų8654.1 Ų54.140%0.40230%0.302SS..SBendtrans-87.2136175.7-62.9-170.419.300110.7D108 E109 Q110Q106-D108 VanDerWaalsContact C-N 3.26Å; Q106-D108 PolarHBondContact O-N 3.43Å; Q106-E109 HydrophobicContact CB-CB 4.44Å; Q106-E109 HydrophobicContact CB-CG 4.29Å; Q106-Q110 VanDerWaalsContact O-CB 3.22Å; Q106-Q110 WeakPolarHBondContact O-CB 3.41Å; Q106-Q110 PolarHBondContact O-N 2.88Å
107S88.3Confident92.9Very high81 Ų8154.1 Ų54.157%0.56630%0.302SS*.Hα-helixtrans-60.4-35-179.550.80000113.3Y111S107-Y111 WeakPolarHBondContact O-CB 3.15Å; S107-Y111 PolarHBondContact O-N 3.45Å
108D89.1Confident92.8Very high67 Ų6757 Ų5736%0.35832%0.315SS..Hα-helixtrans-78.4-43.8-170.4-49.1-18000110.6E66 Q106 Y111 A112E66-D108 HydrophobicContact CG-CB 4.44Å; E66-D108 WeakPolarHBondContact OE1-CB 3.26Å; Q106-D108 VanDerWaalsContact C-N 3.26Å; Q106-D108 PolarHBondContact O-N 3.43Å; D108-Y111 PolarHBondContact O-N 3.38Å; D108-A112 WeakPolarHBondContact O-CB 3.49Å; D108-A112 PolarHBondContact O-N 3.22Å
109E90.1Very high92.7Very high31 Ų3155.8 Ų55.815%0.14530%0.303CS..Hα-helixtrans-65.7-39.2172.5-61.3-179.2154.500111.9E65 A69 Y104 Q106 A112 C113E65-E109 HydrophobicContact CG-CG 4.32Å; A69-E109 HydrophobicContact CB-CB 4.23Å; Y104-E109 HydrophobicContact CD1-CB 3.66Å; Y104-E109 HydrophobicContact CD1-CG 4.47Å; Y104-E109 VanDerWaalsContact CD1-OE2 3.3Å; Y104-E109 WeakPolarHBondContact CD1-OE2 3.38Å; Y104-E109 HydrophobicContact CE1-CB 4.22Å; Y104-E109 HydrophobicContact CG-CB 4.02Å; Q106-E109 HydrophobicContact CB-CB 4.44Å; Q106-E109 HydrophobicContact CB-CG 4.29Å; E109-A112 PolarHBondContact O-N 2.96Å; E109-C113 WeakPolarHBondContact O-CB 3.38Å; E109-C113 PolarHBondContact O-N 2.71Å
110Q93.8Very high92.4Very high56 Ų5654.8 Ų54.826%0.26229%0.293SS..Hα-helixtrans-61.5-47.6175.8-175.5-177.84.600110.6T101 Q106 A112 C113 H114T101-Q110 VanDerWaalsContact CB-NE2 3.33Å; Q106-Q110 VanDerWaalsContact O-CB 3.22Å; Q106-Q110 WeakPolarHBondContact O-CB 3.41Å; Q106-Q110 PolarHBondContact O-N 2.88Å; Q110-A112 VanDerWaalsContact C-N 3.34Å; Q110-A112 PolarHBondContact O-N 3.44Å; Q110-C113 PolarHBondContact O-N 3.46Å; Q110-H114 PolarHBondContact O-CD2 3.28Å; Q110-H114 PolarHBondContact O-N 2.87Å
111Y92.9Very high92.1Very high150 Ų15055.8 Ų55.859%0.58830%0.299SS*.Hα-helixtrans-60.9-43.1176.2-179.7-102.1000111.9S107 D108 C113 H114 L115S107-Y111 WeakPolarHBondContact O-CB 3.15Å; S107-Y111 PolarHBondContact O-N 3.45Å; D108-Y111 PolarHBondContact O-N 3.38Å; Y111-C113 VanDerWaalsContact C-N 3.32Å; Y111-C113 PolarHBondContact O-N 3.29Å; Y111-H114 PolarHBondContact O-N 3.3Å; Y111-L115 PolarHBondContact O-N 3.03Å
112A93.4Very high91.8Very high0 Ų055.7 Ų55.70%030%0.299CS..Hα-helixtrans-61.4-40.6176.800000112.2Y56 E66 A69 C70 D108 E109 Q110 L115 G116Y56-A112 HydrophobicContact CE2-CB 3.89Å; Y56-A112 WeakPolarHBondContact OH-CA 3.32Å; Y56-A112 WeakPolarHBondContact OH-CB 3.17Å; E66-A112 HydrophobicContact CB-CB 4.01Å; E66-A112 VanDerWaalsContact O-CB 3.27Å; E66-A112 WeakPolarHBondContact O-CB 3.13Å; A69-A112 HydrophobicContact CB-CB 4.16Å; C70-A112 VanDerWaalsContact CA-O 3.26Å; C70-A112 WeakPolarHBondContact CA-O 3.42Å; C70-A112 HydrophobicContact CB-CB 4.39Å; C70-A112 WeakPolarHBondContact CB-O 3.07Å; D108-A112 WeakPolarHBondContact O-CB 3.49Å; D108-A112 PolarHBondContact O-N 3.22Å; E109-A112 PolarHBondContact O-N 2.96Å; Q110-A112 VanDerWaalsContact C-N 3.34Å; Q110-A112 PolarHBondContact O-N 3.44Å; A112-L115 WeakPolarHBondContact O-CB 3.34Å; A112-L115 PolarHBondContact O-N 2.97Å; A112-G116 PolarHBondContact O-N 2.74Å
113C94.8Very high91.3Very high2 Ų251 Ų511%0.01428%0.277CS..Hα-helixtrans-63-44.7174.7-170.10000112C100 Y104 E109 Q110 Y111 L115 G116 C117C100-C113 HydrophobicContact CB-CB 3.65Å; C100-C113 WeakPolarHBondContact CB-SG 3.05Å; C100-C113 WeakPolarHBondContact SG-CB 3.5Å; C100-C113 CovalentContact SG-SG 2.04Å; C100-C113 PolarHBondContact SG-SG 2.64Å; Y104-C113 HydrophobicContact CD2-CB 3.94Å; Y104-C113 HydrophobicContact CE2-CB 3.81Å; E109-C113 WeakPolarHBondContact O-CB 3.38Å; E109-C113 PolarHBondContact O-N 2.71Å; Q110-C113 PolarHBondContact O-N 3.46Å; Y111-C113 VanDerWaalsContact C-N 3.32Å; Y111-C113 PolarHBondContact O-N 3.29Å; C113-L115 VanDerWaalsContact C-N 3.29Å; C113-L115 PolarHBondContact O-N 2.75Å; C113-G116 WeakPolarHBondContact O-CA 3.43Å; C113-G116 PolarHBondContact O-N 3.17Å; C113-G116 VanDerWaalsContact O-N 3.09Å; C113-C117 PolarHBondContact O-N 3.08Å
114H95.1Very high90.9Very high42 Ų4247.8 Ų47.819%0.19425%0.249CC..Hα-helixtrans-61-40.6176.6-74.5-143.5000111.5E97 C100 T101 Q110 Y111 G116 C117 Q118E97-H114 HydrophobicContact CG-CB 4.46Å; E97-H114 PolarHBondContact O-NE2 2.94Å; C100-H114 WeakPolarHBondContact CB-CD2 3.18Å; T101-H114 WeakPolarHBondContact CG2-NE2 3.06Å; Q110-H114 PolarHBondContact O-CD2 3.28Å; Q110-H114 PolarHBondContact O-N 2.87Å; Y111-H114 PolarHBondContact O-N 3.3Å; H114-G116 VanDerWaalsContact C-N 3.29Å; H114-G116 PolarHBondContact O-N 3.04Å; H114-C117 WeakPolarHBondContact O-CB 3.47Å; H114-C117 PolarHBondContact O-N 3.22Å; H114-Q118 WeakPolarHBondContact O-CB 2.94Å; H114-Q118 PolarHBondContact O-N 3.45Å
115L93.3Very high90.7Very high24 Ų2450.9 Ų50.913%0.12627%0.265CS..Hα-helixtrans-60.5-40.8174.9-171.678.1000111.4T55 Y56 Y111 A112 C113 Q118 N119T55-L115 HydrophobicContact CG2-CD2 3.54Å; Y56-L115 HydrophobicContact CE2-CD2 3.71Å; Y111-L115 PolarHBondContact O-N 3.03Å; A112-L115 WeakPolarHBondContact O-CB 3.34Å; A112-L115 PolarHBondContact O-N 2.97Å; C113-L115 VanDerWaalsContact C-N 3.29Å; C113-L115 PolarHBondContact O-N 2.75Å; L115-Q118 PolarHBondContact O-N 2.82Å; L115-N119 WeakPolarHBondContact O-CB 3.41Å; L115-N119 VanDerWaalsContact O-CG 3.28Å; L115-N119 PolarHBondContact O-N 2.83Å; L115-N119 PolarHBondContact O-ND2 3.22Å
116G93.4Very high90.5Very high0 Ų049.4 Ų49.40%025%0.247CC..Hα-helixtrans-57.8-48.617300000112.6C48 C70 A112 C113 H114 Q118 N119 Q120C48-G116 PolarHBondContact SG-O 3.41Å; C48-G116 VanDerWaalsContact SG-O 3.42Å; C70-G116 WeakPolarHBondContact O-CA 3.46Å; A112-G116 PolarHBondContact O-N 2.74Å; C113-G116 WeakPolarHBondContact O-CA 3.43Å; C113-G116 PolarHBondContact O-N 3.17Å; C113-G116 VanDerWaalsContact O-N 3.09Å; H114-G116 VanDerWaalsContact C-N 3.29Å; H114-G116 PolarHBondContact O-N 3.04Å; G116-Q118 VanDerWaalsContact C-N 3.31Å; G116-Q118 PolarHBondContact O-N 3.2Å; G116-N119 PolarHBondContact O-N 2.87Å; G116-Q120 PolarHBondContact O-N 3.19Å; G116-Q120 VanDerWaalsContact O-N 3.16Å
117C94.1Very high89.9Confident0 Ų050.9 Ų50.90%025%0.248CC..Hα-helixtrans-58.8-42.6175.2-59.90000111.7F77 C96 E97 C113 H114F77-C117 HydrophobicContact CD2-CB 4.47Å; C96-C117 VanDerWaalsContact C-SG 3.54Å; C96-C117 HydrophobicContact CB-CB 3.79Å; C96-C117 WeakPolarHBondContact CB-SG 2.83Å; C96-C117 WeakPolarHBondContact SG-CB 3.46Å; C96-C117 CovalentContact SG-SG 2.04Å; C96-C117 PolarHBondContact SG-SG 3.1Å; E97-C117 HydrophobicContact CG-CB 4.48Å; C113-C117 PolarHBondContact O-N 3.08Å; H114-C117 WeakPolarHBondContact O-CB 3.47Å; H114-C117 PolarHBondContact O-N 3.22Å
118Q93.6Very high89.5Confident99 Ų9949.4 Ų49.446%0.46323%0.233SC..Hα-helixtrans-70.1-37.2-178.5-174163.522.400112.9H114 L115 G116 Q120 L121 P122H114-Q118 WeakPolarHBondContact O-CB 2.94Å; H114-Q118 PolarHBondContact O-N 3.45Å; L115-Q118 PolarHBondContact O-N 2.82Å; G116-Q118 VanDerWaalsContact C-N 3.31Å; G116-Q118 PolarHBondContact O-N 3.2Å; Q118-Q120 VanDerWaalsContact C-N 3.33Å; Q118-L121 WeakPolarHBondContact O-CB 3.46Å; Q118-P122 WeakPolarHBondContact O-CD 3.4Å
119N90.9Very high89.2Confident40 Ų4052 Ų5221%0.21424%0.242CC..Hα-helixtrans-71.8-27.8179.1-76.4-21.9000112.6L115 G116 P122 F123L115-N119 WeakPolarHBondContact O-CB 3.41Å; L115-N119 VanDerWaalsContact O-CG 3.28Å; L115-N119 PolarHBondContact O-N 2.83Å; L115-N119 PolarHBondContact O-ND2 3.22Å; G116-N119 PolarHBondContact O-N 2.87Å; N119-P122 WeakPolarHBondContact O-CD 3.42Å; N119-F123 WeakPolarHBondContact O-CD2 3.42Å; N119-F123 WeakPolarHBondContact O-CE2 3.43Å
120Q89.4Confident88.8Confident9 Ų955.7 Ų55.74%0.04226%0.26CS..Hα-helixtrans-75.1-28178.1-169.765.819.300112.6F77 G116 Q118 F123 A124F77-Q120 HydrophobicContact CB-CB 3.97Å; F77-Q120 HydrophobicContact CB-CG 3.97Å; F77-Q120 HydrophobicContact CD1-CB 3.8Å; F77-Q120 HydrophobicContact CD1-CG 3.35Å; F77-Q120 HydrophobicContact CE1-CG 4.13Å; F77-Q120 HydrophobicContact CG-CB 3.86Å; F77-Q120 HydrophobicContact CG-CG 3.86Å; G116-Q120 PolarHBondContact O-N 3.19Å; G116-Q120 VanDerWaalsContact O-N 3.16Å; Q118-Q120 VanDerWaalsContact C-N 3.33Å; Q120-F123 PolarHBondContact O-N 2.94Å; Q120-A124 PolarHBondContact O-N 2.97Å
121L89.6Confident87.9Confident22 Ų2258.9 Ų58.912%0.11528%0.278CS..Hα-helixtrans-50.1-56-178.2-17376.6000114.6F77 L89 K93 Q118 F123 A124 E125F77-L121 HydrophobicContact CE2-CD1 3.99Å; F77-L121 HydrophobicContact CZ-CB 4.47Å; F77-L121 HydrophobicContact CZ-CD1 3.79Å; L89-L121 HydrophobicContact CB-CD1 3.76Å; L89-L121 WeakPolarHBondContact O-CD1 3.39Å; K93-L121 HydrophobicContact CB-CD1 4.37Å; K93-L121 HydrophobicContact CD-CD2 4.29Å; Q118-L121 WeakPolarHBondContact O-CB 3.46Å; L121-F123 PolarHBondContact O-N 3.42Å; L121-A124 WeakPolarHBondContact O-CB 3.42Å; L121-A124 PolarHBondContact O-N 3.21Å; L121-A124 VanDerWaalsContact O-N 3.08Å; L121-E125 PolarHBondContact O-N 3.06Å
122P87.1Confident87Confident67 Ų6756.7 Ų56.744%0.43528%0.275SS..Hα-helixtrans-64.4-28-17825.8-36.6000113.3Q118 N119 L126Q118-P122 WeakPolarHBondContact O-CD 3.4Å; N119-P122 WeakPolarHBondContact O-CD 3.42Å; P122-L126 PolarHBondContact O-N 3.29Å
123F84.1Confident86.1Confident77 Ų7760.9 Ų60.934%0.33830%0.304SS..Hα-helixtrans-73.8-34.5175.4-59.6-65.5000111.6S47 N119 Q120 L121 R127S47-F123 WeakPolarHBondContact OG-CE1 3.08Å; S47-F123 WeakPolarHBondContact OG-CZ 3.39Å; N119-F123 WeakPolarHBondContact O-CD2 3.42Å; N119-F123 WeakPolarHBondContact O-CE2 3.43Å; Q120-F123 PolarHBondContact O-N 2.94Å; L121-F123 PolarHBondContact O-N 3.42Å; F123-R127 WeakPolarHBondContact O-CB 3.39Å; F123-R127 PolarHBondContact O-N 3.39Å; F123-R127 VanDerWaalsContact O-N 3.09Å
124A84.9Confident84.9Confident1 Ų167.3 Ų67.31%0.00834%0.337CS..Hα-helixtrans-68.9-39.817500000112.2F77 L89 Q120 L121 R127 Q128F77-A124 HydrophobicContact CE1-CB 3.57Å; F77-A124 HydrophobicContact CZ-CB 4.23Å; L89-A124 HydrophobicContact CD2-CB 3.69Å; Q120-A124 PolarHBondContact O-N 2.97Å; L121-A124 WeakPolarHBondContact O-CB 3.42Å; L121-A124 PolarHBondContact O-N 3.21Å; L121-A124 VanDerWaalsContact O-N 3.08Å; A124-R127 PolarHBondContact O-N 3.06Å; A124-Q128 WeakPolarHBondContact O-CB 3.27Å; A124-Q128 PolarHBondContact O-N 3.35Å
125E86.8Confident83.2Confident90 Ų9070.6 Ų70.642%0.42135%0.354SS..Hα-helixtrans-57.5-53.4173.1-71.8178.9171.700111.3L89 L121 R127 Q128 E129L89-E125 HydrophobicContact CD1-CB 4.09Å; L89-E125 HydrophobicContact CD1-CG 3.35Å; L121-E125 PolarHBondContact O-N 3.06Å; E125-R127 VanDerWaalsContact C-N 3.29Å; E125-R127 PolarHBondContact O-N 3.39Å; E125-Q128 WeakPolarHBondContact O-CB 3.37Å; E125-Q128 PolarHBondContact O-N 3.35Å; E125-Q128 VanDerWaalsContact O-N 3.1Å; E125-E129 WeakPolarHBondContact O-CG 3.49Å; E125-E129 PolarHBondContact O-N 3.27Å
126L84.9Confident81.4Confident93 Ų9374.6 Ų74.649%0.48738%0.381SS..Hα-helixtrans-59.6-40.7179.9-173.372.7000112P122 Q128 E129 Q130P122-L126 PolarHBondContact O-N 3.29Å; L126-Q128 VanDerWaalsContact C-N 3.35Å; L126-E129 PolarHBondContact O-N 3.47Å; L126-Q130 VanDerWaalsContact O-CG 3.32Å; L126-Q130 WeakPolarHBondContact O-CG 3.25Å; L126-Q130 PolarHBondContact O-N 2.77Å
127R79.5Confident79.5Confident117 Ų11783 Ų8344%0.44242%0.418SS..Hα-helixtrans-64.2-41177-177.7-177.9175.8114.2-5.2111.4F123 A124 E125 Q130 L131F123-R127 WeakPolarHBondContact O-CB 3.39Å; F123-R127 PolarHBondContact O-N 3.39Å; F123-R127 VanDerWaalsContact O-N 3.09Å; A124-R127 PolarHBondContact O-N 3.06Å; E125-R127 VanDerWaalsContact C-N 3.29Å; E125-R127 PolarHBondContact O-N 3.39Å; R127-Q130 PolarHBondContact O-N 2.93Å; R127-L131 WeakPolarHBondContact O-CB 3.12Å; R127-L131 PolarHBondContact O-N 3.25Å
128Q79.9Confident77.6Confident51 Ų5190.3 Ų90.324%0.23845%0.454CS..Hα-helixtrans-66.1-42.1177.9-172173.3-11.500111.1G86 L89 A124 E125 L126 Q130 L131 M132G86-Q128 PolarHBondContact O-NE2 2.96Å; G86-Q128 VanDerWaalsContact O-NE2 3.11Å; G86-Q128 PolarHBondContact O-OE1 3.48Å; G86-Q128 VanDerWaalsContact O-OE1 3.11Å; L89-Q128 VanDerWaalsContact CD1-OE1 3.23Å; A124-Q128 WeakPolarHBondContact O-CB 3.27Å; A124-Q128 PolarHBondContact O-N 3.35Å; E125-Q128 WeakPolarHBondContact O-CB 3.37Å; E125-Q128 PolarHBondContact O-N 3.35Å; E125-Q128 VanDerWaalsContact O-N 3.1Å; L126-Q128 VanDerWaalsContact C-N 3.35Å; Q128-Q130 VanDerWaalsContact C-N 3.35Å; Q128-Q130 PolarHBondContact O-N 3.32Å; Q128-L131 PolarHBondContact O-N 2.95Å; Q128-M132 HydrophobicContact CG-CE 4.11Å; Q128-M132 WeakPolarHBondContact O-CB 3.45Å; Q128-M132 VanDerWaalsContact O-CG 3.27Å; Q128-M132 WeakPolarHBondContact O-CG 3.32Å; Q128-M132 PolarHBondContact O-N 3.1Å
129E82.8Confident75.8Confident120 Ų12092.2 Ų92.256%0.56146%0.463SS*.Hα-helixtrans-59.7-44.6173-69.9-176.5152.200112.1E125 L126 M132 S133E125-E129 WeakPolarHBondContact O-CG 3.49Å; E125-E129 PolarHBondContact O-N 3.27Å; L126-E129 PolarHBondContact O-N 3.47Å; E129-M132 HydrophobicContact CG-CE 4.23Å; E129-M132 PolarHBondContact O-N 3.39Å; E129-S133 WeakPolarHBondContact O-CB 3.46Å; E129-S133 PolarHBondContact O-N 3.23Å
130Q81Confident74.3Confident109 Ų10997.8 Ų97.851%0.50949%0.492SS..Hα-helixtrans-60-47.8174.4-74.3177.9-9.400111.2L126 R127 Q128 M132 S133 L134L126-Q130 VanDerWaalsContact O-CG 3.32Å; L126-Q130 WeakPolarHBondContact O-CG 3.25Å; L126-Q130 PolarHBondContact O-N 2.77Å; R127-Q130 PolarHBondContact O-N 2.93Å; Q128-Q130 VanDerWaalsContact C-N 3.35Å; Q128-Q130 PolarHBondContact O-N 3.32Å; Q130-M132 VanDerWaalsContact C-N 3.35Å; Q130-M132 PolarHBondContact O-N 3.37Å; Q130-S133 PolarHBondContact O-N 3.09Å; Q130-S133 VanDerWaalsContact O-N 3.08Å; Q130-S133 PolarHBondContact O-OG 3Å; Q130-L134 WeakPolarHBondContact O-CD1 3.27Å; Q130-L134 PolarHBondContact O-N 3.08Å
131L75.4Confident72.9Confident123 Ų123101.8 Ų101.864%0.64451%0.513SS*.Hα-helixtrans-60.5-43.6178.3-159.796.6000111.7R127 Q128 S133 L134 M135R127-L131 WeakPolarHBondContact O-CB 3.12Å; R127-L131 PolarHBondContact O-N 3.25Å; Q128-L131 PolarHBondContact O-N 2.95Å; L131-S133 PolarHBondContact O-N 2.94Å; L131-L134 PolarHBondContact O-N 3.25Å; L131-M135 PolarHBondContact O-N 2.64Å
132M73.6Confident71.7Confident105 Ų105107.2 Ų107.252%0.51754%0.536SS..Hα-helixtrans-63.9-29.5175.6-73.1-171.6-66.100112.8Q128 E129 Q130Q128-M132 HydrophobicContact CG-CE 4.11Å; Q128-M132 WeakPolarHBondContact O-CB 3.45Å; Q128-M132 VanDerWaalsContact O-CG 3.27Å; Q128-M132 WeakPolarHBondContact O-CG 3.32Å; Q128-M132 PolarHBondContact O-N 3.1Å; E129-M132 HydrophobicContact CG-CE 4.23Å; E129-M132 PolarHBondContact O-N 3.39Å; Q130-M132 VanDerWaalsContact C-N 3.35Å; Q130-M132 PolarHBondContact O-N 3.37Å
133S73.3Confident70.7Confident88 Ų88107.2 Ų107.262%0.61554%0.536SS*.Hα-helixtrans-78-30175.1780000113E129 Q130 L131E129-S133 WeakPolarHBondContact O-CB 3.46Å; E129-S133 PolarHBondContact O-N 3.23Å; Q130-S133 PolarHBondContact O-N 3.09Å; Q130-S133 VanDerWaalsContact O-N 3.08Å; Q130-S133 PolarHBondContact O-OG 3Å; L131-S133 PolarHBondContact O-N 2.94Å
134L69.9Low69.7Low137 Ų137108.7 Ų108.772%0.71755%0.547SS*.Hα-helixtrans-84.3-18.8177-89.580.1000113Q130 L131 P136Q130-L134 WeakPolarHBondContact O-CD1 3.27Å; Q130-L134 PolarHBondContact O-N 3.08Å; L131-L134 PolarHBondContact O-N 3.25Å; L134-P136 VanDerWaalsContact O-CD 3.25Å; L134-P136 WeakPolarHBondContact O-CD 3.46Å; L134-P136 VanDerWaalsContact O-N 3.1Å
135M60Low68.9Low110 Ų110112.3 Ų112.354%0.54257%0.569SS.*SBendtrans-59.3115.9177.1-170.6-178.3-150.900109.4L131 K137L131-M135 PolarHBondContact O-N 2.64Å; M135-K137 PolarHBondContact O-N 3.11Å
136P55.1Low68.1Low108 Ų108112 Ų11270%0.70157%0.569SS**  trans-67.4103.3176.527.3-30.5000107L134 M138L134-P136 VanDerWaalsContact O-CD 3.25Å; L134-P136 WeakPolarHBondContact O-CD 3.46Å; L134-P136 VanDerWaalsContact O-N 3.1Å; P136-M138 VanDerWaalsContact C-N 3.32Å; P136-M138 PolarHBondContact O-N 3.11Å
137K53.1Low67.6Low177 Ų177112 Ų11277%0.7757%0.573SS**  trans-60.6100.7168.9-70.7-171.3173.972.90106.7M135 H139M135-K137 PolarHBondContact O-N 3.11Å; K137-H139 PolarHBondContact O-N 3.35Å
138M54.6Low67.4Low154 Ų154115.8 Ų115.876%0.75959%0.587SS**  trans-57.3106.9177.5-30.7-169-67.500107P136 L140P136-M138 VanDerWaalsContact C-N 3.32Å; P136-M138 PolarHBondContact O-N 3.11Å; M138-L140 PolarHBondContact O-N 2.9Å
139H56.6Low67Low138 Ų138115.7 Ų115.764%0.63959%0.593SS**  trans-65.2132.7178.7-138.6-82.1000107.2K137 L141 F142K137-H139 PolarHBondContact O-N 3.35Å; H139-L141 PolarHBondContact O-N 3.25Å; H139-F142 PolarHBondContact O-N 3.5Å
140L58.8Low66.6Low158 Ų158117.2 Ų117.283%0.82760%0.598SS**THydrogen-bonded Turntrans-52-8.1177.7-16574.5000114M138 P143M138-L140 PolarHBondContact O-N 2.9Å; L140-P143 WeakPolarHBondContact O-CD 3.49Å
141L60Low66.2Low92 Ų92119.9 Ų119.948%0.48260%0.603SS.*THydrogen-bonded Turntrans-92.1-10.5-179.3-54.2178.1000113.7H139 P143 L144 T145H139-L141 PolarHBondContact O-N 3.25Å; L141-P143 VanDerWaalsContact C-CD 3.47Å; L141-L144 HydrophobicContact CD2-CD1 3.71Å; L141-L144 CarbonylContact O-C 3.2Å; L141-L144 WeakPolarHBondContact O-CA 3.48Å; L141-L144 WeakPolarHBondContact O-CB 3.09Å; L141-L144 PolarHBondContact O-N 3.06Å; L141-T145 PolarHBondContact O-N 2.95Å; L141-T145 PolarHBondContact O-OG1 2.92Å
142F63.8Low66.1Low136 Ų136116.4 Ų116.460%0.59659%0.589SS**Hα-helixtrans-60.3-37.9177-168.4-100000113.8H139 L144 T145 L146H139-F142 PolarHBondContact O-N 3.5Å; F142-L144 VanDerWaalsContact C-N 3.3Å; F142-L144 PolarHBondContact O-N 3.43Å; F142-T145 WeakPolarHBondContact CA-OG1 3.42Å; F142-T145 PolarHBondContact O-N 2.86Å; F142-T145 PolarHBondContact O-OG1 3.24Å; F142-L146 HydrophobicContact CD1-CD1 4.18Å; F142-L146 HydrophobicContact CE1-CD1 3.92Å; F142-L146 HydrophobicContact CE1-CG 4.47Å; F142-L146 PolarHBondContact O-N 3.26Å
143P65.8Low66.1Low68 Ų68116 Ų11644%0.44259%0.589SS.*Hα-helixtrans-64-36170.4-19.231.9000112.3L140 L141 T145 L146 V147L140-P143 WeakPolarHBondContact O-CD 3.49Å; L141-P143 VanDerWaalsContact C-CD 3.47Å; P143-T145 VanDerWaalsContact C-N 3.34Å; P143-L146 PolarHBondContact O-N 3.38Å; P143-V147 WeakPolarHBondContact O-CG2 3.41Å; P143-V147 PolarHBondContact O-N 2.95Å
144L64.9Low66.2Low107 Ų107117.2 Ų117.256%0.5659%0.587SS**Hα-helixtrans-70.9-31179.2-61.7177.9000111.9L141 F142 R148L141-L144 HydrophobicContact CD2-CD1 3.71Å; L141-L144 CarbonylContact O-C 3.2Å; L141-L144 WeakPolarHBondContact O-CA 3.48Å; L141-L144 WeakPolarHBondContact O-CB 3.09Å; L141-L144 PolarHBondContact O-N 3.06Å; F142-L144 VanDerWaalsContact C-N 3.3Å; F142-L144 PolarHBondContact O-N 3.43Å; L144-R148 VanDerWaalsContact O-CB 3.27Å; L144-R148 WeakPolarHBondContact O-CB 3.28Å; L144-R148 PolarHBondContact O-N 3.18Å
145T67.8Low66.4Low78 Ų78114.4 Ų114.448%0.47957%0.571SS.*Hα-helixtrans-70.2-34.8174.149.40000112.5L141 F142 P143 R148 S149L141-T145 PolarHBondContact O-N 2.95Å; L141-T145 PolarHBondContact O-OG1 2.92Å; F142-T145 WeakPolarHBondContact CA-OG1 3.42Å; F142-T145 PolarHBondContact O-N 2.86Å; F142-T145 PolarHBondContact O-OG1 3.24Å; P143-T145 VanDerWaalsContact C-N 3.34Å; T145-R148 PolarHBondContact O-N 3.19Å; T145-S149 PolarHBondContact O-N 2.67Å; T145-S149 VanDerWaalsContact O-N 3.14Å
146L69.1Low66.8Low82 Ų82113.7 Ų113.743%0.42957%0.569SS.*Hα-helixtrans-68.4-45.5173.5-69.9168.8000111.5F142 P143 R148 S149 F150F142-L146 HydrophobicContact CD1-CD1 4.18Å; F142-L146 HydrophobicContact CE1-CD1 3.92Å; F142-L146 HydrophobicContact CE1-CG 4.47Å; F142-L146 PolarHBondContact O-N 3.26Å; P143-L146 PolarHBondContact O-N 3.38Å; L146-R148 PolarHBondContact O-N 3.43Å; L146-S149 PolarHBondContact O-N 3.26Å; L146-S149 PolarHBondContact O-OG 3.43Å; L146-F150 VanDerWaalsContact O-CD2 3.26Å; L146-F150 WeakPolarHBondContact O-CD2 3.37Å; L146-F150 PolarHBondContact O-N 2.96Å; L146-F150 VanDerWaalsContact O-N 3.11Å
147V75.7Confident67.4Low94 Ų94111.5 Ų111.557%0.5756%0.556SS**Hα-helixtrans-62.2-36176.5173.90000111.2P143 W151P143-V147 WeakPolarHBondContact O-CG2 3.41Å; P143-V147 PolarHBondContact O-N 2.95Å; V147-W151 WeakPolarHBondContact O-CB 3.29Å; V147-W151 PolarHBondContact O-N 3.37Å
148R74Confident67.8Low196 Ų196105 Ų10574%0.7454%0.536SS*.Hα-helixtrans-66.1-39.2177.2-171.1178.3176.990.31.7112.6L144 T145 L146 W151 S152L144-R148 VanDerWaalsContact O-CB 3.27Å; L144-R148 WeakPolarHBondContact O-CB 3.28Å; L144-R148 PolarHBondContact O-N 3.18Å; T145-R148 PolarHBondContact O-N 3.19Å; L146-R148 PolarHBondContact O-N 3.43Å; R148-W151 PolarHBondContact O-N 2.94Å; R148-S152 PolarHBondContact O-N 3.37Å; R148-S152 PolarHBondContact O-OG 2.84Å
149S71.6Confident68.1Low50 Ų50102.7 Ų102.735%0.3552%0.523SS..Hα-helixtrans-69.9-41.5177.2630000112.1T145 L146 W151 S152 D153T145-S149 PolarHBondContact O-N 2.67Å; T145-S149 VanDerWaalsContact O-N 3.14Å; L146-S149 PolarHBondContact O-N 3.26Å; L146-S149 PolarHBondContact O-OG 3.43Å; S149-W151 VanDerWaalsContact C-N 3.29Å; S149-W151 PolarHBondContact O-N 2.87Å; S149-S152 WeakPolarHBondContact CA-OG 3.35Å; S149-S152 PolarHBondContact O-N 3.08Å; S149-S152 PolarHBondContact O-OG 2.94Å; S149-D153 VanDerWaalsContact O-CG 3.22Å; S149-D153 PolarHBondContact O-N 2.78Å; S149-D153 VanDerWaalsContact O-N 3.08Å
150F75.3Confident68.2Low151 Ų15199.2 Ų99.266%0.66251%0.514SS*.Hα-helixtrans-62.8-37.2174.3-82.7-73.5000112.3L146 M154L146-F150 VanDerWaalsContact O-CD2 3.26Å; L146-F150 WeakPolarHBondContact O-CD2 3.37Å; L146-F150 PolarHBondContact O-N 2.96Å; L146-F150 VanDerWaalsContact O-N 3.11Å; F150-M154 WeakPolarHBondContact O-CB 3.33Å; F150-M154 PolarHBondContact O-N 3.48Å
151W72.6Confident68.1Low165 Ų16599.3 Ų99.363%0.62551%0.508SS*.Hα-helixtrans-70.5-38.6177.7-170-89.8000112.6V147 R148 S149 M154 M155V147-W151 WeakPolarHBondContact O-CB 3.29Å; V147-W151 PolarHBondContact O-N 3.37Å; R148-W151 PolarHBondContact O-N 2.94Å; S149-W151 VanDerWaalsContact C-N 3.29Å; S149-W151 PolarHBondContact O-N 2.87Å; W151-M154 HydrophobicContact CE3-CE 4.22Å; W151-M154 HydrophobicContact CH2-CE 4.27Å; W151-M154 HydrophobicContact CZ3-CE 3.95Å; W151-M155 VanDerWaalsContact O-CB 3.25Å; W151-M155 WeakPolarHBondContact O-CB 3.31Å; W151-M155 PolarHBondContact O-N 2.89Å
152S73.4Confident67.8Low50 Ų50101.4 Ų101.435%0.3552%0.519SS..Hα-helixtrans-63.8-45.3175.453.50000111.6R148 S149 M154 M155 D156R148-S152 PolarHBondContact O-N 3.37Å; R148-S152 PolarHBondContact O-OG 2.84Å; S149-S152 WeakPolarHBondContact CA-OG 3.35Å; S149-S152 PolarHBondContact O-N 3.08Å; S149-S152 PolarHBondContact O-OG 2.94Å; S152-M154 VanDerWaalsContact C-N 3.32Å; S152-M154 PolarHBondContact O-N 3.43Å; S152-M155 PolarHBondContact O-N 2.94Å; S152-M155 VanDerWaalsContact O-N 3.16Å; S152-D156 WeakPolarHBondContact O-CB 3.48Å; S152-D156 VanDerWaalsContact O-CG 3.3Å; S152-D156 PolarHBondContact O-N 2.83Å
153D73.7Confident67.2Low98 Ų9898.8 Ų98.852%0.52451%0.514SS..Hα-helixtrans-66.2-36.6-177.2-63.3-12.9000111.8S149 S157S149-D153 VanDerWaalsContact O-CG 3.22Å; S149-D153 PolarHBondContact O-N 2.78Å; S149-D153 VanDerWaalsContact O-N 3.08Å; D153-S157 WeakPolarHBondContact O-CB 3.43Å; D153-S157 PolarHBondContact O-N 2.85Å; D153-S157 VanDerWaalsContact O-N 3.09Å; D153-S157 PolarHBondContact O-OG 2.76Å
154M73.6Confident66.5Low113 Ų11399.4 Ų99.456%0.55752%0.52SS*.Hα-helixtrans-69.1-41173.9-168.5-178.487.400111.9F150 W151 S152 S157 A158F150-M154 WeakPolarHBondContact O-CB 3.33Å; F150-M154 PolarHBondContact O-N 3.48Å; W151-M154 HydrophobicContact CE3-CE 4.22Å; W151-M154 HydrophobicContact CH2-CE 4.27Å; W151-M154 HydrophobicContact CZ3-CE 3.95Å; S152-M154 VanDerWaalsContact C-N 3.32Å; S152-M154 PolarHBondContact O-N 3.43Å; M154-S157 PolarHBondContact O-N 2.79Å; M154-A158 PolarHBondContact O-N 2.99Å
155M74.4Confident66.3Low77 Ų7797.4 Ų97.438%0.37952%0.515SS..Hα-helixtrans-66.6-41.6179.4-170.266.6-127.400111.6W151 S152 S157 A158 Q159W151-M155 VanDerWaalsContact O-CB 3.25Å; W151-M155 WeakPolarHBondContact O-CB 3.31Å; W151-M155 PolarHBondContact O-N 2.89Å; S152-M155 PolarHBondContact O-N 2.94Å; S152-M155 VanDerWaalsContact O-N 3.16Å; M155-S157 VanDerWaalsContact C-N 3.35Å; M155-A158 PolarHBondContact O-N 3.34Å; M155-Q159 HydrophobicContact CE-CG 3.9Å; M155-Q159 WeakPolarHBondContact O-CG 3.3Å; M155-Q159 PolarHBondContact O-N 3.4Å
156D68.8Low65.8Low95 Ų95101.8 Ų101.851%0.50852%0.523SS..Hα-helixtrans-66.2-39.5177-70.6-16.2000111.2S152 A158 Q159 S160S152-D156 WeakPolarHBondContact O-CB 3.48Å; S152-D156 VanDerWaalsContact O-CG 3.3Å; S152-D156 PolarHBondContact O-N 2.83Å; D156-A158 PolarHBondContact O-N 2.88Å; D156-Q159 PolarHBondContact O-N 2.98Å; D156-S160 PolarHBondContact O-N 3.19Å; D156-S160 VanDerWaalsContact O-N 3.16Å
157S68.3Low65.9Low62 Ų62100.9 Ų100.943%0.43452%0.521SS..Hα-helixtrans-61.1-43.5172.9-610000111.6D153 M154 M155 Q159 S160 F161D153-S157 WeakPolarHBondContact O-CB 3.43Å; D153-S157 PolarHBondContact O-N 2.85Å; D153-S157 VanDerWaalsContact O-N 3.09Å; D153-S157 PolarHBondContact O-OG 2.76Å; M154-S157 PolarHBondContact O-N 2.79Å; M155-S157 VanDerWaalsContact C-N 3.35Å; S157-Q159 PolarHBondContact O-N 2.92Å; S157-S160 PolarHBondContact O-N 3.39Å; S157-S160 PolarHBondContact O-OG 2.77Å; S157-F161 WeakPolarHBondContact O-CD2 3.25Å; S157-F161 PolarHBondContact O-N 3.35Å
158A61.5Low65.7Low41 Ų4199.9 Ų99.934%0.33951%0.509SS..Hα-helixtrans-65.5-37.6177.900000113M154 M155 D156 S160 F161 I162M154-A158 PolarHBondContact O-N 2.99Å; M155-A158 PolarHBondContact O-N 3.34Å; D156-A158 PolarHBondContact O-N 2.88Å; A158-S160 VanDerWaalsContact C-N 3.3Å; A158-S160 PolarHBondContact O-N 3.32Å; A158-F161 PolarHBondContact O-N 2.83Å; A158-I162 WeakPolarHBondContact O-CD1 3.38Å; A158-I162 WeakPolarHBondContact O-CG1 3.36Å; A158-I162 PolarHBondContact O-N 2.79Å
159Q61Low65.7Low105 Ų10597.8 Ų97.849%0.49150%0.502SS..Hα-helixtrans-63.5-36.2175.4-72.8-17512.500112.5M155 D156 S157 F161 I162 T163M155-Q159 HydrophobicContact CE-CG 3.9Å; M155-Q159 WeakPolarHBondContact O-CG 3.3Å; M155-Q159 PolarHBondContact O-N 3.4Å; D156-Q159 PolarHBondContact O-N 2.98Å; S157-Q159 PolarHBondContact O-N 2.92Å; Q159-F161 VanDerWaalsContact C-N 3.29Å; Q159-F161 PolarHBondContact O-N 3.29Å; Q159-I162 PolarHBondContact O-N 3.3Å; Q159-T163 PolarHBondContact O-N 3.47Å; Q159-T163 PolarHBondContact O-OG1 2.92Å
160S59.2Low65.7Low66 Ų66100.1 Ų100.146%0.46251%0.51SS..Hα-helixtrans-64.1-31.8177.979.30000113.2D156 S157 A158D156-S160 PolarHBondContact O-N 3.19Å; D156-S160 VanDerWaalsContact O-N 3.16Å; S157-S160 PolarHBondContact O-N 3.39Å; S157-S160 PolarHBondContact O-OG 2.77Å; A158-S160 VanDerWaalsContact C-N 3.3Å; A158-S160 PolarHBondContact O-N 3.32Å
161F55.9Low65.4Low159 Ų15999.8 Ų99.870%0.69751%0.511SS*.Hα-helixtrans-73.8-37.5174.6-68.9-68.8000112.1S157 A158 Q159 T163 S164S157-F161 WeakPolarHBondContact O-CD2 3.25Å; S157-F161 PolarHBondContact O-N 3.35Å; A158-F161 PolarHBondContact O-N 2.83Å; Q159-F161 VanDerWaalsContact C-N 3.29Å; Q159-F161 PolarHBondContact O-N 3.29Å; F161-T163 VanDerWaalsContact C-N 3.28Å; F161-T163 PolarHBondContact O-N 2.95Å; F161-S164 PolarHBondContact O-OG 3.07Å; F161-S164 VanDerWaalsContact O-OG 3.05Å
162I53.2Low65.3Low137 Ų13794.1 Ų94.170%0.70350%0.499SS*.Hα-helixtrans-70.5-22.8-177.8-63.7164.8000112.3A158 Q159A158-I162 WeakPolarHBondContact O-CD1 3.38Å; A158-I162 WeakPolarHBondContact O-CG1 3.36Å; A158-I162 PolarHBondContact O-N 2.79Å; Q159-I162 PolarHBondContact O-N 3.3Å
163T51.9Low65Low81 Ų81100.6 Ų100.650%0.49753%0.53SS..THydrogen-bonded Turntrans-107.36.7-17835.70000115.2Q159 F161 S165Q159-T163 PolarHBondContact O-N 3.47Å; Q159-T163 PolarHBondContact O-OG1 2.92Å; F161-T163 VanDerWaalsContact C-N 3.28Å; F161-T163 PolarHBondContact O-N 2.95Å; T163-S165 PolarHBondContact O-N 2.89Å
164S51.7Low65Low81 Ų81100.5 Ų100.557%0.56653%0.529SS*.  trans-6993.3-176.960.30000112.6F161 W166F161-S164 PolarHBondContact O-OG 3.07Å; F161-S164 VanDerWaalsContact O-OG 3.05Å; S164-W166 PolarHBondContact O-N 3.09Å
165S59.3Low65Low65 Ų6597.5 Ų97.546%0.45553%0.527SS..  trans-73.6112.416662.20000108.6T163T163-S165 PolarHBondContact O-N 2.89Å
166W58.1Low64.5Low170 Ų170100.4 Ų100.464%0.64454%0.538SS*.  trans-91.1136.7176.659.3-74.1000109.9S164 F168 S182S164-W166 PolarHBondContact O-N 3.09Å; W166-F168 AromaticContact CE3-CD1 3.92Å; W166-F168 HydrophobicContact CE3-CD1 3.92Å; W166-F168 HydrophobicContact CH2-CD1 4.31Å; W166-F168 HydrophobicContact CH2-CE1 4.16Å; W166-F168 AromaticContact CZ3-CD1 3.44Å; W166-F168 HydrophobicContact CZ3-CD1 3.44Å; W166-F168 VanDerWaalsContact CZ3-CD1 3.44Å; W166-F168 AromaticContact CZ3-CE1 3.71Å; W166-F168 HydrophobicContact CZ3-CE1 3.71Å; W166-S182 PolarHBondContact N-OG 2.75Å; W166-S182 PolarHBondContact NE1-OG 2.76Å; W166-S182 VanDerWaalsContact NE1-OG 3.09Å; W166-S182 PolarHBondContact O-N 3.17Å; W166-S182 PolarHBondContact O-OG 3.11Å; W166-S182 VanDerWaalsContact O-OG 3.09Å
167T71.1Confident64.8Low63 Ų63100.9 Ų100.939%0.38754%0.539SS..EExtended strand (participates in β ladder)trans-125.8131.1175.158.60000109F180 Q181T167-F180 WeakPolarHBondContact CA-O 3.39Å; T167-Q181 HydrophobicContact CG2-CB 4.02Å; T167-Q181 HydrophobicContact CG2-CG 3.88Å
168F71.5Confident64.9Low72 Ų72101.2 Ų101.232%0.31654%0.539SS..EExtended strand (participates in β ladder)trans-124.7138.2175.275.8-91.1000110.9W166 L170 F180W166-F168 AromaticContact CE3-CD1 3.92Å; W166-F168 HydrophobicContact CE3-CD1 3.92Å; W166-F168 HydrophobicContact CH2-CD1 4.31Å; W166-F168 HydrophobicContact CH2-CE1 4.16Å; W166-F168 AromaticContact CZ3-CD1 3.44Å; W166-F168 HydrophobicContact CZ3-CD1 3.44Å; W166-F168 VanDerWaalsContact CZ3-CD1 3.44Å; W166-F168 AromaticContact CZ3-CE1 3.71Å; W166-F168 HydrophobicContact CZ3-CE1 3.71Å; F168-L170 HydrophobicContact CD2-CD1 4.17Å; F168-L170 HydrophobicContact CD2-CD2 4.23Å; F168-L170 HydrophobicContact CD2-CG 3.71Å; F168-L170 HydrophobicContact CE2-CD1 3.54Å; F168-L170 HydrophobicContact CE2-CD2 4.42Å; F168-L170 HydrophobicContact CE2-CG 3.6Å; F168-F180 HydrophobicContact CD1-CB 3.56Å; F168-F180 HydrophobicContact CD1-CG 4.36Å; F168-F180 HydrophobicContact CD2-CB 4.36Å; F168-F180 AromaticContact CD2-CD2 3.97Å; F168-F180 HydrophobicContact CD2-CD2 3.97Å; F168-F180 HydrophobicContact CE1-CB 3.12Å; F168-F180 HydrophobicContact CE1-CD1 4.34Å; F168-F180 AromaticContact CE1-CD2 3.95Å; F168-F180 HydrophobicContact CE1-CD2 3.95Å; F168-F180 AromaticContact CE1-CG 3.58Å; F168-F180 HydrophobicContact CE1-CG 3.58Å; F168-F180 HydrophobicContact CE2-CB 3.97Å; F168-F180 AromaticContact CE2-CD2 3.18Å; F168-F180 HydrophobicContact CE2-CD2 3.18Å; F168-F180 AromaticContact CE2-CE2 3.77Å; F168-F180 HydrophobicContact CE2-CE2 3.77Å; F168-F180 AromaticContact CE2-CG 3.74Å; F168-F180 HydrophobicContact CE2-CG 3.74Å; F168-F180 HydrophobicContact CG-CB 4.18Å; F168-F180 HydrophobicContact CZ-CB 3.35Å; F168-F180 AromaticContact CZ-CD1 3.94Å; F168-F180 HydrophobicContact CZ-CD1 3.94Å; F168-F180 AromaticContact CZ-CD2 3.18Å; F168-F180 HydrophobicContact CZ-CD2 3.18Å; F168-F180 AromaticContact CZ-CE2 3.86Å; F168-F180 HydrophobicContact CZ-CE2 3.86Å; F168-F180 AromaticContact CZ-CG 3.21Å; F168-F180 HydrophobicContact CZ-CG 3.21Å; F168-F180 HydrophobicContact CZ-CZ 4.49Å; F168-F180 PolarHBondContact N-O 3.36Å; F168-F180 VanDerWaalsContact N-O 3.13Å; F168-F180 PolarHBondContact O-N 3.26Å; F168-F180 VanDerWaalsContact O-N 3.13Å
169Y73.3Confident65.4Low152 Ų152104.3 Ų104.360%0.59655%0.548SS*.EExtended strand (participates in β ladder)trans-104.6115.5-179.5-57.4-89.1000108.2I177 I179Y169-I177 HydrophobicContact CD1-CG2 4.23Å; Y169-I179 HydrophobicContact CD1-CD1 4.46Å; Y169-I179 HydrophobicContact CD1-CG1 3.91Å; Y169-I179 HydrophobicContact CD1-CG2 4.4Å; Y169-I179 HydrophobicContact CE1-CD1 4.14Å; Y169-I179 HydrophobicContact CE1-CG1 4Å; Y169-I179 HydrophobicContact CE1-CG2 4.09Å
170L71.4Confident65.6Low100 Ų100103.9 Ų103.952%0.52455%0.545SS..EExtended strand (participates in β ladder)trans-106.1122.9168.3-67.7-178.7000108.9F168 V178 F180F168-L170 HydrophobicContact CD2-CD1 4.17Å; F168-L170 HydrophobicContact CD2-CD2 4.23Å; F168-L170 HydrophobicContact CD2-CG 3.71Å; F168-L170 HydrophobicContact CE2-CD1 3.54Å; F168-L170 HydrophobicContact CE2-CD2 4.42Å; F168-L170 HydrophobicContact CE2-CG 3.6Å; L170-V178 PolarHBondContact N-O 3.47Å; L170-V178 VanDerWaalsContact N-O 3.11Å; L170-V178 PolarHBondContact O-N 3.33Å; L170-F180 HydrophobicContact CD1-CE2 4.32Å
171Q69.3Low65.8Low144 Ų144107 Ų10767%0.67355%0.553SS**EExtended strand (participates in β ladder)trans-90.5111167.7-170.3168.818.700107.3I177Q171-I177 HydrophobicContact CG-CG1 4.37Å
172A70.5Confident66.3Low46 Ų46101.1 Ų101.138%0.3853%0.531SS..  trans-77.2158.5174.200000110.1D174 G175 K176A172-D174 WeakPolarHBondContact CB-OD1 3.26Å; A172-D174 PolarHBondContact O-N 3.38Å; A172-G175 PolarHBondContact O-N 3.24Å; A172-K176 PolarHBondContact N-O 3.05Å; A172-K176 VanDerWaalsContact N-O 3.07Å
173D68.3Low66.3Low186 Ų186103 Ų103100%0.99553%0.534SS*.THydrogen-bonded Turntrans-59.4-10.8-175.7-64.2-36.1000114.2G175D173-G175 VanDerWaalsContact C-N 3.35Å
174D73.2Confident66.4Low95 Ų95102.4 Ų102.451%0.50853%0.531SS..THydrogen-bonded Turntrans-91.210.6174.772-23.5000114A172 K176A172-D174 WeakPolarHBondContact CB-OD1 3.26Å; A172-D174 PolarHBondContact O-N 3.38Å; D174-K176 PolarHBondContact O-N 2.89Å; D174-K176 PolarHBondContact OD1-N 3.14Å; D174-K176 WeakPolarHBondContact OD2-CD 3.45Å; D174-K176 WeakPolarHBondContact OD2-CE 3.37Å; D174-K176 IonicContact OD2-NZ 2.77Å; D174-K176 PolarHBondContact OD2-NZ 3.33Å
175G73.1Confident65.9Low51 Ų51106.7 Ų106.753%0.52654%0.543SS..SBendtrans75.25.3177.100000114.4A172 D173A172-G175 PolarHBondContact O-N 3.24Å; D173-G175 VanDerWaalsContact C-N 3.35Å
176K64.3Low65.6Low137 Ų137108.2 Ų108.260%0.59655%0.545SS*.PPolyproline II helixtrans-90.5134.5175.8-61.4-177.5-163.6128.50110.2A172 D174A172-K176 PolarHBondContact N-O 3.05Å; A172-K176 VanDerWaalsContact N-O 3.07Å; D174-K176 PolarHBondContact O-N 2.89Å; D174-K176 PolarHBondContact OD1-N 3.14Å; D174-K176 WeakPolarHBondContact OD2-CD 3.45Å; D174-K176 WeakPolarHBondContact OD2-CE 3.37Å; D174-K176 IonicContact OD2-NZ 2.77Å; D174-K176 PolarHBondContact OD2-NZ 3.33Å
177I75.8Confident64.6Low105 Ų105108.2 Ų108.254%0.53855%0.552SS.*EExtended strand (participates in β ladder)trans-96.4120178.1-56168.3000107.7Y169 Q171 I179Y169-I177 HydrophobicContact CD1-CG2 4.23Å; Q171-I177 HydrophobicContact CG-CG1 4.37Å; I177-I179 HydrophobicContact CG2-CG1 4.44Å
178V68.5Low63.3Low69 Ų69114.2 Ų114.242%0.41857%0.569SS.*EExtended strand (participates in β ladder)trans-100.2124173.2-173.60000108.3L170 F180L170-V178 PolarHBondContact N-O 3.47Å; L170-V178 VanDerWaalsContact N-O 3.11Å; L170-V178 PolarHBondContact O-N 3.33Å; V178-F180 HydrophobicContact CB-CE2 4Å; V178-F180 HydrophobicContact CG1-CD2 4.02Å; V178-F180 HydrophobicContact CG1-CE1 4.46Å; V178-F180 HydrophobicContact CG1-CE2 3.44Å; V178-F180 VanDerWaalsContact CG1-CE2 3.44Å; V178-F180 HydrophobicContact CG1-CZ 3.7Å
179I72.9Confident61.7Low107 Ų107115 Ų11555%0.54959%0.589SS.*EExtended strand (participates in β ladder)trans-101.7117.8-178.9-52174000107.9Y169 I177Y169-I179 HydrophobicContact CD1-CD1 4.46Å; Y169-I179 HydrophobicContact CD1-CG1 3.91Å; Y169-I179 HydrophobicContact CD1-CG2 4.4Å; Y169-I179 HydrophobicContact CE1-CD1 4.14Å; Y169-I179 HydrophobicContact CE1-CG1 4Å; Y169-I179 HydrophobicContact CE1-CG2 4.09Å; I177-I179 HydrophobicContact CG2-CG1 4.44Å
180F64.5Low60Low96 Ų96113.8 Ų113.842%0.42160%0.599SS.*EExtended strand (participates in β ladder)trans-103.2113.3172.6-67.6-90.4000108.5T167 F168 L170 V178T167-F180 WeakPolarHBondContact CA-O 3.39Å; F168-F180 HydrophobicContact CD1-CB 3.56Å; F168-F180 HydrophobicContact CD1-CG 4.36Å; F168-F180 HydrophobicContact CD2-CB 4.36Å; F168-F180 AromaticContact CD2-CD2 3.97Å; F168-F180 HydrophobicContact CD2-CD2 3.97Å; F168-F180 HydrophobicContact CE1-CB 3.12Å; F168-F180 HydrophobicContact CE1-CD1 4.34Å; F168-F180 AromaticContact CE1-CD2 3.95Å; F168-F180 HydrophobicContact CE1-CD2 3.95Å; F168-F180 AromaticContact CE1-CG 3.58Å; F168-F180 HydrophobicContact CE1-CG 3.58Å; F168-F180 HydrophobicContact CE2-CB 3.97Å; F168-F180 AromaticContact CE2-CD2 3.18Å; F168-F180 HydrophobicContact CE2-CD2 3.18Å; F168-F180 AromaticContact CE2-CE2 3.77Å; F168-F180 HydrophobicContact CE2-CE2 3.77Å; F168-F180 AromaticContact CE2-CG 3.74Å; F168-F180 HydrophobicContact CE2-CG 3.74Å; F168-F180 HydrophobicContact CG-CB 4.18Å; F168-F180 HydrophobicContact CZ-CB 3.35Å; F168-F180 AromaticContact CZ-CD1 3.94Å; F168-F180 HydrophobicContact CZ-CD1 3.94Å; F168-F180 AromaticContact CZ-CD2 3.18Å; F168-F180 HydrophobicContact CZ-CD2 3.18Å; F168-F180 AromaticContact CZ-CE2 3.86Å; F168-F180 HydrophobicContact CZ-CE2 3.86Å; F168-F180 AromaticContact CZ-CG 3.21Å; F168-F180 HydrophobicContact CZ-CG 3.21Å; F168-F180 HydrophobicContact CZ-CZ 4.49Å; F168-F180 PolarHBondContact N-O 3.36Å; F168-F180 VanDerWaalsContact N-O 3.13Å; F168-F180 PolarHBondContact O-N 3.26Å; F168-F180 VanDerWaalsContact O-N 3.13Å; L170-F180 HydrophobicContact CD1-CE2 4.32Å; V178-F180 HydrophobicContact CB-CE2 4Å; V178-F180 HydrophobicContact CG1-CD2 4.02Å; V178-F180 HydrophobicContact CG1-CE1 4.46Å; V178-F180 HydrophobicContact CG1-CE2 3.44Å; V178-F180 VanDerWaalsContact CG1-CE2 3.44Å; V178-F180 HydrophobicContact CG1-CZ 3.7Å
181Q64.3Low58.1Low132 Ų132116.7 Ų116.762%0.61761%0.61SS**EExtended strand (participates in β ladder)trans-112.9119.8178.9177.9176.645.200109.7T167T167-Q181 HydrophobicContact CG2-CB 4.02Å; T167-Q181 HydrophobicContact CG2-CG 3.88Å
182S66.1Low56.6Low35 Ų35117.6 Ų117.625%0.24562%0.618CS.*  trans-81.6131.9165.760.80000109.6W166W166-S182 PolarHBondContact N-OG 2.75Å; W166-S182 PolarHBondContact NE1-OG 2.76Å; W166-S182 VanDerWaalsContact NE1-OG 3.09Å; W166-S182 PolarHBondContact O-N 3.17Å; W166-S182 PolarHBondContact O-OG 3.11Å; W166-S182 VanDerWaalsContact O-OG 3.09Å
183K54.2Low54.7Low175 Ų175122.9 Ų122.976%0.76164%0.635SS**  trans-95135.3168.8-72.1-176.5179.5177.60108.6E185K183-E185 PolarHBondContact O-N 3.48Å; K183-E185 VanDerWaalsContact O-N 3.16Å
184P53.4Low53.3Low69 Ų69123 Ų12345%0.44863%0.63SS.*  trans-71.3109170.328.7-30.7000108.2I186P184-I186 HydrophobicContact CB-CG1 4.44Å; P184-I186 PolarHBondContact O-N 3.36Å
185E41.2Very low51.1Low172 Ų172127.3 Ų127.380%0.80465%0.647SS**  trans-8687.4172.1-166.1159.9178.400108.3K183 Q187K183-E185 PolarHBondContact O-N 3.48Å; K183-E185 VanDerWaalsContact O-N 3.16Å; E185-Q187 PolarHBondContact O-N 3.45Å
186I52.4Low48.9Very low96 Ų96129 Ų12949%0.49265%0.651SS.*  trans-75.696.1175.1-41.6169000106.5P184 Y188P184-I186 HydrophobicContact CB-CG1 4.44Å; P184-I186 PolarHBondContact O-N 3.36Å; I186-Y188 HydrophobicContact CB-CE2 4.19Å; I186-Y188 HydrophobicContact CG2-CE1 4.29Å; I186-Y188 HydrophobicContact CG2-CE2 4.21Å; I186-Y188 PolarHBondContact O-N 2.73Å
187Q38.2Very low47.2Very low170 Ų170128.2 Ų128.279%0.79466%0.657SS**  trans-70.299.1164.2-73.1-175.626.700107.7E185 A189E185-Q187 PolarHBondContact O-N 3.45Å; Q187-A189 PolarHBondContact O-N 2.95Å
188Y42.9Very low44.9Very low189 Ų189130.3 Ų130.374%0.74167%0.67SS**PPolyproline II helixtrans-63.4118.7164.3-64.8-83.9000107.4I186I186-Y188 HydrophobicContact CB-CE2 4.19Å; I186-Y188 HydrophobicContact CG2-CE1 4.29Å; I186-Y188 HydrophobicContact CG2-CE2 4.21Å; I186-Y188 PolarHBondContact O-N 2.73Å
189A37.4Very low43.1Very low90 Ų90135.2 Ų135.274%0.74469%0.693SS**PPolyproline II helixtrans-51.6132.4166.800000107.9Q187 H191Q187-A189 PolarHBondContact O-N 2.95Å; A189-H191 PolarHBondContact O-N 3.35Å
190P38.2Very low41Very low125 Ų125140.2 Ų140.281%0.81271%0.705SS**PPolyproline II helixtrans-59.7119.1-17623-30.8000108.3L192P190-L192 PolarHBondContact O-N 3.25Å; P190-L192 VanDerWaalsContact O-N 3.08Å
191H32.1Very low39.2Very low162 Ų162143.3 Ų143.375%0.7572%0.72SS**  trans-49.6115.9166.9-170.6-90.9000106.8A189 E193A189-H191 PolarHBondContact O-N 3.35Å; H191-E193 PolarHBondContact O-N 2.9Å
192L36.3Very low37.5Very low162 Ų162142.3 Ų142.385%0.84873%0.728SS**  trans-71.180.5177.5-153.7144.1000106.3P190 Q194P190-L192 PolarHBondContact O-N 3.25Å; P190-L192 VanDerWaalsContact O-N 3.08Å; L192-Q194 PolarHBondContact O-N 3.38Å; L192-Q194 VanDerWaalsContact O-N 3.15Å
193E30.8Very low35.8Very low158 Ų158145.3 Ų145.374%0.73875%0.749SS**  trans-63114.8167.8-78.8-157118.900107.9H191 E195H191-E193 PolarHBondContact O-N 2.9Å; E193-E195 PolarHBondContact O-N 2.84Å
194Q40Very low34.8Very low189 Ų189145.4 Ų145.488%0.88376%0.757SS**  trans-59.883.9164.8-179.4177.25.600108.8L192L192-Q194 PolarHBondContact O-N 3.38Å; L192-Q194 VanDerWaalsContact O-N 3.15Å
195E25.8Very low33.5Very low185 Ų185146.8 Ų146.886%0.86477%0.769SS**  trans-97105.9164.5-169.5153.3107.300109.8E193E193-E195 PolarHBondContact O-N 2.84Å
196S28.3Very low33Very low87 Ų87148.5 Ų148.561%0.60877%0.773SS**  trans-63.3144.4164.954.10000111.2
197T27.8Very low31.9Very low119 Ų119152.8 Ų152.873%0.7379%0.793SS**  trans102.4106.3153.772.10000118.8
198N27.5Very low31.4Very low150 Ų150149.2 Ų149.280%0.80279%0.787SS**  trans63.7109.9142.5-65.4-67.7000119.6
199L30.8Very low30.8Very low171 Ų171150.8 Ų150.890%0.89579%0.794SS**  -168.195.6116.8-97.9168.6000111.2
200R28.4Very low30.5Very low212 Ų212154.2 Ų154.280%0.880%0.798SS**  trans24.3105.5132.9-160169.7178.8-165.7-2118.7
201E28Very low30.1Very low161 Ų161156.9 Ų156.975%0.75280%0.8SS**  75.697.8121.4-148.3148.1-149.100119
202S27.8Very low30.2Very low112 Ų112157.7 Ų157.778%0.78381%0.806SS**  trans-152.6112.9138.8-139.20000113
203S30.7Very low29.6Very low97 Ų97161.3 Ų161.368%0.67881%0.809SS**  trans60.184.8143.765.40000120.3S205S203-S205 PolarHBondContact O-N 3.47Å
204L33.9Very low29.6Very low177 Ų177161 Ų16193%0.92781%0.812SS**  -4.3109.2115.1-170.5127.6000115.3
205S25.7Very low29.2Very low99 Ų99156.7 Ų156.769%0.69280%0.803SS**  trans-164.7127139.653.30000113.2S203S203-S205 PolarHBondContact O-N 3.47Å
206K31.2Very low29.7Very low207 Ų207157 Ų15790%0.980%0.804SS**  trans78.272.9155.7-68.5174.1175.5170.50118.7
207M28.9Very low29.8Very low186 Ų186157.3 Ų157.392%0.91681%0.812SS**  trans-70.6137.6137.9-178.987.8108.100109.7
208S27Very low29.9Very low95 Ų95159.6 Ų159.666%0.66481%0.814SS**  trans71.6109.9160.6-1650000117.8
209Y30.4Very low30.1Very low223 Ų223163.1 Ų163.188%0.87582%0.816SS**  -175.3138.6126.1-97.8-73.9000109.2
210L31.6Very low30.4Very low162 Ų162163 Ų16385%0.84882%0.816SS**  trans87.694.3179.8-52.4179.4000114
211Q29.1Very low30.6Very low180 Ų180162 Ų16284%0.84182%0.818SS**  49.692.254.8-161.7152-25.400113.9
212M33.8Very low31.1Very low180 Ų180160.8 Ų160.889%0.88782%0.816SS**  trans37.1103.2136.1-161.4156.7-15600117.4
213R25.1Very low31.9Very low238 Ų238164.4 Ų164.490%0.89882%0.821SS**  trans-151.3117.7145-159.7152.7-177.8143.7-2.3112.3
214N30.2Very low32.3Very low151 Ų151168 Ų16881%0.80783%0.833SS**  trans-76.9139.1169.1-161.88.3000109.6
215S31.7Very low32.8Very low98 Ų98161.3 Ų161.369%0.68581%0.806SS**  trans153.198.5150.747.90000109.2
216Q35.4Very low33.9Very low191 Ų191165.6 Ų165.689%0.89382%0.815SS**  85.4125.686-129.8176.415.200114.5
217A30.1Very low34.8Very low95 Ų95159.8 Ų159.879%0.78580%0.801SS**  trans97.8115.9148.200000119.2
218H30.2Very low36Very low167 Ų167156.3 Ų156.377%0.77379%0.786SS**  trans113.784.1133.9-145.171.2000116.9
219R33.3Very low37.4Very low223 Ų223153.9 Ų153.984%0.84278%0.776SS**  -176.8117.8102.8-96.2175.9175.8163.8-1.6111.5
220N35.4Very low38.8Very low168 Ų168150.3 Ų150.390%0.89877%0.765SS**  trans-78.3137.2163.9-64.8-41.2000109.1
221F32.8Very low39.9Very low191 Ų191147.7 Ų147.784%0.83875%0.751SS**  trans-159.8129.8148.2-162.5-108.5000110.3
222L38.4Very low41.2Very low136 Ų136148 Ų14871%0.71275%0.745SS**  trans69.188.8176.3-91.3154.5000115.3
223E45.7Very low42.2Very low188 Ų188144 Ų14488%0.87973%0.734SS**  58.277.471.5-153.5-173.1157.500112.3
224D38.9Very low43.7Very low173 Ų173135.5 Ų135.593%0.92571%0.706SS**  trans-169.8141.1135.9-152.7-9000108.8
225G44.7Very low44.9Very low36 Ų36132 Ų13237%0.37169%0.693SS.*  trans113.248.217100000118S227 D228G225-S227 PolarHBondContact O-N 3.49Å; G225-D228 PolarHBondContact O-N 2.86Å
226E47.2Very low46.3Very low190 Ų190134 Ų13489%0.88870%0.696SS**Hα-helixtrans-55.3-18.1166.7-172.286.892.400112.7
227S51.8Low47.6Very low85 Ų85132.3 Ų132.359%0.59469%0.692SS**Hα-helixtrans-82-27.7-179.2-151.30000114.4G225G225-S227 PolarHBondContact O-N 3.49Å
228D53.8Low49.2Very low113 Ų113128.7 Ų128.760%0.60466%0.662SS**Hα-helixtrans-80.2-23.7-175.5-75.1-22.6000112.9G225 R232G225-D228 PolarHBondContact O-N 2.86Å; D228-R232 VanDerWaalsContact O-CB 3.27Å; D228-R232 WeakPolarHBondContact O-CB 3.43Å; D228-R232 WeakPolarHBondContact O-CG 3.32Å; D228-R232 PolarHBondContact O-N 3.49Å; D228-R232 VanDerWaalsContact O-N 3.08Å
229G56.8Low51.1Low44 Ų44121.8 Ų121.845%0.45464%0.636SS.*Hα-helixtrans-71-38.4178.700000113.5C233G229-C233 PolarHBondContact O-N 2.87Å; G229-C233 VanDerWaalsContact O-N 3.15Å
230F58.6Low52.9Low148 Ų148121.5 Ų121.565%0.64964%0.635SS**Hα-helixtrans-70.2-44.5-179.2-174-103.9000111.7L234F230-L234 HydrophobicContact CD1-CD1 3.73Å; F230-L234 HydrophobicContact CE1-CD1 3.41Å; F230-L234 VanDerWaalsContact CE1-CD1 3.41Å; F230-L234 HydrophobicContact CG-CD1 4.45Å; F230-L234 HydrophobicContact CZ-CD1 3.9Å; F230-L234 WeakPolarHBondContact O-CG 3.3Å; F230-L234 PolarHBondContact O-N 3.29Å; F230-L234 VanDerWaalsContact O-N 3.17Å
231L54.8Low55.1Low106 Ų106118.6 Ų118.656%0.55562%0.618SS**Hα-helixtrans-71-32.3177.3-64.7177000112.5S235L231-S235 WeakPolarHBondContact O-CB 3.23Å; L231-S235 PolarHBondContact O-N 2.8Å
232R56Low57.3Low186 Ų186114 Ų11470%0.70260%0.601SS**Hα-helixtrans-68.9-38.8174.1-87.5-162.6141.8-177.6-1.7113.7D228 S235 L236D228-R232 VanDerWaalsContact O-CB 3.27Å; D228-R232 WeakPolarHBondContact O-CB 3.43Å; D228-R232 WeakPolarHBondContact O-CG 3.32Å; D228-R232 PolarHBondContact O-N 3.49Å; D228-R232 VanDerWaalsContact O-N 3.08Å; R232-S235 WeakPolarHBondContact O-CB 3.43Å; R232-S235 PolarHBondContact O-N 3.23Å; R232-L236 WeakPolarHBondContact O-CD1 3.18Å; R232-L236 PolarHBondContact O-N 3.33Å
233C56.3Low59.3Low98 Ų98111.3 Ų111.366%0.66259%0.591SS**Hα-helixtrans-67.6-37.7174.8-90.50000112.3G229 S235G229-C233 PolarHBondContact O-N 2.87Å; G229-C233 VanDerWaalsContact O-N 3.15Å; C233-S235 VanDerWaalsContact C-N 3.34Å
234L55.6Low61.1Low59 Ų59105.6 Ų105.631%0.30957%0.569SS.*Hα-helixtrans-66.5-35.9171.2-73.5164.9000111.8F230 S238 G239 L242F230-L234 HydrophobicContact CD1-CD1 3.73Å; F230-L234 HydrophobicContact CE1-CD1 3.41Å; F230-L234 VanDerWaalsContact CE1-CD1 3.41Å; F230-L234 HydrophobicContact CG-CD1 4.45Å; F230-L234 HydrophobicContact CZ-CD1 3.9Å; F230-L234 WeakPolarHBondContact O-CG 3.3Å; F230-L234 PolarHBondContact O-N 3.29Å; F230-L234 VanDerWaalsContact O-N 3.17Å; L234-S238 VanDerWaalsContact C-OG 3.26Å; L234-S238 WeakPolarHBondContact CA-OG 3.49Å; L234-S238 WeakPolarHBondContact CD2-OG 3.33Å; L234-S238 CarbonylContact O-C 3.59Å; L234-S238 VanDerWaalsContact O-CA 3.28Å; L234-S238 WeakPolarHBondContact O-CA 3.38Å; L234-S238 WeakPolarHBondContact O-CB 3.34Å; L234-S238 PolarHBondContact O-N 2.85Å; L234-S238 PolarHBondContact O-OG 2.77Å; L234-G239 PolarHBondContact O-N 3.11Å; L234-G239 VanDerWaalsContact O-N 3.17Å; L234-L242 HydrophobicContact CB-CD1 4.42Å
235S56Low63.5Low77 Ų77101 Ų10154%0.53855%0.547SS..Hα-helixtrans-67.4-39.3177.9155.50000113.6L231 R232 C233L231-S235 WeakPolarHBondContact O-CB 3.23Å; L231-S235 PolarHBondContact O-N 2.8Å; R232-S235 WeakPolarHBondContact O-CB 3.43Å; R232-S235 PolarHBondContact O-N 3.23Å; C233-S235 VanDerWaalsContact C-N 3.34Å
236L60.4Low65.4Low141 Ų141104.5 Ų104.574%0.73856%0.557SS**Hα-helixtrans-79-30.2-171.2-82.6155.5000114.4R232R232-L236 WeakPolarHBondContact O-CD1 3.18Å; R232-L236 PolarHBondContact O-N 3.33Å
237N62.9Low67.4Low154 Ų15499.5 Ų99.582%0.82454%0.539SS*.Hα-helixtrans-124.5-19-176.5-136.932.3000114
238S62.5Low68.9Low20 Ų20100.7 Ų100.714%0.1454%0.538CS..Hα-helixtrans-116.413.2177.664.10000114.1L234 W240 I241 L242L234-S238 VanDerWaalsContact C-OG 3.26Å; L234-S238 WeakPolarHBondContact CA-OG 3.49Å; L234-S238 WeakPolarHBondContact CD2-OG 3.33Å; L234-S238 CarbonylContact O-C 3.59Å; L234-S238 VanDerWaalsContact O-CA 3.28Å; L234-S238 WeakPolarHBondContact O-CA 3.38Å; L234-S238 WeakPolarHBondContact O-CB 3.34Å; L234-S238 PolarHBondContact O-N 2.85Å; L234-S238 PolarHBondContact O-OG 2.77Å; S238-W240 PolarHBondContact O-N 3.25Å; S238-I241 WeakPolarHBondContact O-CA 3.33Å; S238-I241 WeakPolarHBondContact O-CB 3.45Å; S238-I241 PolarHBondContact O-N 3.2Å; S238-L242 PolarHBondContact O-N 2.87Å
239G70.3Confident70.7Confident22 Ų2298.1 Ų98.123%0.22753%0.529CS..Hα-helixtrans-54.9-39.1175.400000112.6L234 I241 L242 T243L234-G239 PolarHBondContact O-N 3.11Å; L234-G239 VanDerWaalsContact O-N 3.17Å; G239-I241 VanDerWaalsContact C-N 3.31Å; G239-I241 PolarHBondContact O-N 3.13Å; G239-L242 PolarHBondContact O-N 3.13Å; G239-T243 VanDerWaalsContact O-CG2 3.31Å; G239-T243 WeakPolarHBondContact O-CG2 3.44Å; G239-T243 PolarHBondContact O-N 3.31Å; G239-T243 PolarHBondContact O-OG1 3.09Å
240W71.9Confident72.4Confident217 Ų21799.3 Ų99.382%0.82253%0.527SS*.Hα-helixtrans-65.1-31.9174.6-62.789.6000113.3S238 T243 T244S238-W240 PolarHBondContact O-N 3.25Å; W240-T243 WeakPolarHBondContact CA-OG1 3.38Å; W240-T243 PolarHBondContact O-OG1 3.47Å; W240-T244 WeakPolarHBondContact O-CB 3.27Å; W240-T244 WeakPolarHBondContact O-CG2 3.46Å; W240-T244 PolarHBondContact O-N 2.67Å; W240-T244 PolarHBondContact O-OG1 3.29Å
241I81.5Confident73.7Confident106 Ų10697.7 Ų97.754%0.54452%0.523SS..Hα-helixtrans-76.2-39.7179-63.7155000109.9S238 G239 T244 T245S238-I241 WeakPolarHBondContact O-CA 3.33Å; S238-I241 WeakPolarHBondContact O-CB 3.45Å; S238-I241 PolarHBondContact O-N 3.2Å; G239-I241 VanDerWaalsContact C-N 3.31Å; G239-I241 PolarHBondContact O-N 3.13Å; I241-T244 VanDerWaalsContact CA-OG1 3.3Å; I241-T244 WeakPolarHBondContact CA-OG1 3.04Å; I241-T244 PolarHBondContact O-OG1 3.34Å; I241-T245 WeakPolarHBondContact O-CB 3.31Å; I241-T245 VanDerWaalsContact O-CG2 3.29Å; I241-T245 WeakPolarHBondContact O-CG2 3.37Å; I241-T245 PolarHBondContact O-N 3.16Å; I241-T245 PolarHBondContact O-OG1 3.44Å
242L78.1Confident75.4Confident94 Ų9496.3 Ų96.349%0.49252%0.519SS..Hα-helixtrans-68.7-41.1175.1-69.3173.2000112.2L234 S238 G239 T245 L246L234-L242 HydrophobicContact CB-CD1 4.42Å; S238-L242 PolarHBondContact O-N 2.87Å; G239-L242 PolarHBondContact O-N 3.13Å; L242-T245 WeakPolarHBondContact CA-OG1 3.45Å; L242-T245 PolarHBondContact O-OG1 3.05Å; L242-T245 VanDerWaalsContact O-OG1 3.05Å; L242-L246 VanDerWaalsContact O-CB 3.29Å; L242-L246 WeakPolarHBondContact O-CB 3.3Å; L242-L246 PolarHBondContact O-N 3.39Å
243T81.4Confident76.8Confident80 Ų8093.1 Ų93.149%0.49152%0.515SS..Hα-helixtrans-69-41.9176.255.10000111.5G239 W240 L246 V247G239-T243 VanDerWaalsContact O-CG2 3.31Å; G239-T243 WeakPolarHBondContact O-CG2 3.44Å; G239-T243 PolarHBondContact O-N 3.31Å; G239-T243 PolarHBondContact O-OG1 3.09Å; W240-T243 WeakPolarHBondContact CA-OG1 3.38Å; W240-T243 PolarHBondContact O-OG1 3.47Å; T243-L246 PolarHBondContact O-N 3.49Å; T243-V247 WeakPolarHBondContact O-CB 3.44Å; T243-V247 WeakPolarHBondContact O-CG2 3.47Å; T243-V247 PolarHBondContact O-N 3.02Å
244T84.5Confident78.3Confident69 Ų6993 Ų9342%0.42351%0.508SS..Hα-helixtrans-64.4-43176.451.30000111.9W240 I241 V247 L248W240-T244 WeakPolarHBondContact O-CB 3.27Å; W240-T244 WeakPolarHBondContact O-CG2 3.46Å; W240-T244 PolarHBondContact O-N 2.67Å; W240-T244 PolarHBondContact O-OG1 3.29Å; I241-T244 VanDerWaalsContact CA-OG1 3.3Å; I241-T244 WeakPolarHBondContact CA-OG1 3.04Å; I241-T244 PolarHBondContact O-OG1 3.34Å; T244-V247 PolarHBondContact O-N 3.43Å; T244-L248 VanDerWaalsContact O-CB 3.28Å; T244-L248 WeakPolarHBondContact O-CB 3.42Å; T244-L248 WeakPolarHBondContact O-CG 3.4Å; T244-L248 PolarHBondContact O-N 3.47Å
245T87.9Confident79.9Confident75 Ų7598.8 Ų98.846%0.4653%0.525SS..Hα-helixtrans-65.6-38.7176.547.30000112.8I241 L242 L248 S249I241-T245 WeakPolarHBondContact O-CB 3.31Å; I241-T245 VanDerWaalsContact O-CG2 3.29Å; I241-T245 WeakPolarHBondContact O-CG2 3.37Å; I241-T245 PolarHBondContact O-N 3.16Å; I241-T245 PolarHBondContact O-OG1 3.44Å; L242-T245 WeakPolarHBondContact CA-OG1 3.45Å; L242-T245 PolarHBondContact O-OG1 3.05Å; L242-T245 VanDerWaalsContact O-OG1 3.05Å; T245-L248 PolarHBondContact O-N 3.27Å; T245-S249 WeakPolarHBondContact O-CB 3.28Å; T245-S249 PolarHBondContact O-N 2.87Å
246L85.8Confident81.4Confident111 Ų11199 Ų9958%0.58152%0.52SS*.Hα-helixtrans-67.1-41.4174.3-171.6152.1000112L242 T243 S249 V250L242-L246 VanDerWaalsContact O-CB 3.29Å; L242-L246 WeakPolarHBondContact O-CB 3.3Å; L242-L246 PolarHBondContact O-N 3.39Å; T243-L246 PolarHBondContact O-N 3.49Å; L246-S249 PolarHBondContact O-N 3.34Å; L246-S249 PolarHBondContact O-OG 3.08Å; L246-V250 HydrophobicContact CD2-CG2 4.39Å; L246-V250 WeakPolarHBondContact O-CG2 3.29Å; L246-V250 PolarHBondContact O-N 3.3Å; L246-V250 VanDerWaalsContact O-N 3.07Å
247V88.1Confident82.3Confident85 Ų8595.8 Ų95.852%0.51551%0.508SS..Hα-helixtrans-66.8-41.8176.1170.60000110.9T243 T244 S249 V250 M251T243-V247 WeakPolarHBondContact O-CB 3.44Å; T243-V247 WeakPolarHBondContact O-CG2 3.47Å; T243-V247 PolarHBondContact O-N 3.02Å; T244-V247 PolarHBondContact O-N 3.43Å; V247-S249 VanDerWaalsContact C-N 3.33Å; V247-S249 PolarHBondContact O-N 3.16Å; V247-V250 PolarHBondContact O-N 2.85Å; V247-M251 HydrophobicContact CG1-CG 4.38Å; V247-M251 WeakPolarHBondContact O-CB 3.35Å; V247-M251 VanDerWaalsContact O-CG 3.3Å; V247-M251 WeakPolarHBondContact O-CG 3.49Å; V247-M251 PolarHBondContact O-N 2.96Å
248L84.4Confident82.9Confident109 Ų10992.5 Ų92.557%0.57150%0.497SS*.Hα-helixtrans-63.3-38.7175.6-73.9171.2000111.5T244 T245 M251 V252T244-L248 VanDerWaalsContact O-CB 3.28Å; T244-L248 WeakPolarHBondContact O-CB 3.42Å; T244-L248 WeakPolarHBondContact O-CG 3.4Å; T244-L248 PolarHBondContact O-N 3.47Å; T245-L248 PolarHBondContact O-N 3.27Å; L248-M251 PolarHBondContact O-N 3.02Å; L248-V252 WeakPolarHBondContact O-CB 3.25Å; L248-V252 VanDerWaalsContact O-CG2 3.23Å; L248-V252 WeakPolarHBondContact O-CG2 3.21Å; L248-V252 PolarHBondContact O-N 3.47Å
249S90.3Very high83.6Confident59 Ų5993 Ų9341%0.41350%0.502SS..Hα-helixtrans-65.5-42.8176.775.60000111.8T245 L246 V247 V252 L253T245-S249 WeakPolarHBondContact O-CB 3.28Å; T245-S249 PolarHBondContact O-N 2.87Å; L246-S249 PolarHBondContact O-N 3.34Å; L246-S249 PolarHBondContact O-OG 3.08Å; V247-S249 VanDerWaalsContact C-N 3.33Å; V247-S249 PolarHBondContact O-N 3.16Å; S249-V252 PolarHBondContact O-N 3.38Å; S249-L253 WeakPolarHBondContact O-CB 3.29Å; S249-L253 WeakPolarHBondContact O-CG 3.39Å; S249-L253 PolarHBondContact O-N 2.94Å
250V92.6Very high83.7Confident69 Ų6995.5 Ų95.542%0.41851%0.513SS..Hα-helixtrans-63.5-43.6174.7173.80000111.2L246 V247 V252 L253 L254L246-V250 HydrophobicContact CD2-CG2 4.39Å; L246-V250 WeakPolarHBondContact O-CG2 3.29Å; L246-V250 PolarHBondContact O-N 3.3Å; L246-V250 VanDerWaalsContact O-N 3.07Å; V247-V250 PolarHBondContact O-N 2.85Å; V250-V252 VanDerWaalsContact C-N 3.33Å; V250-V252 PolarHBondContact O-N 2.99Å; V250-L253 PolarHBondContact O-N 3.02Å; V250-L254 HydrophobicContact CG1-CD1 4.06Å; V250-L254 HydrophobicContact CG1-CG 4.42Å; V250-L254 WeakPolarHBondContact O-CB 3.37Å; V250-L254 VanDerWaalsContact O-CG 3.31Å; V250-L254 WeakPolarHBondContact O-CG 3.16Å; V250-L254 PolarHBondContact O-N 3.36Å
251M86.7Confident83.8Confident115 Ų11588.9 Ų88.957%0.56750%0.496SS*.Hα-helixtrans-63.1-37.9176.7-75.7-63-61.400112.5V247 L248 W255V247-M251 HydrophobicContact CG1-CG 4.38Å; V247-M251 WeakPolarHBondContact O-CB 3.35Å; V247-M251 VanDerWaalsContact O-CG 3.3Å; V247-M251 WeakPolarHBondContact O-CG 3.49Å; V247-M251 PolarHBondContact O-N 2.96Å; L248-M251 PolarHBondContact O-N 3.02Å; M251-W255 VanDerWaalsContact O-CB 3.3Å; M251-W255 WeakPolarHBondContact O-CB 3.45Å; M251-W255 PolarHBondContact O-N 3.37Å
252V91.1Very high83.2Confident77 Ų7788 Ų8847%0.46751%0.505SS..Hα-helixtrans-69.8-41.4174.8170.60000111.1L248 S249 V250 L254 W255 I256L248-V252 WeakPolarHBondContact O-CB 3.25Å; L248-V252 VanDerWaalsContact O-CG2 3.23Å; L248-V252 WeakPolarHBondContact O-CG2 3.21Å; L248-V252 PolarHBondContact O-N 3.47Å; S249-V252 PolarHBondContact O-N 3.38Å; V250-V252 VanDerWaalsContact C-N 3.33Å; V250-V252 PolarHBondContact O-N 2.99Å; V252-L254 VanDerWaalsContact C-N 3.34Å; V252-L254 PolarHBondContact O-N 2.85Å; V252-W255 PolarHBondContact O-N 3Å; V252-I256 HydrophobicContact CG1-CD1 3.83Å; V252-I256 HydrophobicContact CG1-CG1 4.28Å; V252-I256 WeakPolarHBondContact O-CB 3.42Å; V252-I256 VanDerWaalsContact O-CG1 3.3Å; V252-I256 WeakPolarHBondContact O-CG1 3.45Å; V252-I256 PolarHBondContact O-N 2.99Å
253L85.4Confident82.3Confident118 Ų11888.3 Ų88.362%0.61851%0.51SS*.Hα-helixtrans-61.7-42.6174.2-73.6171.8000111.4S249 V250 I256 C257S249-L253 WeakPolarHBondContact O-CB 3.29Å; S249-L253 WeakPolarHBondContact O-CG 3.39Å; S249-L253 PolarHBondContact O-N 2.94Å; V250-L253 PolarHBondContact O-N 3.02Å; L253-I256 PolarHBondContact O-N 3.07Å; L253-C257 WeakPolarHBondContact O-CB 3.48Å; L253-C257 PolarHBondContact O-N 2.88Å
254L86.6Confident80.6Confident96 Ų9687.7 Ų87.750%0.50351%0.514SS..Hα-helixtrans-64.3-41.3173.7-72172.8000111.7V250 V252 C257 C258V250-L254 HydrophobicContact CG1-CD1 4.06Å; V250-L254 HydrophobicContact CG1-CG 4.42Å; V250-L254 WeakPolarHBondContact O-CB 3.37Å; V250-L254 VanDerWaalsContact O-CG 3.31Å; V250-L254 WeakPolarHBondContact O-CG 3.16Å; V250-L254 PolarHBondContact O-N 3.36Å; V252-L254 VanDerWaalsContact C-N 3.34Å; V252-L254 PolarHBondContact O-N 2.85Å; L254-C257 PolarHBondContact O-N 3.44Å; L254-C258 WeakPolarHBondContact O-CB 3.38Å; L254-C258 PolarHBondContact O-N 3.49Å; L254-C258 PolarHBondContact O-SG 3.09Å
255W89.4Confident78.5Confident180 Ų18089.8 Ų89.868%0.68253%0.526SS*.Hα-helixtrans-64.2-45.7176.6-179.582.6000111.9M251 V252 C257 C258 A259M251-W255 VanDerWaalsContact O-CB 3.3Å; M251-W255 WeakPolarHBondContact O-CB 3.45Å; M251-W255 PolarHBondContact O-N 3.37Å; V252-W255 PolarHBondContact O-N 3Å; W255-C257 VanDerWaalsContact C-N 3.33Å; W255-C258 PolarHBondContact O-N 2.83Å; W255-A259 VanDerWaalsContact O-CB 3.25Å; W255-A259 WeakPolarHBondContact O-CB 3.3Å; W255-A259 PolarHBondContact O-N 2.8Å
256I87Confident76.6Confident82 Ų8294.1 Ų94.142%0.42154%0.541SS..Hα-helixtrans-63-42.8174.9-66.6173.2000109.6V252 L253 C258 A259 T260V252-I256 HydrophobicContact CG1-CD1 3.83Å; V252-I256 HydrophobicContact CG1-CG1 4.28Å; V252-I256 WeakPolarHBondContact O-CB 3.42Å; V252-I256 VanDerWaalsContact O-CG1 3.3Å; V252-I256 WeakPolarHBondContact O-CG1 3.45Å; V252-I256 PolarHBondContact O-N 2.99Å; L253-I256 PolarHBondContact O-N 3.07Å; I256-C258 PolarHBondContact O-N 2.89Å; I256-A259 PolarHBondContact O-N 3.39Å; I256-T260 HydrophobicContact CG2-CG2 4.16Å; I256-T260 WeakPolarHBondContact O-CB 3.22Å; I256-T260 VanDerWaalsContact O-CG2 3.28Å; I256-T260 WeakPolarHBondContact O-CG2 3.42Å; I256-T260 PolarHBondContact O-N 3.37Å; I256-T260 PolarHBondContact O-OG1 3.24Å
257C79.6Confident74.5Confident73 Ų7396.5 Ų96.549%0.49355%0.549SS..Hα-helixtrans-61.7-45.5178.2-156.90000111.3L253 L254 W255 T260 V261L253-C257 WeakPolarHBondContact O-CB 3.48Å; L253-C257 PolarHBondContact O-N 2.88Å; L254-C257 PolarHBondContact O-N 3.44Å; W255-C257 VanDerWaalsContact C-N 3.33Å; C257-T260 WeakPolarHBondContact CA-OG1 3.27Å; C257-T260 PolarHBondContact O-N 2.91Å; C257-T260 PolarHBondContact O-OG1 3.22Å; C257-V261 VanDerWaalsContact O-CG2 3.29Å; C257-V261 WeakPolarHBondContact O-CG2 3.18Å; C257-V261 PolarHBondContact O-N 3.48Å
258C74.9Confident72.2Confident86 Ų86101.8 Ų101.858%0.58156%0.561SS**Hα-helixtrans-65.7-40.6175.7-72.40000112.3L254 W255 I256 V261 A262L254-C258 WeakPolarHBondContact O-CB 3.38Å; L254-C258 PolarHBondContact O-N 3.49Å; L254-C258 PolarHBondContact O-SG 3.09Å; W255-C258 PolarHBondContact O-N 2.83Å; I256-C258 PolarHBondContact O-N 2.89Å; C258-V261 PolarHBondContact O-N 3.3Å; C258-A262 VanDerWaalsContact O-CB 3.31Å; C258-A262 WeakPolarHBondContact O-CB 3.48Å; C258-A262 PolarHBondContact O-N 3.28Å
259A77.2Confident70.1Confident31 Ų31102.1 Ų102.126%0.25657%0.568SS.*Hα-helixtrans-62.7-47.5174.700000110.2W255 I256 V261 A262 T263W255-A259 VanDerWaalsContact O-CB 3.25Å; W255-A259 WeakPolarHBondContact O-CB 3.3Å; W255-A259 PolarHBondContact O-N 2.8Å; I256-A259 PolarHBondContact O-N 3.39Å; A259-V261 VanDerWaalsContact C-N 3.29Å; A259-V261 PolarHBondContact O-N 3.07Å; A259-A262 CarbonylContact O-C 3.59Å; A259-A262 PolarHBondContact O-N 2.9Å; A259-T263 WeakPolarHBondContact O-CB 3.31Å; A259-T263 WeakPolarHBondContact O-CG2 3.37Å; A259-T263 PolarHBondContact O-N 3.05Å; A259-T263 PolarHBondContact O-OG1 3.01Å
260T74.4Confident67.7Low74 Ų74104 Ų10445%0.45458%0.578SS.*Hα-helixtrans-64.1-30.3178.1540000113.4I256 C257 A264I256-T260 HydrophobicContact CG2-CG2 4.16Å; I256-T260 WeakPolarHBondContact O-CB 3.22Å; I256-T260 VanDerWaalsContact O-CG2 3.28Å; I256-T260 WeakPolarHBondContact O-CG2 3.42Å; I256-T260 PolarHBondContact O-N 3.37Å; I256-T260 PolarHBondContact O-OG1 3.24Å; C257-T260 WeakPolarHBondContact CA-OG1 3.27Å; C257-T260 PolarHBondContact O-N 2.91Å; C257-T260 PolarHBondContact O-OG1 3.22Å; T260-A264 WeakPolarHBondContact O-CA 3.22Å; T260-A264 WeakPolarHBondContact O-CB 3.46Å; T260-A264 PolarHBondContact O-N 3.38Å
261V72.8Confident65.2Low78 Ų78104.9 Ų104.947%0.47359%0.588SS.*Hα-helixtrans-76.8-38.6174.4171.20000111.2C257 C258 A259C257-V261 VanDerWaalsContact O-CG2 3.29Å; C257-V261 WeakPolarHBondContact O-CG2 3.18Å; C257-V261 PolarHBondContact O-N 3.48Å; C258-V261 PolarHBondContact O-N 3.3Å; A259-V261 VanDerWaalsContact C-N 3.29Å; A259-V261 PolarHBondContact O-N 3.07Å
262A70Confident63.1Low87 Ų87108.1 Ų108.172%0.71960%0.601SS**Hα-helixtrans-74.5-26.1177.300000113.1C258 A259C258-A262 VanDerWaalsContact O-CB 3.31Å; C258-A262 WeakPolarHBondContact O-CB 3.48Å; C258-A262 PolarHBondContact O-N 3.28Å; A259-A262 CarbonylContact O-C 3.59Å; A259-A262 PolarHBondContact O-N 2.9Å
263T58.6Low60.8Low100 Ų100110.8 Ų110.861%0.61361%0.607SS**SBendtrans-108.34.7178.571.70000113.1A259 V265A259-T263 WeakPolarHBondContact O-CB 3.31Å; A259-T263 WeakPolarHBondContact O-CG2 3.37Å; A259-T263 PolarHBondContact O-N 3.05Å; A259-T263 PolarHBondContact O-OG1 3.01Å; T263-V265 PolarHBondContact O-N 2.88Å
264A45Very low59Low68 Ų68113.1 Ų113.156%0.56262%0.619SS**  trans-67.884162.300000106.1T260 E266T260-A264 WeakPolarHBondContact O-CA 3.22Å; T260-A264 WeakPolarHBondContact O-CB 3.46Å; T260-A264 PolarHBondContact O-N 3.38Å; A264-E266 PolarHBondContact O-N 3.42Å
265V41.7Very low57.2Low112 Ų112112 Ų11268%0.67962%0.619SS**  trans-35.2131.3162.4169.90000107.6T263 Q267T263-V265 PolarHBondContact O-N 2.88Å; V265-Q267 HydrophobicContact CG1-CG 4.23Å; V265-Q267 PolarHBondContact O-N 2.94Å
266E46.5Very low55.6Low167 Ų167111.2 Ų111.278%0.7863%0.627SS**SBendtrans-58.769.5176.7-65.2-149.416700112.3A264A264-E266 PolarHBondContact O-N 3.42Å
267Q42.8Very low53.8Low161 Ų161115.9 Ų115.975%0.75264%0.64SS**  trans-112.553.2163.6-75.7-177.3-41.800107.3V265 V269V265-Q267 HydrophobicContact CG1-CG 4.23Å; V265-Q267 PolarHBondContact O-N 2.94Å; Q267-V269 PolarHBondContact O-N 2.96Å
268Y38.9Very low52.4Low195 Ų195114.1 Ų114.177%0.76563%0.634SS**  trans-73.476.2152.8-150.7-89000106.6P270Y268-P270 WeakPolarHBondContact O-CD 3.43Å
269V39.8Very low51.3Low116 Ų116116.4 Ų116.470%0.70364%0.641SS**  trans-57.9119.4156.2-178.60000103.7Q267 S271Q267-V269 PolarHBondContact O-N 2.96Å; V269-S271 PolarHBondContact O-N 3.17Å
270P40.8Very low50.3Low99 Ų99120.7 Ų120.764%0.64366%0.659SS**  trans-49.2119.1175.4-22.131.2000106.1Y268 E272Y268-P270 WeakPolarHBondContact O-CD 3.43Å; P270-E272 VanDerWaalsContact C-N 3.26Å; P270-E272 PolarHBondContact O-N 2.7Å
271S39.3Very low49.3Very low88 Ų88122.6 Ų122.662%0.61566%0.663SS**  trans-58.8103175.446.70000106V269 K273V269-S271 PolarHBondContact O-N 3.17Å; S271-K273 VanDerWaalsContact C-N 3.27Å; S271-K273 PolarHBondContact O-N 3.01Å
272E44.3Very low48.4Very low182 Ų182125.1 Ų125.185%0.8567%0.667SS**  trans-55.6103.4168.8-168.8173.8172.400104.3P270 L274P270-E272 VanDerWaalsContact C-N 3.26Å; P270-E272 PolarHBondContact O-N 2.7Å; E272-L274 VanDerWaalsContact C-N 3.34Å; E272-L274 PolarHBondContact O-N 2.98Å
273K41Very low47.5Very low133 Ų133126.2 Ų126.258%0.57866%0.659SS**  trans-59.2100.6-178.7-65.2-172.9-178.3-177.60106.2S271 S275 E281S271-K273 VanDerWaalsContact C-N 3.27Å; S271-K273 PolarHBondContact O-N 3.01Å; K273-S275 PolarHBondContact O-N 2.67Å; K273-E281 IonicContact NZ-OE1 2.77Å; K273-E281 PolarHBondContact NZ-OE1 3.42Å; K273-E281 IonicContact NZ-OE2 3.98Å; K273-E281 PolarHBondContact NZ-OE2 3.39Å
274L48.1Very low47Very low167 Ų167127.2 Ų127.287%0.87466%0.661SS**  trans-62.681145.6-88.4103.6000106.2E272 I276E272-L274 VanDerWaalsContact C-N 3.34Å; E272-L274 PolarHBondContact O-N 2.98Å; L274-I276 VanDerWaalsContact C-N 3.33Å; L274-I276 PolarHBondContact O-N 3.2Å
275S49Very low47.2Very low72 Ų72130.3 Ų130.350%0.50366%0.663SS.*  trans-79.681.3-17655.40000109.1K273 Y277 G278K273-S275 PolarHBondContact O-N 2.67Å; S275-Y277 PolarHBondContact O-N 3.16Å; S275-G278 PolarHBondContact O-N 3.08Å
276I56.6Low47.5Very low164 Ų164131.1 Ų131.184%0.84166%0.66SS**THydrogen-bonded Turntrans-7445.3154.8-52.9178.2000108.5L274L274-I276 VanDerWaalsContact C-N 3.33Å; L274-I276 PolarHBondContact O-N 3.2Å
277Y49.3Very low47.2Very low180 Ų180132.1 Ų132.171%0.70666%0.662SS**THydrogen-bonded Turntrans-177.840.8163.6-133.7-99.3000110.4S275 D279 L280S275-Y277 PolarHBondContact O-N 3.16Å; Y277-D279 VanDerWaalsContact C-N 3.26Å; Y277-D279 PolarHBondContact O-N 2.88Å; Y277-L280 HydrophobicContact CD1-CB 4.07Å; Y277-L280 HydrophobicContact CE1-CB 3.93Å; Y277-L280 HydrophobicContact CE1-CD1 4.32Å; Y277-L280 HydrophobicContact CE1-CD2 4.26Å; Y277-L280 HydrophobicContact CE1-CG 4.4Å
278G49.7Very low47.3Very low36 Ų36131.6 Ų131.637%0.37166%0.663SS.*THydrogen-bonded Turntrans-74.2-10.9-179.500000115S275S275-G278 PolarHBondContact O-N 3.08Å
279D52.6Low47.1Very low134 Ų134127.4 Ų127.472%0.71765%0.654SS**Hα-helixtrans-86.7-18.9-167.9-153.923.1000113.8Y277Y277-D279 VanDerWaalsContact C-N 3.26Å; Y277-D279 PolarHBondContact O-N 2.88Å
280L55.3Low47.1Very low121 Ų121131.7 Ų131.763%0.63466%0.663SS**Hα-helixtrans-82.6-28.8179.5-144.983.1000112.8Y277Y277-L280 HydrophobicContact CD1-CB 4.07Å; Y277-L280 HydrophobicContact CE1-CB 3.93Å; Y277-L280 HydrophobicContact CE1-CD1 4.32Å; Y277-L280 HydrophobicContact CE1-CD2 4.26Å; Y277-L280 HydrophobicContact CE1-CG 4.4Å
281E53.8Low46.8Very low115 Ų115136.3 Ų136.354%0.53767%0.669SS.*Hα-helixtrans-76.9-29.6-179.9-67.8-174.6172.800111.8K273 M283 N284 E285K273-E281 IonicContact NZ-OE1 2.77Å; K273-E281 PolarHBondContact NZ-OE1 3.42Å; K273-E281 IonicContact NZ-OE2 3.98Å; K273-E281 PolarHBondContact NZ-OE2 3.39Å; E281-M283 VanDerWaalsContact C-N 3.34Å; E281-M283 PolarHBondContact O-N 3.01Å; E281-N284 PolarHBondContact O-N 3.17Å; E281-E285 WeakPolarHBondContact O-CG 3.28Å; E281-E285 PolarHBondContact O-N 3.15Å
282F52.4Low46.6Very low130 Ų130137.6 Ų137.657%0.5768%0.676SS**Hα-helixtrans-67-32179.1-161.3-101.1000113.3N284 Q286F282-N284 VanDerWaalsContact C-N 3.34Å; F282-Q286 VanDerWaalsContact CE1-NE2 3.35Å; F282-Q286 PolarHBondContact O-N 3.28Å
283M52.5Low46.5Very low110 Ų110134 Ų13454%0.54268%0.677SS.*Hα-helixtrans-76.3-20.2177.9-71.5-7098.100113.8E281E281-M283 VanDerWaalsContact C-N 3.34Å; E281-M283 PolarHBondContact O-N 3.01Å
284N48.1Very low46.3Very low121 Ų121133.1 Ų133.165%0.64769%0.687SS**Hα-helixtrans-86.3-40.1177.5-159.411.6000111.3E281 F282 Q286 K287E281-N284 PolarHBondContact O-N 3.17Å; F282-N284 VanDerWaalsContact C-N 3.34Å; N284-Q286 VanDerWaalsContact C-N 3.27Å; N284-Q286 PolarHBondContact O-N 3.17Å; N284-K287 PolarHBondContact O-N 2.58Å
285E49.4Very low45.7Very low133 Ų133130 Ų13062%0.62168%0.679SS**Hα-helixtrans-61.5-33.2174.4-68.8-81.2138.700112.4E281 K287E281-E285 WeakPolarHBondContact O-CG 3.28Å; E281-E285 PolarHBondContact O-N 3.15Å; E285-K287 PolarHBondContact O-N 3.02Å
286Q46.8Very low45Very low130 Ų130134.1 Ų134.161%0.60770%0.695SS**THydrogen-bonded Turntrans-70.6-16.4-179.5-136171.768.700113.8F282 N284F282-Q286 VanDerWaalsContact CE1-NE2 3.35Å; F282-Q286 PolarHBondContact O-N 3.28Å; N284-Q286 VanDerWaalsContact C-N 3.27Å; N284-Q286 PolarHBondContact O-N 3.17Å
287K40.7Very low43.9Very low187 Ų187131.5 Ų131.581%0.81369%0.686SS**THydrogen-bonded Turntrans-94.6-8.2-177.8-123-179.8-175.6178.70114.5N284 E285N284-K287 PolarHBondContact O-N 2.58Å; E285-K287 PolarHBondContact O-N 3.02Å
288L45.2Very low43.2Very low150 Ų150128.4 Ų128.479%0.78569%0.686SS**THydrogen-bonded Turntrans-117-10.5-172.6-129.779.4000116.6K290L288-K290 PolarHBondContact O-N 3.03Å
289N34.7Very low42.4Very low107 Ų107132.5 Ų132.557%0.57270%0.704SS**  trans-96.190.3176.1-84.1-34.8000112.5Y291N289-Y291 VanDerWaalsContact C-N 3.34Å; N289-Y291 HydrophobicContact CB-CD2 4.4Å; N289-Y291 HydrophobicContact CB-CE2 4.12Å; N289-Y291 WeakPolarHBondContact O-CD2 3.01Å; N289-Y291 PolarHBondContact O-N 2.92Å
290K40.5Very low41.5Very low206 Ų206137.2 Ų137.290%0.89671%0.711SS**  trans-70.592.8159.9-169.9162.1-171.11640108.2L288L288-K290 PolarHBondContact O-N 3.03Å
291Y33.3Very low40.3Very low197 Ų197136.1 Ų136.177%0.77371%0.714SS**  trans-59.9137.5177.3-79.6-89.2000111.9N289N289-Y291 VanDerWaalsContact C-N 3.34Å; N289-Y291 HydrophobicContact CB-CD2 4.4Å; N289-Y291 HydrophobicContact CB-CE2 4.12Å; N289-Y291 WeakPolarHBondContact O-CD2 3.01Å; N289-Y291 PolarHBondContact O-N 2.92Å
292P35.1Very low39.5Very low115 Ų115139.5 Ų139.575%0.74773%0.726SS**  trans-75.1138.1165.631.4-30.3000109.6S294P292-S294 PolarHBondContact O-N 3.24Å
293A43.1Very low38.4Very low107 Ų107139.3 Ų139.388%0.88474%0.736SS**  trans-72.9111.5179.300000111.2
294S37Very low37.5Very low113 Ų113141.6 Ų141.679%0.7975%0.746SS**  trans-161.2139.515455.60000111.3P292P292-S294 PolarHBondContact O-N 3.24Å
295S35Very low36.7Very low101 Ų101142.9 Ų142.971%0.70675%0.753SS**  trans79.659.4177.8-172.30000117.4V297S295-V297 VanDerWaalsContact C-N 3.35Å; S295-V297 PolarHBondContact O-N 3.06Å; S295-V297 VanDerWaalsContact O-N 3.1Å
296L34.3Very low36.1Very low160 Ų160146.2 Ų146.284%0.83877%0.768SS**  trans-7191.7153.6-130.3163.5000108V298L296-V298 HydrophobicContact CD2-CG2 3.82Å; L296-V298 PolarHBondContact O-N 3.07Å
297V34.2Very low35.7Very low108 Ų108149 Ų14966%0.65578%0.781SS**  trans-81.898166.51770000107.2S295 V299S295-V297 VanDerWaalsContact C-N 3.35Å; S295-V297 PolarHBondContact O-N 3.06Å; S295-V297 VanDerWaalsContact O-N 3.1Å; V297-V299 HydrophobicContact CG1-CG2 4.14Å; V297-V299 PolarHBondContact O-N 3.23Å; V297-V299 VanDerWaalsContact O-N 3.17Å
298V33.7Very low35.6Very low115 Ų115149.2 Ų149.270%0.69779%0.785SS**  trans-71.8101.7167.31760000107.6L296 R300L296-V298 HydrophobicContact CD2-CG2 3.82Å; L296-V298 PolarHBondContact O-N 3.07Å; V298-R300 PolarHBondContact O-N 2.77Å; V298-R300 VanDerWaalsContact O-N 3.16Å
299V33.2Very low35.3Very low123 Ų123147.1 Ų147.175%0.74579%0.789SS**  trans-75.998.7166-179.90000107.4V297 S301V297-V299 HydrophobicContact CG1-CG2 4.14Å; V297-V299 PolarHBondContact O-N 3.23Å; V297-V299 VanDerWaalsContact O-N 3.17Å; V299-S301 PolarHBondContact O-N 3Å
300R33.8Very low36.3Very low233 Ų233145 Ų14588%0.87979%0.793SS**  trans-82.394.2166.9-165.7179.8-166.4129.61.3107.6V298 K302V298-R300 PolarHBondContact O-N 2.77Å; V298-R300 VanDerWaalsContact O-N 3.16Å; R300-K302 PolarHBondContact O-N 3.08Å
301S30.1Very low36.8Very low97 Ų97141.5 Ų141.568%0.67879%0.791SS**  trans-69.6123.9163.754.10000108.2V299V299-S301 PolarHBondContact O-N 3Å
302K36.6Very low37.7Very low186 Ų186139.8 Ų139.881%0.80979%0.794SS**  trans-92.7110.8163.7-170.9-173.2-178.3-170.40106.4R300R300-K302 PolarHBondContact O-N 3.08Å
303T29Very low38.2Very low127 Ų127140.5 Ų140.578%0.77980%0.799SS**  trans-139.2126.9155.739.30000108
304E34.2Very low38.9Very low157 Ų157141.8 Ų141.873%0.73480%0.796SS**  trans-48142.9173.2-80.2147.498.100113.1
305D31.8Very low39.3Very low149 Ų149146.1 Ų146.180%0.79780%0.8SS**  trans52.2104.4144.4-52-28.2000119.7E307D305-E307 PolarHBondContact O-N 2.89Å
306H35.8Very low40.2Very low202 Ų202147.8 Ų147.894%0.93581%0.806SS**  trans-76106.4154.5-89.4-93.6000109.8
307E39.4Very low40.6Very low188 Ų188147.7 Ų147.788%0.87981%0.806SS**PPolyproline II helixtrans-84153.8140-91-176119.100109.5D305D305-E307 PolarHBondContact O-N 2.89Å
308E38.4Very low41.6Very low192 Ų192151.2 Ų151.290%0.89782%0.82SS**PPolyproline II helixtrans-59.6152.2-157.9-72.3164.3126.900117.1
309A38.9Very low42.4Very low106 Ų106149.1 Ų149.188%0.87682%0.815SS**PPolyproline II helixtrans-70.2133.1176.400000112.8
310G54.5Low43.3Very low63 Ų63152.4 Ų152.465%0.64982%0.822SS**PPolyproline II helixtrans-83.8152.2169.300000113.1
311P52Low43.6Very low132 Ų132147.3 Ų147.386%0.85782%0.822SS**PPolyproline II helixtrans-76.6147.7-168.430.2-33.8000113.8
312L51.2Low44.1Very low162 Ų162151.4 Ų151.485%0.84883%0.831SS**PPolyproline II helixtrans-63.4139.5178.1-81.278.7000112.3
313P46.1Very low44.3Very low129 Ų129153.8 Ų153.884%0.83885%0.85SS**PPolyproline II helixtrans-70.9143.1173.127.6-32000112.5
314T57.2Low45.1Very low134 Ų134155.2 Ų155.282%0.82285%0.854SS**PPolyproline II helixtrans-67.8140.3-173.342.60000114.1V316T314-V316 PolarHBondContact O-N 3.15Å
315K45.7Very low45.6Very low204 Ų204155.1 Ų155.189%0.88786%0.86SS**PPolyproline II helixtrans-60.7125.5173.7-68.6-172.6176.8-178.20111.6
316V54.8Low46.4Very low136 Ų136155.4 Ų155.482%0.82486%0.863SS**PPolyproline II helixtrans-91.3128.8167.1-116.50000109.2T314T314-V316 PolarHBondContact O-N 3.15Å
317N41.2Very low47Very low158 Ų158152.6 Ų152.685%0.84586%0.859SS**PPolyproline II helixtrans-82.2127.3178.8-93-75.2000111A319N317-A319 PolarHBondContact O-N 3.39Å; N317-A319 VanDerWaalsContact O-N 3.12Å
318L56.7Low47.5Very low182 Ų182150.4 Ų150.495%0.95386%0.858SS**  trans-79.672.2173.3-78.482.5000111.7
319A50.4Low48.1Very low71 Ų71147.7 Ų147.759%0.58786%0.855SS**  trans-135.8117.9164.900000109.3N317N317-A319 PolarHBondContact O-N 3.39Å; N317-A319 VanDerWaalsContact O-N 3.12Å
320H52.4Low48.8Very low192 Ų192150.6 Ų150.689%0.88985%0.854SS**  trans92.484.5-179.7-53.281.2000115.3
321S39.5Very low48.3Very low127 Ų127157.4 Ų157.489%0.88887%0.87SS**  trans-136.479.8142.5-145.80000107.5
322E40.8Very low48Very low182 Ų182159.5 Ų159.585%0.8587%0.871SS**  trans-95.6137.7150.4-88.2-172.1152.400107.3
323I39.9Very low47.7Very low237 Ų237159.3 Ų159.3100%1.21587%0.873SS**  trans88.70171.4-62.1149.7000115.9

Retrieved 323 of 323 residues in 49.1 ms (Link to these results)