A0A096MP87_PAPAN 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 (H9ZFL4), UniProt , Accession A0A096MP87, Species PAPAN (Papio anubis, Olive baboon), 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 72 ms (Link to these results)