A0A087Y456_POEFO Loading...

Vacuole membrane protein 1

AlphaFold DB , UniProt , Accession A0A087Y456, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 410 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M35.5Very low30.1Very low240 Ų240145.7 Ų145.7100%1.18286%0.855SS**  093.50-76.3167.9163.300105.3
2A32.3Very low30.3Very low93 Ų93149.6 Ų149.677%0.76986%0.859SS**  74.1122.894.300000109.3
3E28.1Very low30.3Very low186 Ų186156.8 Ų156.887%0.86986%0.863SS**  cis-152146.317.3-81.8164.5112.900107.2
4C30.8Very low30.2Very low135 Ų135162.9 Ų162.991%0.91287%0.867SS**  56.8121.166.5-103.30000116.7
5G28.1Very low30.3Very low84 Ų84164.2 Ų164.287%0.86687%0.873SS**  trans174.5114.9164.700000111.9
6A31Very low30.2Very low88 Ų88158.1 Ų158.173%0.72786%0.861SS**  trans-108.9165.2-162.400000114.6
7E29.3Very low30.2Very low187 Ų187157.5 Ų157.587%0.87486%0.857SS**  trans65.2148.3155.7-67.6-179.512800117.7
8S26.6Very low30.3Very low98 Ų98159.7 Ų159.769%0.68586%0.857SS**  cis-167172.622.2-155.10000111.7
9E27.3Very low30.3Very low182 Ų182160.6 Ų160.685%0.8585%0.852SS**  trans82.2112.8153.7-65.6-175.5118.800122.3
10Q30.7Very low30.4Very low188 Ų188161.6 Ų161.688%0.87985%0.851SS**  trans-72.1154.1154.4-80.9178.5-22.400110.9
11P31.1Very low30.5Very low122 Ų122163.3 Ų163.379%0.79285%0.852SS**  -141.1129.1114.326.6-7.9000114.8
12Q33.3Very low30.6Very low192 Ų192159.6 Ų159.690%0.89784%0.836SS**  trans28.6101.7135.8-115.5166.5-18.800118.3
13R29.4Very low30.8Very low244 Ų244158 Ų15892%0.92183%0.83SS**  trans-101.9117.8154.7-97.7-177.4176.31710.1109.9
14R29.4Very low31.4Very low242 Ų242158.5 Ų158.591%0.91383%0.832SS**  trans-51.3133.2174.2-65.3179.8-168.7-171.82.5110.8G16R14-G16 PolarHBondContact O-N 3.47Å
15L31.8Very low31.8Very low182 Ų182157.7 Ų157.795%0.95382%0.818SS**  trans-58.9104.1158.6-108.577.5000107.9
16G28.5Very low33Very low66 Ų66157.8 Ų157.868%0.6880%0.802SS**  trans-87.3106.2165.600000108.5R14 K18R14-G16 PolarHBondContact O-N 3.47Å; G16-K18 PolarHBondContact O-N 3.41Å
17D29.9Very low34.1Very low149 Ų149158.2 Ų158.280%0.79779%0.792SS**  trans-51.898.8172.3-165.111000110.6K19D17-K19 VanDerWaalsContact C-N 3.31Å; D17-K19 PolarHBondContact O-N 2.92Å; D17-K19 VanDerWaalsContact O-N 3.08Å
18K31.8Very low35.3Very low196 Ų196154.1 Ų154.185%0.85278%0.784SS**  trans-79.287.8169.2-82.6-172.2179-179.80107.6G16 H20G16-K18 PolarHBondContact O-N 3.41Å; K18-H20 PolarHBondContact O-N 3.42Å
19K30.2Very low36.7Very low178 Ų178154.4 Ų154.477%0.77478%0.778SS**  trans-44.9112.9158.4-95.8178.6173.7175.50109D17 K21D17-K19 VanDerWaalsContact C-N 3.31Å; D17-K19 PolarHBondContact O-N 2.92Å; D17-K19 VanDerWaalsContact O-N 3.08Å; K19-K21 PolarHBondContact O-N 2.81Å
20H32.2Very low38.3Very low180 Ų180147.3 Ų147.383%0.83375%0.745SS**  trans-53.5103.2159.9-92.5-93.1000108.2K18 N22K18-H20 PolarHBondContact O-N 3.42Å; H20-N22 PolarHBondContact O-N 3.49Å
21K34.3Very low40.2Very low198 Ų198142 Ų14286%0.86173%0.727SS**  trans-81.7106.6157.7-79.6-172.6174.7-177.60106.1K19 G23K19-K21 PolarHBondContact O-N 2.81Å; K21-G23 PolarHBondContact O-N 3.03Å
22N36.8Very low41.8Very low161 Ų161143.4 Ų143.486%0.86172%0.723SS**  trans-64.284.4156.8-78.4-3000107.1H20H20-N22 PolarHBondContact O-N 3.49Å
23G36.9Very low43.1Very low61 Ų61140.2 Ų140.263%0.62971%0.708SS**  trans-93.6121.2160.800000107K21 L25K21-G23 PolarHBondContact O-N 3.03Å; G23-L25 PolarHBondContact O-N 3.35Å; G23-L25 VanDerWaalsContact O-N 3.15Å
24E40.6Very low44.9Very low195 Ų195133.4 Ų133.491%0.91169%0.687SS**  trans-55.1116.2167.4-159.5157.9121.900107.5T26E24-T26 PolarHBondContact O-N 3.13Å; E24-T26 VanDerWaalsContact O-N 3.09Å
25L39.4Very low46.6Very low118 Ų118125.1 Ų125.162%0.61866%0.658SS**  trans-62.1113.3-179.8-15989.6000107.4G23 D29 L30G23-L25 PolarHBondContact O-N 3.35Å; G23-L25 VanDerWaalsContact O-N 3.15Å; L25-D29 HydrophobicContact CD1-CB 4.44Å; L25-D29 HydrophobicContact CG-CB 4.26Å; L25-L30 HydrophobicContact CD2-CD2 3.53Å; L25-L30 HydrophobicContact CD2-CG 3.85Å
26T53.3Low48.2Very low87 Ų87120.4 Ų120.453%0.53463%0.63SS.*  trans-68.3143.2175.519.10000109.8E24 S28 D29E24-T26 PolarHBondContact O-N 3.13Å; E24-T26 VanDerWaalsContact O-N 3.09Å; T26-S28 PolarHBondContact O-N 3.33Å; T26-D29 PolarHBondContact O-N 3.41Å; T26-D29 PolarHBondContact OG1-OD2 2.81Å
27D53.2Low50Low96 Ų96123.1 Ų123.151%0.51362%0.624SS.*THydrogen-bonded Turntrans-55.7-13.4-178.1-159.420.9000113.4K35D27-K35 WeakPolarHBondContact O-CE 3.45Å; D27-K35 PolarHBondContact O-NZ 2.87Å; D27-K35 WeakPolarHBondContact OD1-CE 3.37Å
28S55.4Low51.7Low101 Ų101122.7 Ų122.771%0.70661%0.611SS**THydrogen-bonded Turntrans-74.8-18174.9-45.30000114.8T26T26-S28 PolarHBondContact O-N 3.33Å
29D54.7Low53.3Low105 Ų105116.1 Ų116.156%0.56159%0.586SS**SBendtrans-103.60.5-169.4-59.8-55.3000114L25 T26L25-D29 HydrophobicContact CD1-CB 4.44Å; L25-D29 HydrophobicContact CG-CB 4.26Å; T26-D29 PolarHBondContact O-N 3.41Å; T26-D29 PolarHBondContact OG1-OD2 2.81Å
30L61.7Low54.9Low32 Ų32112.5 Ų112.517%0.16857%0.567CS.*SBendtrans-84.4142.8178.8-71.8165.9000111.5L25 E34L25-L30 HydrophobicContact CD2-CD2 3.53Å; L25-L30 HydrophobicContact CD2-CG 3.85Å; L30-E34 VanDerWaalsContact CD2-OE2 3.3Å; L30-E34 WeakPolarHBondContact CD2-OE2 3.26Å
31P70.7Confident56.4Low76 Ų76109.8 Ų109.849%0.49456%0.555SS.*  trans-52.9140.6168.8-20.530.1000111.2E33 E34 K35P31-E33 PolarHBondContact O-N 3.44Å; P31-E34 HydrophobicContact CB-CG 4.48Å; P31-E34 WeakPolarHBondContact CD-OE2 3.43Å; P31-E34 HydrophobicContact CG-CG 4.3Å; P31-E34 PolarHBondContact O-N 3.16Å; P31-K35 PolarHBondContact O-N 3.16Å; P31-K35 VanDerWaalsContact O-N 3.08Å
32E64.4Low58.1Low153 Ų153103.5 Ų103.572%0.71553%0.531SS*.Hα-helixtrans-52.2-35.6-179.1-87.4-148.5145.100112.9K35 K36E32-K35 PolarHBondContact O-N 3.28Å; E32-K36 WeakPolarHBondContact O-CB 3.44Å; E32-K36 WeakPolarHBondContact O-CG 3.16Å; E32-K36 PolarHBondContact O-N 3.09Å
33E61.6Low59.6Low125 Ų12596.3 Ų96.358%0.58449%0.492SS*.Hα-helixtrans-66.1-41.5177.1-67-60135.200112.9P31 K35 K36 Q37P31-E33 PolarHBondContact O-N 3.44Å; E33-K35 VanDerWaalsContact C-N 3.29Å; E33-K35 PolarHBondContact O-N 2.9Å; E33-K36 PolarHBondContact O-N 3.47Å; E33-K36 IonicContact OE1-NZ 3.96Å; E33-Q37 WeakPolarHBondContact O-CB 3.21Å; E33-Q37 PolarHBondContact O-N 2.87Å
34E66.4Low61.1Low101 Ų10197.5 Ų97.547%0.47248%0.481SS..Hα-helixtrans-69.4-31.3175.9-73.2-169.9162.600111.7L30 P31 R38L30-E34 VanDerWaalsContact CD2-OE2 3.3Å; L30-E34 WeakPolarHBondContact CD2-OE2 3.26Å; P31-E34 HydrophobicContact CB-CG 4.48Å; P31-E34 WeakPolarHBondContact CD-OE2 3.43Å; P31-E34 HydrophobicContact CG-CG 4.3Å; P31-E34 PolarHBondContact O-N 3.16Å; E34-R38 WeakPolarHBondContact O-CB 3.49Å; E34-R38 PolarHBondContact O-N 3.07Å
35K65.4Low62.7Low67 Ų6788.9 Ų88.929%0.29144%0.443SS..Hα-helixtrans-70.6-47.1175.9-150.5170.5-176.4169.50111D27 P31 E32 E33 Q37 R38 D39D27-K35 WeakPolarHBondContact O-CE 3.45Å; D27-K35 PolarHBondContact O-NZ 2.87Å; D27-K35 WeakPolarHBondContact OD1-CE 3.37Å; P31-K35 PolarHBondContact O-N 3.16Å; P31-K35 VanDerWaalsContact O-N 3.08Å; E32-K35 PolarHBondContact O-N 3.28Å; E33-K35 VanDerWaalsContact C-N 3.29Å; E33-K35 PolarHBondContact O-N 2.9Å; K35-Q37 VanDerWaalsContact C-N 3.29Å; K35-Q37 PolarHBondContact O-N 3.31Å; K35-R38 PolarHBondContact O-N 3.43Å; K35-D39 VanDerWaalsContact O-CB 3.25Å; K35-D39 WeakPolarHBondContact O-CB 3.32Å; K35-D39 PolarHBondContact O-N 3.23Å
36K65.4Low64.5Low84 Ų8483.7 Ų83.737%0.36542%0.415SS..Hα-helixtrans-55.4-43.3170.7-78.8-179.6-179176.60111.5E32 E33 D39 R40 D222E32-K36 WeakPolarHBondContact O-CB 3.44Å; E32-K36 WeakPolarHBondContact O-CG 3.16Å; E32-K36 PolarHBondContact O-N 3.09Å; E33-K36 PolarHBondContact O-N 3.47Å; E33-K36 IonicContact OE1-NZ 3.96Å; K36-D39 PolarHBondContact O-N 3.4Å; K36-R40 WeakPolarHBondContact O-CB 3.35Å; K36-R40 PolarHBondContact O-N 3.22Å; K36-D222 IonicContact NZ-OD2 2.78Å; K36-D222 PolarHBondContact NZ-OD2 3.31Å
37Q65.3Low66Low122 Ų12280.7 Ų80.757%0.5740%0.397SS*.Hα-helixtrans-69.8-42.3-178.9-167.7166.1-2.300112.7E33 K35 D39 R40 E41E33-Q37 WeakPolarHBondContact O-CB 3.21Å; E33-Q37 PolarHBondContact O-N 2.87Å; K35-Q37 VanDerWaalsContact C-N 3.29Å; K35-Q37 PolarHBondContact O-N 3.31Å; Q37-D39 VanDerWaalsContact C-N 3.33Å; Q37-R40 WeakPolarHBondContact O-CB 3.1Å; Q37-R40 PolarHBondContact O-N 3.22Å; Q37-E41 WeakPolarHBondContact O-CG 3.29Å; Q37-E41 PolarHBondContact O-N 2.81Å
38R66.1Low67.5Low140 Ų14077.8 Ų77.853%0.52838%0.381SS..Hα-helixtrans-66-37.9174.8-165.6-179.5-64.9-114.61.3111.8E34 K35 R40 E41 D42E34-R38 WeakPolarHBondContact O-CB 3.49Å; E34-R38 PolarHBondContact O-N 3.07Å; K35-R38 PolarHBondContact O-N 3.43Å; R38-R40 VanDerWaalsContact C-N 3.33Å; R38-E41 PolarHBondContact O-N 3.03Å; R38-D42 PolarHBondContact O-N 3.22Å
39D64.8Low68.8Low59 Ų5981.1 Ų81.132%0.31638%0.378SS..Hα-helixtrans-64.2-36.5172.3-91.5-42.7000112.4K35 K36 Q37 D42 H43 R400K35-D39 VanDerWaalsContact O-CB 3.25Å; K35-D39 WeakPolarHBondContact O-CB 3.32Å; K35-D39 PolarHBondContact O-N 3.23Å; K36-D39 PolarHBondContact O-N 3.4Å; Q37-D39 VanDerWaalsContact C-N 3.33Å; D39-D42 PolarHBondContact O-N 3.1Å; D39-H43 WeakPolarHBondContact O-CB 3.14Å; D39-H43 PolarHBondContact O-N 3.48Å; D39-R400 VanDerWaalsContact C-NH2 3.33Å; D39-R400 VanDerWaalsContact CA-NH2 3.32Å; D39-R400 PolarHBondContact O-NH1 2.77Å; D39-R400 PolarHBondContact O-NH2 3.36Å; D39-R400 IonicContact OD1-CZ 3.63Å; D39-R400 VanDerWaalsContact OD1-CZ 3.29Å; D39-R400 IonicContact OD1-NE 3.15Å; D39-R400 PolarHBondContact OD1-NE 3.28Å; D39-R400 IonicContact OD1-NH2 2.56Å; D39-R400 PolarHBondContact OD1-NH2 3.42Å
40R63.6Low70.3Confident101 Ų10182.8 Ų82.838%0.38138%0.38SS..Hα-helixtrans-64-45174-172.3176.8179.5165.95.3111.2K36 Q37 R38 D42 H43 E44K36-R40 WeakPolarHBondContact O-CB 3.35Å; K36-R40 PolarHBondContact O-N 3.22Å; Q37-R40 WeakPolarHBondContact O-CB 3.1Å; Q37-R40 PolarHBondContact O-N 3.22Å; R38-R40 VanDerWaalsContact C-N 3.33Å; R40-D42 PolarHBondContact O-N 3.23Å; R40-H43 PolarHBondContact O-N 3.13Å; R40-E44 IonicContact NE-OE1 2.59Å; R40-E44 WeakPolarHBondContact O-CG 3.26Å; R40-E44 PolarHBondContact O-N 3.39Å
41E65.2Low71.5Confident123 Ų12386.2 Ų86.258%0.57539%0.391SS*.Hα-helixtrans-62.3-41.3176.1-70.6177.5-179.800112.2Q37 R38 H43 E44 S45Q37-E41 WeakPolarHBondContact O-CG 3.29Å; Q37-E41 PolarHBondContact O-N 2.81Å; R38-E41 PolarHBondContact O-N 3.03Å; E41-H43 VanDerWaalsContact C-N 3.35Å; E41-E44 PolarHBondContact O-N 3Å; E41-S45 WeakPolarHBondContact O-CB 3.36Å; E41-S45 PolarHBondContact O-N 2.99Å
42D68.4Low72.4Confident66 Ų6685.7 Ų85.735%0.35339%0.388SS..Hα-helixtrans-67.9-33.5176.5-95.2-33.5000112.5R38 D39 R40 S45 L46 R51R38-D42 PolarHBondContact O-N 3.22Å; D39-D42 PolarHBondContact O-N 3.1Å; R40-D42 PolarHBondContact O-N 3.23Å; D42-S45 WeakPolarHBondContact O-CB 3.21Å; D42-S45 PolarHBondContact O-N 3.39Å; D42-S45 PolarHBondContact O-OG 3.47Å; D42-L46 PolarHBondContact O-N 2.96Å; D42-R51 IonicContact OD1-CZ 3.12Å; D42-R51 IonicContact OD1-NH1 2.66Å; D42-R51 PolarHBondContact OD1-NH1 3.34Å; D42-R51 IonicContact OD1-NH2 2.76Å; D42-R51 PolarHBondContact OD1-NH2 3.17Å
43H68.3Low73.6Confident10 Ų1085.4 Ų85.45%0.04639%0.391CS..Hα-helixtrans-68.9-44.8174.4-169.9-94.2000112.2D39 R40 E41 S45 L46 E224 Q393D39-H43 WeakPolarHBondContact O-CB 3.14Å; D39-H43 PolarHBondContact O-N 3.48Å; R40-H43 PolarHBondContact O-N 3.13Å; E41-H43 VanDerWaalsContact C-N 3.35Å; H43-S45 PolarHBondContact O-N 3.35Å; H43-L46 WeakPolarHBondContact O-CB 3.47Å; H43-L46 PolarHBondContact O-N 3.08Å; H43-L46 VanDerWaalsContact O-N 3.11Å; H43-E224 IonicContact CE1-OE2 3.82Å; H43-Q393 WeakPolarHBondContact NE2-CB 3.27Å; H43-Q393 PolarHBondContact NE2-O 3.47Å; H43-Q393 PolarHBondContact O-NE2 2.92Å
44E68.1Low74.8Confident87 Ų8782.3 Ų82.341%0.40738%0.378SS..Hα-helixtrans-69.5-15.8174.1-68.4-178.5-175.500112.7R40 E41R40-E44 IonicContact NE-OE1 2.59Å; R40-E44 WeakPolarHBondContact O-CG 3.26Å; R40-E44 PolarHBondContact O-N 3.39Å; E41-E44 PolarHBondContact O-N 3Å
45S76.2Confident75.9Confident14 Ų1477.5 Ų77.510%0.09836%0.355CS..Hα-helixtrans-79.7-1917288.10000113.6E41 D42 H43 V47 K50 R51E41-S45 WeakPolarHBondContact O-CB 3.36Å; E41-S45 PolarHBondContact O-N 2.99Å; D42-S45 WeakPolarHBondContact O-CB 3.21Å; D42-S45 PolarHBondContact O-N 3.39Å; D42-S45 PolarHBondContact O-OG 3.47Å; H43-S45 PolarHBondContact O-N 3.35Å; S45-V47 PolarHBondContact O-N 2.89Å; S45-K50 WeakPolarHBondContact O-CB 3.32Å; S45-R51 VanDerWaalsContact OG-CZ 3.32Å; S45-R51 PolarHBondContact OG-NH1 3.46Å
46L76.8Confident77.2Confident9 Ų978.1 Ų78.15%0.04736%0.361CS..  trans-78.265.2179.3-79158.1000111.6D42 H43 L54 Y58 Q393 A396D42-L46 PolarHBondContact O-N 2.96Å; H43-L46 WeakPolarHBondContact O-CB 3.47Å; H43-L46 PolarHBondContact O-N 3.08Å; H43-L46 VanDerWaalsContact O-N 3.11Å; L46-L54 HydrophobicContact CD2-CD2 3.88Å; L46-L54 HydrophobicContact CD2-CG 3.99Å; L46-Y58 HydrophobicContact CD1-CD2 4.22Å; L46-Y58 HydrophobicContact CD1-CE2 4.26Å; L46-Y58 HydrophobicContact CD2-CD2 3.74Å; L46-Y58 HydrophobicContact CD2-CE2 4.02Å; L46-Q393 HydrophobicContact CB-CG 4.18Å; L46-A396 HydrophobicContact CD1-CB 3.62Å
47V84.6Confident78.4Confident24 Ų2480.7 Ų80.715%0.14537%0.37CS..SBendtrans-124145.8173-65.30000110.2S45 W49 K50 R51 T55 N389S45-V47 PolarHBondContact O-N 2.89Å; V47-W49 PolarHBondContact O-N 3Å; V47-K50 HydrophobicContact CG2-CB 3.66Å; V47-K50 HydrophobicContact CG2-CD 3.69Å; V47-K50 HydrophobicContact CG2-CG 3.53Å; V47-K50 PolarHBondContact O-N 3.11Å; V47-R51 PolarHBondContact O-N 3.33Å; V47-T55 PolarHBondContact N-OG1 2.96Å; V47-N389 WeakPolarHBondContact CA-OD1 3.26Å; V47-N389 HydrophobicContact CG1-CB 4.49Å
48L83.9Confident79.7Confident35 Ų3576.6 Ų76.618%0.18335%0.349CS..THydrogen-bonded Turntrans-46.6-37.5178.9-92156.3000113.2P52 T55 L56 C385 V388 N389L48-P52 WeakPolarHBondContact O-CA 3.5Å; L48-P52 VanDerWaalsContact O-CB 3.26Å; L48-P52 WeakPolarHBondContact O-CB 3.32Å; L48-P52 WeakPolarHBondContact O-CD 3.3Å; L48-T55 HydrophobicContact CG-CG2 4.31Å; L48-L56 HydrophobicContact CD2-CD2 4.19Å; L48-L56 HydrophobicContact CD2-CG 4.12Å; L48-C385 HydrophobicContact CD1-CB 3.94Å; L48-V388 HydrophobicContact CD1-CB 3.76Å; L48-V388 HydrophobicContact CD1-CG1 3.69Å; L48-V388 HydrophobicContact CD1-CG2 4.44Å; L48-V388 HydrophobicContact CD2-CG1 4.4Å; L48-V388 HydrophobicContact CG-CG1 4.03Å; L48-N389 PolarHBondContact N-OD1 2.69Å
49W82.4Confident80.9Confident171 Ų17172.1 Ų72.165%0.64833%0.334SS*.THydrogen-bonded Turntrans-78.4-22.1-177.1-21.795.2000114.1V47 C385V47-W49 PolarHBondContact O-N 3Å; W49-C385 HydrophobicContact CH2-CB 3.98Å; W49-C385 HydrophobicContact CZ2-CB 3.69Å
50K86Confident82.2Confident139 Ų13972 Ų7260%0.60434%0.337SS*.THydrogen-bonded Turntrans-99.8-46.8-179.7-71.1-177.6-175.9172.60111.7S45 V47S45-K50 WeakPolarHBondContact O-CB 3.32Å; V47-K50 HydrophobicContact CG2-CB 3.66Å; V47-K50 HydrophobicContact CG2-CD 3.69Å; V47-K50 HydrophobicContact CG2-CG 3.53Å; V47-K50 PolarHBondContact O-N 3.11Å
51R87.5Confident83.6Confident105 Ų10569.4 Ų69.440%0.39633%0.331SS..SBendtrans-134.765.1-175.5-64.3-172.4178169.54.7111.4D42 S45 V47 L53 L54 T55D42-R51 IonicContact OD1-CZ 3.12Å; D42-R51 IonicContact OD1-NH1 2.66Å; D42-R51 PolarHBondContact OD1-NH1 3.34Å; D42-R51 IonicContact OD1-NH2 2.76Å; D42-R51 PolarHBondContact OD1-NH2 3.17Å; S45-R51 VanDerWaalsContact OG-CZ 3.32Å; S45-R51 PolarHBondContact OG-NH1 3.46Å; V47-R51 PolarHBondContact O-N 3.33Å; R51-L53 PolarHBondContact O-N 3.09Å; R51-L54 HydrophobicContact CB-CB 4.26Å; R51-L54 PolarHBondContact O-N 3.39Å; R51-T55 WeakPolarHBondContact O-CB 3.46Å; R51-T55 PolarHBondContact O-N 3.4Å; R51-T55 PolarHBondContact O-OG1 3.47Å
52P89Confident84.8Confident65 Ų6563.8 Ų63.842%0.42231%0.305SS..Hα-helixtrans-56-48.2-168.318.5-31000114.2L48 L56L48-P52 WeakPolarHBondContact O-CA 3.5Å; L48-P52 VanDerWaalsContact O-CB 3.26Å; L48-P52 WeakPolarHBondContact O-CB 3.32Å; L48-P52 WeakPolarHBondContact O-CD 3.3Å; P52-L56 WeakPolarHBondContact O-CB 3.4Å; P52-L56 VanDerWaalsContact O-CG 3.3Å; P52-L56 WeakPolarHBondContact O-CG 3.34Å; P52-L56 PolarHBondContact O-N 2.87Å
53L89.9Confident86Confident147 Ų14763.7 Ų63.777%0.7730%0.304SS*.Hα-helixtrans-67.5-41.1-176.8-64.4176.2000112.2R51 Y57R51-L53 PolarHBondContact O-N 3.09Å; L53-Y57 WeakPolarHBondContact O-CB 3.5Å; L53-Y57 PolarHBondContact O-N 3.43Å
54L88Confident87.2Confident60 Ų6069.6 Ų69.631%0.31433%0.329SS..Hα-helixtrans-69.6-43.6179.3-174.566.2000111.1L46 R51 Y57 Y58L46-L54 HydrophobicContact CD2-CD2 3.88Å; L46-L54 HydrophobicContact CD2-CG 3.99Å; R51-L54 HydrophobicContact CB-CB 4.26Å; R51-L54 PolarHBondContact O-N 3.39Å; L54-Y57 PolarHBondContact O-N 2.79Å; L54-Y58 HydrophobicContact CD1-CD1 4.38Å; L54-Y58 HydrophobicContact CD1-CE1 3.92Å; L54-Y58 HydrophobicContact CD1-CE2 4.37Å; L54-Y58 HydrophobicContact CG-CE2 4.4Å; L54-Y58 PolarHBondContact O-N 2.83Å
55T89.8Confident88.2Confident0 Ų068.8 Ų68.80%033%0.327CS..Hα-helixtrans-60.8-45.6175.9-59.60000110.9V47 L48 R51 Y57 Y58 F59 V388 A392V47-T55 PolarHBondContact N-OG1 2.96Å; L48-T55 HydrophobicContact CG-CG2 4.31Å; R51-T55 WeakPolarHBondContact O-CB 3.46Å; R51-T55 PolarHBondContact O-N 3.4Å; R51-T55 PolarHBondContact O-OG1 3.47Å; T55-Y57 PolarHBondContact O-N 2.88Å; T55-Y58 PolarHBondContact O-N 2.86Å; T55-F59 WeakPolarHBondContact O-CB 3.36Å; T55-F59 PolarHBondContact O-N 3.45Å; T55-V388 HydrophobicContact CG2-CG1 4.28Å; T55-A392 HydrophobicContact CG2-CB 3.59Å; T55-A392 VanDerWaalsContact O-CB 3.29Å; T55-A392 WeakPolarHBondContact O-CB 3.47Å
56L90.9Very high88.8Confident80 Ų8070.2 Ų70.242%0.41934%0.336SS..Hα-helixtrans-64-38.7176.6-75.5172.1000112.7L48 P52 S60 V388L48-L56 HydrophobicContact CD2-CD2 4.19Å; L48-L56 HydrophobicContact CD2-CG 4.12Å; P52-L56 WeakPolarHBondContact O-CB 3.4Å; P52-L56 VanDerWaalsContact O-CG 3.3Å; P52-L56 WeakPolarHBondContact O-CG 3.34Å; P52-L56 PolarHBondContact O-N 2.87Å; L56-S60 WeakPolarHBondContact O-CB 3.41Å; L56-S60 PolarHBondContact O-N 3.47Å; L56-S60 PolarHBondContact O-OG 3.25Å; L56-V388 HydrophobicContact CD2-CG1 4.19Å
57Y92.4Very high89.5Confident137 Ų13774.2 Ų74.254%0.53736%0.356SS..Hα-helixtrans-62.8-51.3176.1177.4-110000111.5L53 L54 T55 F59 S60 L61L53-Y57 WeakPolarHBondContact O-CB 3.5Å; L53-Y57 PolarHBondContact O-N 3.43Å; L54-Y57 PolarHBondContact O-N 2.79Å; T55-Y57 PolarHBondContact O-N 2.88Å; Y57-F59 PolarHBondContact O-N 3.44Å; Y57-S60 PolarHBondContact O-N 2.94Å; Y57-S60 PolarHBondContact O-OG 3.43Å; Y57-L61 PolarHBondContact O-N 3.48Å; Y57-L61 VanDerWaalsContact O-N 3.11Å
58Y91.4Very high89.9Confident37 Ų3780 Ų8015%0.14538%0.379CS..Hα-helixtrans-63.5-39.8177.5-75.71.3000112.5L46 L54 T55 S60 L61 E62 Y395 A396L46-Y58 HydrophobicContact CD1-CD2 4.22Å; L46-Y58 HydrophobicContact CD1-CE2 4.26Å; L46-Y58 HydrophobicContact CD2-CD2 3.74Å; L46-Y58 HydrophobicContact CD2-CE2 4.02Å; L54-Y58 HydrophobicContact CD1-CD1 4.38Å; L54-Y58 HydrophobicContact CD1-CE1 3.92Å; L54-Y58 HydrophobicContact CD1-CE2 4.37Å; L54-Y58 HydrophobicContact CG-CE2 4.4Å; L54-Y58 PolarHBondContact O-N 2.83Å; T55-Y58 PolarHBondContact O-N 2.86Å; Y58-S60 PolarHBondContact O-N 2.93Å; Y58-L61 PolarHBondContact O-N 3.29Å; Y58-E62 PolarHBondContact O-N 2.79Å; Y58-Y395 AromaticContact CD1-CD1 3.72Å; Y58-Y395 HydrophobicContact CD1-CD1 3.72Å; Y58-Y395 AromaticContact CD1-CE1 3.9Å; Y58-Y395 HydrophobicContact CD1-CE1 3.9Å; Y58-Y395 HydrophobicContact CD2-CD1 4.16Å; Y58-Y395 HydrophobicContact CE1-CD1 4.23Å; Y58-Y395 HydrophobicContact CE1-CE1 4.09Å; Y58-Y395 AromaticContact CG-CD1 3.68Å; Y58-Y395 HydrophobicContact CG-CD1 3.68Å; Y58-Y395 HydrophobicContact CG-CE1 4.34Å; Y58-A396 HydrophobicContact CD2-CB 4.3Å; Y58-A396 HydrophobicContact CE2-CB 4.31Å
59F91.9Very high90.2Very high45 Ų4579.8 Ų79.820%0.19739%0.386CS..Hα-helixtrans-54.7-49.9170.8164.1-98.4000111.7T55 Y57 L61 E62 L63 V388 M391 A392T55-F59 WeakPolarHBondContact O-CB 3.36Å; T55-F59 PolarHBondContact O-N 3.45Å; Y57-F59 PolarHBondContact O-N 3.44Å; F59-L61 VanDerWaalsContact C-N 3.27Å; F59-L61 PolarHBondContact O-N 2.93Å; F59-E62 PolarHBondContact O-N 2.86Å; F59-L63 HydrophobicContact CE1-CD2 4.08Å; F59-L63 HydrophobicContact CZ-CD2 4Å; F59-L63 VanDerWaalsContact O-CB 3.25Å; F59-L63 WeakPolarHBondContact O-CB 3.45Å; F59-L63 PolarHBondContact O-N 3.27Å; F59-V388 HydrophobicContact CB-CG1 4.07Å; F59-V388 HydrophobicContact CD2-CB 4.27Å; F59-V388 HydrophobicContact CD2-CG1 4.1Å; F59-V388 HydrophobicContact CD2-CG2 4.26Å; F59-V388 HydrophobicContact CE2-CG2 4.14Å; F59-V388 HydrophobicContact CG-CG1 3.99Å; F59-V388 HydrophobicContact CZ-CG2 4.46Å; F59-M391 HydrophobicContact CD2-CB 3.7Å; F59-M391 HydrophobicContact CD2-CG 4.37Å; F59-M391 HydrophobicContact CD2-SD 3.96Å; F59-M391 HydrophobicContact CE2-CB 4.27Å; F59-M391 HydrophobicContact CE2-CE 4.37Å; F59-M391 HydrophobicContact CE2-CG 4.46Å; F59-M391 HydrophobicContact CE2-SD 3.54Å; F59-M391 VanDerWaalsContact CE2-SD 3.54Å; F59-A392 HydrophobicContact CB-CB 4.31Å
60S91.7Very high90.5Very high57 Ų5778.4 Ų78.440%0.39938%0.381SS..Hα-helixtrans-62.9-36-177.172.40000112.5L56 Y57 Y58 F64L56-S60 WeakPolarHBondContact O-CB 3.41Å; L56-S60 PolarHBondContact O-N 3.47Å; L56-S60 PolarHBondContact O-OG 3.25Å; Y57-S60 PolarHBondContact O-N 2.94Å; Y57-S60 PolarHBondContact O-OG 3.43Å; Y58-S60 PolarHBondContact O-N 2.93Å; S60-F64 PolarHBondContact O-N 3.2Å
61L92.6Very high90.6Very high46 Ų4678 Ų7824%0.24138%0.383CS..Hα-helixtrans-73.6-43.3179.6-166.851.8000111.4Y57 Y58 F59 L63 F64 I65 Y395Y57-L61 PolarHBondContact O-N 3.48Å; Y57-L61 VanDerWaalsContact O-N 3.11Å; Y58-L61 PolarHBondContact O-N 3.29Å; F59-L61 VanDerWaalsContact C-N 3.27Å; F59-L61 PolarHBondContact O-N 2.93Å; L61-L63 VanDerWaalsContact C-N 3.29Å; L61-L63 PolarHBondContact O-N 3.24Å; L61-F64 PolarHBondContact O-N 3.41Å; L61-I65 HydrophobicContact CG-CD1 4.32Å; L61-I65 WeakPolarHBondContact O-CG1 3.41Å; L61-I65 PolarHBondContact O-N 3.36Å; L61-Y395 HydrophobicContact CB-CD2 4.33Å; L61-Y395 HydrophobicContact CB-CE2 4.22Å; L61-Y395 HydrophobicContact CD2-CD2 4.44Å; L61-Y395 HydrophobicContact CD2-CE1 3.72Å; L61-Y395 HydrophobicContact CD2-CE2 3.6Å; L61-Y395 WeakPolarHBondContact CD2-OH 3.32Å; L61-Y395 HydrophobicContact CG-CD2 4.15Å; L61-Y395 HydrophobicContact CG-CE1 4.41Å; L61-Y395 HydrophobicContact CG-CE2 3.58Å
62E91.7Very high90.8Very high5 Ų581.9 Ų81.92%0.02340%0.398CS..Hα-helixtrans-58.9-44.2172.4-166.454.8-160.300111.7Y58 F59 F64 I65 T66 M391 Y395 R398Y58-E62 PolarHBondContact O-N 2.79Å; F59-E62 PolarHBondContact O-N 2.86Å; E62-F64 VanDerWaalsContact C-N 3.33Å; E62-F64 PolarHBondContact O-N 3.09Å; E62-I65 PolarHBondContact O-N 2.97Å; E62-T66 WeakPolarHBondContact O-CB 3.43Å; E62-T66 PolarHBondContact O-N 3.45Å; E62-T66 PolarHBondContact O-OG1 2.85Å; E62-M391 HydrophobicContact CB-CE 4.28Å; E62-M391 HydrophobicContact CG-CB 4.45Å; E62-M391 HydrophobicContact CG-CE 4.09Å; E62-M391 WeakPolarHBondContact CG-O 3.19Å; E62-Y395 VanDerWaalsContact OE2-CA 3.3Å; E62-Y395 WeakPolarHBondContact OE2-CA 3.4Å; E62-Y395 WeakPolarHBondContact OE2-CB 3.4Å; E62-Y395 WeakPolarHBondContact OE2-CD2 2.99Å; E62-R398 IonicContact OE1-CZ 3.33Å; E62-R398 IonicContact OE1-NE 2.82Å; E62-R398 PolarHBondContact OE1-NE 3.41Å; E62-R398 IonicContact OE1-NH2 3.29Å; E62-R398 PolarHBondContact OE1-NH2 3.34Å; E62-R398 IonicContact OE2-NE 2.84Å; E62-R398 PolarHBondContact OE2-NE 3.24Å; E62-R398 VanDerWaalsContact OE2-NE 3.15Å
63L91.9Very high90.8Very high64 Ų6486.4 Ų86.434%0.33541%0.406SS..Hα-helixtrans-59.7-46.7178.3-178.864.6000109.9F59 L61 T66 L67 M391F59-L63 HydrophobicContact CE1-CD2 4.08Å; F59-L63 HydrophobicContact CZ-CD2 4Å; F59-L63 VanDerWaalsContact O-CB 3.25Å; F59-L63 WeakPolarHBondContact O-CB 3.45Å; F59-L63 PolarHBondContact O-N 3.27Å; L61-L63 VanDerWaalsContact C-N 3.29Å; L61-L63 PolarHBondContact O-N 3.24Å; L63-T66 PolarHBondContact O-N 2.91Å; L63-L67 HydrophobicContact CD1-CD1 4.08Å; L63-L67 HydrophobicContact CD1-CG 4.2Å; L63-L67 HydrophobicContact CG-CD1 3.85Å; L63-L67 HydrophobicContact CG-CG 4.37Å; L63-L67 VanDerWaalsContact O-CB 3.26Å; L63-L67 WeakPolarHBondContact O-CB 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.42Å; L63-L67 PolarHBondContact O-N 3.06Å; L63-M391 HydrophobicContact CB-CE 4Å; L63-M391 HydrophobicContact CD1-CE 4.03Å
64F93.5Very high90.7Very high134 Ų13483.3 Ų83.359%0.58839%0.39SS*.Hα-helixtrans-64.4-45.2178.8-173-99.2000113S60 L61 E62 T66 L67 K68S60-F64 PolarHBondContact O-N 3.2Å; L61-F64 PolarHBondContact O-N 3.41Å; E62-F64 VanDerWaalsContact C-N 3.33Å; E62-F64 PolarHBondContact O-N 3.09Å; F64-T66 VanDerWaalsContact C-N 3.33Å; F64-T66 PolarHBondContact O-N 2.97Å; F64-L67 PolarHBondContact O-N 3.19Å; F64-K68 WeakPolarHBondContact O-CB 3.43Å; F64-K68 PolarHBondContact O-N 3.42Å
65I91.1Very high90.8Very high70 Ų7088.8 Ų88.836%0.35941%0.407SS..Hα-helixtrans-59.4-48.2177.2-69.5166.4000110L61 E62 K68 G69 Y395L61-I65 HydrophobicContact CG-CD1 4.32Å; L61-I65 WeakPolarHBondContact O-CG1 3.41Å; L61-I65 PolarHBondContact O-N 3.36Å; E62-I65 PolarHBondContact O-N 2.97Å; I65-K68 PolarHBondContact O-N 3.26Å; I65-G69 PolarHBondContact O-N 3.08Å; I65-Y395 HydrophobicContact CD1-CD2 3.96Å; I65-Y395 HydrophobicContact CD1-CE2 3.65Å
66T88.1Confident90.8Very high45 Ų4596.3 Ų96.328%0.27644%0.442SS..Hα-helixtrans-61.7-49.6179.7-60.30000110.4E62 L63 F64 K68 G69 W70E62-T66 WeakPolarHBondContact O-CB 3.43Å; E62-T66 PolarHBondContact O-N 3.45Å; E62-T66 PolarHBondContact O-OG1 2.85Å; L63-T66 PolarHBondContact O-N 2.91Å; F64-T66 VanDerWaalsContact C-N 3.33Å; F64-T66 PolarHBondContact O-N 2.97Å; T66-K68 PolarHBondContact O-N 3.25Å; T66-G69 WeakPolarHBondContact O-CA 3.25Å; T66-G69 PolarHBondContact O-N 2.92Å; T66-G69 VanDerWaalsContact O-N 3.09Å; T66-W70 VanDerWaalsContact CG2-NE1 3.33Å; T66-W70 PolarHBondContact O-N 3.27Å
67L90.6Very high90.8Very high92 Ų9298.3 Ų98.348%0.48245%0.449SS..Hα-helixtrans-58.3-44.6177.4-74.8172.5000112.1L63 F64 G69 W70 M71L63-L67 HydrophobicContact CD1-CD1 4.08Å; L63-L67 HydrophobicContact CD1-CG 4.2Å; L63-L67 HydrophobicContact CG-CD1 3.85Å; L63-L67 HydrophobicContact CG-CG 4.37Å; L63-L67 VanDerWaalsContact O-CB 3.26Å; L63-L67 WeakPolarHBondContact O-CB 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.42Å; L63-L67 PolarHBondContact O-N 3.06Å; F64-L67 PolarHBondContact O-N 3.19Å; L67-G69 VanDerWaalsContact C-N 3.29Å; L67-G69 PolarHBondContact O-N 3.24Å; L67-W70 PolarHBondContact O-N 3.49Å; L67-M71 WeakPolarHBondContact O-CB 3.21Å; L67-M71 VanDerWaalsContact O-CG 3.26Å; L67-M71 WeakPolarHBondContact O-CG 3.29Å; L67-M71 PolarHBondContact O-N 2.92Å
68K93Very high90.7Very high145 Ų14598.9 Ų98.963%0.6345%0.45SS*.Hα-helixtrans-59.9-41.5175.2-175.3179.6177.3179.10111.3F64 I65 T66 M71 W72F64-K68 WeakPolarHBondContact O-CB 3.43Å; F64-K68 PolarHBondContact O-N 3.42Å; I65-K68 PolarHBondContact O-N 3.26Å; T66-K68 PolarHBondContact O-N 3.25Å; K68-M71 PolarHBondContact O-N 3.49Å; K68-W72 WeakPolarHBondContact O-CB 3.38Å; K68-W72 PolarHBondContact O-N 3.42Å
69G90.8Very high90.6Very high32 Ų32103.8 Ų103.833%0.3347%0.474SS..Hα-helixtrans-61.1-45.6174.600000113I65 T66 L67 W72 R73I65-G69 PolarHBondContact O-N 3.08Å; T66-G69 WeakPolarHBondContact O-CA 3.25Å; T66-G69 PolarHBondContact O-N 2.92Å; T66-G69 VanDerWaalsContact O-N 3.09Å; L67-G69 VanDerWaalsContact C-N 3.29Å; L67-G69 PolarHBondContact O-N 3.24Å; G69-W72 PolarHBondContact O-N 2.96Å; G69-R73 WeakPolarHBondContact O-CG 3.48Å; G69-R73 PolarHBondContact O-N 2.86Å
70W87.9Confident90.5Very high142 Ų142106.3 Ų106.354%0.53849%0.493SS..Hα-helixtrans-63.1-44.7174.8-72.5107.1000112.1T66 L67 W72 R73 L74T66-W70 VanDerWaalsContact CG2-NE1 3.33Å; T66-W70 PolarHBondContact O-N 3.27Å; L67-W70 PolarHBondContact O-N 3.49Å; W70-W72 VanDerWaalsContact C-N 3.32Å; W70-W72 PolarHBondContact O-N 3.5Å; W70-R73 PolarHBondContact O-N 3.22Å; W70-L74 WeakPolarHBondContact O-CB 3.43Å; W70-L74 WeakPolarHBondContact O-CG 3.4Å; W70-L74 PolarHBondContact O-N 3.48Å
71M89.8Confident90.5Very high131 Ų131106.1 Ų106.165%0.64549%0.49SS*.Hα-helixtrans-59.4-42.6176.4-73-66.6-71.200111.7L67 K68 L74 W75L67-M71 WeakPolarHBondContact O-CB 3.21Å; L67-M71 VanDerWaalsContact O-CG 3.26Å; L67-M71 WeakPolarHBondContact O-CG 3.29Å; L67-M71 PolarHBondContact O-N 2.92Å; K68-M71 PolarHBondContact O-N 3.49Å; M71-L74 PolarHBondContact O-N 3.35Å; M71-W75 VanDerWaalsContact O-CB 3.32Å; M71-W75 WeakPolarHBondContact O-CB 3.41Å; M71-W75 PolarHBondContact O-N 2.89Å
72W91.9Very high90.4Very high185 Ų185109.8 Ų109.870%0.70150%0.504SS*.Hα-helixtrans-63.9-43.5176.2-174.3-102000112.4K68 G69 W70 W75 H76K68-W72 WeakPolarHBondContact O-CB 3.38Å; K68-W72 PolarHBondContact O-N 3.42Å; G69-W72 PolarHBondContact O-N 2.96Å; W70-W72 VanDerWaalsContact C-N 3.32Å; W70-W72 PolarHBondContact O-N 3.5Å; W72-W75 PolarHBondContact O-N 2.79Å; W72-H76 PolarHBondContact O-N 3.29Å
73R88.8Confident90.5Very high160 Ų160111.4 Ų111.460%0.60452%0.522SS*.Hα-helixtrans-63.5-44175.6-71.9178-174.3172.82112.1G69 W70 W75 H76 Q77G69-R73 WeakPolarHBondContact O-CG 3.48Å; G69-R73 PolarHBondContact O-N 2.86Å; W70-R73 PolarHBondContact O-N 3.22Å; R73-W75 VanDerWaalsContact C-N 3.31Å; R73-W75 PolarHBondContact O-N 3.3Å; R73-H76 PolarHBondContact O-N 2.92Å; R73-Q77 PolarHBondContact O-N 2.98Å; R73-Q77 VanDerWaalsContact O-N 3.07Å
74L87.1Confident90.5Very high83 Ų83113.1 Ų113.144%0.43553%0.531SS..Hα-helixtrans-60.8-42175.1-74.7169.9000111.1W70 M71 Q77 R78 V81W70-L74 WeakPolarHBondContact O-CB 3.43Å; W70-L74 WeakPolarHBondContact O-CG 3.4Å; W70-L74 PolarHBondContact O-N 3.48Å; M71-L74 PolarHBondContact O-N 3.35Å; L74-Q77 CarbonylContact O-C 3.26Å; L74-Q77 VanDerWaalsContact O-C 3.26Å; L74-Q77 PolarHBondContact O-N 3.12Å; L74-Q77 VanDerWaalsContact O-N 3.16Å; L74-R78 PolarHBondContact O-N 2.85Å; L74-R78 VanDerWaalsContact O-N 3.16Å; L74-V81 HydrophobicContact CB-CG2 4.49Å; L74-V81 HydrophobicContact CD2-CG2 3.89Å
75W89.9Confident90.5Very high175 Ų175109.8 Ų109.866%0.66352%0.522SS*.Hα-helixtrans-64.1-41.5176.2-168.8-94.1000112.4M71 W72 R73 Q77 R78M71-W75 VanDerWaalsContact O-CB 3.32Å; M71-W75 WeakPolarHBondContact O-CB 3.41Å; M71-W75 PolarHBondContact O-N 2.89Å; W72-W75 PolarHBondContact O-N 2.79Å; R73-W75 VanDerWaalsContact C-N 3.31Å; R73-W75 PolarHBondContact O-N 3.3Å; W75-Q77 PolarHBondContact O-N 2.98Å; W75-R78 WeakPolarHBondContact O-CB 3.41Å; W75-R78 WeakPolarHBondContact O-CG 3.45Å; W75-R78 PolarHBondContact O-N 3.47Å; W75-R78 VanDerWaalsContact O-N 3.09Å
76H90.9Very high90.7Very high157 Ų157110.1 Ų110.173%0.72752%0.522SS*.Hα-helixtrans-61.9-31.7174.6-167.2-72.6000111.9W72 R73W72-H76 PolarHBondContact O-N 3.29Å; R73-H76 PolarHBondContact O-N 2.92Å
77Q89.9Confident91Very high122 Ų122112.2 Ų112.257%0.5753%0.532SS*.THydrogen-bonded Turntrans-96.425.6175-64.8-171.8-16.400113.5R73 L74 W75 Q79 T80 V81R73-Q77 PolarHBondContact O-N 2.98Å; R73-Q77 VanDerWaalsContact O-N 3.07Å; L74-Q77 CarbonylContact O-C 3.26Å; L74-Q77 VanDerWaalsContact O-C 3.26Å; L74-Q77 PolarHBondContact O-N 3.12Å; L74-Q77 VanDerWaalsContact O-N 3.16Å; W75-Q77 PolarHBondContact O-N 2.98Å; Q77-Q79 PolarHBondContact O-N 3.49Å; Q77-T80 PolarHBondContact O-N 2.96Å; Q77-V81 PolarHBondContact O-N 2.94Å; Q77-V81 VanDerWaalsContact O-N 3.12Å
78R90.6Very high91.1Very high150 Ų150112.8 Ų112.857%0.56654%0.535SS*.Hα-helixtrans-49.6-34.1-172.861-178.7-176.2175.21115.5L74 W75 F82L74-R78 PolarHBondContact O-N 2.85Å; L74-R78 VanDerWaalsContact O-N 3.16Å; W75-R78 WeakPolarHBondContact O-CB 3.41Å; W75-R78 WeakPolarHBondContact O-CG 3.45Å; W75-R78 PolarHBondContact O-N 3.47Å; W75-R78 VanDerWaalsContact O-N 3.09Å; R78-F82 WeakPolarHBondContact O-CB 3.3Å; R78-F82 PolarHBondContact O-N 3.27Å
79Q89.8Confident91.1Very high139 Ų139109.5 Ų109.565%0.6552%0.523SS*.Hα-helixtrans-68.1-44.2-179.3-62.6-61.8-10.900111.5Q77 F82 G83Q77-Q79 PolarHBondContact O-N 3.49Å; Q79-F82 PolarHBondContact O-N 3.03Å; Q79-G83 PolarHBondContact O-N 3.35Å
80T89.3Confident91.2Very high98 Ų98113.4 Ų113.460%0.60154%0.536SS*.Hα-helixtrans-65.4-43.8176-50.50000110.8Q77 G83 L84Q77-T80 PolarHBondContact O-N 2.96Å; T80-G83 PolarHBondContact O-N 2.86Å; T80-L84 WeakPolarHBondContact O-CB 3.41Å; T80-L84 PolarHBondContact O-N 2.96Å
81V90.5Very high91.3Very high54 Ų54113 Ų11333%0.32754%0.538SS..Hα-helixtrans-61.4-46.9176.7177.80000110.6L74 Q77 G83 L84 V85L74-V81 HydrophobicContact CB-CG2 4.49Å; L74-V81 HydrophobicContact CD2-CG2 3.89Å; Q77-V81 PolarHBondContact O-N 2.94Å; Q77-V81 VanDerWaalsContact O-N 3.12Å; V81-G83 PolarHBondContact O-N 2.95Å; V81-L84 PolarHBondContact O-N 3.45Å; V81-V85 HydrophobicContact CG1-CG2 4.31Å; V81-V85 VanDerWaalsContact O-CG2 3.3Å; V81-V85 WeakPolarHBondContact O-CG2 3.45Å; V81-V85 PolarHBondContact O-N 3.15Å
82F92.3Very high91.2Very high122 Ų122109.5 Ų109.554%0.53553%0.527SS..Hα-helixtrans-61.9-44.1178.5-174.5-97.6000111.9R78 Q79 L84 V85 M86R78-F82 WeakPolarHBondContact O-CB 3.3Å; R78-F82 PolarHBondContact O-N 3.27Å; Q79-F82 PolarHBondContact O-N 3.03Å; F82-L84 VanDerWaalsContact C-N 3.31Å; F82-L84 PolarHBondContact O-N 3Å; F82-V85 PolarHBondContact O-N 3.46Å; F82-M86 HydrophobicContact CD1-CG 4.05Å; F82-M86 HydrophobicContact CE1-CG 3.64Å; F82-M86 HydrophobicContact CE1-SD 4.43Å; F82-M86 HydrophobicContact CE2-CE 3.9Å; F82-M86 HydrophobicContact CE2-CG 4.42Å; F82-M86 HydrophobicContact CZ-CE 3.86Å; F82-M86 HydrophobicContact CZ-CG 3.85Å; F82-M86 HydrophobicContact CZ-SD 4.12Å; F82-M86 WeakPolarHBondContact O-CB 3.2Å; F82-M86 WeakPolarHBondContact O-CG 3.49Å; F82-M86 PolarHBondContact O-N 2.88Å
83G93.6Very high91.1Very high39 Ų39104.6 Ų104.640%0.40251%0.513SS..Hα-helixtrans-59-41.4174.600000112.6Q79 T80 V81 M86 L87Q79-G83 PolarHBondContact O-N 3.35Å; T80-G83 PolarHBondContact O-N 2.86Å; V81-G83 PolarHBondContact O-N 2.95Å; G83-M86 PolarHBondContact O-N 3.32Å; G83-L87 WeakPolarHBondContact O-CB 3.4Å; G83-L87 PolarHBondContact O-N 3.2Å
84L92.2Very high91Very high100 Ų10098.8 Ų98.852%0.52450%0.499SS..Hα-helixtrans-70.4-39.7178.8-157.3143.8000112T80 V81 F82 L87 L88T80-L84 WeakPolarHBondContact O-CB 3.41Å; T80-L84 PolarHBondContact O-N 2.96Å; V81-L84 PolarHBondContact O-N 3.45Å; F82-L84 VanDerWaalsContact C-N 3.31Å; F82-L84 PolarHBondContact O-N 3Å; L84-L87 WeakPolarHBondContact O-CB 3.33Å; L84-L87 PolarHBondContact O-N 2.94Å; L84-L88 HydrophobicContact CD2-CD1 3.81Å; L84-L88 HydrophobicContact CD2-CG 4.25Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 3.16Å
85V93.2Very high91.1Very high64 Ų6499.4 Ų99.439%0.38850%0.497SS..Hα-helixtrans-64-44.7173.9170.90000111.1V81 F82 L87 L88 I89V81-V85 HydrophobicContact CG1-CG2 4.31Å; V81-V85 VanDerWaalsContact O-CG2 3.3Å; V81-V85 WeakPolarHBondContact O-CG2 3.45Å; V81-V85 PolarHBondContact O-N 3.15Å; F82-V85 PolarHBondContact O-N 3.46Å; V85-L87 VanDerWaalsContact C-N 3.32Å; V85-L87 PolarHBondContact O-N 3.03Å; V85-L88 PolarHBondContact O-N 3.47Å; V85-I89 HydrophobicContact CG1-CD1 3.91Å; V85-I89 VanDerWaalsContact O-CG1 3.32Å; V85-I89 WeakPolarHBondContact O-CG1 3.46Å; V85-I89 PolarHBondContact O-N 3.04Å
86M94.6Very high91.1Very high77 Ų7797.6 Ų97.638%0.37950%0.495SS..Hα-helixtrans-60.6-42.6175.1-75.8-63.5117.400111.7F82 G83 L88 I89 L90F82-M86 HydrophobicContact CD1-CG 4.05Å; F82-M86 HydrophobicContact CE1-CG 3.64Å; F82-M86 HydrophobicContact CE1-SD 4.43Å; F82-M86 HydrophobicContact CE2-CE 3.9Å; F82-M86 HydrophobicContact CE2-CG 4.42Å; F82-M86 HydrophobicContact CZ-CE 3.86Å; F82-M86 HydrophobicContact CZ-CG 3.85Å; F82-M86 HydrophobicContact CZ-SD 4.12Å; F82-M86 WeakPolarHBondContact O-CB 3.2Å; F82-M86 WeakPolarHBondContact O-CG 3.49Å; F82-M86 PolarHBondContact O-N 2.88Å; G83-M86 PolarHBondContact O-N 3.32Å; M86-L88 PolarHBondContact O-N 3.01Å; M86-I89 HydrophobicContact CE-CD1 3.65Å; M86-I89 PolarHBondContact O-N 3.24Å; M86-L90 WeakPolarHBondContact O-CG 3.21Å; M86-L90 PolarHBondContact O-N 3.49Å
87L94.1Very high91.1Very high89 Ų8994.6 Ų94.647%0.46648%0.484SS..Hα-helixtrans-60.9-44175.3-175.170000111.8G83 L84 V85 I89 L90 F91G83-L87 WeakPolarHBondContact O-CB 3.4Å; G83-L87 PolarHBondContact O-N 3.2Å; L84-L87 WeakPolarHBondContact O-CB 3.33Å; L84-L87 PolarHBondContact O-N 2.94Å; V85-L87 VanDerWaalsContact C-N 3.32Å; V85-L87 PolarHBondContact O-N 3.03Å; L87-I89 VanDerWaalsContact C-N 3.34Å; L87-I89 PolarHBondContact O-N 3.48Å; L87-L90 PolarHBondContact O-N 3.11Å; L87-F91 HydrophobicContact CD1-CD2 4.16Å; L87-F91 HydrophobicContact CD1-CE2 3.69Å; L87-F91 HydrophobicContact CD2-CE2 4.02Å; L87-F91 HydrophobicContact CG-CD2 3.83Å; L87-F91 HydrophobicContact CG-CE2 3.59Å; L87-F91 WeakPolarHBondContact O-CD2 3.26Å; L87-F91 PolarHBondContact O-N 3.47Å
88L92.6Very high91Very high104 Ų10497.6 Ų97.655%0.54550%0.498SS..Hα-helixtrans-62.3-40.6176.1-74.3172.4000112.2L84 V85 M86 F91 S92L84-L88 HydrophobicContact CD2-CD1 3.81Å; L84-L88 HydrophobicContact CD2-CG 4.25Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 3.16Å; V85-L88 PolarHBondContact O-N 3.47Å; M86-L88 PolarHBondContact O-N 3.01Å; L88-F91 PolarHBondContact O-N 3.37Å; L88-S92 WeakPolarHBondContact O-CB 3.33Å; L88-S92 PolarHBondContact O-N 3.22Å
89I94Very high91Very high77 Ų7791.9 Ų91.940%0.39549%0.485SS..Hα-helixtrans-62.7-45.5175.1-69.1165000110.2V85 M86 L87 F91 S92 I93V85-I89 HydrophobicContact CG1-CD1 3.91Å; V85-I89 VanDerWaalsContact O-CG1 3.32Å; V85-I89 WeakPolarHBondContact O-CG1 3.46Å; V85-I89 PolarHBondContact O-N 3.04Å; M86-I89 HydrophobicContact CE-CD1 3.65Å; M86-I89 PolarHBondContact O-N 3.24Å; L87-I89 VanDerWaalsContact C-N 3.34Å; L87-I89 PolarHBondContact O-N 3.48Å; I89-F91 VanDerWaalsContact C-N 3.34Å; I89-F91 PolarHBondContact O-N 3.12Å; I89-S92 PolarHBondContact O-N 3.19Å; I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.35Å; I89-I93 WeakPolarHBondContact O-CB 3.43Å; I89-I93 VanDerWaalsContact O-CG1 3.26Å; I89-I93 WeakPolarHBondContact O-CG1 3.44Å; I89-I93 PolarHBondContact O-N 3.38Å
90L92.2Very high91Very high113 Ų11391.1 Ų91.159%0.59249%0.493SS*.Hα-helixtrans-60.3-42.1176.5-71170.1000112.1M86 L87 I93 A94M86-L90 WeakPolarHBondContact O-CG 3.21Å; M86-L90 PolarHBondContact O-N 3.49Å; L87-L90 PolarHBondContact O-N 3.11Å; L90-I93 PolarHBondContact O-N 2.98Å; L90-A94 WeakPolarHBondContact O-CB 3.48Å; L90-A94 PolarHBondContact O-N 3.3Å
91F89.3Confident90.9Very high134 Ų13489.6 Ų89.659%0.58848%0.478SS*.Hα-helixtrans-64.9-40.9174.3-83-62.6000112.6L87 L88 I89 A94 Y95L87-F91 HydrophobicContact CD1-CD2 4.16Å; L87-F91 HydrophobicContact CD1-CE2 3.69Å; L87-F91 HydrophobicContact CD2-CE2 4.02Å; L87-F91 HydrophobicContact CG-CD2 3.83Å; L87-F91 HydrophobicContact CG-CE2 3.59Å; L87-F91 WeakPolarHBondContact O-CD2 3.26Å; L87-F91 PolarHBondContact O-N 3.47Å; L88-F91 PolarHBondContact O-N 3.37Å; I89-F91 VanDerWaalsContact C-N 3.34Å; I89-F91 PolarHBondContact O-N 3.12Å; F91-A94 PolarHBondContact O-N 3.14Å; F91-Y95 WeakPolarHBondContact O-CB 3.49Å; F91-Y95 PolarHBondContact O-N 3.19Å
92S89.1Confident90.9Very high58 Ų5888.5 Ų88.541%0.40647%0.47SS..Hα-helixtrans-63.2-43.7176.3177.30000111.4L88 I89 A94 Y95 H96L88-S92 WeakPolarHBondContact O-CB 3.33Å; L88-S92 PolarHBondContact O-N 3.22Å; I89-S92 PolarHBondContact O-N 3.19Å; S92-A94 PolarHBondContact O-N 3.46Å; S92-Y95 WeakPolarHBondContact O-CB 3.4Å; S92-Y95 PolarHBondContact O-N 3.15Å; S92-H96 PolarHBondContact O-CD2 2.94Å; S92-H96 PolarHBondContact O-N 2.82Å
93I89.7Confident90.6Very high81 Ų8190.8 Ų90.842%0.41548%0.479SS..Hα-helixtrans-59.9-47.5173.7-68.6167.9000110.1I89 L90 Y95 H96 I97I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.35Å; I89-I93 WeakPolarHBondContact O-CB 3.43Å; I89-I93 VanDerWaalsContact O-CG1 3.26Å; I89-I93 WeakPolarHBondContact O-CG1 3.44Å; I89-I93 PolarHBondContact O-N 3.38Å; L90-I93 PolarHBondContact O-N 2.98Å; I93-Y95 PolarHBondContact O-N 2.96Å; I93-H96 PolarHBondContact O-N 2.72Å; I93-I97 HydrophobicContact CG2-CD1 3.37Å; I93-I97 HydrophobicContact CG2-CG1 4.06Å; I93-I97 WeakPolarHBondContact O-CB 3.29Å; I93-I97 VanDerWaalsContact O-CG1 3.29Å; I93-I97 WeakPolarHBondContact O-CG1 3.3Å; I93-I97 PolarHBondContact O-N 3.29Å
94A87.3Confident90.4Very high38 Ų3896.9 Ų96.931%0.31449%0.492SS..Hα-helixtrans-62-30.3177.900000113.3L90 F91 S92 H101L90-A94 WeakPolarHBondContact O-CB 3.48Å; L90-A94 PolarHBondContact O-N 3.3Å; F91-A94 PolarHBondContact O-N 3.14Å; S92-A94 PolarHBondContact O-N 3.46Å; A94-H101 PolarHBondContact O-CD2 3.28Å; A94-H101 VanDerWaalsContact O-CD2 3.31Å; A94-H101 PolarHBondContact O-NE2 3.04Å
95Y88.9Confident90.2Very high97 Ų9793.8 Ų93.838%0.3848%0.477SS..Hα-helixtrans-74.1-37.7176.8-176.3-91.2000112.8F91 S92 I93 Q102 V105 E109F91-Y95 WeakPolarHBondContact O-CB 3.49Å; F91-Y95 PolarHBondContact O-N 3.19Å; S92-Y95 WeakPolarHBondContact O-CB 3.4Å; S92-Y95 PolarHBondContact O-N 3.15Å; I93-Y95 PolarHBondContact O-N 2.96Å; Y95-Q102 PolarHBondContact O-NE2 3.33Å; Y95-Q102 VanDerWaalsContact O-NE2 3.12Å; Y95-Q102 PolarHBondContact O-OE1 3.15Å; Y95-V105 HydrophobicContact CD2-CG1 3.46Å; Y95-V105 VanDerWaalsContact CD2-CG1 3.46Å; Y95-V105 HydrophobicContact CE2-CG1 3.95Å; Y95-V105 HydrophobicContact CG-CG1 4.39Å; Y95-E109 PolarHBondContact OH-OE1 3.43Å
96H89Confident89.9Confident136 Ų13697.8 Ų97.863%0.6349%0.485SS*.Hα-helixtrans-86.3-27.4-177.3-74.2-62.4000114.1S92 I93 E98S92-H96 PolarHBondContact O-CD2 2.94Å; S92-H96 PolarHBondContact O-N 2.82Å; I93-H96 PolarHBondContact O-N 2.72Å; H96-E98 PolarHBondContact O-N 2.92Å
97I91.4Very high89.6Confident94 Ų94100.3 Ų100.348%0.48249%0.491SS..SBendtrans-72.7119.8177.3-68.1176.2000109.6I93 G99 H101I93-I97 HydrophobicContact CG2-CD1 3.37Å; I93-I97 HydrophobicContact CG2-CG1 4.06Å; I93-I97 WeakPolarHBondContact O-CB 3.29Å; I93-I97 VanDerWaalsContact O-CG1 3.29Å; I93-I97 WeakPolarHBondContact O-CG1 3.3Å; I93-I97 PolarHBondContact O-N 3.29Å; I97-G99 PolarHBondContact O-N 3.28Å; I97-H101 PolarHBondContact O-CE1 2.91Å; I97-H101 PolarHBondContact O-NE2 3.31Å
98E88.4Confident89.4Confident185 Ų185100.8 Ų100.886%0.86449%0.492SS*.  trans-66129.9171.7-63-175.617100110.8H96H96-E98 PolarHBondContact O-N 2.92Å
99G89.2Confident89.2Confident30 Ų3099.3 Ų99.331%0.30948%0.482SS..SBendtrans-176.1179.6179.300000113.5I97 H101 Q102I97-G99 PolarHBondContact O-N 3.28Å; G99-H101 PolarHBondContact O-N 2.93Å; G99-Q102 WeakPolarHBondContact O-CB 3.21Å; G99-Q102 PolarHBondContact O-N 2.87Å
100P89.5Confident88.9Confident124 Ų124102.7 Ų102.781%0.80549%0.494SS*.THydrogen-bonded Turntrans-62.6-25.8179.525.9-34000112.5Q102P100-Q102 PolarHBondContact O-N 3.35Å
101H88.4Confident88.8Confident65 Ų65100 Ų10030%0.30148%0.478SS..THydrogen-bonded Turntrans-65.8-20.8174.761.9-71.4000113A94 I97 G99 K103 Y104 V105A94-H101 PolarHBondContact O-CD2 3.28Å; A94-H101 VanDerWaalsContact O-CD2 3.31Å; A94-H101 PolarHBondContact O-NE2 3.04Å; I97-H101 PolarHBondContact O-CE1 2.91Å; I97-H101 PolarHBondContact O-NE2 3.31Å; G99-H101 PolarHBondContact O-N 2.93Å; H101-K103 PolarHBondContact O-N 2.66Å; H101-K103 VanDerWaalsContact O-N 3.14Å; H101-Y104 WeakPolarHBondContact O-CA 3.42Å; H101-Y104 WeakPolarHBondContact O-CB 3.48Å; H101-Y104 PolarHBondContact O-N 2.76Å; H101-V105 WeakPolarHBondContact O-CG2 3.33Å; H101-V105 PolarHBondContact O-N 3.01Å
102Q89Confident88.9Confident31 Ų3197.8 Ų97.815%0.14548%0.475CS..Hα-helixtrans-61.6-27-177.2-159.366.9-3.800113.1Y95 G99 P100 Y104 V105 R106Y95-Q102 PolarHBondContact O-NE2 3.33Å; Y95-Q102 VanDerWaalsContact O-NE2 3.12Å; Y95-Q102 PolarHBondContact O-OE1 3.15Å; G99-Q102 WeakPolarHBondContact O-CB 3.21Å; G99-Q102 PolarHBondContact O-N 2.87Å; P100-Q102 PolarHBondContact O-N 3.35Å; Q102-Y104 VanDerWaalsContact C-N 3.34Å; Q102-V105 PolarHBondContact O-N 3.5Å; Q102-R106 WeakPolarHBondContact O-CB 3.44Å; Q102-R106 WeakPolarHBondContact O-CG 3.25Å; Q102-R106 PolarHBondContact O-N 2.94Å
103K87.7Confident89Confident170 Ų170100.5 Ų100.574%0.73949%0.485SS*.Hα-helixtrans-63.1-41.9172.9-171.4179.7-178.8-178.90111.4H101 Y107H101-K103 PolarHBondContact O-N 2.66Å; H101-K103 VanDerWaalsContact O-N 3.14Å; K103-Y107 WeakPolarHBondContact O-CB 3.45Å; K103-Y107 PolarHBondContact O-N 3.27Å; K103-Y107 VanDerWaalsContact O-N 3.15Å
104Y88.9Confident89.1Confident168 Ų16899.1 Ų99.166%0.65947%0.474SS*.Hα-helixtrans-73.5-39.6177.3-60.1-83.1000111.3H101 Q102 Y107 M108H101-Y104 WeakPolarHBondContact O-CA 3.42Å; H101-Y104 WeakPolarHBondContact O-CB 3.48Å; H101-Y104 PolarHBondContact O-N 2.76Å; Q102-Y104 VanDerWaalsContact C-N 3.34Å; Y104-Y107 PolarHBondContact O-N 3.38Å; Y104-M108 WeakPolarHBondContact O-CB 3.3Å; Y104-M108 VanDerWaalsContact O-CG 3.26Å; Y104-M108 WeakPolarHBondContact O-CG 3.46Å; Y104-M108 PolarHBondContact O-N 3.47Å
105V88.6Confident89.4Confident34 Ų3498.6 Ų98.621%0.20647%0.468CS..Hα-helixtrans-58.7-51.2176.1175.80000110.8Y95 H101 Q102 Y107 M108 E109Y95-V105 HydrophobicContact CD2-CG1 3.46Å; Y95-V105 VanDerWaalsContact CD2-CG1 3.46Å; Y95-V105 HydrophobicContact CE2-CG1 3.95Å; Y95-V105 HydrophobicContact CG-CG1 4.39Å; H101-V105 WeakPolarHBondContact O-CG2 3.33Å; H101-V105 PolarHBondContact O-N 3.01Å; Q102-V105 PolarHBondContact O-N 3.5Å; V105-Y107 VanDerWaalsContact C-N 3.33Å; V105-Y107 PolarHBondContact O-N 3.35Å; V105-M108 PolarHBondContact O-N 3.24Å; V105-E109 WeakPolarHBondContact O-CB 3.5Å; V105-E109 PolarHBondContact O-N 3.33Å
106R86.6Confident89.6Confident149 Ų14996.7 Ų96.756%0.56247%0.472SS*.Hα-helixtrans-63-37.6177.3-69.4179.2-162.3152.54.9112.6Q102 K110Q102-R106 WeakPolarHBondContact O-CB 3.44Å; Q102-R106 WeakPolarHBondContact O-CG 3.25Å; Q102-R106 PolarHBondContact O-N 2.94Å; R106-K110 WeakPolarHBondContact O-CB 3.4Å; R106-K110 WeakPolarHBondContact O-CG 3.4Å; R106-K110 PolarHBondContact O-N 2.88Å
107Y88.3Confident89.7Confident129 Ų12995.5 Ų95.551%0.50646%0.463SS..Hα-helixtrans-64.3-46175.2174.9-98.9000111.4K103 Y104 V105 K110 K111K103-Y107 WeakPolarHBondContact O-CB 3.45Å; K103-Y107 PolarHBondContact O-N 3.27Å; K103-Y107 VanDerWaalsContact O-N 3.15Å; Y104-Y107 PolarHBondContact O-N 3.38Å; V105-Y107 VanDerWaalsContact C-N 3.33Å; V105-Y107 PolarHBondContact O-N 3.35Å; Y107-K110 PolarHBondContact O-N 2.97Å; Y107-K111 HydrophobicContact CD1-CG 4.48Å; Y107-K111 HydrophobicContact CD2-CG 4.36Å; Y107-K111 HydrophobicContact CE1-CG 4.04Å; Y107-K111 HydrophobicContact CE2-CD 4.42Å; Y107-K111 HydrophobicContact CE2-CG 3.91Å; Y107-K111 WeakPolarHBondContact O-CB 3.33Å; Y107-K111 WeakPolarHBondContact O-CG 3.38Å; Y107-K111 PolarHBondContact O-N 3.1Å
108M89.2Confident89.8Confident100 Ų10091.4 Ų91.449%0.49344%0.441SS..Hα-helixtrans-63.9-41.2176.1-73.7-70.9100.800111.9Y104 V105 K111 T112Y104-M108 WeakPolarHBondContact O-CB 3.3Å; Y104-M108 VanDerWaalsContact O-CG 3.26Å; Y104-M108 WeakPolarHBondContact O-CG 3.46Å; Y104-M108 PolarHBondContact O-N 3.47Å; V105-M108 PolarHBondContact O-N 3.24Å; M108-K111 PolarHBondContact O-N 3.43Å; M108-T112 WeakPolarHBondContact O-CA 3.4Å; M108-T112 WeakPolarHBondContact O-CB 3.44Å; M108-T112 PolarHBondContact O-N 2.89Å; M108-T112 PolarHBondContact O-OG1 3.24Å
109E89.2Confident90.1Very high72 Ų7284.1 Ų84.134%0.33641%0.409SS..Hα-helixtrans-59.3-53.6175.2177.3179.4-140.500110.5Y95 V105 K111 T112 L113Y95-E109 PolarHBondContact OH-OE1 3.43Å; V105-E109 WeakPolarHBondContact O-CB 3.5Å; V105-E109 PolarHBondContact O-N 3.33Å; E109-K111 PolarHBondContact O-N 3.02Å; E109-T112 PolarHBondContact O-N 3.28Å; E109-L113 HydrophobicContact CG-CD1 4.05Å; E109-L113 WeakPolarHBondContact O-CB 3.27Å; E109-L113 WeakPolarHBondContact O-CG 3.35Å; E109-L113 PolarHBondContact O-N 3.34Å
110K87.8Confident90.1Very high149 Ų14983.9 Ų83.965%0.64841%0.407SS*.Hα-helixtrans-57.1-47.7177.2-74.2-176.7178.5-168.40112.1R106 Y107 W114R106-K110 WeakPolarHBondContact O-CB 3.4Å; R106-K110 WeakPolarHBondContact O-CG 3.4Å; R106-K110 PolarHBondContact O-N 2.88Å; Y107-K110 PolarHBondContact O-N 2.97Å; K110-W114 VanDerWaalsContact O-CB 3.28Å; K110-W114 WeakPolarHBondContact O-CB 3.46Å; K110-W114 PolarHBondContact O-N 3.45Å
111K89.9Confident89.9Confident57 Ų5778.9 Ų78.925%0.24837%0.373CS..Hα-helixtrans-68.9-37.4179.8-69.8-61.6-178.9-168.50112.5Y107 M108 E109 W114 C115Y107-K111 HydrophobicContact CD1-CG 4.48Å; Y107-K111 HydrophobicContact CD2-CG 4.36Å; Y107-K111 HydrophobicContact CE1-CG 4.04Å; Y107-K111 HydrophobicContact CE2-CD 4.42Å; Y107-K111 HydrophobicContact CE2-CG 3.91Å; Y107-K111 WeakPolarHBondContact O-CB 3.33Å; Y107-K111 WeakPolarHBondContact O-CG 3.38Å; Y107-K111 PolarHBondContact O-N 3.1Å; M108-K111 PolarHBondContact O-N 3.43Å; E109-K111 PolarHBondContact O-N 3.02Å; K111-W114 PolarHBondContact O-N 3.11Å; K111-C115 WeakPolarHBondContact O-CB 3.5Å; K111-C115 PolarHBondContact O-N 3.44Å; K111-C115 PolarHBondContact O-SG 2.66Å
112T91.3Very high90Very high86 Ų8675.8 Ų75.853%0.52836%0.359SS..Hα-helixtrans-66.3-46.2177.4-59.70000110.8M108 E109 W114 C115 A116M108-T112 WeakPolarHBondContact O-CA 3.4Å; M108-T112 WeakPolarHBondContact O-CB 3.44Å; M108-T112 PolarHBondContact O-N 2.89Å; M108-T112 PolarHBondContact O-OG1 3.24Å; E109-T112 PolarHBondContact O-N 3.28Å; T112-W114 VanDerWaalsContact C-N 3.32Å; T112-W114 PolarHBondContact O-N 3.34Å; T112-C115 PolarHBondContact O-N 3.34Å; T112-A116 VanDerWaalsContact O-CB 3.25Å; T112-A116 WeakPolarHBondContact O-CB 3.5Å; T112-A116 PolarHBondContact O-N 3.33Å
113L91.1Very high89.9Confident116 Ų11676.8 Ų76.861%0.60737%0.365SS*.Hα-helixtrans-62-41.3175.7-71.7173.7000111.4E109 A116 Y117E109-L113 HydrophobicContact CG-CD1 4.05Å; E109-L113 WeakPolarHBondContact O-CB 3.27Å; E109-L113 WeakPolarHBondContact O-CG 3.35Å; E109-L113 PolarHBondContact O-N 3.34Å; L113-A116 PolarHBondContact O-N 2.96Å; L113-Y117 WeakPolarHBondContact O-CB 3.32Å; L113-Y117 PolarHBondContact O-N 2.9Å
114W90.9Very high89.6Confident52 Ų5274.5 Ų74.520%0.19736%0.36CS..Hα-helixtrans-62-47.2175.1-170.3-115.1000112.3K110 K111 T112 Y117 W118 P165 E192K110-W114 VanDerWaalsContact O-CB 3.28Å; K110-W114 WeakPolarHBondContact O-CB 3.46Å; K110-W114 PolarHBondContact O-N 3.45Å; K111-W114 PolarHBondContact O-N 3.11Å; T112-W114 VanDerWaalsContact C-N 3.32Å; T112-W114 PolarHBondContact O-N 3.34Å; W114-Y117 WeakPolarHBondContact O-CB 3.47Å; W114-Y117 PolarHBondContact O-N 2.78Å; W114-W118 AromaticContact CD1-CD1 3.99Å; W114-W118 AromaticContact CD2-NE1 3.73Å; W114-W118 AromaticContact CE2-CD1 3.75Å; W114-W118 AromaticContact CE2-NE1 3.13Å; W114-W118 HydrophobicContact CH2-CZ2 4.4Å; W114-W118 AromaticContact CH2-NE1 3.76Å; W114-W118 AromaticContact CZ2-CE2 3.97Å; W114-W118 HydrophobicContact CZ2-CZ2 4.18Å; W114-W118 AromaticContact CZ2-NE1 3.16Å; W114-W118 AromaticContact NE1-CD1 3.75Å; W114-W118 AromaticContact NE1-NE1 3.47Å; W114-W118 PolarHBondContact O-N 3.45Å; W114-W118 VanDerWaalsContact O-N 3.16Å; W114-P165 HydrophobicContact CE3-CG 4.29Å; W114-P165 HydrophobicContact CH2-CB 3.85Å; W114-P165 HydrophobicContact CH2-CG 3.57Å; W114-P165 HydrophobicContact CZ2-CB 3.99Å; W114-P165 HydrophobicContact CZ2-CG 3.98Å; W114-P165 HydrophobicContact CZ3-CG 3.74Å; W114-E192 HydrophobicContact CZ2-CG 4.06Å; W114-E192 PolarHBondContact NE1-OE1 2.98Å
115C94.3Very high89.1Confident27 Ų2766.6 Ų66.618%0.18233%0.329CS..Hα-helixtrans-61.9-44.6174.9-70.60000111.8K111 T112 Y117 W118 V119 M195K111-C115 WeakPolarHBondContact O-CB 3.5Å; K111-C115 PolarHBondContact O-N 3.44Å; K111-C115 PolarHBondContact O-SG 2.66Å; T112-C115 PolarHBondContact O-N 3.34Å; C115-Y117 VanDerWaalsContact C-N 3.31Å; C115-Y117 PolarHBondContact O-N 3.49Å; C115-W118 PolarHBondContact O-N 3.46Å; C115-V119 WeakPolarHBondContact O-CB 3.34Å; C115-V119 VanDerWaalsContact O-CG2 3.3Å; C115-V119 WeakPolarHBondContact O-CG2 3.42Å; C115-V119 PolarHBondContact O-N 2.72Å; C115-M195 HydrophobicContact CB-CG 3.91Å; C115-M195 HydrophobicContact CB-SD 3.91Å
116A92.7Very high88.4Confident56 Ų5666 Ų6646%0.46333%0.327SS..Hα-helixtrans-62-39.1179.200000111.7T112 L113 G120T112-A116 VanDerWaalsContact O-CB 3.25Å; T112-A116 WeakPolarHBondContact O-CB 3.5Å; T112-A116 PolarHBondContact O-N 3.33Å; L113-A116 PolarHBondContact O-N 2.96Å; A116-G120 PolarHBondContact O-N 2.94Å
117Y91.7Very high87.3Confident112 Ų11263.5 Ų63.544%0.43933%0.327SS..Hα-helixtrans-59.2-51.9173.1175.2-102.1000111.5L113 W114 C115 G120 L121L113-Y117 WeakPolarHBondContact O-CB 3.32Å; L113-Y117 PolarHBondContact O-N 2.9Å; W114-Y117 WeakPolarHBondContact O-CB 3.47Å; W114-Y117 PolarHBondContact O-N 2.78Å; C115-Y117 VanDerWaalsContact C-N 3.31Å; C115-Y117 PolarHBondContact O-N 3.49Å; Y117-G120 PolarHBondContact O-N 3.26Å; Y117-L121 HydrophobicContact CD1-CD1 4.04Å; Y117-L121 HydrophobicContact CE1-CD1 3.41Å; Y117-L121 VanDerWaalsContact CE1-CD1 3.41Å; Y117-L121 HydrophobicContact CE1-CG 4.33Å; Y117-L121 HydrophobicContact CE2-CD1 4.04Å; Y117-L121 HydrophobicContact CE2-CG 4.26Å; Y117-L121 VanDerWaalsContact CZ-CD1 3.43Å; Y117-L121 WeakPolarHBondContact O-CG 3.49Å; Y117-L121 PolarHBondContact O-N 2.7Å
118W93.4Very high85.4Confident8 Ų858.9 Ų58.93%0.0332%0.319CS..Hα-helixtrans-66.1-39.9179.7-74.9108.8000113.2W114 C115 L121 G122 L140 H143 E192 M195 W196W114-W118 AromaticContact CD1-CD1 3.99Å; W114-W118 AromaticContact CD2-NE1 3.73Å; W114-W118 AromaticContact CE2-CD1 3.75Å; W114-W118 AromaticContact CE2-NE1 3.13Å; W114-W118 HydrophobicContact CH2-CZ2 4.4Å; W114-W118 AromaticContact CH2-NE1 3.76Å; W114-W118 AromaticContact CZ2-CE2 3.97Å; W114-W118 HydrophobicContact CZ2-CZ2 4.18Å; W114-W118 AromaticContact CZ2-NE1 3.16Å; W114-W118 AromaticContact NE1-CD1 3.75Å; W114-W118 AromaticContact NE1-NE1 3.47Å; W114-W118 PolarHBondContact O-N 3.45Å; W114-W118 VanDerWaalsContact O-N 3.16Å; C115-W118 PolarHBondContact O-N 3.46Å; W118-L121 HydrophobicContact CE3-CD1 4.35Å; W118-L121 HydrophobicContact CZ3-CD1 4.32Å; W118-G122 PolarHBondContact O-N 3.19Å; W118-L140 HydrophobicContact CE3-CD1 4.01Å; W118-L140 HydrophobicContact CH2-CB 4.4Å; W118-L140 HydrophobicContact CH2-CD1 3.86Å; W118-L140 HydrophobicContact CZ3-CB 3.75Å; W118-L140 HydrophobicContact CZ3-CD1 3.56Å; W118-L140 HydrophobicContact CZ3-CG 4.21Å; W118-H143 HydrophobicContact CH2-CB 3.92Å; W118-H143 HydrophobicContact CZ2-CB 4.26Å; W118-H143 AromaticContact CZ2-CD2 3.99Å; W118-H143 AromaticContact CZ2-CG 3.9Å; W118-E192 HydrophobicContact CD2-CB 3.98Å; W118-E192 HydrophobicContact CD2-CG 4.38Å; W118-E192 HydrophobicContact CG-CB 4.19Å; W118-E192 HydrophobicContact CG-CG 4.45Å; W118-E192 HydrophobicContact CZ2-CB 4.22Å; W118-E192 HydrophobicContact CZ2-CG 4.2Å; W118-E192 VanDerWaalsContact NE1-CG 3.33Å; W118-M195 HydrophobicContact CB-CB 3.7Å; W118-W196 HydrophobicContact CE3-CB 4.35Å; W118-W196 AromaticContact CE3-CE3 3.65Å; W118-W196 HydrophobicContact CE3-CE3 3.65Å; W118-W196 HydrophobicContact CE3-CZ3 4.3Å; W118-W196 AromaticContact CZ3-CE3 3.79Å; W118-W196 HydrophobicContact CZ3-CE3 3.79Å; W118-W196 HydrophobicContact CZ3-CZ3 4.07Å; W118-W196 WeakPolarHBondContact O-CA 3.37Å
119V93.6Very high83.3Confident31 Ų3159.3 Ų59.319%0.18832%0.323CS..Hα-helixtrans-61.8-47.3172.6170.70000110.5C115 G122 I123 M195 G199 I202C115-V119 WeakPolarHBondContact O-CB 3.34Å; C115-V119 VanDerWaalsContact O-CG2 3.3Å; C115-V119 WeakPolarHBondContact O-CG2 3.42Å; C115-V119 PolarHBondContact O-N 2.72Å; V119-G122 WeakPolarHBondContact O-CA 3.35Å; V119-G122 PolarHBondContact O-N 3.35Å; V119-G122 VanDerWaalsContact O-N 3.13Å; V119-I123 HydrophobicContact CG1-CD1 3.98Å; V119-I123 HydrophobicContact CG1-CG1 4.48Å; V119-I123 WeakPolarHBondContact O-CG1 3.34Å; V119-I123 PolarHBondContact O-N 3.38Å; V119-M195 WeakPolarHBondContact CA-O 3.49Å; V119-M195 HydrophobicContact CG2-CB 3.99Å; V119-M195 HydrophobicContact CG2-CG 4.49Å; V119-M195 WeakPolarHBondContact CG2-O 3.28Å; V119-M195 HydrophobicContact CG2-SD 3.99Å; V119-G199 VanDerWaalsContact O-CA 3.26Å; V119-G199 WeakPolarHBondContact O-CA 3.48Å; V119-I202 HydrophobicContact CG1-CD1 4.12Å
120G89.8Confident81.5Confident25 Ų2558.5 Ų58.526%0.25833%0.334SS..Hα-helixtrans-60-47.5179.500000112.2A116 Y117 G122 I123 L124A116-G120 PolarHBondContact O-N 2.94Å; Y117-G120 PolarHBondContact O-N 3.26Å; G120-G122 VanDerWaalsContact C-N 3.28Å; G120-G122 PolarHBondContact O-N 3.2Å; G120-I123 PolarHBondContact O-N 2.88Å; G120-L124 WeakPolarHBondContact O-CG 3.34Å; G120-L124 PolarHBondContact O-N 3.46Å
121L86.6Confident79.9Confident20 Ų2055.3 Ų55.311%0.10533%0.327CS..Hα-helixtrans-59.4-39.7173.2-71.8-178.2000112.2Y117 W118 L124 S125 Y139 W196Y117-L121 HydrophobicContact CD1-CD1 4.04Å; Y117-L121 HydrophobicContact CE1-CD1 3.41Å; Y117-L121 VanDerWaalsContact CE1-CD1 3.41Å; Y117-L121 HydrophobicContact CE1-CG 4.33Å; Y117-L121 HydrophobicContact CE2-CD1 4.04Å; Y117-L121 HydrophobicContact CE2-CG 4.26Å; Y117-L121 VanDerWaalsContact CZ-CD1 3.43Å; Y117-L121 WeakPolarHBondContact O-CG 3.49Å; Y117-L121 PolarHBondContact O-N 2.7Å; W118-L121 HydrophobicContact CE3-CD1 4.35Å; W118-L121 HydrophobicContact CZ3-CD1 4.32Å; L121-L124 PolarHBondContact O-N 2.94Å; L121-S125 WeakPolarHBondContact O-CB 3.4Å; L121-S125 PolarHBondContact O-N 2.88Å; L121-Y139 HydrophobicContact CD1-CD1 4.09Å; L121-Y139 HydrophobicContact CD1-CG 4.22Å; L121-Y139 HydrophobicContact CD2-CD1 4.46Å; L121-Y139 HydrophobicContact CD2-CE1 4.44Å; L121-W196 HydrophobicContact CB-CE3 3.71Å; L121-W196 HydrophobicContact CB-CH2 4.38Å; L121-W196 HydrophobicContact CB-CZ3 3.48Å; L121-W196 VanDerWaalsContact CB-CZ3 3.48Å; L121-W196 HydrophobicContact CD1-CE3 4.46Å; L121-W196 HydrophobicContact CD1-CZ3 3.96Å; L121-W196 HydrophobicContact CG-CZ3 4.35Å
122G89.1Confident78.5Confident0 Ų052.9 Ų52.90%032%0.319CS..Hα-helixtrans-60.4-44.7174.200000112.8W118 V119 G120 S125W118-G122 PolarHBondContact O-N 3.19Å; V119-G122 WeakPolarHBondContact O-CA 3.35Å; V119-G122 PolarHBondContact O-N 3.35Å; V119-G122 VanDerWaalsContact O-N 3.13Å; G120-G122 VanDerWaalsContact C-N 3.28Å; G120-G122 PolarHBondContact O-N 3.2Å; G122-S125 PolarHBondContact O-N 3.36Å; G122-S125 PolarHBondContact O-OG 2.96Å
123I87.1Confident77.3Confident52 Ų5253.7 Ų53.727%0.26732%0.319SS..Hα-helixtrans-61.7-51.3176.3-66.2167.1000110V119 G120 S125 S126 V127 G199 I202V119-I123 HydrophobicContact CG1-CD1 3.98Å; V119-I123 HydrophobicContact CG1-CG1 4.48Å; V119-I123 WeakPolarHBondContact O-CG1 3.34Å; V119-I123 PolarHBondContact O-N 3.38Å; G120-I123 PolarHBondContact O-N 2.88Å; I123-S125 PolarHBondContact O-N 3.31Å; I123-S126 PolarHBondContact O-N 3.02Å; I123-V127 HydrophobicContact CG2-CG2 4.05Å; I123-V127 WeakPolarHBondContact O-CG2 3.33Å; I123-V127 PolarHBondContact O-N 2.86Å; I123-G199 WeakPolarHBondContact CA-O 3.49Å; I123-G199 VanDerWaalsContact CG1-O 3.28Å; I123-G199 WeakPolarHBondContact CG1-O 3.46Å; I123-G199 PolarHBondContact N-O 3.22Å; I123-I202 HydrophobicContact CD1-CB 4.28Å; I123-I202 HydrophobicContact CD1-CG2 3.85Å; I123-I202 HydrophobicContact CG1-CB 3.99Å; I123-I202 HydrophobicContact CG1-CG2 3.94Å
124L81.8Confident76Confident122 Ų12252.8 Ų52.864%0.63931%0.311SS*.Hα-helixtrans-61.4-34-178.8-67.8172.8000112.2G120 L121 S126 G128G120-L124 WeakPolarHBondContact O-CG 3.34Å; G120-L124 PolarHBondContact O-N 3.46Å; L121-L124 PolarHBondContact O-N 2.94Å; L124-S126 PolarHBondContact O-N 3.14Å; L124-G128 PolarHBondContact O-N 2.99Å
125S77.5Confident75Confident2 Ų251.2 Ų51.21%0.01431%0.307CS..Hα-helixtrans-64.1-23.9176.977.70000114L121 G122 I123 T135 T200L121-S125 WeakPolarHBondContact O-CB 3.4Å; L121-S125 PolarHBondContact O-N 2.88Å; G122-S125 PolarHBondContact O-N 3.36Å; G122-S125 PolarHBondContact O-OG 2.96Å; I123-S125 PolarHBondContact O-N 3.31Å; S125-T135 VanDerWaalsContact CB-CB 3.49Å; S125-T200 WeakPolarHBondContact OG-CG2 3.35Å
126S73.9Confident74.2Confident22 Ų2250.2 Ų50.215%0.15430%0.3CS..Hα-helixtrans-98.7-42.1-176.6156.70000112.1I123 L124 G128 G203 E204I123-S126 PolarHBondContact O-N 3.02Å; L124-S126 PolarHBondContact O-N 3.14Å; S126-G128 VanDerWaalsContact C-N 3.35Å; S126-G128 PolarHBondContact O-N 3.48Å; S126-G203 PolarHBondContact OG-O 2.78Å; S126-E204 WeakPolarHBondContact OG-CG 3.4Å; S126-E204 PolarHBondContact OG-N 2.92Å
127V64.9Low73.2Confident95 Ų9552.4 Ų52.458%0.57630%0.304SS*.Hα-helixtrans-73.2-24.1-174.4177.20000112.8I123 G203I123-V127 HydrophobicContact CG2-CG2 4.05Å; I123-V127 WeakPolarHBondContact O-CG2 3.33Å; I123-V127 PolarHBondContact O-N 2.86Å; V127-G203 WeakPolarHBondContact CG2-O 3.37Å
128G48.3Very low72.1Confident32 Ų3251.7 Ų51.733%0.3331%0.307SS..THydrogen-bonded Turntrans-104.5-23.8-163.800000119.5L124 S126L124-G128 PolarHBondContact O-N 2.99Å; S126-G128 VanDerWaalsContact C-N 3.35Å; S126-G128 PolarHBondContact O-N 3.48Å
129L43.6Very low71.5Confident109 Ų10956 Ų5657%0.57132%0.324SS*.THydrogen-bonded Turntrans-150.59.2-167.7-76.7173.1000115.8T131L129-T131 PolarHBondContact O-N 3.35Å; L129-T131 PolarHBondContact O-OG1 3.46Å
130G51.4Low71Confident55 Ų5554.6 Ų54.657%0.56732%0.315SS*.SBendtrans64.2-10.7174.400000116.8
131T56.2Low70.6Confident82 Ų8253.7 Ų53.750%0.50331%0.306SS..  trans-12671.9-177.959.90000109.9L129 L133 H134L129-T131 PolarHBondContact O-N 3.35Å; L129-T131 PolarHBondContact O-OG1 3.46Å; T131-L133 PolarHBondContact O-N 3.07Å; T131-H134 PolarHBondContact O-N 2.96Å
132G60.4Low70.2Confident7 Ų755.3 Ų55.37%0.07232%0.318CS..Hα-helixtrans-54.3-10.4177.100000114.9F136 N270G132-F136 VanDerWaalsContact O-CB 3.3Å; G132-F136 WeakPolarHBondContact O-CB 3.26Å; G132-F136 PolarHBondContact O-N 2.75Å; G132-F136 VanDerWaalsContact O-N 3.16Å; G132-N270 PolarHBondContact N-ND2 3.08Å
133L65.9Low70Confident102 Ų10256.7 Ų56.753%0.53432%0.324SS..Hα-helixtrans-63.9-41.1166.7-174.466.1000113.1T131 F136 L137T131-L133 PolarHBondContact O-N 3.07Å; L133-F136 WeakPolarHBondContact O-CB 3.12Å; L133-F136 PolarHBondContact O-N 3.03Å; L133-L137 HydrophobicContact CG-CD1 4.35Å; L133-L137 WeakPolarHBondContact O-CG 3.48Å; L133-L137 PolarHBondContact O-N 2.84Å
134H62.8Low70Confident97 Ų9754.2 Ų54.245%0.44931%0.311SS..Hα-helixtrans-65.9-48.3-178-175.3-103000111T131 F136 L137 L138T131-H134 PolarHBondContact O-N 2.96Å; H134-F136 VanDerWaalsContact C-N 3.3Å; H134-F136 PolarHBondContact O-N 3.11Å; H134-L137 PolarHBondContact O-N 2.69Å; H134-L137 VanDerWaalsContact O-N 3.14Å; H134-L138 WeakPolarHBondContact O-CG 3.42Å; H134-L138 PolarHBondContact O-N 3.02Å; H134-L138 VanDerWaalsContact O-N 3.12Å
135T70.8Confident70Confident19 Ų1948.7 Ų48.712%0.11728%0.283CS..Hα-helixtrans-65.2-35.7177-35.20000111.5S125 L137 L138 Y139 W196S125-T135 VanDerWaalsContact CB-CB 3.49Å; T135-L137 VanDerWaalsContact C-N 3.35Å; T135-L137 PolarHBondContact O-N 2.93Å; T135-L138 PolarHBondContact O-N 3.26Å; T135-Y139 HydrophobicContact CG2-CD2 3.8Å; T135-Y139 HydrophobicContact CG2-CE2 4.02Å; T135-Y139 PolarHBondContact O-N 3.25Å; T135-Y139 VanDerWaalsContact O-N 3.1Å; T135-W196 HydrophobicContact CG2-CH2 3.82Å; T135-W196 HydrophobicContact CG2-CZ2 4.27Å; T135-W196 WeakPolarHBondContact O-CH2 3.35Å
136F77.7Confident70.1Confident6 Ų649.2 Ų49.23%0.02629%0.288CS..Hα-helixtrans-57.9-47.3171.6171.7-90.9000111.3G132 L133 H134 L138 Y139 L140 G141 I144 W196 M303 Q306 V310G132-F136 VanDerWaalsContact O-CB 3.3Å; G132-F136 WeakPolarHBondContact O-CB 3.26Å; G132-F136 PolarHBondContact O-N 2.75Å; G132-F136 VanDerWaalsContact O-N 3.16Å; L133-F136 WeakPolarHBondContact O-CB 3.12Å; L133-F136 PolarHBondContact O-N 3.03Å; H134-F136 VanDerWaalsContact C-N 3.3Å; H134-F136 PolarHBondContact O-N 3.11Å; F136-L138 PolarHBondContact O-N 3.2Å; F136-Y139 PolarHBondContact O-N 2.86Å; F136-L140 HydrophobicContact CD2-CB 3.93Å; F136-L140 HydrophobicContact CD2-CD2 3.82Å; F136-L140 HydrophobicContact CD2-CG 4.14Å; F136-L140 HydrophobicContact CE2-CB 4.15Å; F136-L140 HydrophobicContact CE2-CD2 3.68Å; F136-L140 HydrophobicContact CE2-CG 3.91Å; F136-L140 PolarHBondContact O-N 2.94Å; F136-G141 PolarHBondContact O-N 3.03Å; F136-I144 HydrophobicContact CE2-CD1 4.4Å; F136-I144 HydrophobicContact CZ-CD1 4.45Å; F136-W196 HydrophobicContact CB-CZ2 4.2Å; F136-M303 HydrophobicContact CE2-SD 4.44Å; F136-Q306 HydrophobicContact CE1-CB 4.49Å; F136-Q306 HydrophobicContact CE2-CB 4.05Å; F136-Q306 HydrophobicContact CZ-CB 3.88Å; F136-V310 HydrophobicContact CE1-CG2 3.81Å; F136-V310 HydrophobicContact CZ-CG2 3.79Å
137L70Confident70.8Confident103 Ų10348.2 Ų48.254%0.53928%0.281SS..Hα-helixtrans-66.6-20.6178.8-70.5173.5000113.8L133 H134 T135 P142L133-L137 HydrophobicContact CG-CD1 4.35Å; L133-L137 WeakPolarHBondContact O-CG 3.48Å; L133-L137 PolarHBondContact O-N 2.84Å; H134-L137 PolarHBondContact O-N 2.69Å; H134-L137 VanDerWaalsContact O-N 3.14Å; T135-L137 VanDerWaalsContact C-N 3.35Å; T135-L137 PolarHBondContact O-N 2.93Å; L137-P142 WeakPolarHBondContact O-CD 3.35Å; L137-P142 WeakPolarHBondContact O-CG 3.47Å
138L69.7Low71.8Confident96 Ų9643.7 Ų43.750%0.50325%0.253SS..Hα-helixtrans-88.6-32.2179.1-72.7179.7000114H134 T135 F136H134-L138 WeakPolarHBondContact O-CG 3.42Å; H134-L138 PolarHBondContact O-N 3.02Å; H134-L138 VanDerWaalsContact O-N 3.12Å; T135-L138 PolarHBondContact O-N 3.26Å; F136-L138 PolarHBondContact O-N 3.2Å
139Y80.2Confident73.3Confident100 Ų10042.9 Ų42.939%0.39224%0.241SC..THydrogen-bonded Turntrans-119.3-67.2-172.5-66.1-85.5000112.4L121 T135 F136 H143 W196L121-Y139 HydrophobicContact CD1-CD1 4.09Å; L121-Y139 HydrophobicContact CD1-CG 4.22Å; L121-Y139 HydrophobicContact CD2-CD1 4.46Å; L121-Y139 HydrophobicContact CD2-CE1 4.44Å; T135-Y139 HydrophobicContact CG2-CD2 3.8Å; T135-Y139 HydrophobicContact CG2-CE2 4.02Å; T135-Y139 PolarHBondContact O-N 3.25Å; T135-Y139 VanDerWaalsContact O-N 3.1Å; F136-Y139 PolarHBondContact O-N 2.86Å; Y139-H143 PolarHBondContact O-N 3.23Å; Y139-W196 HydrophobicContact CD2-CH2 4.42Å; Y139-W196 HydrophobicContact CG-CZ3 4.48Å
140L84.3Confident75.1Confident0 Ų038.2 Ų38.20%022%0.219CC..Hα-helixtrans-72.3-41-172.8-177.160.5000112.9W118 F136 H143 I144 E192 W196 M303W118-L140 HydrophobicContact CE3-CD1 4.01Å; W118-L140 HydrophobicContact CH2-CB 4.4Å; W118-L140 HydrophobicContact CH2-CD1 3.86Å; W118-L140 HydrophobicContact CZ3-CB 3.75Å; W118-L140 HydrophobicContact CZ3-CD1 3.56Å; W118-L140 HydrophobicContact CZ3-CG 4.21Å; F136-L140 HydrophobicContact CD2-CB 3.93Å; F136-L140 HydrophobicContact CD2-CD2 3.82Å; F136-L140 HydrophobicContact CD2-CG 4.14Å; F136-L140 HydrophobicContact CE2-CB 4.15Å; F136-L140 HydrophobicContact CE2-CD2 3.68Å; F136-L140 HydrophobicContact CE2-CG 3.91Å; F136-L140 PolarHBondContact O-N 2.94Å; L140-H143 PolarHBondContact O-N 2.97Å; L140-I144 HydrophobicContact CD1-CD1 3.99Å; L140-I144 HydrophobicContact CD1-CG1 4.11Å; L140-I144 HydrophobicContact CD2-CD1 4.32Å; L140-I144 HydrophobicContact CG-CD1 3.74Å; L140-I144 HydrophobicContact CG-CG1 4.31Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.35Å; L140-I144 PolarHBondContact O-N 3.45Å; L140-E192 HydrophobicContact CD1-CB 4.24Å; L140-W196 HydrophobicContact CB-CD2 4.12Å; L140-W196 HydrophobicContact CB-CE3 4.09Å; L140-W196 HydrophobicContact CB-CZ3 4.22Å; L140-W196 HydrophobicContact CD2-CB 3.82Å; L140-W196 HydrophobicContact CD2-CD2 4.08Å; L140-W196 HydrophobicContact CD2-CG 3.7Å; L140-M303 HydrophobicContact CD2-CE 3.16Å; L140-M303 HydrophobicContact CD2-SD 3.69Å
141G80.7Confident76.9Confident6 Ų635.6 Ų35.66%0.06219%0.192CC..Hα-helixtrans-57.2-53.5177.700000112.4F136 H143 I144 A145F136-G141 PolarHBondContact O-N 3.03Å; G141-H143 VanDerWaalsContact C-N 3.34Å; G141-H143 PolarHBondContact O-N 3.38Å; G141-I144 PolarHBondContact O-N 3.3Å; G141-A145 WeakPolarHBondContact O-CB 3.19Å; G141-A145 PolarHBondContact O-N 3.33Å
142P78.4Confident78.1Confident55 Ų5535.3 Ų35.336%0.35718%0.182SC..Hα-helixtrans-58.8-40.3175-28.837.5000113.3L137 A145 A146L137-P142 WeakPolarHBondContact O-CD 3.35Å; L137-P142 WeakPolarHBondContact O-CG 3.47Å; P142-A145 PolarHBondContact O-N 2.89Å; P142-A146 WeakPolarHBondContact O-CB 3.2Å; P142-A146 PolarHBondContact O-N 2.92Å
143H83.7Confident79.1Confident28 Ų2838.8 Ų38.813%0.1320%0.196CC..Hα-helixtrans-61-47175178.476.3000112.2W118 Y139 L140 G141 A145 A146 V147W118-H143 HydrophobicContact CH2-CB 3.92Å; W118-H143 HydrophobicContact CZ2-CB 4.26Å; W118-H143 AromaticContact CZ2-CD2 3.99Å; W118-H143 AromaticContact CZ2-CG 3.9Å; Y139-H143 PolarHBondContact O-N 3.23Å; L140-H143 PolarHBondContact O-N 2.97Å; G141-H143 VanDerWaalsContact C-N 3.34Å; G141-H143 PolarHBondContact O-N 3.38Å; H143-A145 VanDerWaalsContact C-N 3.34Å; H143-A145 PolarHBondContact O-N 3.17Å; H143-A146 PolarHBondContact O-N 3.47Å; H143-V147 WeakPolarHBondContact O-CG2 3.33Å; H143-V147 PolarHBondContact O-N 2.84Å
144I87.8Confident79.9Confident0 Ų034.4 Ų34.40%017%0.174CC..Hα-helixtrans-62.8-42.8176.7-66.4166.1000110.6F136 L140 G141 V147 T148 V189 K307 V310 I311F136-I144 HydrophobicContact CE2-CD1 4.4Å; F136-I144 HydrophobicContact CZ-CD1 4.45Å; L140-I144 HydrophobicContact CD1-CD1 3.99Å; L140-I144 HydrophobicContact CD1-CG1 4.11Å; L140-I144 HydrophobicContact CD2-CD1 4.32Å; L140-I144 HydrophobicContact CG-CD1 3.74Å; L140-I144 HydrophobicContact CG-CG1 4.31Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.35Å; L140-I144 PolarHBondContact O-N 3.45Å; G141-I144 PolarHBondContact O-N 3.3Å; I144-V147 PolarHBondContact O-N 3.03Å; I144-T148 VanDerWaalsContact O-CB 3.31Å; I144-T148 WeakPolarHBondContact O-CB 3.46Å; I144-T148 PolarHBondContact O-N 3.15Å; I144-T148 PolarHBondContact O-OG1 3.45Å; I144-V189 HydrophobicContact CG1-CB 4.26Å; I144-V189 HydrophobicContact CG1-CG1 4.44Å; I144-V189 HydrophobicContact CG1-CG2 4.2Å; I144-V189 HydrophobicContact CG2-CG2 4.47Å; I144-K307 HydrophobicContact CD1-CB 3.78Å; I144-V310 HydrophobicContact CB-CG1 4.01Å; I144-V310 HydrophobicContact CG2-CB 4.05Å; I144-V310 HydrophobicContact CG2-CG1 3.7Å; I144-I311 HydrophobicContact CG2-CD1 4.3Å; I144-I311 HydrophobicContact CG2-CG1 3.65Å
145A81.9Confident80.9Confident7 Ų731.8 Ų31.86%0.05817%0.173CC..Hα-helixtrans-61.7-44.6177.500000111.5G141 P142 H143 T148 L149 V310 F314G141-A145 WeakPolarHBondContact O-CB 3.19Å; G141-A145 PolarHBondContact O-N 3.33Å; P142-A145 PolarHBondContact O-N 2.89Å; H143-A145 VanDerWaalsContact C-N 3.34Å; H143-A145 PolarHBondContact O-N 3.17Å; A145-T148 WeakPolarHBondContact O-CB 3.31Å; A145-T148 PolarHBondContact O-N 2.96Å; A145-L149 WeakPolarHBondContact O-CB 3.43Å; A145-L149 WeakPolarHBondContact O-CG 3.45Å; A145-L149 PolarHBondContact O-N 2.84Å; A145-V310 HydrophobicContact CB-CG1 4.24Å; A145-F314 HydrophobicContact CB-CD1 3.91Å; A145-F314 HydrophobicContact CB-CD2 3.76Å; A145-F314 HydrophobicContact CB-CE1 3.93Å; A145-F314 HydrophobicContact CB-CE2 3.79Å; A145-F314 HydrophobicContact CB-CG 3.83Å; A145-F314 HydrophobicContact CB-CZ 3.88Å
146A80.5Confident81.7Confident13 Ų1332.5 Ų32.511%0.10718%0.179CC..Hα-helixtrans-60.9-48177.900000112.2P142 H143 T148 L149 A150 I168 L353P142-A146 WeakPolarHBondContact O-CB 3.2Å; P142-A146 PolarHBondContact O-N 2.92Å; H143-A146 PolarHBondContact O-N 3.47Å; A146-T148 VanDerWaalsContact C-N 3.31Å; A146-T148 PolarHBondContact O-N 2.93Å; A146-L149 PolarHBondContact O-N 3Å; A146-A150 VanDerWaalsContact O-CB 3.3Å; A146-A150 WeakPolarHBondContact O-CB 3.42Å; A146-A150 PolarHBondContact O-N 3.24Å; A146-I168 HydrophobicContact CB-CD1 4.16Å; A146-L353 HydrophobicContact CB-CD1 3.8Å; A146-L353 HydrophobicContact CB-CD2 3.68Å; A146-L353 HydrophobicContact CB-CG 4.36Å
147V88Confident82.1Confident0 Ų032.9 Ų32.90%018%0.182CC..Hα-helixtrans-62.4-39.1175.6169.50000111.5H143 I144 A151 F159 I168 K188 V189H143-V147 WeakPolarHBondContact O-CG2 3.33Å; H143-V147 PolarHBondContact O-N 2.84Å; I144-V147 PolarHBondContact O-N 3.03Å; V147-A151 WeakPolarHBondContact O-CB 3.48Å; V147-A151 PolarHBondContact O-N 3.28Å; V147-F159 HydrophobicContact CG1-CE2 4.05Å; V147-F159 HydrophobicContact CG1-CZ 4.44Å; V147-F159 HydrophobicContact CG2-CE2 4.46Å; V147-I168 HydrophobicContact CG2-CD1 4Å; V147-K188 HydrophobicContact CG1-CB 4.49Å; V147-K188 HydrophobicContact CG1-CG 3.92Å; V147-V189 HydrophobicContact CB-CG1 3.82Å; V147-V189 HydrophobicContact CG1-CG1 3.56Å; V147-V189 HydrophobicContact CG2-CG1 4.15Å
148T86.4Confident83Confident0 Ų034.5 Ų34.50%019%0.186CC..Hα-helixtrans-64.7-48.3178.4-58.80000111.5I144 A145 A146 A151 Y152 I185 I311 F314I144-T148 VanDerWaalsContact O-CB 3.31Å; I144-T148 WeakPolarHBondContact O-CB 3.46Å; I144-T148 PolarHBondContact O-N 3.15Å; I144-T148 PolarHBondContact O-OG1 3.45Å; A145-T148 WeakPolarHBondContact O-CB 3.31Å; A145-T148 PolarHBondContact O-N 2.96Å; A146-T148 VanDerWaalsContact C-N 3.31Å; A146-T148 PolarHBondContact O-N 2.93Å; T148-A151 PolarHBondContact O-N 2.8Å; T148-Y152 HydrophobicContact CG2-CD2 3.95Å; T148-Y152 HydrophobicContact CG2-CE2 3.68Å; T148-Y152 WeakPolarHBondContact O-CD2 3.41Å; T148-Y152 PolarHBondContact O-N 2.74Å; T148-Y152 VanDerWaalsContact O-N 3.14Å; T148-I185 HydrophobicContact CG2-CD1 4.13Å; T148-I311 HydrophobicContact CG2-CG2 4.13Å; T148-F314 HydrophobicContact CG2-CB 4.17Å
149L79.3Confident83.8Confident16 Ų1630.3 Ų30.38%0.08416%0.164CC..Hα-helixtrans-63.1-48.8178.8-72.5173.3000111.1A145 A146 A151 Y152 E153 F314 K350 L353A145-L149 WeakPolarHBondContact O-CB 3.43Å; A145-L149 WeakPolarHBondContact O-CG 3.45Å; A145-L149 PolarHBondContact O-N 2.84Å; A146-L149 PolarHBondContact O-N 3Å; L149-A151 VanDerWaalsContact C-N 3.29Å; L149-A151 PolarHBondContact O-N 2.65Å; L149-Y152 PolarHBondContact O-N 3.44Å; L149-E153 WeakPolarHBondContact O-CG 3.39Å; L149-E153 PolarHBondContact O-N 2.95Å; L149-F314 HydrophobicContact CD1-CD1 4.33Å; L149-F314 HydrophobicContact CG-CD1 4.47Å; L149-K350 HydrophobicContact CD1-CB 4.47Å; L149-L353 HydrophobicContact CD1-CD2 4.16Å
150A82.1Confident84Confident11 Ų1128 Ų289%0.09116%0.161CC..Hα-helixtrans-63.3-36.9178.800000111.9A146 E153 C154 F159 I168A146-A150 VanDerWaalsContact O-CB 3.3Å; A146-A150 WeakPolarHBondContact O-CB 3.42Å; A146-A150 PolarHBondContact O-N 3.24Å; A150-E153 PolarHBondContact O-N 2.81Å; A150-C154 VanDerWaalsContact O-CB 3.22Å; A150-C154 WeakPolarHBondContact O-CB 3.39Å; A150-C154 PolarHBondContact O-N 3.4Å; A150-C154 PolarHBondContact O-SG 3.01Å; A150-F159 HydrophobicContact CB-CE1 3.89Å; A150-F159 HydrophobicContact CB-CZ 3.91Å; A150-I168 HydrophobicContact CB-CB 4.06Å; A150-I168 HydrophobicContact CB-CD1 4.02Å; A150-I168 HydrophobicContact CB-CG2 3.41Å; A150-I168 VanDerWaalsContact CB-CG2 3.41Å
151A87.4Confident83.8Confident0 Ų033.8 Ų33.80%019%0.189CC..Hα-helixtrans-56.3-58.7173.100000109.7V147 T148 L149 E153 C154 G155 S156 V157 I180 I185V147-A151 WeakPolarHBondContact O-CB 3.48Å; V147-A151 PolarHBondContact O-N 3.28Å; T148-A151 PolarHBondContact O-N 2.8Å; L149-A151 VanDerWaalsContact C-N 3.29Å; L149-A151 PolarHBondContact O-N 2.65Å; A151-E153 VanDerWaalsContact C-N 3.28Å; A151-E153 PolarHBondContact O-N 3.23Å; A151-C154 PolarHBondContact O-N 3.43Å; A151-G155 PolarHBondContact O-N 2.74Å; A151-S156 WeakPolarHBondContact CA-O 3.45Å; A151-S156 PolarHBondContact O-N 3.07Å; A151-V157 HydrophobicContact CB-CG1 3.9Å; A151-I180 HydrophobicContact CB-CD1 3.87Å; A151-I180 HydrophobicContact CB-CG2 4.38Å; A151-I180 WeakPolarHBondContact O-CD1 3.42Å; A151-I185 HydrophobicContact CB-CD1 4.03Å; A151-I185 HydrophobicContact CB-CG1 4Å
152Y82.7Confident83.4Confident75 Ų7539.3 Ų39.329%0.29422%0.223SC..Hα-helixtrans-60.2-33.2-178.9-73.9-61000114.2T148 L149 I180 I185 S315T148-Y152 HydrophobicContact CG2-CD2 3.95Å; T148-Y152 HydrophobicContact CG2-CE2 3.68Å; T148-Y152 WeakPolarHBondContact O-CD2 3.41Å; T148-Y152 PolarHBondContact O-N 2.74Å; T148-Y152 VanDerWaalsContact O-N 3.14Å; L149-Y152 PolarHBondContact O-N 3.44Å; Y152-I180 HydrophobicContact CE1-CB 4.46Å; Y152-I185 HydrophobicContact CD2-CD1 4.26Å; Y152-I185 HydrophobicContact CE1-CD1 4.45Å; Y152-I185 HydrophobicContact CE2-CD1 3.67Å; Y152-S315 WeakPolarHBondContact CE2-OG 3.34Å; Y152-S315 WeakPolarHBondContact OH-CB 3.4Å; Y152-S315 PolarHBondContact OH-OG 3.17Å
153E80.1Confident83.3Confident81 Ų8139.1 Ų39.138%0.37922%0.222SC..Hα-helixtrans-73-43.5176.7-72.8179.6174.700112.6L149 A150 A151 K350 H354L149-E153 WeakPolarHBondContact O-CG 3.39Å; L149-E153 PolarHBondContact O-N 2.95Å; A150-E153 PolarHBondContact O-N 2.81Å; A151-E153 VanDerWaalsContact C-N 3.28Å; A151-E153 PolarHBondContact O-N 3.23Å; E153-K350 WeakPolarHBondContact OE1-CE 3.37Å; E153-K350 IonicContact OE1-NZ 2.63Å; E153-K350 PolarHBondContact OE1-NZ 3.16Å; E153-H354 IonicContact OE1-NE2 2.75Å; E153-H354 IonicContact OE2-CE1 3.75Å; E153-H354 PolarHBondContact OE2-CE1 3.33Å; E153-H354 IonicContact OE2-NE2 3.11Å; E153-H354 PolarHBondContact OE2-NE2 2.87Å
154C83.3Confident82.9Confident10 Ų1038.7 Ų38.77%0.06822%0.219CC..Hα-helixtrans-83.6-14.7-176.7-56.80000113.6A150 A151 S156 C170A150-C154 VanDerWaalsContact O-CB 3.22Å; A150-C154 WeakPolarHBondContact O-CB 3.39Å; A150-C154 PolarHBondContact O-N 3.4Å; A150-C154 PolarHBondContact O-SG 3.01Å; A151-C154 PolarHBondContact O-N 3.43Å; C154-S156 PolarHBondContact O-N 2.84Å; C154-C170 WeakPolarHBondContact CA-SG 3.38Å; C154-C170 HydrophobicContact CB-CB 3.72Å; C154-C170 WeakPolarHBondContact CB-SG 3.3Å; C154-C170 WeakPolarHBondContact SG-CA 3.28Å; C154-C170 WeakPolarHBondContact SG-CB 3.4Å; C154-C170 CovalentContact SG-SG 2.04Å; C154-C170 PolarHBondContact SG-SG 2.96Å
155G84.5Confident82.2Confident42 Ų4240.8 Ų40.843%0.43323%0.233SC..THydrogen-bonded Turntrans69.712.6-171.400000113.5A151A151-G155 PolarHBondContact O-N 2.74Å
156S86.8Confident81.8Confident33 Ų3347 Ų4723%0.23127%0.265CS..  trans-154.9154.2-174.2-176.90000112.2A151 C154 E158A151-S156 WeakPolarHBondContact CA-O 3.45Å; A151-S156 PolarHBondContact O-N 3.07Å; C154-S156 PolarHBondContact O-N 2.84Å; S156-E158 WeakPolarHBondContact OG-CB 3.4Å; S156-E158 PolarHBondContact OG-N 3.3Å
157V86.6Confident81.6Confident15 Ų1550.3 Ų50.39%0.09128%0.278CS..SBendtrans-102.5-0.2168.6-63.10000113A151 F159 T184 I185 K188A151-V157 HydrophobicContact CB-CG1 3.9Å; V157-F159 PolarHBondContact O-N 3.45Å; V157-T184 HydrophobicContact CB-CG2 4.41Å; V157-T184 HydrophobicContact CG1-CG2 3.9Å; V157-T184 HydrophobicContact CG2-CG2 3.6Å; V157-I185 HydrophobicContact CG1-CG1 4.41Å; V157-K188 HydrophobicContact CB-CB 4.13Å; V157-K188 HydrophobicContact CB-CD 4.24Å; V157-K188 HydrophobicContact CB-CG 4.05Å; V157-K188 HydrophobicContact CG1-CB 4.29Å; V157-K188 WeakPolarHBondContact O-CE 3.42Å; V157-K188 PolarHBondContact O-NZ 3.21Å
158E88.1Confident81.3Confident136 Ų13652.2 Ų52.264%0.63629%0.288SS*.  trans-85.883.8176.2-64.8-61.1150.900109S156S156-E158 WeakPolarHBondContact OG-CB 3.4Å; S156-E158 PolarHBondContact OG-N 3.3Å
159F87.5Confident81.1Confident9 Ų955.4 Ų55.44%0.03931%0.307CS..  trans-82.6134175.3-49.7-55.7000109.8V147 A150 V157 Y164 I168V147-F159 HydrophobicContact CG1-CE2 4.05Å; V147-F159 HydrophobicContact CG1-CZ 4.44Å; V147-F159 HydrophobicContact CG2-CE2 4.46Å; A150-F159 HydrophobicContact CB-CE1 3.89Å; A150-F159 HydrophobicContact CB-CZ 3.91Å; V157-F159 PolarHBondContact O-N 3.45Å; F159-Y164 HydrophobicContact CB-CD2 3.64Å; F159-Y164 HydrophobicContact CB-CE2 4.2Å; F159-Y164 HydrophobicContact CB-CG 3.87Å; F159-Y164 AromaticContact CD2-CD2 3.63Å; F159-Y164 HydrophobicContact CD2-CD2 3.63Å; F159-Y164 AromaticContact CD2-CE2 3.28Å; F159-Y164 HydrophobicContact CD2-CE2 3.28Å; F159-Y164 HydrophobicContact CD2-CG 4.46Å; F159-Y164 AromaticContact CD2-CZ 3.82Å; F159-Y164 AromaticContact CE2-CE2 3.97Å; F159-Y164 HydrophobicContact CE2-CE2 3.97Å; F159-Y164 AromaticContact CG-CD2 3.97Å; F159-Y164 HydrophobicContact CG-CD2 3.97Å; F159-Y164 HydrophobicContact CG-CE2 4.09Å; F159-I168 HydrophobicContact CB-CG2 4.27Å; F159-I168 HydrophobicContact CD1-CG2 3.29Å; F159-I168 HydrophobicContact CD2-CG2 3.9Å; F159-I168 HydrophobicContact CE1-CG2 3.42Å; F159-I168 VanDerWaalsContact CE1-CG2 3.42Å; F159-I168 HydrophobicContact CE2-CG2 3.99Å; F159-I168 HydrophobicContact CG-CG2 3.54Å; F159-I168 HydrophobicContact CZ-CG2 3.76Å
160P83.5Confident81.2Confident51 Ų5157.3 Ų57.333%0.33132%0.322SS..  trans-66.7133.5-179.928.1-30.9000111.3Y164 V169P160-Y164 WeakPolarHBondContact O-CB 3.28Å; P160-V169 WeakPolarHBondContact CD-O 3.41Å; P160-V169 HydrophobicContact CG-CB 4.28Å
161E80.5Confident81.3Confident122 Ų12258.5 Ų58.557%0.5733%0.328SS*.THydrogen-bonded Turntrans-106.8127.4173.1-68.9-178.2-173.400109.3Y164E161-Y164 HydrophobicContact CG-CD1 3.99Å
162P72.8Confident80.5Confident122 Ų12268.3 Ų68.379%0.79237%0.374SS*.THydrogen-bonded Turncis-79.5158.9-8.133.6-33.9000112.7
163P75.9Confident79.7Confident50 Ų5073.7 Ų73.733%0.32540%0.402SS..THydrogen-bonded Turncis-1048.718.839.1-36.9000116.9D166 Q167 V169P163-D166 PolarHBondContact O-N 3.44Å; P163-D166 VanDerWaalsContact O-N 3.16Å; P163-Q167 HydrophobicContact CB-CB 4.21Å; P163-Q167 HydrophobicContact CG-CB 3.85Å; P163-Q167 PolarHBondContact O-N 3.1Å; P163-V169 HydrophobicContact CG-CG2 3.93Å
164Y74.8Confident78.6Confident20 Ų2073.1 Ų73.18%0.07841%0.411CS..THydrogen-bonded Turntrans-60.9137.4174.9-176.6-95.6000111F159 P160 E161 Q167 I168 K188F159-Y164 HydrophobicContact CB-CD2 3.64Å; F159-Y164 HydrophobicContact CB-CE2 4.2Å; F159-Y164 HydrophobicContact CB-CG 3.87Å; F159-Y164 AromaticContact CD2-CD2 3.63Å; F159-Y164 HydrophobicContact CD2-CD2 3.63Å; F159-Y164 AromaticContact CD2-CE2 3.28Å; F159-Y164 HydrophobicContact CD2-CE2 3.28Å; F159-Y164 HydrophobicContact CD2-CG 4.46Å; F159-Y164 AromaticContact CD2-CZ 3.82Å; F159-Y164 AromaticContact CE2-CE2 3.97Å; F159-Y164 HydrophobicContact CE2-CE2 3.97Å; F159-Y164 AromaticContact CG-CD2 3.97Å; F159-Y164 HydrophobicContact CG-CD2 3.97Å; F159-Y164 HydrophobicContact CG-CE2 4.09Å; P160-Y164 WeakPolarHBondContact O-CB 3.28Å; E161-Y164 HydrophobicContact CG-CD1 3.99Å; Y164-Q167 WeakPolarHBondContact CA-O 3.45Å; Y164-Q167 PolarHBondContact N-O 3.41Å; Y164-I168 HydrophobicContact CD2-CG1 4.09Å; Y164-I168 HydrophobicContact CE2-CG1 4.17Å; Y164-K188 VanDerWaalsContact OH-CE 3.23Å; Y164-K188 WeakPolarHBondContact OH-CE 3.25Å
165P73.8Confident77.2Confident43 Ų4375.7 Ų75.728%0.27944%0.44SS..THydrogen-bonded Turncis-92.7-2.114.636.7-36.5000116.9W114W114-P165 HydrophobicContact CE3-CG 4.29Å; W114-P165 HydrophobicContact CH2-CB 3.85Å; W114-P165 HydrophobicContact CH2-CG 3.57Å; W114-P165 HydrophobicContact CZ2-CB 3.99Å; W114-P165 HydrophobicContact CZ2-CG 3.98Å; W114-P165 HydrophobicContact CZ3-CG 3.74Å
166D73.9Confident75.8Confident137 Ų13782.2 Ų82.273%0.73346%0.463SS*.THydrogen-bonded Turntrans-74.3-34.5-173.4-59-39.9000112.3P163P163-D166 PolarHBondContact O-N 3.44Å; P163-D166 VanDerWaalsContact O-N 3.16Å
167Q76.6Confident74.1Confident84 Ų8490 Ų9039%0.39350%0.496SS..SBendtrans-133.2133174-66.7177-2.100109.6P163 Y164P163-Q167 HydrophobicContact CB-CB 4.21Å; P163-Q167 HydrophobicContact CG-CB 3.85Å; P163-Q167 PolarHBondContact O-N 3.1Å; Y164-Q167 WeakPolarHBondContact CA-O 3.45Å; Y164-Q167 PolarHBondContact N-O 3.41Å
168I80.4Confident72.8Confident39 Ų3991.6 Ų91.620%0.252%0.515CS..  trans-97.9113179.8-50.4178.6000109.1A146 V147 A150 F159 Y164A146-I168 HydrophobicContact CB-CD1 4.16Å; V147-I168 HydrophobicContact CG2-CD1 4Å; A150-I168 HydrophobicContact CB-CB 4.06Å; A150-I168 HydrophobicContact CB-CD1 4.02Å; A150-I168 HydrophobicContact CB-CG2 3.41Å; A150-I168 VanDerWaalsContact CB-CG2 3.41Å; F159-I168 HydrophobicContact CB-CG2 4.27Å; F159-I168 HydrophobicContact CD1-CG2 3.29Å; F159-I168 HydrophobicContact CD2-CG2 3.9Å; F159-I168 HydrophobicContact CE1-CG2 3.42Å; F159-I168 VanDerWaalsContact CE1-CG2 3.42Å; F159-I168 HydrophobicContact CE2-CG2 3.99Å; F159-I168 HydrophobicContact CG-CG2 3.54Å; F159-I168 HydrophobicContact CZ-CG2 3.76Å; Y164-I168 HydrophobicContact CD2-CG1 4.09Å; Y164-I168 HydrophobicContact CE2-CG1 4.17Å
169V81.7Confident71.9Confident67 Ų6791 Ų9141%0.40653%0.526SS..  trans-111.4140.1178.4-175.20000109P160 P163P160-V169 WeakPolarHBondContact CD-O 3.41Å; P160-V169 HydrophobicContact CG-CB 4.28Å; P163-V169 HydrophobicContact CG-CG2 3.93Å
170C83Confident71.6Confident57 Ų5792 Ų9239%0.38553%0.532SS..  trans-73.6143175.8-62.70000111.6C154C154-C170 WeakPolarHBondContact CA-SG 3.38Å; C154-C170 HydrophobicContact CB-CB 3.72Å; C154-C170 WeakPolarHBondContact CB-SG 3.3Å; C154-C170 WeakPolarHBondContact SG-CA 3.28Å; C154-C170 WeakPolarHBondContact SG-CB 3.4Å; C154-C170 CovalentContact SG-SG 2.04Å; C154-C170 PolarHBondContact SG-SG 2.96Å
171P82.4Confident71.7Confident36 Ų3692 Ų9223%0.23453%0.533CS..  trans-64.8144.5173.627.5-33.7000111.2Q173 A174P171-Q173 PolarHBondContact O-N 2.88Å; P171-A174 PolarHBondContact O-N 3.38Å
172Q71.4Confident72Confident206 Ų20688.3 Ų88.396%0.96352%0.517SS*.THydrogen-bonded Turntrans-65.2-20-176.2-67.9176.2-6.100114A174Q172-A174 PolarHBondContact O-N 3.37Å
173Q66.6Low72.7Confident187 Ų18790 Ų9087%0.87451%0.508SS*.THydrogen-bonded Turntrans-97.239.6177.2-70.2173.1-19.500112.4P171 G175P171-Q173 PolarHBondContact O-N 2.88Å; Q173-G175 PolarHBondContact O-N 3.27Å
174A57.3Low73.4Confident69 Ų6990.3 Ų90.357%0.5751%0.509SS*.THydrogen-bonded Turntrans-73.174.3173.400000110.6P171 Q172P171-A174 PolarHBondContact O-N 3.38Å; Q172-A174 PolarHBondContact O-N 3.37Å
175G53.2Low74.1Confident65 Ų6589.3 Ų89.367%0.6751%0.505SS*.THydrogen-bonded Turntrans-149.7-7-175.200000117.2Q173Q173-G175 PolarHBondContact O-N 3.27Å
176L54.5Low75Confident178 Ų17887.4 Ų87.493%0.93249%0.492SS*.SBendtrans-121.691.6176.6-85.8141.8000109.5G178L176-G178 PolarHBondContact O-N 3.23Å
177Q52.6Low75.8Confident197 Ų19782.9 Ų82.992%0.92147%0.471SS*.PPolyproline II helixtrans-60117.1-172.4-70.1175.4-32.200113.2
178G57.5Low76.6Confident48 Ų4881.3 Ų81.350%0.49546%0.463SS..PPolyproline II helixtrans-99.6136.714200000108.5L176 I180L176-G178 PolarHBondContact O-N 3.23Å; G178-I180 PolarHBondContact O-N 2.83Å
179S69.4Low77.2Confident123 Ų12379.5 Ų79.586%0.8645%0.454SS*.PPolyproline II helixtrans-61.4124.9166.350.50000108.6S181S179-S181 PolarHBondContact O-N 3.46Å; S179-S181 VanDerWaalsContact O-N 3.12Å
180I82.4Confident77.8Confident30 Ų3081.4 Ų81.415%0.15445%0.454CS..  trans-72.1114.3178.9-60.5178.8000108.6A151 Y152 G178 I185A151-I180 HydrophobicContact CB-CD1 3.87Å; A151-I180 HydrophobicContact CB-CG2 4.38Å; A151-I180 WeakPolarHBondContact O-CD1 3.42Å; Y152-I180 HydrophobicContact CE1-CB 4.46Å; G178-I180 PolarHBondContact O-N 2.83Å; I180-I185 HydrophobicContact CG2-CD1 3.79Å; I180-I185 HydrophobicContact CG2-CG1 3.61Å
181S85.9Confident78.3Confident51 Ų5181.8 Ų81.836%0.35745%0.452SS..  trans-74.8147172.385.50000110.5S179 W183 T184 I185S179-S181 PolarHBondContact O-N 3.46Å; S179-S181 VanDerWaalsContact O-N 3.12Å; S181-W183 PolarHBondContact O-N 2.89Å; S181-W183 PolarHBondContact OG-N 3.24Å; S181-T184 VanDerWaalsContact O-CB 3.29Å; S181-T184 WeakPolarHBondContact O-CB 3.39Å; S181-T184 PolarHBondContact O-N 2.58Å; S181-T184 PolarHBondContact OG-N 2.97Å; S181-T184 VanDerWaalsContact OG-N 3.08Å; S181-T184 PolarHBondContact OG-OG1 3.31Å; S181-I185 PolarHBondContact O-N 3.49Å
182L85.7Confident78.8Confident46 Ų4680.6 Ų80.624%0.24144%0.443CS..Hα-helixtrans-56-32.9171.4174.9138.3000111.8T184 I185 I186 L308 I311 I312 I318L182-T184 VanDerWaalsContact C-N 3.34Å; L182-T184 PolarHBondContact O-N 3.31Å; L182-I185 PolarHBondContact O-N 2.88Å; L182-I186 HydrophobicContact CD2-CD1 3.42Å; L182-I186 VanDerWaalsContact CD2-CD1 3.42Å; L182-I186 HydrophobicContact CD2-CG1 4.4Å; L182-I186 HydrophobicContact CG-CD1 4.14Å; L182-I186 VanDerWaalsContact O-CG1 3.27Å; L182-I186 WeakPolarHBondContact O-CG1 3.03Å; L182-I186 PolarHBondContact O-N 2.87Å; L182-L308 HydrophobicContact CD2-CD2 3.75Å; L182-I311 HydrophobicContact CD1-CG2 3.92Å; L182-I311 HydrophobicContact CG-CG2 3.99Å; L182-I312 HydrophobicContact CD1-CD1 4.48Å; L182-I312 HydrophobicContact CD1-CG1 3.68Å; L182-I318 HydrophobicContact CD1-CD1 3.59Å
183W87.5Confident79.8Confident157 Ų15770.8 Ų70.860%0.59540%0.397SS*.Hα-helixtrans-65.6-34.4175.7-173.6-108.6000113.6S181 I186 S187S181-W183 PolarHBondContact O-N 2.89Å; S181-W183 PolarHBondContact OG-N 3.24Å; W183-I186 HydrophobicContact CE3-CD1 4.24Å; W183-I186 HydrophobicContact CE3-CG2 4.3Å; W183-I186 HydrophobicContact CZ3-CG2 4.31Å; W183-I186 PolarHBondContact O-N 3.45Å; W183-S187 WeakPolarHBondContact O-CB 3.44Å; W183-S187 PolarHBondContact O-N 3.36Å; W183-S187 PolarHBondContact O-OG 3.45Å
184T90.6Very high81.1Confident56 Ų5663.2 Ų63.234%0.34437%0.365SS..Hα-helixtrans-62.9-45.3175.8-52.30000110.2V157 S181 L182 S187 K188V157-T184 HydrophobicContact CB-CG2 4.41Å; V157-T184 HydrophobicContact CG1-CG2 3.9Å; V157-T184 HydrophobicContact CG2-CG2 3.6Å; S181-T184 VanDerWaalsContact O-CB 3.29Å; S181-T184 WeakPolarHBondContact O-CB 3.39Å; S181-T184 PolarHBondContact O-N 2.58Å; S181-T184 PolarHBondContact OG-N 2.97Å; S181-T184 VanDerWaalsContact OG-N 3.08Å; S181-T184 PolarHBondContact OG-OG1 3.31Å; L182-T184 VanDerWaalsContact C-N 3.34Å; L182-T184 PolarHBondContact O-N 3.31Å; T184-S187 PolarHBondContact O-N 2.88Å; T184-K188 PolarHBondContact O-N 3.33Å
185I90.6Very high82.9Confident0 Ų062.3 Ų62.30%035%0.349CS..Hα-helixtrans-66.4-45.7177.9-55.9176.6000110.7T148 A151 Y152 V157 I180 S181 L182 S187 K188 V189 I311T148-I185 HydrophobicContact CG2-CD1 4.13Å; A151-I185 HydrophobicContact CB-CD1 4.03Å; A151-I185 HydrophobicContact CB-CG1 4Å; Y152-I185 HydrophobicContact CD2-CD1 4.26Å; Y152-I185 HydrophobicContact CE1-CD1 4.45Å; Y152-I185 HydrophobicContact CE2-CD1 3.67Å; V157-I185 HydrophobicContact CG1-CG1 4.41Å; I180-I185 HydrophobicContact CG2-CD1 3.79Å; I180-I185 HydrophobicContact CG2-CG1 3.61Å; S181-I185 PolarHBondContact O-N 3.49Å; L182-I185 PolarHBondContact O-N 2.88Å; I185-S187 PolarHBondContact O-N 3.46Å; I185-K188 WeakPolarHBondContact O-CB 3.25Å; I185-K188 PolarHBondContact O-N 3.3Å; I185-K188 VanDerWaalsContact O-N 3.08Å; I185-V189 PolarHBondContact O-N 2.89Å; I185-I311 HydrophobicContact CB-CD1 4.45Å; I185-I311 HydrophobicContact CB-CG2 4.37Å; I185-I311 HydrophobicContact CD1-CG2 4.42Å; I185-I311 HydrophobicContact CG2-CD1 3.93Å; I185-I311 HydrophobicContact CG2-CG1 4.02Å; I185-I311 HydrophobicContact CG2-CG2 4.16Å
186I91.2Very high84.8Confident3 Ų359.4 Ų59.42%0.01532%0.318CS..Hα-helixtrans-55.4-38.5175.6-74168.8000112.2L182 W183 R190 L308 I311L182-I186 HydrophobicContact CD2-CD1 3.42Å; L182-I186 VanDerWaalsContact CD2-CD1 3.42Å; L182-I186 HydrophobicContact CD2-CG1 4.4Å; L182-I186 HydrophobicContact CG-CD1 4.14Å; L182-I186 VanDerWaalsContact O-CG1 3.27Å; L182-I186 WeakPolarHBondContact O-CG1 3.03Å; L182-I186 PolarHBondContact O-N 2.87Å; W183-I186 HydrophobicContact CE3-CD1 4.24Å; W183-I186 HydrophobicContact CE3-CG2 4.3Å; W183-I186 HydrophobicContact CZ3-CG2 4.31Å; W183-I186 PolarHBondContact O-N 3.45Å; I186-R190 PolarHBondContact O-N 3.47Å; I186-L308 HydrophobicContact CD1-CD2 3.34Å; I186-L308 HydrophobicContact CD1-CG 4.15Å; I186-L308 HydrophobicContact CG1-CD2 4.3Å; I186-I311 HydrophobicContact CB-CD1 4.35Å; I186-I311 HydrophobicContact CG1-CD1 3.48Å; I186-I311 VanDerWaalsContact CG1-CD1 3.48Å
187S92Very high86.6Confident41 Ų4151 Ų5129%0.28727%0.274SS..Hα-helixtrans-74.2-35.8-179.6-62.30000111.4W183 T184 I185 R190W183-S187 WeakPolarHBondContact O-CB 3.44Å; W183-S187 PolarHBondContact O-N 3.36Å; W183-S187 PolarHBondContact O-OG 3.45Å; T184-S187 PolarHBondContact O-N 2.88Å; I185-S187 PolarHBondContact O-N 3.46Å; S187-R190 VanDerWaalsContact O-CB 3.31Å; S187-R190 WeakPolarHBondContact O-CB 3.47Å; S187-R190 PolarHBondContact O-N 2.88Å; S187-R190 PolarHBondContact OG-NH2 2.9Å
188K92.6Very high88.5Confident51 Ų5142.4 Ų42.422%0.22224%0.237CC..Hα-helixtrans-62.5-44.6176.9-178.561.9178179.60112.7V147 V157 Y164 T184 I185 R190V147-K188 HydrophobicContact CG1-CB 4.49Å; V147-K188 HydrophobicContact CG1-CG 3.92Å; V157-K188 HydrophobicContact CB-CB 4.13Å; V157-K188 HydrophobicContact CB-CD 4.24Å; V157-K188 HydrophobicContact CB-CG 4.05Å; V157-K188 HydrophobicContact CG1-CB 4.29Å; V157-K188 WeakPolarHBondContact O-CE 3.42Å; V157-K188 PolarHBondContact O-NZ 3.21Å; Y164-K188 VanDerWaalsContact OH-CE 3.23Å; Y164-K188 WeakPolarHBondContact OH-CE 3.25Å; T184-K188 PolarHBondContact O-N 3.33Å; I185-K188 WeakPolarHBondContact O-CB 3.25Å; I185-K188 PolarHBondContact O-N 3.3Å; I185-K188 VanDerWaalsContact O-N 3.08Å; K188-R190 VanDerWaalsContact C-N 3.32Å
189V93.6Very high90.2Very high1 Ų140.1 Ų40.11%0.00621%0.213CC..THydrogen-bonded Turntrans-90.59.4-178.7-56.30000113.7I144 V147 I185 L191 E192 A193 I311I144-V189 HydrophobicContact CG1-CB 4.26Å; I144-V189 HydrophobicContact CG1-CG1 4.44Å; I144-V189 HydrophobicContact CG1-CG2 4.2Å; I144-V189 HydrophobicContact CG2-CG2 4.47Å; V147-V189 HydrophobicContact CB-CG1 3.82Å; V147-V189 HydrophobicContact CG1-CG1 3.56Å; V147-V189 HydrophobicContact CG2-CG1 4.15Å; I185-V189 PolarHBondContact O-N 2.89Å; V189-L191 PolarHBondContact O-N 3.38Å; V189-E192 VanDerWaalsContact C-OE2 3.29Å; V189-E192 WeakPolarHBondContact CA-OE2 3.46Å; V189-A193 WeakPolarHBondContact O-CB 3.43Å; V189-A193 PolarHBondContact O-N 2.94Å; V189-A193 VanDerWaalsContact O-N 3.14Å; V189-I311 HydrophobicContact CG2-CD1 4.42Å
190R93.9Very high91.1Very high107 Ų10734.8 Ų34.840%0.40418%0.175SC..Hα-helixtrans-63.8-41.5-170.5-175.7-173.4-59.31772.1111.8I186 S187 K188 C194I186-R190 PolarHBondContact O-N 3.47Å; S187-R190 VanDerWaalsContact O-CB 3.31Å; S187-R190 WeakPolarHBondContact O-CB 3.47Å; S187-R190 PolarHBondContact O-N 2.88Å; S187-R190 PolarHBondContact OG-NH2 2.9Å; K188-R190 VanDerWaalsContact C-N 3.32Å; R190-C194 VanDerWaalsContact O-CB 3.29Å; R190-C194 WeakPolarHBondContact O-CB 3.43Å; R190-C194 PolarHBondContact O-N 2.86Å; R190-C194 PolarHBondContact O-SG 3.43Å
191L92.8Very high91.5Very high66 Ų6633.3 Ų33.335%0.34617%0.168SC..Hα-helixtrans-66.1-52.3-173.7-178.963.5000110.2V189 A193 C194 M195V189-L191 PolarHBondContact O-N 3.38Å; L191-A193 VanDerWaalsContact C-N 3.32Å; L191-A193 PolarHBondContact O-N 3.27Å; L191-C194 PolarHBondContact O-N 3.2Å; L191-M195 HydrophobicContact CD1-CE 4.33Å; L191-M195 HydrophobicContact CD1-CG 4.08Å; L191-M195 HydrophobicContact CG-CG 4.39Å; L191-M195 WeakPolarHBondContact O-CB 3.39Å; L191-M195 WeakPolarHBondContact O-CG 3.37Å; L191-M195 PolarHBondContact O-N 2.98Å
192E93.1Very high91.7Very high10 Ų1034 Ų345%0.04717%0.167CC..Hα-helixtrans-56.4-48.3178.7-62.677.3-16500110.6W114 W118 L140 V189 M195 W196W114-E192 HydrophobicContact CZ2-CG 4.06Å; W114-E192 PolarHBondContact NE1-OE1 2.98Å; W118-E192 HydrophobicContact CD2-CB 3.98Å; W118-E192 HydrophobicContact CD2-CG 4.38Å; W118-E192 HydrophobicContact CG-CB 4.19Å; W118-E192 HydrophobicContact CG-CG 4.45Å; W118-E192 HydrophobicContact CZ2-CB 4.22Å; W118-E192 HydrophobicContact CZ2-CG 4.2Å; W118-E192 VanDerWaalsContact NE1-CG 3.33Å; L140-E192 HydrophobicContact CD1-CB 4.24Å; V189-E192 VanDerWaalsContact C-OE2 3.29Å; V189-E192 WeakPolarHBondContact CA-OE2 3.46Å; E192-M195 PolarHBondContact O-N 2.87Å; E192-W196 WeakPolarHBondContact O-CB 3.27Å; E192-W196 PolarHBondContact O-N 3.36Å
193A92.8Very high91.7Very high0 Ų032 Ų320%016%0.158CC..Hα-helixtrans-61.5-50.7177.900000111.8V189 L191 M195 W196 G197 M303 K307V189-A193 WeakPolarHBondContact O-CB 3.43Å; V189-A193 PolarHBondContact O-N 2.94Å; V189-A193 VanDerWaalsContact O-N 3.14Å; L191-A193 VanDerWaalsContact C-N 3.32Å; L191-A193 PolarHBondContact O-N 3.27Å; A193-M195 PolarHBondContact O-N 2.79Å; A193-W196 PolarHBondContact O-N 3.32Å; A193-G197 PolarHBondContact O-N 2.81Å; A193-M303 HydrophobicContact CB-CE 4.31Å; A193-M303 HydrophobicContact CB-CG 3.56Å; A193-M303 HydrophobicContact CB-SD 3.63Å; A193-M303 WeakPolarHBondContact O-CE 3.45Å; A193-M303 WeakPolarHBondContact O-CG 3.37Å; A193-K307 HydrophobicContact CB-CD 4.1Å
194C93.9Very high91.5Very high29 Ų2924.9 Ų24.920%0.19613%0.131CC..Hα-helixtrans-66.2-38.5-179.7-72.10000112.3R190 L191 G197 A198 A299R190-C194 VanDerWaalsContact O-CB 3.29Å; R190-C194 WeakPolarHBondContact O-CB 3.43Å; R190-C194 PolarHBondContact O-N 2.86Å; R190-C194 PolarHBondContact O-SG 3.43Å; L191-C194 PolarHBondContact O-N 3.2Å; C194-G197 PolarHBondContact O-N 3.42Å; C194-A198 WeakPolarHBondContact O-CB 3.4Å; C194-A198 PolarHBondContact O-N 3.13Å; C194-A299 PolarHBondContact SG-O 3.4Å; C194-A299 VanDerWaalsContact SG-O 3.35Å
195M95Very high91.4Very high50 Ų5023.3 Ų23.325%0.24612%0.12CC..Hα-helixtrans-65.6-43.2177.3-71.6-55.6105.300111.8C115 W118 V119 L191 E192 A193 A198 G199C115-M195 HydrophobicContact CB-CG 3.91Å; C115-M195 HydrophobicContact CB-SD 3.91Å; W118-M195 HydrophobicContact CB-CB 3.7Å; V119-M195 WeakPolarHBondContact CA-O 3.49Å; V119-M195 HydrophobicContact CG2-CB 3.99Å; V119-M195 HydrophobicContact CG2-CG 4.49Å; V119-M195 WeakPolarHBondContact CG2-O 3.28Å; V119-M195 HydrophobicContact CG2-SD 3.99Å; L191-M195 HydrophobicContact CD1-CE 4.33Å; L191-M195 HydrophobicContact CD1-CG 4.08Å; L191-M195 HydrophobicContact CG-CG 4.39Å; L191-M195 WeakPolarHBondContact O-CB 3.39Å; L191-M195 WeakPolarHBondContact O-CG 3.37Å; L191-M195 PolarHBondContact O-N 2.98Å; E192-M195 PolarHBondContact O-N 2.87Å; A193-M195 PolarHBondContact O-N 2.79Å; M195-A198 PolarHBondContact O-N 3.24Å; M195-G199 PolarHBondContact O-N 3.46Å
196W93.5Very high91.1Very high4 Ų426.2 Ų26.22%0.01514%0.139CC..Hα-helixtrans-58.3-49.5171.1176.7-73.6000111.6W118 L121 T135 F136 Y139 L140 E192 A193 A198 G199 T200 M303W118-W196 HydrophobicContact CE3-CB 4.35Å; W118-W196 AromaticContact CE3-CE3 3.65Å; W118-W196 HydrophobicContact CE3-CE3 3.65Å; W118-W196 HydrophobicContact CE3-CZ3 4.3Å; W118-W196 AromaticContact CZ3-CE3 3.79Å; W118-W196 HydrophobicContact CZ3-CE3 3.79Å; W118-W196 HydrophobicContact CZ3-CZ3 4.07Å; W118-W196 WeakPolarHBondContact O-CA 3.37Å; L121-W196 HydrophobicContact CB-CE3 3.71Å; L121-W196 HydrophobicContact CB-CH2 4.38Å; L121-W196 HydrophobicContact CB-CZ3 3.48Å; L121-W196 VanDerWaalsContact CB-CZ3 3.48Å; L121-W196 HydrophobicContact CD1-CE3 4.46Å; L121-W196 HydrophobicContact CD1-CZ3 3.96Å; L121-W196 HydrophobicContact CG-CZ3 4.35Å; T135-W196 HydrophobicContact CG2-CH2 3.82Å; T135-W196 HydrophobicContact CG2-CZ2 4.27Å; T135-W196 WeakPolarHBondContact O-CH2 3.35Å; F136-W196 HydrophobicContact CB-CZ2 4.2Å; Y139-W196 HydrophobicContact CD2-CH2 4.42Å; Y139-W196 HydrophobicContact CG-CZ3 4.48Å; L140-W196 HydrophobicContact CB-CD2 4.12Å; L140-W196 HydrophobicContact CB-CE3 4.09Å; L140-W196 HydrophobicContact CB-CZ3 4.22Å; L140-W196 HydrophobicContact CD2-CB 3.82Å; L140-W196 HydrophobicContact CD2-CD2 4.08Å; L140-W196 HydrophobicContact CD2-CG 3.7Å; E192-W196 WeakPolarHBondContact O-CB 3.27Å; E192-W196 PolarHBondContact O-N 3.36Å; A193-W196 PolarHBondContact O-N 3.32Å; W196-A198 VanDerWaalsContact C-N 3.29Å; W196-A198 PolarHBondContact O-N 3.1Å; W196-G199 CarbonylContact O-C 3.53Å; W196-G199 WeakPolarHBondContact O-CA 3.48Å; W196-G199 PolarHBondContact O-N 2.88Å; W196-T200 WeakPolarHBondContact O-CG2 3.28Å; W196-T200 PolarHBondContact O-N 3.17Å; W196-M303 HydrophobicContact CB-CE 3.88Å; W196-M303 VanDerWaalsContact CD1-CE 3.42Å; W196-M303 HydrophobicContact CG-CE 3.88Å
197G91.4Very high90.7Very high1 Ų127.4 Ų27.41%0.0115%0.147CC..Hα-helixtrans-61.6-36.7179.100000112.8A193 C194 T200 A201A193-G197 PolarHBondContact O-N 2.81Å; C194-G197 PolarHBondContact O-N 3.42Å; G197-T200 PolarHBondContact O-N 2.85Å; G197-T200 PolarHBondContact O-OG1 3.26Å; G197-A201 PolarHBondContact O-N 3.17Å
198A93.6Very high90.4Very high16 Ų1625.5 Ų25.513%0.13213%0.133CC..Hα-helixtrans-63.9-42.1171.600000111.9C194 M195 W196 T200 A201 I202 L295 A299C194-A198 WeakPolarHBondContact O-CB 3.4Å; C194-A198 PolarHBondContact O-N 3.13Å; M195-A198 PolarHBondContact O-N 3.24Å; W196-A198 VanDerWaalsContact C-N 3.29Å; W196-A198 PolarHBondContact O-N 3.1Å; A198-T200 PolarHBondContact O-N 3.25Å; A198-A201 WeakPolarHBondContact O-CB 3.39Å; A198-A201 PolarHBondContact O-N 3.37Å; A198-I202 WeakPolarHBondContact O-CG1 3.45Å; A198-I202 PolarHBondContact O-N 2.79Å; A198-L295 HydrophobicContact CB-CD1 3.67Å; A198-A299 HydrophobicContact CB-CB 4.44Å
199G92.1Very high90.1Very high0 Ų027.7 Ų27.70%014%0.143CC..Hα-helixtrans-57.2-45.8171.800000112.8V119 I123 M195 W196 A201 I202 G203V119-G199 VanDerWaalsContact O-CA 3.26Å; V119-G199 WeakPolarHBondContact O-CA 3.48Å; I123-G199 WeakPolarHBondContact CA-O 3.49Å; I123-G199 VanDerWaalsContact CG1-O 3.28Å; I123-G199 WeakPolarHBondContact CG1-O 3.46Å; I123-G199 PolarHBondContact N-O 3.22Å; M195-G199 PolarHBondContact O-N 3.46Å; W196-G199 CarbonylContact O-C 3.53Å; W196-G199 WeakPolarHBondContact O-CA 3.48Å; W196-G199 PolarHBondContact O-N 2.88Å; G199-A201 VanDerWaalsContact C-N 3.31Å; G199-A201 PolarHBondContact O-N 2.99Å; G199-I202 PolarHBondContact O-N 2.98Å; G199-I202 VanDerWaalsContact O-N 3.15Å; G199-G203 PolarHBondContact O-N 3.23Å
200T89.1Confident89.5Confident11 Ų1132.6 Ų32.67%0.06717%0.167CC..Hα-helixtrans-62.1-38.2175.865.10000112.1S125 W196 G197 A198 I202 G203 E204S125-T200 WeakPolarHBondContact OG-CG2 3.35Å; W196-T200 WeakPolarHBondContact O-CG2 3.28Å; W196-T200 PolarHBondContact O-N 3.17Å; G197-T200 PolarHBondContact O-N 2.85Å; G197-T200 PolarHBondContact O-OG1 3.26Å; A198-T200 PolarHBondContact O-N 3.25Å; T200-I202 VanDerWaalsContact C-N 3.29Å; T200-I202 PolarHBondContact O-N 3.02Å; T200-G203 PolarHBondContact O-N 2.75Å; T200-E204 WeakPolarHBondContact O-CG 3.39Å; T200-E204 PolarHBondContact O-N 3.22Å; T200-E204 VanDerWaalsContact O-N 3.15Å
201A90.1Very high88.8Confident0 Ų027.5 Ų27.50%015%0.148CC..Hα-helixtrans-63.2-35.5175.800000112.6G197 A198 G199 F291 T294 L295 K298G197-A201 PolarHBondContact O-N 3.17Å; A198-A201 WeakPolarHBondContact O-CB 3.39Å; A198-A201 PolarHBondContact O-N 3.37Å; G199-A201 VanDerWaalsContact C-N 3.31Å; G199-A201 PolarHBondContact O-N 2.99Å; A201-F291 HydrophobicContact CB-CE2 4.39Å; A201-T294 HydrophobicContact CB-CG2 3.75Å; A201-L295 HydrophobicContact CB-CD1 4.19Å; A201-K298 HydrophobicContact CB-CB 4.42Å; A201-K298 HydrophobicContact CB-CD 4.2Å
202I90.8Very high88.4Confident66 Ų6627.5 Ų27.534%0.33814%0.143SC..Hα-helixtrans-72-44.6175.1-65.3164.4000110.7V119 I123 A198 G199 T200 E204 L205 F291V119-I202 HydrophobicContact CG1-CD1 4.12Å; I123-I202 HydrophobicContact CD1-CB 4.28Å; I123-I202 HydrophobicContact CD1-CG2 3.85Å; I123-I202 HydrophobicContact CG1-CB 3.99Å; I123-I202 HydrophobicContact CG1-CG2 3.94Å; A198-I202 WeakPolarHBondContact O-CG1 3.45Å; A198-I202 PolarHBondContact O-N 2.79Å; G199-I202 PolarHBondContact O-N 2.98Å; G199-I202 VanDerWaalsContact O-N 3.15Å; T200-I202 VanDerWaalsContact C-N 3.29Å; T200-I202 PolarHBondContact O-N 3.02Å; I202-E204 PolarHBondContact O-N 3.38Å; I202-L205 VanDerWaalsContact O-CB 3.3Å; I202-L205 WeakPolarHBondContact O-CB 3.33Å; I202-L205 WeakPolarHBondContact O-CG 3.33Å; I202-L205 PolarHBondContact O-N 2.93Å; I202-L205 VanDerWaalsContact O-N 3.13Å; I202-F291 HydrophobicContact CG1-CE2 4.14Å; I202-F291 HydrophobicContact CG1-CZ 4.29Å
203G86.1Confident87.9Confident4 Ų429.5 Ų29.54%0.04116%0.162CC..Hα-helixtrans-61.7-28.2-178.700000113.9S126 V127 G199 T200 P206S126-G203 PolarHBondContact OG-O 2.78Å; V127-G203 WeakPolarHBondContact CG2-O 3.37Å; G199-G203 PolarHBondContact O-N 3.23Å; T200-G203 PolarHBondContact O-N 2.75Å; G203-P206 WeakPolarHBondContact O-CD 3.47Å
204E83.1Confident87Confident7 Ų730.4 Ų30.43%0.03317%0.17CC..THydrogen-bonded Turntrans-91.77.1179.5-56.8-179.6-150.500113.2S126 T200 I202 P207 F273 K298S126-E204 WeakPolarHBondContact OG-CG 3.4Å; S126-E204 PolarHBondContact OG-N 2.92Å; T200-E204 WeakPolarHBondContact O-CG 3.39Å; T200-E204 PolarHBondContact O-N 3.22Å; T200-E204 VanDerWaalsContact O-N 3.15Å; I202-E204 PolarHBondContact O-N 3.38Å; E204-P207 WeakPolarHBondContact O-CD 3.38Å; E204-F273 HydrophobicContact CB-CD1 3.57Å; E204-F273 HydrophobicContact CB-CE1 3.21Å; E204-F273 HydrophobicContact CB-CZ 4.16Å; E204-F273 HydrophobicContact CG-CD1 4.19Å; E204-F273 HydrophobicContact CG-CE1 4.26Å; E204-F273 WeakPolarHBondContact O-CE1 3.32Å; E204-F273 WeakPolarHBondContact OE2-CB 3.47Å; E204-F273 WeakPolarHBondContact OE2-CD1 3.48Å; E204-F273 WeakPolarHBondContact OE2-CE1 3.49Å; E204-F273 WeakPolarHBondContact OE2-CG 3.34Å; E204-K298 WeakPolarHBondContact OE1-CE 3.26Å; E204-K298 IonicContact OE1-NZ 3.56Å; E204-K298 PolarHBondContact OE1-NZ 3.14Å; E204-K298 WeakPolarHBondContact OE2-CE 3.42Å; E204-K298 IonicContact OE2-NZ 3.31Å; E204-K298 PolarHBondContact OE2-NZ 3.34Å
205L87.2Confident86.2Confident22 Ų2235.3 Ų35.312%0.11518%0.184CC..  trans-67.8-28.7172.9-71.2176.5000116.6I202 Y208 F209 F287 F290 F291I202-L205 VanDerWaalsContact O-CB 3.3Å; I202-L205 WeakPolarHBondContact O-CB 3.33Å; I202-L205 WeakPolarHBondContact O-CG 3.33Å; I202-L205 PolarHBondContact O-N 2.93Å; I202-L205 VanDerWaalsContact O-N 3.13Å; L205-Y208 WeakPolarHBondContact O-CB 3.3Å; L205-Y208 PolarHBondContact O-N 3.4Å; L205-Y208 VanDerWaalsContact O-N 3.1Å; L205-F209 HydrophobicContact CB-CD2 4.08Å; L205-F209 HydrophobicContact CB-CE2 4Å; L205-F209 HydrophobicContact CD1-CE2 4.16Å; L205-F209 HydrophobicContact CD2-CE2 4.48Å; L205-F209 HydrophobicContact CG-CE2 4.44Å; L205-F209 PolarHBondContact O-N 2.97Å; L205-F287 HydrophobicContact CD1-CE2 4.23Å; L205-F287 HydrophobicContact CD2-CE2 3.99Å; L205-F290 HydrophobicContact CD2-CD1 4.22Å; L205-F290 HydrophobicContact CD2-CE1 3.72Å; L205-F291 HydrophobicContact CD1-CD2 4.25Å; L205-F291 HydrophobicContact CD1-CE2 4.33Å; L205-F291 HydrophobicContact CD2-CD2 3.94Å; L205-F291 HydrophobicContact CG-CD2 4.46Å
206P85.2Confident85.3Confident61 Ų6138.1 Ų38.140%0.39620%0.199SC..Hα-helixtrans-53.6-46.6-173.6-25.733.1000114.7G203 Y208 F209 M210G203-P206 WeakPolarHBondContact O-CD 3.47Å; P206-Y208 VanDerWaalsContact C-N 3.27Å; P206-Y208 PolarHBondContact O-N 3.4Å; P206-F209 PolarHBondContact O-N 2.89Å; P206-M210 WeakPolarHBondContact O-CB 3.26Å; P206-M210 VanDerWaalsContact O-CG 3.25Å; P206-M210 WeakPolarHBondContact O-CG 3.44Å; P206-M210 PolarHBondContact O-N 3.34Å
207P81.9Confident84.2Confident29 Ų2942.2 Ų42.219%0.18823%0.229CC..Hα-helixtrans-57.4-37.3178-24.834.6000113.7E204 A211 L278E204-P207 WeakPolarHBondContact O-CD 3.38Å; P207-A211 WeakPolarHBondContact O-CB 3.49Å; P207-A211 PolarHBondContact O-N 3.2Å; P207-L278 HydrophobicContact CB-CD2 3.88Å; P207-L278 HydrophobicContact CB-CG 3.99Å
208Y86.6Confident82.6Confident0 Ų045 Ų450%026%0.257CS..Hα-helixtrans-64.9-47.7177.2169.1-91.2000112.1L205 P206 R212 G277 C280 G281 V285 F287 F290L205-Y208 WeakPolarHBondContact O-CB 3.3Å; L205-Y208 PolarHBondContact O-N 3.4Å; L205-Y208 VanDerWaalsContact O-N 3.1Å; P206-Y208 VanDerWaalsContact C-N 3.27Å; P206-Y208 PolarHBondContact O-N 3.4Å; Y208-R212 WeakPolarHBondContact O-CB 3.33Å; Y208-R212 PolarHBondContact O-N 3.37Å; Y208-R212 PolarHBondContact OH-NH1 3.15Å; Y208-G277 WeakPolarHBondContact CA-O 3.42Å; Y208-C280 HydrophobicContact CD2-CB 3.92Å; Y208-C280 HydrophobicContact CE2-CB 4.12Å; Y208-G281 WeakPolarHBondContact O-CA 3.46Å; Y208-V285 PolarHBondContact OH-O 3Å; Y208-F287 HydrophobicContact CE1-CB 4.48Å; Y208-F287 HydrophobicContact CE1-CD2 4.03Å; Y208-F287 VanDerWaalsContact OH-CA 3.31Å; Y208-F287 WeakPolarHBondContact OH-CA 3.36Å; Y208-F287 PolarHBondContact OH-N 2.8Å; Y208-F290 VanDerWaalsContact CB-CE1 3.43Å; Y208-F290 HydrophobicContact CD1-CD1 4.07Å; Y208-F290 HydrophobicContact CD1-CE1 4.19Å; Y208-F290 HydrophobicContact CD2-CB 4.33Å; Y208-F290 AromaticContact CD2-CD1 3.48Å; Y208-F290 HydrophobicContact CD2-CD1 3.48Å; Y208-F290 VanDerWaalsContact CD2-CD1 3.48Å; Y208-F290 HydrophobicContact CD2-CD2 4.25Å; Y208-F290 AromaticContact CD2-CE1 3.73Å; Y208-F290 HydrophobicContact CD2-CE1 3.73Å; Y208-F290 HydrophobicContact CD2-CE2 4.47Å; Y208-F290 AromaticContact CD2-CG 3.76Å; Y208-F290 HydrophobicContact CD2-CG 3.76Å; Y208-F290 HydrophobicContact CD2-CZ 4.22Å; Y208-F290 HydrophobicContact CE1-CD1 4.43Å; Y208-F290 HydrophobicContact CE2-CB 3.99Å; Y208-F290 AromaticContact CE2-CD1 3.87Å; Y208-F290 HydrophobicContact CE2-CD1 3.87Å; Y208-F290 AromaticContact CE2-CG 3.93Å; Y208-F290 HydrophobicContact CE2-CG 3.93Å; Y208-F290 AromaticContact CG-CD1 3.59Å; Y208-F290 HydrophobicContact CG-CD1 3.59Å; Y208-F290 AromaticContact CG-CE1 3.51Å; Y208-F290 HydrophobicContact CG-CE1 3.51Å; Y208-F290 HydrophobicContact CG-CG 4.34Å; Y208-F290 HydrophobicContact CG-CZ 4.21Å
209F86.3Confident80.7Confident98 Ų9845.1 Ų45.143%0.4326%0.258SS..Hα-helixtrans-70-37.1179.8-75.3-63.5000112.2L205 P206 R212 A213 F287L205-F209 HydrophobicContact CB-CD2 4.08Å; L205-F209 HydrophobicContact CB-CE2 4Å; L205-F209 HydrophobicContact CD1-CE2 4.16Å; L205-F209 HydrophobicContact CD2-CE2 4.48Å; L205-F209 HydrophobicContact CG-CE2 4.44Å; L205-F209 PolarHBondContact O-N 2.97Å; P206-F209 PolarHBondContact O-N 2.89Å; F209-R212 PolarHBondContact O-N 3.47Å; F209-A213 WeakPolarHBondContact O-CB 3.38Å; F209-A213 PolarHBondContact O-N 3.33Å; F209-F287 HydrophobicContact CE1-CD2 4.28Å; F209-F287 HydrophobicContact CE2-CE2 4.19Å; F209-F287 AromaticContact CZ-CD2 3.73Å; F209-F287 HydrophobicContact CZ-CD2 3.73Å; F209-F287 AromaticContact CZ-CE2 3.69Å; F209-F287 HydrophobicContact CZ-CE2 3.69Å
210M81.1Confident78.8Confident103 Ų10350.4 Ų50.451%0.50729%0.286SS..Hα-helixtrans-59.3-54.3174.5-72.7176.967.500111P206 R212 A213 A214 M232P206-M210 WeakPolarHBondContact O-CB 3.26Å; P206-M210 VanDerWaalsContact O-CG 3.25Å; P206-M210 WeakPolarHBondContact O-CG 3.44Å; P206-M210 PolarHBondContact O-N 3.34Å; M210-R212 VanDerWaalsContact C-N 3.32Å; M210-R212 PolarHBondContact O-N 2.97Å; M210-A213 PolarHBondContact O-N 2.93Å; M210-A214 WeakPolarHBondContact O-CB 3.41Å; M210-A214 PolarHBondContact O-N 3.29Å; M210-M232 HydrophobicContact CE-CE 4.34Å
211A79.4Confident77.1Confident0 Ų053.9 Ų53.90%031%0.309CS..Hα-helixtrans-63.9-36.818000000112.7P207 R215 F229 L278 H282P207-A211 WeakPolarHBondContact O-CB 3.49Å; P207-A211 PolarHBondContact O-N 3.2Å; A211-R215 WeakPolarHBondContact O-CB 3.38Å; A211-R215 PolarHBondContact O-N 3.21Å; A211-R215 VanDerWaalsContact O-N 3.1Å; A211-F229 HydrophobicContact CB-CE2 4.21Å; A211-F229 HydrophobicContact CB-CZ 3.69Å; A211-L278 HydrophobicContact CB-CD2 4.19Å; A211-L278 VanDerWaalsContact CB-O 3.27Å; A211-L278 WeakPolarHBondContact CB-O 2.93Å; A211-H282 HydrophobicContact CB-CB 4.47Å
212R85.2Confident75.3Confident66 Ų6658.1 Ų58.125%0.24933%0.332CS..Hα-helixtrans-67.6-43.3176.4-172.5178.4-179107.310.2112.1Y208 F209 M210 R215 L216 G281 L284 V285Y208-R212 WeakPolarHBondContact O-CB 3.33Å; Y208-R212 PolarHBondContact O-N 3.37Å; Y208-R212 PolarHBondContact OH-NH1 3.15Å; F209-R212 PolarHBondContact O-N 3.47Å; M210-R212 VanDerWaalsContact C-N 3.32Å; M210-R212 PolarHBondContact O-N 2.97Å; R212-R215 PolarHBondContact O-N 2.92Å; R212-L216 HydrophobicContact CG-CD1 3.96Å; R212-L216 HydrophobicContact CG-CG 4.47Å; R212-L216 WeakPolarHBondContact O-CB 3.36Å; R212-L216 WeakPolarHBondContact O-CG 3.41Å; R212-L216 PolarHBondContact O-N 3.09Å; R212-G281 WeakPolarHBondContact CA-O 3.21Å; R212-L284 HydrophobicContact CG-CD2 3.78Å; R212-L284 PolarHBondContact NH1-O 2.92Å; R212-V285 PolarHBondContact NH1-O 3.5Å
213A81.1Confident73.9Confident52 Ų5256.7 Ų56.743%0.4333%0.325SS..Hα-helixtrans-65.6-42.9178.200000111.2F209 M210 R215 L216 S217F209-A213 WeakPolarHBondContact O-CB 3.38Å; F209-A213 PolarHBondContact O-N 3.33Å; M210-A213 PolarHBondContact O-N 2.93Å; A213-R215 VanDerWaalsContact C-N 3.34Å; A213-R215 PolarHBondContact O-N 3.44Å; A213-L216 PolarHBondContact O-N 3.49Å; A213-S217 VanDerWaalsContact O-CB 3.32Å; A213-S217 WeakPolarHBondContact O-CB 3.43Å; A213-S217 PolarHBondContact O-N 2.91Å; A213-S217 PolarHBondContact O-OG 3.28Å
214A74.9Confident72.6Confident20 Ų2058.8 Ų58.817%0.16533%0.333CS..Hα-helixtrans-57.3-47.1174.400000111.3M210 F229M210-A214 WeakPolarHBondContact O-CB 3.41Å; M210-A214 PolarHBondContact O-N 3.29Å; A214-F229 HydrophobicContact CB-CD1 4.19Å; A214-F229 HydrophobicContact CB-CE1 4.34Å; A214-F229 HydrophobicContact CB-CG 4.47Å
215R76.8Confident71.6Confident132 Ų13263 Ų6350%0.49836%0.356SS..Hα-helixtrans-66.2-41.9179.3-175.366.5-178.5129.8-2113.5A211 R212 A213 H282 L284A211-R215 WeakPolarHBondContact O-CB 3.38Å; A211-R215 PolarHBondContact O-N 3.21Å; A211-R215 VanDerWaalsContact O-N 3.1Å; R212-R215 PolarHBondContact O-N 2.92Å; A213-R215 VanDerWaalsContact C-N 3.34Å; A213-R215 PolarHBondContact O-N 3.44Å; R215-H282 WeakPolarHBondContact CG-O 3.42Å; R215-L284 HydrophobicContact CB-CD2 4.02Å; R215-L284 HydrophobicContact CG-CD1 4.22Å; R215-L284 HydrophobicContact CG-CD2 3.91Å; R215-L284 HydrophobicContact CG-CG 4.03Å
216L76.9Confident70.4Confident109 Ų10964.7 Ų64.757%0.57136%0.361SS*.Hα-helixtrans-75.1-27.6-178-74.2175.2000113.5R212 A213 G218 L284R212-L216 HydrophobicContact CG-CD1 3.96Å; R212-L216 HydrophobicContact CG-CG 4.47Å; R212-L216 WeakPolarHBondContact O-CB 3.36Å; R212-L216 WeakPolarHBondContact O-CG 3.41Å; R212-L216 PolarHBondContact O-N 3.09Å; A213-L216 PolarHBondContact O-N 3.49Å; L216-G218 PolarHBondContact O-N 3.3Å; L216-L284 HydrophobicContact CD1-CD2 4.39Å; L216-L284 HydrophobicContact CD2-CD1 3.99Å; L216-L284 HydrophobicContact CD2-CD2 3.9Å; L216-L284 HydrophobicContact CG-CD2 3.75Å
217S70.3Confident69.2Low90 Ų9064.6 Ų64.663%0.62936%0.356SS*.THydrogen-bonded Turntrans-69.4-11.1178.6-56.90000112A213 A219A213-S217 VanDerWaalsContact O-CB 3.32Å; A213-S217 WeakPolarHBondContact O-CB 3.43Å; A213-S217 PolarHBondContact O-N 2.91Å; A213-S217 PolarHBondContact O-OG 3.28Å; S217-A219 PolarHBondContact O-N 2.9Å
218G57.2Low68.2Low58 Ų5867.1 Ų67.160%0.59836%0.364SS*.THydrogen-bonded Turntrans52.83017900000111.7L216 D220L216-G218 PolarHBondContact O-N 3.3Å; G218-D220 PolarHBondContact O-N 2.97Å
219A52.5Low67Low19 Ų1968 Ų6816%0.15737%0.368CS..  trans-53.6129-170.800000107.7S217 D223 Y226S217-A219 PolarHBondContact O-N 2.9Å; A219-D223 HydrophobicContact CB-CB 3.69Å; A219-Y226 HydrophobicContact CB-CD2 4.04Å; A219-Y226 HydrophobicContact CB-CG 4.23Å
220D52.3Low65.9Low111 Ų11167.7 Ų67.759%0.59437%0.367SS*.  trans-46.7138.8172.7-144.3-34.7000106.9G218 D222 D223G218-D220 PolarHBondContact O-N 2.97Å; D220-D222 HydrophobicContact CB-CB 4.46Å; D220-D222 PolarHBondContact O-N 3.2Å; D220-D223 VanDerWaalsContact O-CB 3.27Å; D220-D223 WeakPolarHBondContact O-CB 3.33Å; D220-D223 PolarHBondContact O-N 3.39Å
221P53.6Low65Low85 Ų8567.3 Ų67.355%0.55237%0.365SS*.THydrogen-bonded Turntrans-50.4-16.6170.713.9-29.2000113.7Q227P221-Q227 WeakPolarHBondContact O-CG 3.49Å; P221-Q227 PolarHBondContact O-NE2 2.9Å
222D52Low63.9Low89 Ų8971.9 Ų71.948%0.47639%0.387SS..THydrogen-bonded Turntrans-85.4-4.5171.2-80.57.7000115.5K36 D220 E224K36-D222 IonicContact NZ-OD2 2.78Å; K36-D222 PolarHBondContact NZ-OD2 3.31Å; D220-D222 HydrophobicContact CB-CB 4.46Å; D220-D222 PolarHBondContact O-N 3.2Å; D222-E224 PolarHBondContact O-N 3.44Å
223D62.4Low62.6Low35 Ų3570.6 Ų70.619%0.18739%0.385CS..  trans-72.5123.8177.8-169.1-39.7000110.4A219 D220 D225 Y226 Q227 K397A219-D223 HydrophobicContact CB-CB 3.69Å; D220-D223 VanDerWaalsContact O-CB 3.27Å; D220-D223 WeakPolarHBondContact O-CB 3.33Å; D220-D223 PolarHBondContact O-N 3.39Å; D223-D225 PolarHBondContact O-N 2.85Å; D223-D225 VanDerWaalsContact O-N 3.16Å; D223-D225 PolarHBondContact OD1-N 3.45Å; D223-Y226 WeakPolarHBondContact O-CA 3.13Å; D223-Y226 WeakPolarHBondContact O-CB 3.38Å; D223-Y226 PolarHBondContact O-N 2.98Å; D223-Q227 PolarHBondContact O-N 3.26Å; D223-K397 VanDerWaalsContact CG-NZ 3.33Å; D223-K397 IonicContact OD1-NZ 3.98Å; D223-K397 PolarHBondContact OD1-NZ 2.92Å; D223-K397 IonicContact OD2-NZ 3.38Å; D223-K397 PolarHBondContact OD2-NZ 3.23Å; D223-K397 VanDerWaalsContact OD2-NZ 3.11Å
224E59.6Low61.4Low48 Ų4872.2 Ų72.222%0.22439%0.386CS..Hα-helixtrans-53-35.4-177.9-59.4174.5-178.700113.9H43 D222 K228 R400H43-E224 IonicContact CE1-OE2 3.82Å; D222-E224 PolarHBondContact O-N 3.44Å; E224-K228 WeakPolarHBondContact O-CG 3.41Å; E224-K228 PolarHBondContact O-N 2.86Å; E224-K228 VanDerWaalsContact O-N 3.17Å; E224-R400 IonicContact OE1-NH1 3.33Å
225D60.8Low60.4Low95 Ų9577.7 Ų77.751%0.50841%0.408SS..Hα-helixtrans-76.1-29.1179.7-66.4-46.8000111.6D223 F229 K397D223-D225 PolarHBondContact O-N 2.85Å; D223-D225 VanDerWaalsContact O-N 3.16Å; D223-D225 PolarHBondContact OD1-N 3.45Å; D225-F229 WeakPolarHBondContact O-CB 3.35Å; D225-F229 PolarHBondContact O-N 3.26Å; D225-K397 IonicContact OD2-NZ 2.71Å; D225-K397 PolarHBondContact OD2-NZ 3.16Å
226Y63.1Low59.2Low58 Ų5875.3 Ų75.323%0.22741%0.409CS..Hα-helixtrans-74.7-44.9176.3-167.3-93.8000110.9A219 D223 F229 E230A219-Y226 HydrophobicContact CB-CD2 4.04Å; A219-Y226 HydrophobicContact CB-CG 4.23Å; D223-Y226 WeakPolarHBondContact O-CA 3.13Å; D223-Y226 WeakPolarHBondContact O-CB 3.38Å; D223-Y226 PolarHBondContact O-N 2.98Å; Y226-F229 WeakPolarHBondContact O-CB 3.23Å; Y226-F229 PolarHBondContact O-N 2.66Å; Y226-F229 VanDerWaalsContact O-N 3.17Å; Y226-E230 WeakPolarHBondContact O-CB 3.44Å; Y226-E230 PolarHBondContact O-N 3.13Å
227Q59.7Low57.8Low60 Ų6074.9 Ų74.928%0.2840%0.404SS..Hα-helixtrans-62.1-43.7175.9-68.7-178.80.600112.3P221 D223 F229 E230 E231P221-Q227 WeakPolarHBondContact O-CG 3.49Å; P221-Q227 PolarHBondContact O-NE2 2.9Å; D223-Q227 PolarHBondContact O-N 3.26Å; Q227-F229 VanDerWaalsContact C-N 3.28Å; Q227-F229 PolarHBondContact O-N 3.4Å; Q227-E230 PolarHBondContact O-N 3.04Å; Q227-E231 WeakPolarHBondContact O-CB 3.47Å; Q227-E231 WeakPolarHBondContact O-CG 3.21Å; Q227-E231 PolarHBondContact O-N 3.44Å
228K60.9Low56.5Low81 Ų8175 Ų7535%0.35240%0.404SS..Hα-helixtrans-62.6-35.2174.4-78173.2-177159.30112.7E224 M232E224-K228 WeakPolarHBondContact O-CG 3.41Å; E224-K228 PolarHBondContact O-N 2.86Å; E224-K228 VanDerWaalsContact O-N 3.17Å; K228-M232 WeakPolarHBondContact O-CB 3.33Å; K228-M232 WeakPolarHBondContact O-CG 3.43Å; K228-M232 PolarHBondContact O-N 3.42Å
229F62.1Low56Low20 Ų2074.9 Ų74.99%0.08840%0.398CS..Hα-helixtrans-70.7-40.4175.9178.5-102.8000111.7A211 A214 D225 Y226 Q227 M232 L233 L278A211-F229 HydrophobicContact CB-CE2 4.21Å; A211-F229 HydrophobicContact CB-CZ 3.69Å; A214-F229 HydrophobicContact CB-CD1 4.19Å; A214-F229 HydrophobicContact CB-CE1 4.34Å; A214-F229 HydrophobicContact CB-CG 4.47Å; D225-F229 WeakPolarHBondContact O-CB 3.35Å; D225-F229 PolarHBondContact O-N 3.26Å; Y226-F229 WeakPolarHBondContact O-CB 3.23Å; Y226-F229 PolarHBondContact O-N 2.66Å; Y226-F229 VanDerWaalsContact O-N 3.17Å; Q227-F229 VanDerWaalsContact C-N 3.28Å; Q227-F229 PolarHBondContact O-N 3.4Å; F229-M232 HydrophobicContact CD2-CE 4.42Å; F229-M232 PolarHBondContact O-N 3.28Å; F229-L233 HydrophobicContact CD1-CD1 3.8Å; F229-L233 HydrophobicContact CE1-CD1 3.37Å; F229-L233 HydrophobicContact CE1-CG 4.26Å; F229-L233 HydrophobicContact CZ-CD1 3.81Å; F229-L233 HydrophobicContact CZ-CG 4.31Å; F229-L233 WeakPolarHBondContact O-CG 3.22Å; F229-L233 PolarHBondContact O-N 2.84Å; F229-L278 HydrophobicContact CE2-CD2 3.95Å; F229-L278 HydrophobicContact CZ-CD2 4.24Å
230E62.5Low56Low90 Ų9082.3 Ų82.342%0.42143%0.429SS..Hα-helixtrans-66.7-43.1175.1-157.5166.4-15000111.2Y226 Q227 M232 L233 D234Y226-E230 WeakPolarHBondContact O-CB 3.44Å; Y226-E230 PolarHBondContact O-N 3.13Å; Q227-E230 PolarHBondContact O-N 3.04Å; E230-M232 PolarHBondContact O-N 3.32Å; E230-L233 CarbonylContact O-C 3.59Å; E230-L233 WeakPolarHBondContact O-CB 3.16Å; E230-L233 PolarHBondContact O-N 3.36Å; E230-L233 VanDerWaalsContact O-N 3.14Å; E230-D234 WeakPolarHBondContact O-CB 3.29Å; E230-D234 PolarHBondContact O-N 3.23Å
231E61.8Low56.2Low96 Ų9682.8 Ų82.845%0.44943%0.432SS..Hα-helixtrans-62.3-38.6172-75.4178.6-175.500112.6Q227 L233 D234 Q235Q227-E231 WeakPolarHBondContact O-CB 3.47Å; Q227-E231 WeakPolarHBondContact O-CG 3.21Å; Q227-E231 PolarHBondContact O-N 3.44Å; E231-L233 VanDerWaalsContact C-N 3.34Å; E231-D234 PolarHBondContact O-N 3.28Å; E231-Q235 WeakPolarHBondContact O-CB 3.32Å; E231-Q235 VanDerWaalsContact O-CG 3.24Å; E231-Q235 WeakPolarHBondContact O-CG 3.48Å; E231-Q235 PolarHBondContact O-N 3.04Å
232M56.3Low56.3Low95 Ų9586.9 Ų86.947%0.46844%0.441SS..Hα-helixtrans-65.9-37.3173-84-166.9-63.400112.2M210 K228 F229 E230 T236M210-M232 HydrophobicContact CE-CE 4.34Å; K228-M232 WeakPolarHBondContact O-CB 3.33Å; K228-M232 WeakPolarHBondContact O-CG 3.43Å; K228-M232 PolarHBondContact O-N 3.42Å; F229-M232 HydrophobicContact CD2-CE 4.42Å; F229-M232 PolarHBondContact O-N 3.28Å; E230-M232 PolarHBondContact O-N 3.32Å; M232-T236 PolarHBondContact O-N 3.33Å; M232-T236 PolarHBondContact O-OG1 3.4Å
233L58.2Low56.4Low40 Ų4087.4 Ų87.421%0.20944%0.441CS..Hα-helixtrans-64.9-45.8172.6-74.9168.2000110.2F229 E230 E231 T236 E237 L278F229-L233 HydrophobicContact CD1-CD1 3.8Å; F229-L233 HydrophobicContact CE1-CD1 3.37Å; F229-L233 HydrophobicContact CE1-CG 4.26Å; F229-L233 HydrophobicContact CZ-CD1 3.81Å; F229-L233 HydrophobicContact CZ-CG 4.31Å; F229-L233 WeakPolarHBondContact O-CG 3.22Å; F229-L233 PolarHBondContact O-N 2.84Å; E230-L233 CarbonylContact O-C 3.59Å; E230-L233 WeakPolarHBondContact O-CB 3.16Å; E230-L233 PolarHBondContact O-N 3.36Å; E230-L233 VanDerWaalsContact O-N 3.14Å; E231-L233 VanDerWaalsContact C-N 3.34Å; L233-T236 CarbonylContact O-C 3.57Å; L233-T236 WeakPolarHBondContact O-CA 3.44Å; L233-T236 VanDerWaalsContact O-CB 3.3Å; L233-T236 WeakPolarHBondContact O-CB 3.37Å; L233-T236 PolarHBondContact O-N 3.15Å; L233-E237 WeakPolarHBondContact O-CG 3.34Å; L233-E237 PolarHBondContact O-N 3.39Å; L233-L278 HydrophobicContact CD2-CD1 4.11Å
234D55.8Low56.4Low85 Ų8588.3 Ų88.346%0.45545%0.45SS..Hα-helixtrans-68.5-37.5-178.8-791.1000113E230 E231 T236 E237 S238E230-D234 WeakPolarHBondContact O-CB 3.29Å; E230-D234 PolarHBondContact O-N 3.23Å; E231-D234 PolarHBondContact O-N 3.28Å; D234-T236 VanDerWaalsContact C-N 3.26Å; D234-T236 PolarHBondContact O-N 3.05Å; D234-E237 CarbonylContact O-C 3.56Å; D234-E237 WeakPolarHBondContact O-CA 3.49Å; D234-E237 WeakPolarHBondContact O-CB 3.22Å; D234-E237 PolarHBondContact O-N 2.9Å; D234-S238 PolarHBondContact O-N 3.47Å
235Q53.9Low56.7Low135 Ų13595 Ų9563%0.63147%0.473SS*.Hα-helixtrans-62.4-37.6171.8-77177.37.100111.1E231 E237 S238E231-Q235 WeakPolarHBondContact O-CB 3.32Å; E231-Q235 VanDerWaalsContact O-CG 3.24Å; E231-Q235 WeakPolarHBondContact O-CG 3.48Å; E231-Q235 PolarHBondContact O-N 3.04Å; Q235-E237 VanDerWaalsContact C-N 3.28Å; Q235-E237 PolarHBondContact O-N 3.48Å; Q235-S238 PolarHBondContact O-OG 2.85Å
236T50.7Low56.9Low82 Ų8291.6 Ų91.650%0.50346%0.459SS..Hα-helixtrans-68.8-26.6171.3-51.20000111.9M232 L233 D234M232-T236 PolarHBondContact O-N 3.33Å; M232-T236 PolarHBondContact O-OG1 3.4Å; L233-T236 CarbonylContact O-C 3.57Å; L233-T236 WeakPolarHBondContact O-CA 3.44Å; L233-T236 VanDerWaalsContact O-CB 3.3Å; L233-T236 WeakPolarHBondContact O-CB 3.37Å; L233-T236 PolarHBondContact O-N 3.15Å; D234-T236 VanDerWaalsContact C-N 3.26Å; D234-T236 PolarHBondContact O-N 3.05Å
237E47.2Very low56.9Low101 Ų10191.1 Ų91.147%0.47246%0.458SS..Hα-helixtrans-82.1-25.9176.7-70.9-171.9172.400114.3L233 D234 Q235 A239 K247L233-E237 WeakPolarHBondContact O-CG 3.34Å; L233-E237 PolarHBondContact O-N 3.39Å; D234-E237 CarbonylContact O-C 3.56Å; D234-E237 WeakPolarHBondContact O-CA 3.49Å; D234-E237 WeakPolarHBondContact O-CB 3.22Å; D234-E237 PolarHBondContact O-N 2.9Å; Q235-E237 VanDerWaalsContact C-N 3.28Å; Q235-E237 PolarHBondContact O-N 3.48Å; E237-A239 PolarHBondContact O-N 3.02Å; E237-K247 IonicContact OE1-NZ 3.36Å; E237-K247 PolarHBondContact OE1-NZ 3.18Å
238S44Very low57.3Low91 Ų9191.3 Ų91.364%0.63646%0.463SS*.SBendtrans-70.9-12.5-175.570.70000114.5D234 Q235D234-S238 PolarHBondContact O-N 3.47Å; Q235-S238 PolarHBondContact O-OG 2.85Å
239A47.2Very low57.7Low56 Ų5690.1 Ų90.146%0.46347%0.468SS..SBendtrans-89.3101169.400000110.8E237E237-A239 PolarHBondContact O-N 3.02Å
240Q51.5Low58Low176 Ų17689.6 Ų89.682%0.82247%0.467SS*.  trans-64.2157.6-155.9-70.4174.5-3700120.2F242Q240-F242 PolarHBondContact O-N 3.47Å
241D56Low58.3Low120 Ų12088.3 Ų88.364%0.64246%0.461SS*.THydrogen-bonded Turntrans60.1-45.3156.9-118.126.7000121.1S244 R245D241-S244 WeakPolarHBondContact CA-OG 3.39Å; D241-S244 PolarHBondContact O-OG 2.88Å; D241-R245 WeakPolarHBondContact O-CD 3.48Å; D241-R245 WeakPolarHBondContact O-CG 3.47Å; D241-R245 PolarHBondContact O-N 3.06Å
242F56.9Low58.9Low172 Ų17290.3 Ų90.375%0.75447%0.468SS*.Hα-helixtrans-83.6-43.1178.3-174.4-100.4000111.7Q240 R245 A246Q240-F242 PolarHBondContact O-N 3.47Å; F242-R245 PolarHBondContact O-N 2.69Å; F242-A246 VanDerWaalsContact O-CB 3.31Å; F242-A246 WeakPolarHBondContact O-CB 3.35Å; F242-A246 PolarHBondContact O-N 3.15Å
243Q54.6Low59.8Low99 Ų9988.8 Ų88.846%0.46346%0.461SS..Hα-helixtrans-66.7-36.3177.3-84.4-177.9-24.300112.2A246 K247Q243-A246 PolarHBondContact O-N 3.33Å; Q243-K247 VanDerWaalsContact O-CB 3.28Å; Q243-K247 WeakPolarHBondContact O-CB 3.24Å; Q243-K247 PolarHBondContact O-N 2.97Å
244S61.5Low60.6Low55 Ų5587.4 Ų87.439%0.38545%0.454SS..Hα-helixtrans-66.9-42.4175.562.10000112.1D241 K247 V248D241-S244 WeakPolarHBondContact CA-OG 3.39Å; D241-S244 PolarHBondContact O-OG 2.88Å; S244-K247 WeakPolarHBondContact O-CB 3.43Å; S244-K247 PolarHBondContact O-N 3.44Å; S244-V248 WeakPolarHBondContact O-CG2 3.23Å; S244-V248 PolarHBondContact O-N 2.89Å
245R65.1Low61.3Low187 Ų18789 Ų8971%0.70646%0.459SS*.Hα-helixtrans-66.5-40.1174-70.4177.389174.17.4112D241 F242 K247 V248 A249D241-R245 WeakPolarHBondContact O-CD 3.48Å; D241-R245 WeakPolarHBondContact O-CG 3.47Å; D241-R245 PolarHBondContact O-N 3.06Å; F242-R245 PolarHBondContact O-N 2.69Å; R245-K247 VanDerWaalsContact C-N 3.35Å; R245-V248 PolarHBondContact O-N 3.36Å; R245-A249 VanDerWaalsContact O-CB 3.25Å; R245-A249 WeakPolarHBondContact O-CB 3.36Å; R245-A249 PolarHBondContact O-N 2.78Å
246A64.8Low62.3Low25 Ų2591.5 Ų91.521%0.20747%0.468CS..Hα-helixtrans-62.8-40.7173.100000111.4F242 Q243 A249 V250F242-A246 VanDerWaalsContact O-CB 3.31Å; F242-A246 WeakPolarHBondContact O-CB 3.35Å; F242-A246 PolarHBondContact O-N 3.15Å; Q243-A246 PolarHBondContact O-N 3.33Å; A246-A249 PolarHBondContact O-N 3.32Å; A246-V250 WeakPolarHBondContact O-CB 3.48Å; A246-V250 WeakPolarHBondContact O-CG2 2.93Å; A246-V250 PolarHBondContact O-N 3.14Å
247K63.5Low63.5Low47 Ų4790.7 Ų90.720%0.20446%0.462CS..Hα-helixtrans-61.3-49.9174.9-176.6173.1-176.3-179.30112.2E237 Q243 S244 R245 A249 V250 Q251 L275E237-K247 IonicContact OE1-NZ 3.36Å; E237-K247 PolarHBondContact OE1-NZ 3.18Å; Q243-K247 VanDerWaalsContact O-CB 3.28Å; Q243-K247 WeakPolarHBondContact O-CB 3.24Å; Q243-K247 PolarHBondContact O-N 2.97Å; S244-K247 WeakPolarHBondContact O-CB 3.43Å; S244-K247 PolarHBondContact O-N 3.44Å; R245-K247 VanDerWaalsContact C-N 3.35Å; K247-A249 VanDerWaalsContact C-N 3.29Å; K247-A249 PolarHBondContact O-N 3.39Å; K247-V250 PolarHBondContact O-N 2.8Å; K247-Q251 VanDerWaalsContact O-CB 3.27Å; K247-Q251 WeakPolarHBondContact O-CB 2.7Å; K247-Q251 PolarHBondContact O-N 3.29Å; K247-L275 HydrophobicContact CB-CD1 4.39Å; K247-L275 HydrophobicContact CB-CD2 3.94Å; K247-L275 HydrophobicContact CD-CD1 4.09Å; K247-L275 HydrophobicContact CG-CD1 3.97Å; K247-L275 HydrophobicContact CG-CD2 4.33Å
248V68Low65.3Low65 Ų6587.3 Ų87.339%0.39445%0.454SS..Hα-helixtrans-62.6-38176.1174.30000111.1S244 R245 K252S244-V248 WeakPolarHBondContact O-CG2 3.23Å; S244-V248 PolarHBondContact O-N 2.89Å; R245-V248 PolarHBondContact O-N 3.36Å; V248-K252 HydrophobicContact CG1-CD 4.07Å; V248-K252 HydrophobicContact CG1-CG 4.48Å; V248-K252 WeakPolarHBondContact O-CB 3.29Å; V248-K252 VanDerWaalsContact O-CG 3.26Å; V248-K252 WeakPolarHBondContact O-CG 2.93Å; V248-K252 PolarHBondContact O-N 3.45Å
249A69.9Low67.3Low56 Ų5686.2 Ų86.246%0.46344%0.438SS..Hα-helixtrans-66.8-45.3176.300000112.1R245 A246 K247 K252 L253R245-A249 VanDerWaalsContact O-CB 3.25Å; R245-A249 WeakPolarHBondContact O-CB 3.36Å; R245-A249 PolarHBondContact O-N 2.78Å; A246-A249 PolarHBondContact O-N 3.32Å; K247-A249 VanDerWaalsContact C-N 3.29Å; K247-A249 PolarHBondContact O-N 3.39Å; A249-K252 PolarHBondContact O-N 2.93Å; A249-L253 WeakPolarHBondContact O-CB 3.39Å; A249-L253 PolarHBondContact O-N 2.81Å
250V68.7Low69.2Low9 Ų990.4 Ų90.46%0.05545%0.446CS..Hα-helixtrans-63.1-44.4176.2167.10000110.4A246 K247 L253 I254 L272 A276A246-V250 WeakPolarHBondContact O-CB 3.48Å; A246-V250 WeakPolarHBondContact O-CG2 2.93Å; A246-V250 PolarHBondContact O-N 3.14Å; K247-V250 PolarHBondContact O-N 2.8Å; V250-L253 PolarHBondContact O-N 2.79Å; V250-I254 HydrophobicContact CG1-CD1 3.57Å; V250-I254 HydrophobicContact CG1-CG1 4.33Å; V250-I254 WeakPolarHBondContact O-CB 3.41Å; V250-I254 VanDerWaalsContact O-CG1 3.27Å; V250-I254 WeakPolarHBondContact O-CG1 3.3Å; V250-I254 PolarHBondContact O-N 3.43Å; V250-L272 HydrophobicContact CG2-CD2 4Å; V250-A276 HydrophobicContact CG1-CB 4.38Å
251Q69.4Low70.9Confident63 Ų6382.1 Ų82.129%0.29441%0.408SS..Hα-helixtrans-60.4-49.4175.8-176.6-178.9-0.800111.4K247 L253 I254 Q255 F283K247-Q251 VanDerWaalsContact O-CB 3.27Å; K247-Q251 WeakPolarHBondContact O-CB 2.7Å; K247-Q251 PolarHBondContact O-N 3.29Å; Q251-L253 VanDerWaalsContact C-N 3.3Å; Q251-L253 PolarHBondContact O-N 3.04Å; Q251-I254 PolarHBondContact O-N 2.8Å; Q251-Q255 WeakPolarHBondContact O-CB 3.08Å; Q251-Q255 VanDerWaalsContact O-CG 3.31Å; Q251-Q255 WeakPolarHBondContact O-CG 3.46Å; Q251-Q255 PolarHBondContact O-N 3.39Å; Q251-F283 HydrophobicContact CG-CE2 4.04Å; Q251-F283 HydrophobicContact CG-CZ 4.42Å
252K73.6Confident72.4Confident137 Ų13776.4 Ų76.460%0.59638%0.377SS*.Hα-helixtrans-61.9-37.6176.2-75.8177.7-179.2178.40111.9V248 A249 K256V248-K252 HydrophobicContact CG1-CD 4.07Å; V248-K252 HydrophobicContact CG1-CG 4.48Å; V248-K252 WeakPolarHBondContact O-CB 3.29Å; V248-K252 VanDerWaalsContact O-CG 3.26Å; V248-K252 WeakPolarHBondContact O-CG 2.93Å; V248-K252 PolarHBondContact O-N 3.45Å; A249-K252 PolarHBondContact O-N 2.93Å; K252-K256 WeakPolarHBondContact O-CB 3.46Å; K252-K256 PolarHBondContact O-N 3.23Å
253L75.1Confident73.9Confident64 Ų6469.4 Ų69.434%0.33535%0.347SS..Hα-helixtrans-67.2-46.4178-174.672.9000111.5A249 V250 Q251 K256 V257 A264A249-L253 WeakPolarHBondContact O-CB 3.39Å; A249-L253 PolarHBondContact O-N 2.81Å; V250-L253 PolarHBondContact O-N 2.79Å; Q251-L253 VanDerWaalsContact C-N 3.3Å; Q251-L253 PolarHBondContact O-N 3.04Å; L253-K256 PolarHBondContact O-N 3.1Å; L253-V257 HydrophobicContact CD1-CB 4.45Å; L253-V257 HydrophobicContact CD1-CG2 3.7Å; L253-V257 HydrophobicContact CG-CG2 4.41Å; L253-V257 WeakPolarHBondContact O-CA 3.4Å; L253-V257 VanDerWaalsContact O-CB 3.31Å; L253-V257 WeakPolarHBondContact O-CB 3.41Å; L253-V257 WeakPolarHBondContact O-CG2 3.31Å; L253-V257 PolarHBondContact O-N 3.34Å; L253-A264 HydrophobicContact CD2-CB 4.45Å
254I74.3Confident75.4Confident10 Ų1066.6 Ų66.65%0.05134%0.341CS..Hα-helixtrans-65.5-43.4178.4-67.5167.2000110.2V250 Q251 K256 G258 I262 A276 T279V250-I254 HydrophobicContact CG1-CD1 3.57Å; V250-I254 HydrophobicContact CG1-CG1 4.33Å; V250-I254 WeakPolarHBondContact O-CB 3.41Å; V250-I254 VanDerWaalsContact O-CG1 3.27Å; V250-I254 WeakPolarHBondContact O-CG1 3.3Å; V250-I254 PolarHBondContact O-N 3.43Å; Q251-I254 PolarHBondContact O-N 2.8Å; I254-K256 PolarHBondContact O-N 3.29Å; I254-G258 VanDerWaalsContact O-CA 3.22Å; I254-G258 WeakPolarHBondContact O-CA 3.22Å; I254-G258 PolarHBondContact O-N 2.9Å; I254-I262 HydrophobicContact CG1-CG1 4.25Å; I254-I262 HydrophobicContact CG2-CG1 4.28Å; I254-A276 HydrophobicContact CD1-CB 4.07Å; I254-T279 HydrophobicContact CD1-CG2 4.15Å
255Q72.1Confident76.5Confident119 Ų11964.3 Ų64.356%0.55633%0.325SS*.Hα-helixtrans-66.6-36.6177.7-73.4-179.1-14.800112.8Q251Q251-Q255 WeakPolarHBondContact O-CB 3.08Å; Q251-Q255 VanDerWaalsContact O-CG 3.31Å; Q251-Q255 WeakPolarHBondContact O-CG 3.46Å; Q251-Q255 PolarHBondContact O-N 3.39Å
256K75.2Confident77.4Confident188 Ų18855.4 Ų55.482%0.81729%0.291SS*.Hα-helixtrans-86.3-35.4-175.7-170.6174.4-177.2178.70113.7K252 L253 I254K252-K256 WeakPolarHBondContact O-CB 3.46Å; K252-K256 PolarHBondContact O-N 3.23Å; L253-K256 PolarHBondContact O-N 3.1Å; I254-K256 PolarHBondContact O-N 3.29Å
257V75.2Confident78.3Confident65 Ų6555.2 Ų55.239%0.39429%0.289SS..Hα-helixtrans-115.1-12.7-169.2-1580000112L253 F259 F260L253-V257 HydrophobicContact CD1-CB 4.45Å; L253-V257 HydrophobicContact CD1-CG2 3.7Å; L253-V257 HydrophobicContact CG-CG2 4.41Å; L253-V257 WeakPolarHBondContact O-CA 3.4Å; L253-V257 VanDerWaalsContact O-CB 3.31Å; L253-V257 WeakPolarHBondContact O-CB 3.41Å; L253-V257 WeakPolarHBondContact O-CG2 3.31Å; L253-V257 PolarHBondContact O-N 3.34Å; V257-F259 PolarHBondContact O-N 2.71Å; V257-F260 HydrophobicContact CG1-CB 3.8Å; V257-F260 PolarHBondContact O-N 3.01Å
258G84Confident78.9Confident29 Ų2956.7 Ų56.730%0.29930%0.298SS..THydrogen-bonded Turntrans58.9-121.8175.300000112.1I254 F260 G261 I262I254-G258 VanDerWaalsContact O-CA 3.22Å; I254-G258 WeakPolarHBondContact O-CA 3.22Å; I254-G258 PolarHBondContact O-N 2.9Å; G258-F260 VanDerWaalsContact C-N 3.34Å; G258-F260 PolarHBondContact O-N 2.9Å; G258-G261 PolarHBondContact O-N 3.1Å; G258-I262 WeakPolarHBondContact O-CG1 3.24Å; G258-I262 PolarHBondContact O-N 2.83Å; G258-I262 VanDerWaalsContact O-N 3.14Å
259F86.9Confident78.8Confident69 Ų6957.9 Ų57.930%0.30331%0.307SS..Hα-helixtrans-50.4-46.9-177.2-178-92.3000113.8V257 G261 I262 L263 T289 A293 I296V257-F259 PolarHBondContact O-N 2.71Å; F259-G261 VanDerWaalsContact C-N 3.31Å; F259-G261 PolarHBondContact O-N 3.14Å; F259-I262 PolarHBondContact O-N 3.48Å; F259-L263 WeakPolarHBondContact O-CB 3.42Å; F259-L263 PolarHBondContact O-N 3.22Å; F259-T289 HydrophobicContact CB-CG2 4.16Å; F259-T289 HydrophobicContact CD2-CG2 4Å; F259-T289 WeakPolarHBondContact CD2-O 3.38Å; F259-A293 HydrophobicContact CD2-CB 3.87Å; F259-A293 HydrophobicContact CE2-CB 3.7Å; F259-A293 HydrophobicContact CG-CB 4.37Å; F259-A293 HydrophobicContact CZ-CB 4.04Å; F259-I296 HydrophobicContact CZ-CD1 3.99Å
260F87.6Confident78.6Confident144 Ų14456.3 Ų56.363%0.63229%0.291SS*.Hα-helixtrans-72.2-26.8-178.1-63.5-78.5000112.8V257 G258 L263 A264V257-F260 HydrophobicContact CG1-CB 3.8Å; V257-F260 PolarHBondContact O-N 3.01Å; G258-F260 VanDerWaalsContact C-N 3.34Å; G258-F260 PolarHBondContact O-N 2.9Å; F260-L263 HydrophobicContact CD1-CD2 4.3Å; F260-L263 PolarHBondContact O-N 2.92Å; F260-A264 WeakPolarHBondContact O-CB 3.41Å; F260-A264 PolarHBondContact O-N 3.21Å
261G86Confident78.5Confident1 Ų160.4 Ų60.41%0.0132%0.318CS..Hα-helixtrans-65.4-45.4171.800000111.4G258 F259 L263 A264 C265G258-G261 PolarHBondContact O-N 3.1Å; F259-G261 VanDerWaalsContact C-N 3.31Å; F259-G261 PolarHBondContact O-N 3.14Å; G261-L263 VanDerWaalsContact C-N 3.34Å; G261-L263 PolarHBondContact O-N 3.5Å; G261-A264 PolarHBondContact O-N 3.08Å; G261-C265 PolarHBondContact O-N 3.41Å; G261-C265 VanDerWaalsContact O-N 3.09Å; G261-C265 PolarHBondContact O-SG 3.48Å; G261-C265 VanDerWaalsContact O-SG 3.38Å
262I87.4Confident78.3Confident1 Ų160 Ų601%0.00532%0.318CS..Hα-helixtrans-62.7-43.2175.3-57.4168.6000110.4I254 G258 F259 A264 C265 A266 V285 T289 F290 A293I254-I262 HydrophobicContact CG1-CG1 4.25Å; I254-I262 HydrophobicContact CG2-CG1 4.28Å; G258-I262 WeakPolarHBondContact O-CG1 3.24Å; G258-I262 PolarHBondContact O-N 2.83Å; G258-I262 VanDerWaalsContact O-N 3.14Å; F259-I262 PolarHBondContact O-N 3.48Å; I262-A264 VanDerWaalsContact C-N 3.33Å; I262-A264 PolarHBondContact O-N 3.04Å; I262-C265 PolarHBondContact O-N 3.27Å; I262-A266 WeakPolarHBondContact O-CB 3.47Å; I262-A266 PolarHBondContact O-N 2.88Å; I262-V285 HydrophobicContact CD1-CG1 4Å; I262-T289 HydrophobicContact CD1-CG2 4.41Å; I262-F290 HydrophobicContact CG2-CD2 3.83Å; I262-F290 HydrophobicContact CG2-CE2 4.37Å; I262-A293 HydrophobicContact CB-CB 3.78Å; I262-A293 HydrophobicContact CG2-CB 3.61Å
263L89.9Confident78.2Confident24 Ų2453.5 Ų53.513%0.12629%0.289CS..Hα-helixtrans-59.4-44178178.363.1000111.8F259 F260 G261 A266 S267 A293 I296 G297 I301F259-L263 WeakPolarHBondContact O-CB 3.42Å; F259-L263 PolarHBondContact O-N 3.22Å; F260-L263 HydrophobicContact CD1-CD2 4.3Å; F260-L263 PolarHBondContact O-N 2.92Å; G261-L263 VanDerWaalsContact C-N 3.34Å; G261-L263 PolarHBondContact O-N 3.5Å; L263-A266 PolarHBondContact O-N 3.5Å; L263-S267 WeakPolarHBondContact O-CB 3.43Å; L263-S267 PolarHBondContact O-N 2.92Å; L263-S267 PolarHBondContact O-OG 3.36Å; L263-A293 HydrophobicContact CB-CB 4.21Å; L263-A293 VanDerWaalsContact CD1-O 3.25Å; L263-A293 WeakPolarHBondContact CD1-O 3.26Å; L263-I296 HydrophobicContact CD1-CB 3.81Å; L263-I296 HydrophobicContact CD1-CG2 3.7Å; L263-G297 VanDerWaalsContact CD1-N 3.32Å; L263-I301 HydrophobicContact CD1-CD1 3.9Å; L263-I301 HydrophobicContact CD2-CD1 4.31Å; L263-I301 HydrophobicContact CG-CD1 4.16Å
264A86.1Confident78.1Confident40 Ų4053.5 Ų53.533%0.33129%0.29SS..Hα-helixtrans-62.3-47.2176.900000111.3L253 F260 G261 I262 A266 S267 I268L253-A264 HydrophobicContact CD2-CB 4.45Å; F260-A264 WeakPolarHBondContact O-CB 3.41Å; F260-A264 PolarHBondContact O-N 3.21Å; G261-A264 PolarHBondContact O-N 3.08Å; I262-A264 VanDerWaalsContact C-N 3.33Å; I262-A264 PolarHBondContact O-N 3.04Å; A264-A266 VanDerWaalsContact C-N 3.31Å; A264-A266 PolarHBondContact O-N 2.93Å; A264-S267 PolarHBondContact O-N 2.9Å; A264-I268 WeakPolarHBondContact O-CD1 3.42Å; A264-I268 VanDerWaalsContact O-CG1 3.29Å; A264-I268 WeakPolarHBondContact O-CG1 3.34Å
265C83.4Confident77.8Confident7 Ų754.4 Ų54.45%0.04729%0.294CS..Hα-helixtrans-60.2-39.4175.9-670000112.5G261 I262 S267 A276G261-C265 PolarHBondContact O-N 3.41Å; G261-C265 VanDerWaalsContact O-N 3.09Å; G261-C265 PolarHBondContact O-SG 3.48Å; G261-C265 VanDerWaalsContact O-SG 3.38Å; I262-C265 PolarHBondContact O-N 3.27Å; C265-S267 VanDerWaalsContact C-N 3.31Å; C265-S267 PolarHBondContact O-N 3.36Å; C265-A276 HydrophobicContact CB-CB 3.77Å
266A84.5Confident78.1Confident0 Ų048.8 Ų48.80%027%0.268CS..Hα-helixtrans-72.5-21178.700000114.7I262 L263 A264 F273I262-A266 WeakPolarHBondContact O-CB 3.47Å; I262-A266 PolarHBondContact O-N 2.88Å; L263-A266 PolarHBondContact O-N 3.5Å; A264-A266 VanDerWaalsContact C-N 3.31Å; A264-A266 PolarHBondContact O-N 2.93Å; A266-F273 HydrophobicContact CB-CD2 3.78Å; A266-F273 HydrophobicContact CB-CE2 3.94Å
267S83.6Confident78.5Confident22 Ų2239.8 Ų39.815%0.15423%0.229CC..Hα-helixtrans-86.4-10.6-179.1-56.90000113.5L263 A264 C265 G297 I301L263-S267 WeakPolarHBondContact O-CB 3.43Å; L263-S267 PolarHBondContact O-N 2.92Å; L263-S267 PolarHBondContact O-OG 3.36Å; A264-S267 PolarHBondContact O-N 2.9Å; C265-S267 VanDerWaalsContact C-N 3.31Å; C265-S267 PolarHBondContact O-N 3.36Å; S267-G297 WeakPolarHBondContact OG-CA 3.45Å; S267-I301 WeakPolarHBondContact OG-CD1 3.3Å
268I75.8Confident78.7Confident78 Ų7838.6 Ų38.640%0.422%0.22SC..SBendtrans-109.9164.8-171.6-67175000108.9A264 L272A264-I268 WeakPolarHBondContact O-CD1 3.42Å; A264-I268 VanDerWaalsContact O-CG1 3.29Å; A264-I268 WeakPolarHBondContact O-CG1 3.34Å; I268-L272 HydrophobicContact CB-CD1 4.42Å; I268-L272 HydrophobicContact CG2-CD1 3.37Å
269P66.2Low78.3Confident90 Ų9037.8 Ų37.858%0.58421%0.209SC*.  trans-50151.7-172.3-3338.3000116.3P271 L272P269-P271 WeakPolarHBondContact O-CD 3.24Å; P269-P271 VanDerWaalsContact O-N 3.11Å; P269-L272 PolarHBondContact O-N 3.38Å; P269-L272 VanDerWaalsContact O-N 3.13Å
270N66.2Low78.2Confident22 Ų2234.5 Ų34.512%0.11820%0.195CC..Hα-helixtrans-46.7-41.8-167.4-68.87.5000116.7G132 L272 F273 D274 K302G132-N270 PolarHBondContact N-ND2 3.08Å; N270-L272 PolarHBondContact O-N 3.23Å; N270-L272 VanDerWaalsContact O-N 3.12Å; N270-F273 WeakPolarHBondContact O-CB 3.39Å; N270-F273 PolarHBondContact O-N 3.43Å; N270-D274 PolarHBondContact O-N 3.37Å; N270-K302 PolarHBondContact OD1-NZ 2.93Å
271P65.3Low78Confident96 Ų9627.7 Ų27.762%0.62317%0.165SC*.Hα-helixtrans-59.8-29.1-177.6-26.235.7000114.5P269 F273P269-P271 WeakPolarHBondContact O-CD 3.24Å; P269-P271 VanDerWaalsContact O-N 3.11Å; P271-F273 VanDerWaalsContact C-N 3.33Å
272L65.9Low77.7Confident55 Ų5531 Ų3129%0.28818%0.18SC..Hα-helixtrans-75.5-25.1177.4-77.9165.8000112.5V250 I268 P269 N270 A276V250-L272 HydrophobicContact CG2-CD2 4Å; I268-L272 HydrophobicContact CB-CD1 4.42Å; I268-L272 HydrophobicContact CG2-CD1 3.37Å; P269-L272 PolarHBondContact O-N 3.38Å; P269-L272 VanDerWaalsContact O-N 3.13Å; N270-L272 PolarHBondContact O-N 3.23Å; N270-L272 VanDerWaalsContact O-N 3.12Å; L272-A276 WeakPolarHBondContact O-CB 3.42Å; L272-A276 PolarHBondContact O-N 3.16Å
273F72.4Confident77.4Confident0 Ų035.1 Ų35.10%020%0.198CC..Hα-helixtrans-75.3-46.1176.5-177.6-89.6000112E204 A266 N270 P271 L275 A276 G277 F290 T294E204-F273 HydrophobicContact CB-CD1 3.57Å; E204-F273 HydrophobicContact CB-CE1 3.21Å; E204-F273 HydrophobicContact CB-CZ 4.16Å; E204-F273 HydrophobicContact CG-CD1 4.19Å; E204-F273 HydrophobicContact CG-CE1 4.26Å; E204-F273 WeakPolarHBondContact O-CE1 3.32Å; E204-F273 WeakPolarHBondContact OE2-CB 3.47Å; E204-F273 WeakPolarHBondContact OE2-CD1 3.48Å; E204-F273 WeakPolarHBondContact OE2-CE1 3.49Å; E204-F273 WeakPolarHBondContact OE2-CG 3.34Å; A266-F273 HydrophobicContact CB-CD2 3.78Å; A266-F273 HydrophobicContact CB-CE2 3.94Å; N270-F273 WeakPolarHBondContact O-CB 3.39Å; N270-F273 PolarHBondContact O-N 3.43Å; P271-F273 VanDerWaalsContact C-N 3.33Å; F273-L275 PolarHBondContact O-N 2.89Å; F273-A276 CarbonylContact O-C 3.52Å; F273-A276 WeakPolarHBondContact O-CA 3.25Å; F273-A276 WeakPolarHBondContact O-CB 3.4Å; F273-A276 PolarHBondContact O-N 3.43Å; F273-G277 PolarHBondContact O-N 3.39Å; F273-F290 HydrophobicContact CE1-CZ 4.12Å; F273-F290 HydrophobicContact CE2-CE2 4.08Å; F273-F290 HydrophobicContact CE2-CZ 4.13Å; F273-F290 HydrophobicContact CZ-CE1 4.39Å; F273-F290 AromaticContact CZ-CE2 3.87Å; F273-F290 HydrophobicContact CZ-CE2 3.87Å; F273-F290 AromaticContact CZ-CZ 3.45Å; F273-F290 HydrophobicContact CZ-CZ 3.45Å; F273-F290 VanDerWaalsContact CZ-CZ 3.45Å; F273-T294 HydrophobicContact CD2-CG2 4.34Å; F273-T294 HydrophobicContact CE1-CG2 4.4Å; F273-T294 HydrophobicContact CE2-CG2 3.28Å; F273-T294 WeakPolarHBondContact CE2-OG1 3.42Å; F273-T294 HydrophobicContact CZ-CG2 3.29Å; F273-T294 WeakPolarHBondContact CZ-OG1 3.33Å
274D71.1Confident77.1Confident64 Ų6436.9 Ų36.934%0.34221%0.207SC..Hα-helixtrans-57.3-40.7-179.3-63.6-28000110.6N270 G277 L278N270-D274 PolarHBondContact O-N 3.37Å; D274-G277 PolarHBondContact O-N 3.28Å; D274-L278 WeakPolarHBondContact O-CG 3.48Å; D274-L278 PolarHBondContact O-N 2.95Å
275L69.6Low77.1Confident29 Ų2936.2 Ų36.215%0.15220%0.199CC..Hα-helixtrans-63.7-42.7173.7-172.561.6000113.1K247 F273 G277 T279K247-L275 HydrophobicContact CB-CD1 4.39Å; K247-L275 HydrophobicContact CB-CD2 3.94Å; K247-L275 HydrophobicContact CD-CD1 4.09Å; K247-L275 HydrophobicContact CG-CD1 3.97Å; K247-L275 HydrophobicContact CG-CD2 4.33Å; F273-L275 PolarHBondContact O-N 2.89Å; L275-G277 VanDerWaalsContact C-N 3.32Å; L275-T279 VanDerWaalsContact O-CB 3.29Å; L275-T279 WeakPolarHBondContact O-CB 3.48Å; L275-T279 PolarHBondContact O-N 3.29Å; L275-T279 PolarHBondContact O-OG1 3.45Å
276A77.7Confident77.4Confident0 Ų039.7 Ų39.70%022%0.221CC..Hα-helixtrans-65.2-37.1175.500000111.6V250 I254 C265 L272 F273 T279 C280V250-A276 HydrophobicContact CG1-CB 4.38Å; I254-A276 HydrophobicContact CD1-CB 4.07Å; C265-A276 HydrophobicContact CB-CB 3.77Å; L272-A276 WeakPolarHBondContact O-CB 3.42Å; L272-A276 PolarHBondContact O-N 3.16Å; F273-A276 CarbonylContact O-C 3.52Å; F273-A276 WeakPolarHBondContact O-CA 3.25Å; F273-A276 WeakPolarHBondContact O-CB 3.4Å; F273-A276 PolarHBondContact O-N 3.43Å; A276-T279 PolarHBondContact O-N 2.96Å; A276-C280 VanDerWaalsContact O-CB 3.22Å; A276-C280 WeakPolarHBondContact O-CB 3.46Å; A276-C280 PolarHBondContact O-N 2.56Å; A276-C280 PolarHBondContact O-SG 3.41Å
277G83.5Confident77.7Confident0 Ų042.4 Ų42.40%023%0.233CC..Hα-helixtrans-61.2-52.9175.700000112.2Y208 F273 D274 L275 T279 C280 G281Y208-G277 WeakPolarHBondContact CA-O 3.42Å; F273-G277 PolarHBondContact O-N 3.39Å; D274-G277 PolarHBondContact O-N 3.28Å; L275-G277 VanDerWaalsContact C-N 3.32Å; G277-T279 PolarHBondContact O-N 2.87Å; G277-C280 PolarHBondContact O-N 3.41Å; G277-G281 PolarHBondContact O-N 3.14Å
278L78.9Confident78.1Confident39 Ų3950.7 Ų50.720%0.20426%0.262CS..Hα-helixtrans-57.1-48.1175.2-69.8171.6000111.6P207 A211 F229 L233 D274 G281 H282P207-L278 HydrophobicContact CB-CD2 3.88Å; P207-L278 HydrophobicContact CB-CG 3.99Å; A211-L278 HydrophobicContact CB-CD2 4.19Å; A211-L278 VanDerWaalsContact CB-O 3.27Å; A211-L278 WeakPolarHBondContact CB-O 2.93Å; F229-L278 HydrophobicContact CE2-CD2 3.95Å; F229-L278 HydrophobicContact CZ-CD2 4.24Å; L233-L278 HydrophobicContact CD2-CD1 4.11Å; D274-L278 WeakPolarHBondContact O-CG 3.48Å; D274-L278 PolarHBondContact O-N 2.95Å; L278-G281 PolarHBondContact O-N 3.24Å; L278-H282 WeakPolarHBondContact O-CB 3.31Å; L278-H282 PolarHBondContact O-N 2.97Å
279T76.4Confident78.8Confident13 Ų1349.3 Ų49.38%0.0826%0.257CS..Hα-helixtrans-61.7-47.5-179.6-57.40000111.5I254 L275 A276 G277 G281 H282 F283I254-T279 HydrophobicContact CD1-CG2 4.15Å; L275-T279 VanDerWaalsContact O-CB 3.29Å; L275-T279 WeakPolarHBondContact O-CB 3.48Å; L275-T279 PolarHBondContact O-N 3.29Å; L275-T279 PolarHBondContact O-OG1 3.45Å; A276-T279 PolarHBondContact O-N 2.96Å; G277-T279 PolarHBondContact O-N 2.87Å; T279-G281 VanDerWaalsContact C-N 3.34Å; T279-G281 PolarHBondContact O-N 3.17Å; T279-H282 PolarHBondContact O-N 3.35Å; T279-F283 HydrophobicContact CG2-CD2 3.64Å; T279-F283 HydrophobicContact CG2-CE2 3.71Å; T279-F283 WeakPolarHBondContact O-CD2 3.27Å; T279-F283 PolarHBondContact O-N 3.13Å
280C84.1Confident80Confident0 Ų045 Ų450%023%0.229CC..Hα-helixtrans-65-38178.9-71.50000112.4Y208 A276 G277 L284 V285 F290Y208-C280 HydrophobicContact CD2-CB 3.92Å; Y208-C280 HydrophobicContact CE2-CB 4.12Å; A276-C280 VanDerWaalsContact O-CB 3.22Å; A276-C280 WeakPolarHBondContact O-CB 3.46Å; A276-C280 PolarHBondContact O-N 2.56Å; A276-C280 PolarHBondContact O-SG 3.41Å; G277-C280 PolarHBondContact O-N 3.41Å; C280-L284 PolarHBondContact O-N 2.71Å; C280-V285 HydrophobicContact CB-CB 4.1Å; C280-V285 HydrophobicContact CB-CG2 4.1Å; C280-V285 PolarHBondContact O-N 2.8Å; C280-F290 HydrophobicContact CB-CD2 3.81Å; C280-F290 HydrophobicContact CB-CE2 4.27Å; C280-F290 HydrophobicContact CB-CG 4.37Å
281G84.3Confident81.2Confident0 Ų045.5 Ų45.50%023%0.23CC..Hα-helixtrans-64.8-49.417500000111.5Y208 R212 G277 L278 T279 F283 L284Y208-G281 WeakPolarHBondContact O-CA 3.46Å; R212-G281 WeakPolarHBondContact CA-O 3.21Å; G277-G281 PolarHBondContact O-N 3.14Å; L278-G281 PolarHBondContact O-N 3.24Å; T279-G281 VanDerWaalsContact C-N 3.34Å; T279-G281 PolarHBondContact O-N 3.17Å; G281-F283 VanDerWaalsContact C-N 3.35Å; G281-F283 PolarHBondContact O-N 2.87Å; G281-L284 PolarHBondContact O-N 2.83Å
282H79.6Confident82.6Confident72 Ų7241.9 Ų41.933%0.33321%0.21SC..Hα-helixtrans-59.7-41.2178.4178.7-94.2000112.8A211 R215 L278 T279 L284A211-H282 HydrophobicContact CB-CB 4.47Å; R215-H282 WeakPolarHBondContact CG-O 3.42Å; L278-H282 WeakPolarHBondContact O-CB 3.31Å; L278-H282 PolarHBondContact O-N 2.97Å; T279-H282 PolarHBondContact O-N 3.35Å; H282-L284 PolarHBondContact O-N 3.08Å
283F79.9Confident83.8Confident87 Ų8739.3 Ų39.338%0.38220%0.196SC..THydrogen-bonded Turntrans-83.58.6175.9-69.9-64.1000114.1Q251 T279 G281 V285Q251-F283 HydrophobicContact CG-CE2 4.04Å; Q251-F283 HydrophobicContact CG-CZ 4.42Å; T279-F283 HydrophobicContact CG2-CD2 3.64Å; T279-F283 HydrophobicContact CG2-CE2 3.71Å; T279-F283 WeakPolarHBondContact O-CD2 3.27Å; T279-F283 PolarHBondContact O-N 3.13Å; G281-F283 VanDerWaalsContact C-N 3.35Å; G281-F283 PolarHBondContact O-N 2.87Å; F283-V285 HydrophobicContact CB-CG2 4.45Å; F283-V285 PolarHBondContact O-N 3.34Å; F283-V285 VanDerWaalsContact O-N 3.15Å
284L83.6Confident84.7Confident61 Ų6139.3 Ų39.332%0.31920%0.196SC..THydrogen-bonded Turntrans57.526.5176.2-54.8178.2000114.7R212 R215 L216 C280 G281 H282R212-L284 HydrophobicContact CG-CD2 3.78Å; R212-L284 PolarHBondContact NH1-O 2.92Å; R215-L284 HydrophobicContact CB-CD2 4.02Å; R215-L284 HydrophobicContact CG-CD1 4.22Å; R215-L284 HydrophobicContact CG-CD2 3.91Å; R215-L284 HydrophobicContact CG-CG 4.03Å; L216-L284 HydrophobicContact CD1-CD2 4.39Å; L216-L284 HydrophobicContact CD2-CD1 3.99Å; L216-L284 HydrophobicContact CD2-CD2 3.9Å; L216-L284 HydrophobicContact CG-CD2 3.75Å; C280-L284 PolarHBondContact O-N 2.71Å; G281-L284 PolarHBondContact O-N 2.83Å; H282-L284 PolarHBondContact O-N 3.08Å
285V86.4Confident85.7Confident25 Ų2539 Ų3915%0.15220%0.195CC..  trans-52.2133.6177.4176.70000109.4Y208 R212 I262 C280 F283 F287 T289Y208-V285 PolarHBondContact OH-O 3Å; R212-V285 PolarHBondContact NH1-O 3.5Å; I262-V285 HydrophobicContact CD1-CG1 4Å; C280-V285 HydrophobicContact CB-CB 4.1Å; C280-V285 HydrophobicContact CB-CG2 4.1Å; C280-V285 PolarHBondContact O-N 2.8Å; F283-V285 HydrophobicContact CB-CG2 4.45Å; F283-V285 PolarHBondContact O-N 3.34Å; F283-V285 VanDerWaalsContact O-N 3.15Å; V285-F287 PolarHBondContact O-N 3.49Å; V285-T289 HydrophobicContact CG1-CG2 4.26Å
286P90.5Very high86.9Confident80 Ų8041 Ų4152%0.51920%0.204SC..  trans-54.4138.9-178.5-2633.9000112.6W288 T289 F290P286-W288 VanDerWaalsContact C-N 3.31Å; P286-W288 PolarHBondContact O-N 3.5Å; P286-T289 WeakPolarHBondContact O-CB 3.27Å; P286-T289 PolarHBondContact O-N 3.3Å; P286-T289 VanDerWaalsContact O-N 3.09Å; P286-F290 PolarHBondContact O-N 2.97Å; P286-F290 VanDerWaalsContact O-N 3.14Å
287F90.7Very high87.5Confident57 Ų5741 Ų4125%0.2520%0.204CC..Hα-helixtrans-53.5-47.1-176169.7-102.1000112.3L205 Y208 F209 V285 T289 F290 F291L205-F287 HydrophobicContact CD1-CE2 4.23Å; L205-F287 HydrophobicContact CD2-CE2 3.99Å; Y208-F287 HydrophobicContact CE1-CB 4.48Å; Y208-F287 HydrophobicContact CE1-CD2 4.03Å; Y208-F287 VanDerWaalsContact OH-CA 3.31Å; Y208-F287 WeakPolarHBondContact OH-CA 3.36Å; Y208-F287 PolarHBondContact OH-N 2.8Å; F209-F287 HydrophobicContact CE1-CD2 4.28Å; F209-F287 HydrophobicContact CE2-CE2 4.19Å; F209-F287 AromaticContact CZ-CD2 3.73Å; F209-F287 HydrophobicContact CZ-CD2 3.73Å; F209-F287 AromaticContact CZ-CE2 3.69Å; F209-F287 HydrophobicContact CZ-CE2 3.69Å; V285-F287 PolarHBondContact O-N 3.49Å; F287-T289 VanDerWaalsContact C-N 3.3Å; F287-T289 PolarHBondContact O-N 3.3Å; F287-F290 PolarHBondContact O-N 3.24Å; F287-F291 HydrophobicContact CD1-CB 4.5Å; F287-F291 HydrophobicContact CD2-CB 4.24Å; F287-F291 HydrophobicContact CE1-CB 4.06Å; F287-F291 HydrophobicContact CE1-CD1 4.09Å; F287-F291 HydrophobicContact CE1-CG 4.21Å; F287-F291 HydrophobicContact CE2-CB 3.78Å; F287-F291 HydrophobicContact CE2-CG 4.13Å; F287-F291 HydrophobicContact CZ-CB 3.68Å; F287-F291 AromaticContact CZ-CD1 3.89Å; F287-F291 HydrophobicContact CZ-CD1 3.89Å; F287-F291 HydrophobicContact CZ-CD2 4.26Å; F287-F291 AromaticContact CZ-CG 3.67Å; F287-F291 HydrophobicContact CZ-CG 3.67Å; F287-F291 VanDerWaalsContact O-CB 3.28Å; F287-F291 WeakPolarHBondContact O-CB 3.31Å; F287-F291 PolarHBondContact O-N 2.94Å
288W92.1Very high87.7Confident197 Ų19741 Ų4175%0.74621%0.205SC*.Hα-helixtrans-65.9-30.6-177.9-67111.9000113.7P286 F291 G292P286-W288 VanDerWaalsContact C-N 3.31Å; P286-W288 PolarHBondContact O-N 3.5Å; W288-F291 HydrophobicContact CE3-CD1 4.44Å; W288-F291 HydrophobicContact CZ3-CD1 4.3Å; W288-G292 WeakPolarHBondContact O-CA 3.48Å; W288-G292 PolarHBondContact O-N 3.12Å
289T90.5Very high88.3Confident48 Ų4839.6 Ų39.629%0.29420%0.198SC..Hα-helixtrans-68.6-45.9174.4-53.30000110.5F259 I262 V285 P286 F287 A293F259-T289 HydrophobicContact CB-CG2 4.16Å; F259-T289 HydrophobicContact CD2-CG2 4Å; F259-T289 WeakPolarHBondContact CD2-O 3.38Å; I262-T289 HydrophobicContact CD1-CG2 4.41Å; V285-T289 HydrophobicContact CG1-CG2 4.26Å; P286-T289 WeakPolarHBondContact O-CB 3.27Å; P286-T289 PolarHBondContact O-N 3.3Å; P286-T289 VanDerWaalsContact O-N 3.09Å; F287-T289 VanDerWaalsContact C-N 3.3Å; F287-T289 PolarHBondContact O-N 3.3Å; T289-A293 WeakPolarHBondContact O-CB 3.06Å; T289-A293 PolarHBondContact O-N 2.95Å
290F90.6Very high89Confident0 Ų042.3 Ų42.30%022%0.215CC..Hα-helixtrans-66.9-59.2177.5170.9-109.8000111.3L205 Y208 I262 F273 C280 P286 F287 G292 A293 T294L205-F290 HydrophobicContact CD2-CD1 4.22Å; L205-F290 HydrophobicContact CD2-CE1 3.72Å; Y208-F290 VanDerWaalsContact CB-CE1 3.43Å; Y208-F290 HydrophobicContact CD1-CD1 4.07Å; Y208-F290 HydrophobicContact CD1-CE1 4.19Å; Y208-F290 HydrophobicContact CD2-CB 4.33Å; Y208-F290 AromaticContact CD2-CD1 3.48Å; Y208-F290 HydrophobicContact CD2-CD1 3.48Å; Y208-F290 VanDerWaalsContact CD2-CD1 3.48Å; Y208-F290 HydrophobicContact CD2-CD2 4.25Å; Y208-F290 AromaticContact CD2-CE1 3.73Å; Y208-F290 HydrophobicContact CD2-CE1 3.73Å; Y208-F290 HydrophobicContact CD2-CE2 4.47Å; Y208-F290 AromaticContact CD2-CG 3.76Å; Y208-F290 HydrophobicContact CD2-CG 3.76Å; Y208-F290 HydrophobicContact CD2-CZ 4.22Å; Y208-F290 HydrophobicContact CE1-CD1 4.43Å; Y208-F290 HydrophobicContact CE2-CB 3.99Å; Y208-F290 AromaticContact CE2-CD1 3.87Å; Y208-F290 HydrophobicContact CE2-CD1 3.87Å; Y208-F290 AromaticContact CE2-CG 3.93Å; Y208-F290 HydrophobicContact CE2-CG 3.93Å; Y208-F290 AromaticContact CG-CD1 3.59Å; Y208-F290 HydrophobicContact CG-CD1 3.59Å; Y208-F290 AromaticContact CG-CE1 3.51Å; Y208-F290 HydrophobicContact CG-CE1 3.51Å; Y208-F290 HydrophobicContact CG-CG 4.34Å; Y208-F290 HydrophobicContact CG-CZ 4.21Å; I262-F290 HydrophobicContact CG2-CD2 3.83Å; I262-F290 HydrophobicContact CG2-CE2 4.37Å; F273-F290 HydrophobicContact CE1-CZ 4.12Å; F273-F290 HydrophobicContact CE2-CE2 4.08Å; F273-F290 HydrophobicContact CE2-CZ 4.13Å; F273-F290 HydrophobicContact CZ-CE1 4.39Å; F273-F290 AromaticContact CZ-CE2 3.87Å; F273-F290 HydrophobicContact CZ-CE2 3.87Å; F273-F290 AromaticContact CZ-CZ 3.45Å; F273-F290 HydrophobicContact CZ-CZ 3.45Å; F273-F290 VanDerWaalsContact CZ-CZ 3.45Å; C280-F290 HydrophobicContact CB-CD2 3.81Å; C280-F290 HydrophobicContact CB-CE2 4.27Å; C280-F290 HydrophobicContact CB-CG 4.37Å; P286-F290 PolarHBondContact O-N 2.97Å; P286-F290 VanDerWaalsContact O-N 3.14Å; F287-F290 PolarHBondContact O-N 3.24Å; F290-G292 PolarHBondContact O-N 2.59Å; F290-A293 PolarHBondContact O-N 2.91Å; F290-T294 PolarHBondContact O-N 3Å; F290-T294 PolarHBondContact O-OG1 3.39Å
291F92.6Very high89.3Confident33 Ų3345.3 Ų45.315%0.14523%0.23CC..Hα-helixtrans-62.6-39.3-176.4-179.6-114.5000112.6A201 I202 L205 F287 W288 T294 L295A201-F291 HydrophobicContact CB-CE2 4.39Å; I202-F291 HydrophobicContact CG1-CE2 4.14Å; I202-F291 HydrophobicContact CG1-CZ 4.29Å; L205-F291 HydrophobicContact CD1-CD2 4.25Å; L205-F291 HydrophobicContact CD1-CE2 4.33Å; L205-F291 HydrophobicContact CD2-CD2 3.94Å; L205-F291 HydrophobicContact CG-CD2 4.46Å; F287-F291 HydrophobicContact CD1-CB 4.5Å; F287-F291 HydrophobicContact CD2-CB 4.24Å; F287-F291 HydrophobicContact CE1-CB 4.06Å; F287-F291 HydrophobicContact CE1-CD1 4.09Å; F287-F291 HydrophobicContact CE1-CG 4.21Å; F287-F291 HydrophobicContact CE2-CB 3.78Å; F287-F291 HydrophobicContact CE2-CG 4.13Å; F287-F291 HydrophobicContact CZ-CB 3.68Å; F287-F291 AromaticContact CZ-CD1 3.89Å; F287-F291 HydrophobicContact CZ-CD1 3.89Å; F287-F291 HydrophobicContact CZ-CD2 4.26Å; F287-F291 AromaticContact CZ-CG 3.67Å; F287-F291 HydrophobicContact CZ-CG 3.67Å; F287-F291 VanDerWaalsContact O-CB 3.28Å; F287-F291 WeakPolarHBondContact O-CB 3.31Å; F287-F291 PolarHBondContact O-N 2.94Å; W288-F291 HydrophobicContact CE3-CD1 4.44Å; W288-F291 HydrophobicContact CZ3-CD1 4.3Å; F291-T294 PolarHBondContact O-N 3.23Å; F291-L295 HydrophobicContact CE1-CD2 4.41Å; F291-L295 VanDerWaalsContact O-CB 3.23Å; F291-L295 WeakPolarHBondContact O-CB 3.36Å; F291-L295 PolarHBondContact O-N 3.05Å
292G93.3Very high89.4Confident20 Ų2046.7 Ų46.721%0.20624%0.236CC..Hα-helixtrans-61.7-45.9175.800000112.2W288 F290 L295 I296W288-G292 WeakPolarHBondContact O-CA 3.48Å; W288-G292 PolarHBondContact O-N 3.12Å; F290-G292 PolarHBondContact O-N 2.59Å; G292-L295 PolarHBondContact O-N 2.69Å; G292-I296 WeakPolarHBondContact O-CG1 3.43Å; G292-I296 PolarHBondContact O-N 3.27Å; G292-I296 VanDerWaalsContact O-N 3.1Å
293A92.1Very high89.9Confident0 Ų043.4 Ų43.40%022%0.221CC..Hα-helixtrans-63.9-42.7175.600000111.8F259 I262 L263 T289 F290 G297F259-A293 HydrophobicContact CD2-CB 3.87Å; F259-A293 HydrophobicContact CE2-CB 3.7Å; F259-A293 HydrophobicContact CG-CB 4.37Å; F259-A293 HydrophobicContact CZ-CB 4.04Å; I262-A293 HydrophobicContact CB-CB 3.78Å; I262-A293 HydrophobicContact CG2-CB 3.61Å; L263-A293 HydrophobicContact CB-CB 4.21Å; L263-A293 VanDerWaalsContact CD1-O 3.25Å; L263-A293 WeakPolarHBondContact CD1-O 3.26Å; T289-A293 WeakPolarHBondContact O-CB 3.06Å; T289-A293 PolarHBondContact O-N 2.95Å; F290-A293 PolarHBondContact O-N 2.91Å; A293-G297 PolarHBondContact O-N 3Å
294T90.5Very high90.3Very high0 Ų041.4 Ų41.40%021%0.213CC..Hα-helixtrans-60-47.4175.4-56.10000112.3A201 F273 F290 F291 I296 G297 K298A201-T294 HydrophobicContact CB-CG2 3.75Å; F273-T294 HydrophobicContact CD2-CG2 4.34Å; F273-T294 HydrophobicContact CE1-CG2 4.4Å; F273-T294 HydrophobicContact CE2-CG2 3.28Å; F273-T294 WeakPolarHBondContact CE2-OG1 3.42Å; F273-T294 HydrophobicContact CZ-CG2 3.29Å; F273-T294 WeakPolarHBondContact CZ-OG1 3.33Å; F290-T294 PolarHBondContact O-N 3Å; F290-T294 PolarHBondContact O-OG1 3.39Å; F291-T294 PolarHBondContact O-N 3.23Å; T294-I296 PolarHBondContact O-N 3.34Å; T294-G297 PolarHBondContact O-N 2.88Å; T294-K298 HydrophobicContact CG2-CD 3.92Å; T294-K298 HydrophobicContact CG2-CG 4.48Å; T294-K298 WeakPolarHBondContact O-CB 3.33Å; T294-K298 PolarHBondContact O-N 2.94Å
295L93.4Very high90.6Very high58 Ų5843.5 Ų43.530%0.30422%0.223SC..Hα-helixtrans-62.8-45.4-177.6-175.565.9000110.6A198 A201 F291 G292 A299A198-L295 HydrophobicContact CB-CD1 3.67Å; A201-L295 HydrophobicContact CB-CD1 4.19Å; F291-L295 HydrophobicContact CE1-CD2 4.41Å; F291-L295 VanDerWaalsContact O-CB 3.23Å; F291-L295 WeakPolarHBondContact O-CB 3.36Å; F291-L295 PolarHBondContact O-N 3.05Å; G292-L295 PolarHBondContact O-N 2.69Å; L295-A299 HydrophobicContact CD1-CB 4.1Å; L295-A299 WeakPolarHBondContact O-CA 3.32Å; L295-A299 WeakPolarHBondContact O-CB 3.23Å; L295-A299 PolarHBondContact O-N 3.42Å
296I93.6Very high90.5Very high70 Ų7044 Ų4436%0.35922%0.224SC..Iπ-helixtrans-64.8-46.4176-63172.4000110.3F259 L263 G292 T294 K298 V300 I301F259-I296 HydrophobicContact CZ-CD1 3.99Å; L263-I296 HydrophobicContact CD1-CB 3.81Å; L263-I296 HydrophobicContact CD1-CG2 3.7Å; G292-I296 WeakPolarHBondContact O-CG1 3.43Å; G292-I296 PolarHBondContact O-N 3.27Å; G292-I296 VanDerWaalsContact O-N 3.1Å; T294-I296 PolarHBondContact O-N 3.34Å; I296-K298 VanDerWaalsContact C-N 3.31Å; I296-K298 PolarHBondContact O-N 3.49Å; I296-V300 HydrophobicContact CG2-CB 4.44Å; I296-V300 WeakPolarHBondContact O-CA 3.22Å; I296-V300 VanDerWaalsContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CB 3.47Å; I296-V300 PolarHBondContact O-N 3.31Å; I296-V300 VanDerWaalsContact O-N 3.08Å; I296-I301 HydrophobicContact CG2-CD1 4.49Å; I296-I301 PolarHBondContact O-N 3.38Å
297G90.2Very high90.3Very high0 Ų040.2 Ų40.20%020%0.199CC..Iπ-helixtrans-58.9-41.5-179.600000112.5L263 S267 A293 T294 I301 K302L263-G297 VanDerWaalsContact CD1-N 3.32Å; S267-G297 WeakPolarHBondContact OG-CA 3.45Å; A293-G297 PolarHBondContact O-N 3Å; T294-G297 PolarHBondContact O-N 2.88Å; G297-I301 PolarHBondContact O-N 3.34Å; G297-K302 VanDerWaalsContact O-CB 3.24Å; G297-K302 WeakPolarHBondContact O-CB 3.04Å; G297-K302 PolarHBondContact O-N 3.48Å
298K88.4Confident90.3Very high2 Ų240.2 Ų40.21%0.00920%0.202CC..Iπ-helixtrans-91-49.7-175.8-68.6-177.4-175.9-77.80114.1A201 E204 T294 I296 M303A201-K298 HydrophobicContact CB-CB 4.42Å; A201-K298 HydrophobicContact CB-CD 4.2Å; E204-K298 WeakPolarHBondContact OE1-CE 3.26Å; E204-K298 IonicContact OE1-NZ 3.56Å; E204-K298 PolarHBondContact OE1-NZ 3.14Å; E204-K298 WeakPolarHBondContact OE2-CE 3.42Å; E204-K298 IonicContact OE2-NZ 3.31Å; E204-K298 PolarHBondContact OE2-NZ 3.34Å; T294-K298 HydrophobicContact CG2-CD 3.92Å; T294-K298 HydrophobicContact CG2-CG 4.48Å; T294-K298 WeakPolarHBondContact O-CB 3.33Å; T294-K298 PolarHBondContact O-N 2.94Å; I296-K298 VanDerWaalsContact C-N 3.31Å; I296-K298 PolarHBondContact O-N 3.49Å; K298-M303 WeakPolarHBondContact O-CB 3.47Å; K298-M303 PolarHBondContact O-N 3.44Å; K298-M303 VanDerWaalsContact O-N 3.13Å
299A91.6Very high89.9Confident8 Ų837.7 Ų37.77%0.06620%0.196CC..Iπ-helixtrans-78.3-23-175.800000113.5C194 A198 L295C194-A299 PolarHBondContact SG-O 3.4Å; C194-A299 VanDerWaalsContact SG-O 3.35Å; A198-A299 HydrophobicContact CB-CB 4.44Å; L295-A299 HydrophobicContact CD1-CB 4.1Å; L295-A299 WeakPolarHBondContact O-CA 3.32Å; L295-A299 WeakPolarHBondContact O-CB 3.23Å; L295-A299 PolarHBondContact O-N 3.42Å
300V91.1Very high89.6Confident70 Ų7035.9 Ų35.942%0.42419%0.185SC..Iπ-helixtrans-109.6-65.6179.1-169.90000110.4I296 H304I296-V300 HydrophobicContact CG2-CB 4.44Å; I296-V300 WeakPolarHBondContact O-CA 3.22Å; I296-V300 VanDerWaalsContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CB 3.47Å; I296-V300 PolarHBondContact O-N 3.31Å; I296-V300 VanDerWaalsContact O-N 3.08Å; V300-H304 WeakPolarHBondContact O-CB 3.48Å; V300-H304 PolarHBondContact O-CD2 3.48Å; V300-H304 VanDerWaalsContact O-CG 3.22Å; V300-H304 PolarHBondContact O-N 3.24Å
301I90Very high89.3Confident64 Ų6435.9 Ų35.933%0.32819%0.185SC..Iπ-helixtrans-70.6-64.1-168.4-58.9175.5000111.6L263 S267 I296 G297 M303 H304 I305L263-I301 HydrophobicContact CD1-CD1 3.9Å; L263-I301 HydrophobicContact CD2-CD1 4.31Å; L263-I301 HydrophobicContact CG-CD1 4.16Å; S267-I301 WeakPolarHBondContact OG-CD1 3.3Å; I296-I301 HydrophobicContact CG2-CD1 4.49Å; I296-I301 PolarHBondContact O-N 3.38Å; G297-I301 PolarHBondContact O-N 3.34Å; I301-M303 VanDerWaalsContact C-N 3.32Å; I301-M303 PolarHBondContact O-N 2.92Å; I301-H304 PolarHBondContact O-N 3.39Å; I301-H304 VanDerWaalsContact O-N 3.15Å; I301-I305 HydrophobicContact CG2-CD1 4.07Å; I301-I305 WeakPolarHBondContact O-CG1 3.3Å; I301-I305 PolarHBondContact O-N 3.38Å; I301-I305 VanDerWaalsContact O-N 3.07Å
302K87.9Confident88.8Confident29 Ų2936.5 Ų36.513%0.12619%0.189CC..Iπ-helixtrans-57.2-46.6-178-178.6-176.7175.6-175.50111.3N270 G297 H304 I305 Q306N270-K302 PolarHBondContact OD1-NZ 2.93Å; G297-K302 VanDerWaalsContact O-CB 3.24Å; G297-K302 WeakPolarHBondContact O-CB 3.04Å; G297-K302 PolarHBondContact O-N 3.48Å; K302-H304 VanDerWaalsContact C-N 3.34Å; K302-H304 PolarHBondContact O-N 3.3Å; K302-I305 PolarHBondContact O-N 2.84Å; K302-Q306 WeakPolarHBondContact O-CG 3.15Å; K302-Q306 PolarHBondContact O-N 3.4Å
303M88.4Confident87.9Confident2 Ų236.8 Ų36.81%0.0119%0.187CC..Hα-helixtrans-62.5-40.6179.2179.754.380.300112.2F136 L140 A193 W196 K298 I301 I305 Q306 K307F136-M303 HydrophobicContact CE2-SD 4.44Å; L140-M303 HydrophobicContact CD2-CE 3.16Å; L140-M303 HydrophobicContact CD2-SD 3.69Å; A193-M303 HydrophobicContact CB-CE 4.31Å; A193-M303 HydrophobicContact CB-CG 3.56Å; A193-M303 HydrophobicContact CB-SD 3.63Å; A193-M303 WeakPolarHBondContact O-CE 3.45Å; A193-M303 WeakPolarHBondContact O-CG 3.37Å; W196-M303 HydrophobicContact CB-CE 3.88Å; W196-M303 VanDerWaalsContact CD1-CE 3.42Å; W196-M303 HydrophobicContact CG-CE 3.88Å; K298-M303 WeakPolarHBondContact O-CB 3.47Å; K298-M303 PolarHBondContact O-N 3.44Å; K298-M303 VanDerWaalsContact O-N 3.13Å; I301-M303 VanDerWaalsContact C-N 3.32Å; I301-M303 PolarHBondContact O-N 2.92Å; M303-I305 VanDerWaalsContact C-N 3.34Å; M303-I305 PolarHBondContact O-N 3.41Å; M303-Q306 PolarHBondContact O-N 2.81Å; M303-K307 WeakPolarHBondContact O-CG 3.42Å; M303-K307 PolarHBondContact O-N 2.93Å
304H89.4Confident86.9Confident45 Ų4538 Ų3821%0.20819%0.192CC..Hα-helixtrans-63.2-40175.8-82.1-114000112.7V300 I301 K302 K307 L308V300-H304 WeakPolarHBondContact O-CB 3.48Å; V300-H304 PolarHBondContact O-CD2 3.48Å; V300-H304 VanDerWaalsContact O-CG 3.22Å; V300-H304 PolarHBondContact O-N 3.24Å; I301-H304 PolarHBondContact O-N 3.39Å; I301-H304 VanDerWaalsContact O-N 3.15Å; K302-H304 VanDerWaalsContact C-N 3.34Å; K302-H304 PolarHBondContact O-N 3.3Å; H304-K307 PolarHBondContact CD2-NZ 2.9Å; H304-K307 PolarHBondContact CE1-NZ 2.98Å; H304-K307 VanDerWaalsContact ND1-CE 3.34Å; H304-K307 WeakPolarHBondContact ND1-CE 3.34Å; H304-K307 PolarHBondContact NE2-NZ 2.96Å; H304-K307 WeakPolarHBondContact O-CG 3.36Å; H304-L308 WeakPolarHBondContact O-CB 3.48Å; H304-L308 WeakPolarHBondContact O-CD1 3.43Å; H304-L308 WeakPolarHBondContact O-CG 3.14Å; H304-L308 PolarHBondContact O-N 2.72Å
305I88.4Confident86.1Confident105 Ų10538 Ų3854%0.53819%0.193SC..Hα-helixtrans-62.5-48.7174.7-63.7165.9000110.5I301 K302 M303 L308 F309I301-I305 HydrophobicContact CG2-CD1 4.07Å; I301-I305 WeakPolarHBondContact O-CG1 3.3Å; I301-I305 PolarHBondContact O-N 3.38Å; I301-I305 VanDerWaalsContact O-N 3.07Å; K302-I305 PolarHBondContact O-N 2.84Å; M303-I305 VanDerWaalsContact C-N 3.34Å; M303-I305 PolarHBondContact O-N 3.41Å; I305-L308 PolarHBondContact O-N 3.17Å; I305-F309 WeakPolarHBondContact O-CB 3.49Å; I305-F309 PolarHBondContact O-N 2.7Å
306Q84.3Confident84.8Confident36 Ų3640.6 Ų40.617%0.16820%0.201CC..Hα-helixtrans-63.8-45.7-178.8-72.6-177-40.600112.7F136 K302 M303 F309 V310F136-Q306 HydrophobicContact CE1-CB 4.49Å; F136-Q306 HydrophobicContact CE2-CB 4.05Å; F136-Q306 HydrophobicContact CZ-CB 3.88Å; K302-Q306 WeakPolarHBondContact O-CG 3.15Å; K302-Q306 PolarHBondContact O-N 3.4Å; M303-Q306 PolarHBondContact O-N 2.81Å; Q306-F309 PolarHBondContact O-N 2.84Å; Q306-V310 WeakPolarHBondContact O-CG2 3.29Å; Q306-V310 PolarHBondContact O-N 3.42Å; Q306-V310 VanDerWaalsContact O-N 3.14Å
307K88.2Confident83.3Confident0 Ų042.9 Ų42.90%021%0.21CC..Hα-helixtrans-68.9-36.7177.975.2-173.7170.5176.10112.4I144 A193 M303 H304 F309 V310 I311I144-K307 HydrophobicContact CD1-CB 3.78Å; A193-K307 HydrophobicContact CB-CD 4.1Å; M303-K307 WeakPolarHBondContact O-CG 3.42Å; M303-K307 PolarHBondContact O-N 2.93Å; H304-K307 PolarHBondContact CD2-NZ 2.9Å; H304-K307 PolarHBondContact CE1-NZ 2.98Å; H304-K307 VanDerWaalsContact ND1-CE 3.34Å; H304-K307 WeakPolarHBondContact ND1-CE 3.34Å; H304-K307 PolarHBondContact NE2-NZ 2.96Å; H304-K307 WeakPolarHBondContact O-CG 3.36Å; K307-F309 VanDerWaalsContact C-N 3.33Å; K307-V310 PolarHBondContact O-N 2.73Å; K307-I311 WeakPolarHBondContact O-CB 3.38Å; K307-I311 WeakPolarHBondContact O-CG1 3.31Å; K307-I311 PolarHBondContact O-N 2.94Å
308L88.8Confident81.9Confident58 Ų5844.9 Ų44.930%0.30422%0.22SC..Hα-helixtrans-59.6-46.8174.9-85.1168000110.8L182 I186 H304 I305 V310 I311 I312L182-L308 HydrophobicContact CD2-CD2 3.75Å; I186-L308 HydrophobicContact CD1-CD2 3.34Å; I186-L308 HydrophobicContact CD1-CG 4.15Å; I186-L308 HydrophobicContact CG1-CD2 4.3Å; H304-L308 WeakPolarHBondContact O-CB 3.48Å; H304-L308 WeakPolarHBondContact O-CD1 3.43Å; H304-L308 WeakPolarHBondContact O-CG 3.14Å; H304-L308 PolarHBondContact O-N 2.72Å; I305-L308 PolarHBondContact O-N 3.17Å; L308-V310 PolarHBondContact O-N 3.49Å; L308-I311 PolarHBondContact O-N 3.42Å; L308-I312 WeakPolarHBondContact O-CB 3.48Å; L308-I312 VanDerWaalsContact O-CG1 3.23Å; L308-I312 WeakPolarHBondContact O-CG1 3.33Å; L308-I312 PolarHBondContact O-N 3.25Å
309F84.7Confident80.5Confident144 Ų14445.8 Ų45.863%0.63223%0.226SC*.Hα-helixtrans-55.3-52176.1179.1-100.4000110.9I305 Q306 K307 I311 I312 T313I305-F309 WeakPolarHBondContact O-CB 3.49Å; I305-F309 PolarHBondContact O-N 2.7Å; Q306-F309 PolarHBondContact O-N 2.84Å; K307-F309 VanDerWaalsContact C-N 3.33Å; F309-I311 PolarHBondContact O-N 3.31Å; F309-I312 PolarHBondContact O-N 3.22Å; F309-T313 WeakPolarHBondContact O-CB 3.28Å; F309-T313 PolarHBondContact O-N 3.49Å; F309-T313 PolarHBondContact O-OG1 3.1Å
310V83.6Confident79.2Confident9 Ų950.7 Ų50.76%0.05525%0.248CC..Hα-helixtrans-60.3-48.2178.5178.60000111.9F136 I144 A145 Q306 K307 L308 I312 T313 F314F136-V310 HydrophobicContact CE1-CG2 3.81Å; F136-V310 HydrophobicContact CZ-CG2 3.79Å; I144-V310 HydrophobicContact CB-CG1 4.01Å; I144-V310 HydrophobicContact CG2-CB 4.05Å; I144-V310 HydrophobicContact CG2-CG1 3.7Å; A145-V310 HydrophobicContact CB-CG1 4.24Å; Q306-V310 WeakPolarHBondContact O-CG2 3.29Å; Q306-V310 PolarHBondContact O-N 3.42Å; Q306-V310 VanDerWaalsContact O-N 3.14Å; K307-V310 PolarHBondContact O-N 2.73Å; L308-V310 PolarHBondContact O-N 3.49Å; V310-I312 VanDerWaalsContact C-N 3.31Å; V310-I312 PolarHBondContact O-N 2.95Å; V310-T313 PolarHBondContact O-N 3.37Å; V310-F314 HydrophobicContact CG1-CD2 3.85Å; V310-F314 HydrophobicContact CG1-CE2 4.15Å; V310-F314 VanDerWaalsContact O-CD2 3.3Å; V310-F314 WeakPolarHBondContact O-CD2 3.25Å; V310-F314 PolarHBondContact O-N 3.2Å
311I85.5Confident77.8Confident0 Ų052 Ų520%025%0.249CC..Hα-helixtrans-61.2-41-178.8-66.1165.6000111.1I144 T148 L182 I185 I186 V189 K307 L308 F309 F314 S315I144-I311 HydrophobicContact CG2-CD1 4.3Å; I144-I311 HydrophobicContact CG2-CG1 3.65Å; T148-I311 HydrophobicContact CG2-CG2 4.13Å; L182-I311 HydrophobicContact CD1-CG2 3.92Å; L182-I311 HydrophobicContact CG-CG2 3.99Å; I185-I311 HydrophobicContact CB-CD1 4.45Å; I185-I311 HydrophobicContact CB-CG2 4.37Å; I185-I311 HydrophobicContact CD1-CG2 4.42Å; I185-I311 HydrophobicContact CG2-CD1 3.93Å; I185-I311 HydrophobicContact CG2-CG1 4.02Å; I185-I311 HydrophobicContact CG2-CG2 4.16Å; I186-I311 HydrophobicContact CB-CD1 4.35Å; I186-I311 HydrophobicContact CG1-CD1 3.48Å; I186-I311 VanDerWaalsContact CG1-CD1 3.48Å; V189-I311 HydrophobicContact CG2-CD1 4.42Å; K307-I311 WeakPolarHBondContact O-CB 3.38Å; K307-I311 WeakPolarHBondContact O-CG1 3.31Å; K307-I311 PolarHBondContact O-N 2.94Å; L308-I311 PolarHBondContact O-N 3.42Å; F309-I311 PolarHBondContact O-N 3.31Å; I311-F314 PolarHBondContact O-N 3.12Å; I311-S315 VanDerWaalsContact O-CB 3.25Å; I311-S315 WeakPolarHBondContact O-CB 3.2Å; I311-S315 PolarHBondContact O-N 3.14Å
312I81.7Confident76.2Confident47 Ų4753.6 Ų53.624%0.24126%0.256CS..Hα-helixtrans-65-48.2176.9-70.9169.1000110.6L182 L308 F309 V310 F314 S315 I318 V319 M322L182-I312 HydrophobicContact CD1-CD1 4.48Å; L182-I312 HydrophobicContact CD1-CG1 3.68Å; L308-I312 WeakPolarHBondContact O-CB 3.48Å; L308-I312 VanDerWaalsContact O-CG1 3.23Å; L308-I312 WeakPolarHBondContact O-CG1 3.33Å; L308-I312 PolarHBondContact O-N 3.25Å; F309-I312 PolarHBondContact O-N 3.22Å; V310-I312 VanDerWaalsContact C-N 3.31Å; V310-I312 PolarHBondContact O-N 2.95Å; I312-F314 PolarHBondContact O-N 3.29Å; I312-S315 PolarHBondContact O-N 2.99Å; I312-I318 HydrophobicContact CG2-CG2 3.8Å; I312-V319 WeakPolarHBondContact O-CG2 3.34Å; I312-M322 HydrophobicContact CG2-CE 4.42Å; I312-M322 HydrophobicContact CG2-SD 3.98Å
313T73.4Confident74.9Confident25 Ų2553.5 Ų53.515%0.15326%0.258CS..Hα-helixtrans-56.9-35.7178.4-66.20000112.5F309 V310 V319 F342F309-T313 WeakPolarHBondContact O-CB 3.28Å; F309-T313 PolarHBondContact O-N 3.49Å; F309-T313 PolarHBondContact O-OG1 3.1Å; V310-T313 PolarHBondContact O-N 3.37Å; T313-V319 WeakPolarHBondContact O-CG2 3.39Å; T313-F342 HydrophobicContact CG2-CE2 3.79Å; T313-F342 HydrophobicContact CG2-CZ 3.42Å; T313-F342 VanDerWaalsContact CG2-CZ 3.42Å; T313-F342 WeakPolarHBondContact O-CZ 3.21Å
314F72.2Confident73.6Confident26 Ų2656.2 Ų56.211%0.11428%0.277CS..THydrogen-bonded Turntrans-99.73.5-178.3-73.7-89.6000113.9A145 T148 L149 V310 I311 I312 K316 L346A145-F314 HydrophobicContact CB-CD1 3.91Å; A145-F314 HydrophobicContact CB-CD2 3.76Å; A145-F314 HydrophobicContact CB-CE1 3.93Å; A145-F314 HydrophobicContact CB-CE2 3.79Å; A145-F314 HydrophobicContact CB-CG 3.83Å; A145-F314 HydrophobicContact CB-CZ 3.88Å; T148-F314 HydrophobicContact CG2-CB 4.17Å; L149-F314 HydrophobicContact CD1-CD1 4.33Å; L149-F314 HydrophobicContact CG-CD1 4.47Å; V310-F314 HydrophobicContact CG1-CD2 3.85Å; V310-F314 HydrophobicContact CG1-CE2 4.15Å; V310-F314 VanDerWaalsContact O-CD2 3.3Å; V310-F314 WeakPolarHBondContact O-CD2 3.25Å; V310-F314 PolarHBondContact O-N 3.2Å; I311-F314 PolarHBondContact O-N 3.12Å; I312-F314 PolarHBondContact O-N 3.29Å; F314-K316 PolarHBondContact O-N 3.48Å; F314-L346 HydrophobicContact CD1-CD2 3.23Å; F314-L346 HydrophobicContact CE1-CD2 3.38Å; F314-L346 HydrophobicContact CG-CD2 3.92Å; F314-L346 HydrophobicContact CZ-CD2 4.16Å
315S73.1Confident72.1Confident1 Ų159.3 Ų59.31%0.00730%0.295CS..  trans-88.7105.2174.3179.10000110.6Y152 I311 I312 H317 I318 V319Y152-S315 WeakPolarHBondContact CE2-OG 3.34Å; Y152-S315 WeakPolarHBondContact OH-CB 3.4Å; Y152-S315 PolarHBondContact OH-OG 3.17Å; I311-S315 VanDerWaalsContact O-CB 3.25Å; I311-S315 WeakPolarHBondContact O-CB 3.2Å; I311-S315 PolarHBondContact O-N 3.14Å; I312-S315 PolarHBondContact O-N 2.99Å; S315-H317 VanDerWaalsContact C-N 3.28Å; S315-H317 PolarHBondContact O-N 2.77Å; S315-I318 PolarHBondContact O-N 3.25Å; S315-I318 VanDerWaalsContact O-N 3.11Å; S315-I318 WeakPolarHBondContact OG-CG1 3.34Å; S315-V319 WeakPolarHBondContact O-CB 3.33Å; S315-V319 VanDerWaalsContact O-CG2 3.24Å; S315-V319 WeakPolarHBondContact O-CG2 3.26Å; S315-V319 PolarHBondContact O-N 3.4Å
316K65.7Low70.6Confident112 Ų11258.2 Ų58.249%0.48729%0.289SS..Hα-helixtrans-51.1-46-178.8-69.2-175.8174.3-174.60113.1F314 E320F314-K316 PolarHBondContact O-N 3.48Å; K316-E320 WeakPolarHBondContact O-CB 3.3Å; K316-E320 VanDerWaalsContact O-CG 3.28Å; K316-E320 WeakPolarHBondContact O-CG 3.41Å; K316-E320 PolarHBondContact O-N 3.49Å
317H62.5Low69.2Low118 Ų11857.5 Ų57.555%0.54629%0.291SS..Hα-helixtrans-65.9-39.7-178.6-170.1-50.8000112.4S315 Q321S315-H317 VanDerWaalsContact C-N 3.28Å; S315-H317 PolarHBondContact O-N 2.77Å; H317-Q321 PolarHBondContact CE1-NE2 3.04Å; H317-Q321 PolarHBondContact CE1-OE1 2.93Å; H317-Q321 VanDerWaalsContact ND1-CD 3.32Å; H317-Q321 PolarHBondContact ND1-OE1 3.22Å; H317-Q321 WeakPolarHBondContact O-CB 3.5Å; H317-Q321 VanDerWaalsContact O-CG 3.29Å; H317-Q321 WeakPolarHBondContact O-CG 3.48Å; H317-Q321 PolarHBondContact O-N 3.16Å; H317-Q321 VanDerWaalsContact O-N 3.15Å
318I60.9Low67.8Low41 Ų4164.1 Ų64.121%0.2133%0.327CS..Hα-helixtrans-77.5-36.6-178.7-59174.9000110.5L182 I312 S315 Q321 M322L182-I318 HydrophobicContact CD1-CD1 3.59Å; I312-I318 HydrophobicContact CG2-CG2 3.8Å; S315-I318 PolarHBondContact O-N 3.25Å; S315-I318 VanDerWaalsContact O-N 3.11Å; S315-I318 WeakPolarHBondContact OG-CG1 3.34Å; I318-Q321 PolarHBondContact O-N 3.38Å; I318-M322 WeakPolarHBondContact O-CB 3.1Å; I318-M322 PolarHBondContact O-N 3.48Å
319V60Low66.2Low21 Ų2166.4 Ų66.413%0.12735%0.348CS..Hα-helixtrans-62.2-46.6174.3172.60000110.6I312 T313 S315 Q321 M322 V323 F342I312-V319 WeakPolarHBondContact O-CG2 3.34Å; T313-V319 WeakPolarHBondContact O-CG2 3.39Å; S315-V319 WeakPolarHBondContact O-CB 3.33Å; S315-V319 VanDerWaalsContact O-CG2 3.24Å; S315-V319 WeakPolarHBondContact O-CG2 3.26Å; S315-V319 PolarHBondContact O-N 3.4Å; V319-Q321 VanDerWaalsContact C-N 3.31Å; V319-Q321 PolarHBondContact O-N 2.82Å; V319-M322 PolarHBondContact O-N 3.03Å; V319-V323 HydrophobicContact CG1-CG2 4.11Å; V319-V323 VanDerWaalsContact O-CB 3.28Å; V319-V323 WeakPolarHBondContact O-CB 3.06Å; V319-V323 WeakPolarHBondContact O-CG2 3.49Å; V319-V323 PolarHBondContact O-N 3.18Å; V319-F342 HydrophobicContact CB-CE1 4.46Å; V319-F342 HydrophobicContact CG1-CD1 3.93Å; V319-F342 HydrophobicContact CG1-CE1 3.64Å; V319-F342 HydrophobicContact CG2-CE1 3.88Å
320E64.3Low64.6Low111 Ų11163 Ų6352%0.51935%0.346SS..Hα-helixtrans-63.5-36.6177.6-73.1171.7-176.600112.1K316 S324K316-E320 WeakPolarHBondContact O-CB 3.3Å; K316-E320 VanDerWaalsContact O-CG 3.28Å; K316-E320 WeakPolarHBondContact O-CG 3.41Å; K316-E320 PolarHBondContact O-N 3.49Å; E320-S324 WeakPolarHBondContact O-CB 3.33Å; E320-S324 PolarHBondContact O-N 3.23Å; E320-S324 PolarHBondContact O-OG 2.77Å
321Q60.5Low63.2Low98 Ų9865.8 Ų65.846%0.45836%0.363SS..Hα-helixtrans-69.5-42172.8-75.7-179.5-47.400113H317 I318 V319 S324 L325H317-Q321 PolarHBondContact CE1-NE2 3.04Å; H317-Q321 PolarHBondContact CE1-OE1 2.93Å; H317-Q321 VanDerWaalsContact ND1-CD 3.32Å; H317-Q321 PolarHBondContact ND1-OE1 3.22Å; H317-Q321 WeakPolarHBondContact O-CB 3.5Å; H317-Q321 VanDerWaalsContact O-CG 3.29Å; H317-Q321 WeakPolarHBondContact O-CG 3.48Å; H317-Q321 PolarHBondContact O-N 3.16Å; H317-Q321 VanDerWaalsContact O-N 3.15Å; I318-Q321 PolarHBondContact O-N 3.38Å; V319-Q321 VanDerWaalsContact C-N 3.31Å; V319-Q321 PolarHBondContact O-N 2.82Å; Q321-S324 WeakPolarHBondContact CA-OG 3.12Å; Q321-S324 PolarHBondContact O-OG 2.8Å; Q321-L325 WeakPolarHBondContact O-CB 3.17Å; Q321-L325 WeakPolarHBondContact O-CD1 3.34Å; Q321-L325 WeakPolarHBondContact O-CG 3.39Å; Q321-L325 PolarHBondContact O-N 3.41Å
322M57.8Low61.8Low97 Ų9770.6 Ų70.648%0.47839%0.394SS..Hα-helixtrans-66.3-42.7176-97.9-172.2161.900111.5I312 I318 V319 L325 I326I312-M322 HydrophobicContact CG2-CE 4.42Å; I312-M322 HydrophobicContact CG2-SD 3.98Å; I318-M322 WeakPolarHBondContact O-CB 3.1Å; I318-M322 PolarHBondContact O-N 3.48Å; V319-M322 PolarHBondContact O-N 3.03Å; M322-L325 PolarHBondContact O-N 3.31Å; M322-I326 HydrophobicContact CB-CD1 4.5Å; M322-I326 VanDerWaalsContact O-CB 3.27Å; M322-I326 WeakPolarHBondContact O-CB 3.22Å; M322-I326 WeakPolarHBondContact O-CD1 3.49Å; M322-I326 WeakPolarHBondContact O-CG1 3.22Å; M322-I326 PolarHBondContact O-N 3.03Å
323V59.5Low60.4Low28 Ų2875.6 Ų75.617%0.1742%0.421CS..Hα-helixtrans-66.8-38.8179.2171.60000111V319 G327 Q339V319-V323 HydrophobicContact CG1-CG2 4.11Å; V319-V323 VanDerWaalsContact O-CB 3.28Å; V319-V323 WeakPolarHBondContact O-CB 3.06Å; V319-V323 WeakPolarHBondContact O-CG2 3.49Å; V319-V323 PolarHBondContact O-N 3.18Å; V323-G327 WeakPolarHBondContact O-CA 3.19Å; V323-G327 PolarHBondContact O-N 3.08Å; V323-Q339 HydrophobicContact CG1-CB 3.93Å; V323-Q339 HydrophobicContact CG1-CG 3.79Å
324S60.5Low59.2Low58 Ų5879.4 Ų79.441%0.40644%0.439SS..Hα-helixtrans-69.4-37.4173.453.30000112.8E320 Q321 N328E320-S324 WeakPolarHBondContact O-CB 3.33Å; E320-S324 PolarHBondContact O-N 3.23Å; E320-S324 PolarHBondContact O-OG 2.77Å; Q321-S324 WeakPolarHBondContact CA-OG 3.12Å; Q321-S324 PolarHBondContact O-OG 2.8Å; S324-N328 WeakPolarHBondContact O-CB 3.31Å; S324-N328 PolarHBondContact O-N 2.69Å; S324-N328 PolarHBondContact O-ND2 3.24Å
325L59.3Low58.3Low111 Ų11178.4 Ų78.458%0.58144%0.437SS*.Hα-helixtrans-68.7-43.1174.2-72.9168.2000112.8Q321 M322 N328 S329Q321-L325 WeakPolarHBondContact O-CB 3.17Å; Q321-L325 WeakPolarHBondContact O-CD1 3.34Å; Q321-L325 WeakPolarHBondContact O-CG 3.39Å; Q321-L325 PolarHBondContact O-N 3.41Å; M322-L325 PolarHBondContact O-N 3.31Å; L325-N328 PolarHBondContact O-N 3.5Å; L325-S329 VanDerWaalsContact O-CB 3.3Å; L325-S329 WeakPolarHBondContact O-CB 3.43Å; L325-S329 PolarHBondContact O-N 2.89Å; L325-S329 PolarHBondContact O-OG 2.87Å
326I57.2Low57.6Low81 Ų8181.2 Ų81.242%0.41546%0.46SS..Hα-helixtrans-68.3-39.9176.7-69.7165.4000110.7M322 N328 A330 V331M322-I326 HydrophobicContact CB-CD1 4.5Å; M322-I326 VanDerWaalsContact O-CB 3.27Å; M322-I326 WeakPolarHBondContact O-CB 3.22Å; M322-I326 WeakPolarHBondContact O-CD1 3.49Å; M322-I326 WeakPolarHBondContact O-CG1 3.22Å; M322-I326 PolarHBondContact O-N 3.03Å; I326-N328 VanDerWaalsContact C-N 3.3Å; I326-N328 PolarHBondContact O-N 2.98Å; I326-A330 PolarHBondContact O-N 2.98Å; I326-A330 VanDerWaalsContact O-N 3.11Å; I326-V331 PolarHBondContact O-N 3.05Å
327G53.8Low57.1Low21 Ų2179 Ų7922%0.21646%0.462CS..Hα-helixtrans-63.2-34.1173.800000113V323V323-G327 WeakPolarHBondContact O-CA 3.19Å; V323-G327 PolarHBondContact O-N 3.08Å
328N59.2Low56.5Low139 Ų13978.3 Ų78.374%0.74346%0.462SS*.Hα-helixtrans-90.9-21.6-179.5-69.8-13.1000114.5S324 L325 I326S324-N328 WeakPolarHBondContact O-CB 3.31Å; S324-N328 PolarHBondContact O-N 2.69Å; S324-N328 PolarHBondContact O-ND2 3.24Å; L325-N328 PolarHBondContact O-N 3.5Å; I326-N328 VanDerWaalsContact C-N 3.3Å; I326-N328 PolarHBondContact O-N 2.98Å
329S54Low56.3Low106 Ų10680.4 Ų80.474%0.74147%0.471SS*.Hα-helixtrans-127.9-16.9-169-58.90000117L325L325-S329 VanDerWaalsContact O-CB 3.3Å; L325-S329 WeakPolarHBondContact O-CB 3.43Å; L325-S329 PolarHBondContact O-N 2.89Å; L325-S329 PolarHBondContact O-OG 2.87Å
330A52.5Low56.3Low72 Ų7286.7 Ų86.760%0.59550%0.497SS*.THydrogen-bonded Turntrans-119-53.1-174.700000114.7I326I326-A330 PolarHBondContact O-N 2.98Å; I326-A330 VanDerWaalsContact O-N 3.11Å
331V52.7Low55.8Low68 Ų6884.5 Ų84.541%0.41249%0.492SS..  trans-160.7106.8174.8-174.50000109.2I326 L333 L334 G335I326-V331 PolarHBondContact O-N 3.05Å; V331-L333 HydrophobicContact CG1-CB 4.21Å; V331-L333 PolarHBondContact O-N 3.17Å; V331-L333 VanDerWaalsContact O-N 3.14Å; V331-L334 HydrophobicContact CB-CB 4Å; V331-L334 HydrophobicContact CG1-CB 4Å; V331-L334 PolarHBondContact O-N 3.49Å; V331-G335 PolarHBondContact O-N 2.86Å
332P56.4Low55.4Low102 Ų10283.2 Ų83.266%0.66249%0.485SS*.Hα-helixtrans-57.6-30.8-178.3-24.432.2000113.9
333L53.3Low55.4Low151 Ų15185.1 Ų85.179%0.79149%0.487SS*.Hα-helixtrans-76-36.4-177.5-151.379.3000113.1V331 A337V331-L333 HydrophobicContact CG1-CB 4.21Å; V331-L333 PolarHBondContact O-N 3.17Å; V331-L333 VanDerWaalsContact O-N 3.14Å; L333-A337 WeakPolarHBondContact O-CB 3.44Å
334L48.8Very low55.5Low105 Ų10589.9 Ų89.955%0.5551%0.507SS..Hα-helixtrans-80.8-35.6-176.9-138.582.9000111.6V331 A337 L338V331-L334 HydrophobicContact CB-CB 4Å; V331-L334 HydrophobicContact CG1-CB 4Å; V331-L334 PolarHBondContact O-N 3.49Å; L334-A337 PolarHBondContact O-N 3.44Å; L334-L338 HydrophobicContact CD2-CD1 4.19Å; L334-L338 HydrophobicContact CG-CD1 4.23Å; L334-L338 WeakPolarHBondContact O-CB 3.29Å; L334-L338 VanDerWaalsContact O-CG 3.32Å; L334-L338 WeakPolarHBondContact O-CG 3.27Å; L334-L338 PolarHBondContact O-N 3.35Å
335G53Low55.1Low5 Ų593.3 Ų93.35%0.05251%0.513CS..Hα-helixtrans-63.1-46.8178.100000112.9V331 A337 L338 Q339V331-G335 PolarHBondContact O-N 2.86Å; G335-A337 VanDerWaalsContact C-N 3.34Å; G335-A337 PolarHBondContact O-N 3.15Å; G335-L338 PolarHBondContact O-N 3.01Å; G335-Q339 VanDerWaalsContact O-CB 3.27Å; G335-Q339 WeakPolarHBondContact O-CB 3.35Å; G335-Q339 PolarHBondContact O-N 3.47Å
336A57.8Low55Low61 Ų6189.3 Ų89.350%0.50449%0.491SS..Hα-helixtrans-67.4-33.9178.200000112.8
337A54.4Low55.2Low64 Ų6490.5 Ų90.553%0.52950%0.495SS..Hα-helixtrans-73.6-31.917700000113L333 L334 G335 P341L333-A337 WeakPolarHBondContact O-CB 3.44Å; L334-A337 PolarHBondContact O-N 3.44Å; G335-A337 VanDerWaalsContact C-N 3.34Å; G335-A337 PolarHBondContact O-N 3.15Å; A337-P341 WeakPolarHBondContact O-CD 3.22Å; A337-P341 WeakPolarHBondContact O-CG 3.13Å
338L51.6Low55.5Low105 Ų10592 Ų9255%0.5551%0.506SS..Hα-helixtrans-85.3-27.6177.3-72.1169.3000113L334 G335 P341 F342L334-L338 HydrophobicContact CD2-CD1 4.19Å; L334-L338 HydrophobicContact CG-CD1 4.23Å; L334-L338 WeakPolarHBondContact O-CB 3.29Å; L334-L338 VanDerWaalsContact O-CG 3.32Å; L334-L338 WeakPolarHBondContact O-CG 3.27Å; L334-L338 PolarHBondContact O-N 3.35Å; G335-L338 PolarHBondContact O-N 3.01Å; L338-P341 WeakPolarHBondContact O-CD 3.41Å; L338-P341 WeakPolarHBondContact O-CG 3.16Å; L338-F342 WeakPolarHBondContact O-CB 3.44Å; L338-F342 PolarHBondContact O-N 3.36Å; L338-F342 VanDerWaalsContact O-N 3.16Å
339Q56.3Low55.3Low84 Ų8488.6 Ų88.639%0.39349%0.485SS..Hα-helixtrans-62.9-45.6-176.7-177.2176.59.600113.2V323 G335 R343V323-Q339 HydrophobicContact CG1-CB 3.93Å; V323-Q339 HydrophobicContact CG1-CG 3.79Å; G335-Q339 VanDerWaalsContact O-CB 3.27Å; G335-Q339 WeakPolarHBondContact O-CB 3.35Å; G335-Q339 PolarHBondContact O-N 3.47Å; Q339-R343 WeakPolarHBondContact O-CB 3.45Å; Q339-R343 PolarHBondContact O-N 2.94Å
340K59.6Low55.6Low153 Ų15386.3 Ų86.367%0.66546%0.462SS*.Hα-helixtrans-64.4-56.2179.7-75.1-173.3177.4-176.40113.7F342 R343 E344K340-F342 PolarHBondContact O-N 3.07Å; K340-R343 PolarHBondContact O-N 3.24Å; K340-E344 WeakPolarHBondContact O-CB 3.33Å; K340-E344 WeakPolarHBondContact O-CG 3.22Å; K340-E344 PolarHBondContact O-N 3.13Å
341P53.3Low56Low66 Ų6685.6 Ų85.643%0.42946%0.456SS..Hα-helixtrans-64.7-32-178.525.6-34.8000112A337 L338 Y345A337-P341 WeakPolarHBondContact O-CD 3.22Å; A337-P341 WeakPolarHBondContact O-CG 3.13Å; L338-P341 WeakPolarHBondContact O-CD 3.41Å; L338-P341 WeakPolarHBondContact O-CG 3.16Å; P341-Y345 WeakPolarHBondContact O-CB 3.39Å; P341-Y345 PolarHBondContact O-N 3.45Å
342F51.9Low56.2Low71 Ų7189.6 Ų89.631%0.31147%0.468SS..Hα-helixtrans-71.1-41.3177.1-169.9-100.5000112.3T313 V319 L338 K340 Y345 L346T313-F342 HydrophobicContact CG2-CE2 3.79Å; T313-F342 HydrophobicContact CG2-CZ 3.42Å; T313-F342 VanDerWaalsContact CG2-CZ 3.42Å; T313-F342 WeakPolarHBondContact O-CZ 3.21Å; V319-F342 HydrophobicContact CB-CE1 4.46Å; V319-F342 HydrophobicContact CG1-CD1 3.93Å; V319-F342 HydrophobicContact CG1-CE1 3.64Å; V319-F342 HydrophobicContact CG2-CE1 3.88Å; L338-F342 WeakPolarHBondContact O-CB 3.44Å; L338-F342 PolarHBondContact O-N 3.36Å; L338-F342 VanDerWaalsContact O-N 3.16Å; K340-F342 PolarHBondContact O-N 3.07Å; F342-Y345 PolarHBondContact O-N 3.09Å; F342-L346 HydrophobicContact CD1-CD1 3.68Å; F342-L346 HydrophobicContact CD1-CG 4.33Å; F342-L346 HydrophobicContact CE1-CD1 3.41Å; F342-L346 VanDerWaalsContact CE1-CD1 3.41Å; F342-L346 HydrophobicContact CE1-CG 4.14Å; F342-L346 HydrophobicContact CZ-CD1 4.18Å; F342-L346 WeakPolarHBondContact O-CB 3.36Å; F342-L346 WeakPolarHBondContact O-CG 3.49Å; F342-L346 PolarHBondContact O-N 2.78Å
343R57.5Low55.9Low136 Ų13688 Ų8851%0.51345%0.453SS..Hα-helixtrans-66.7-43175.8-168.5178.2-178.7165.59.2111.6Q339 K340 L346 E347Q339-R343 WeakPolarHBondContact O-CB 3.45Å; Q339-R343 PolarHBondContact O-N 2.94Å; K340-R343 PolarHBondContact O-N 3.24Å; R343-L346 PolarHBondContact O-N 3.3Å; R343-E347 IonicContact NE-OE1 3.4Å; R343-E347 PolarHBondContact NE-OE1 2.8Å; R343-E347 WeakPolarHBondContact O-CB 2.78Å; R343-E347 VanDerWaalsContact O-CG 3.3Å; R343-E347 WeakPolarHBondContact O-CG 3.16Å; R343-E347 PolarHBondContact O-N 3.3Å
344E61.8Low55.9Low128 Ų12884.9 Ų84.960%0.59844%0.435SS*.Hα-helixtrans-64-40.4174.4-73.4171.2-173.400111.9K340 E347 A348K340-E344 WeakPolarHBondContact O-CB 3.33Å; K340-E344 WeakPolarHBondContact O-CG 3.22Å; K340-E344 PolarHBondContact O-N 3.13Å; E344-E347 PolarHBondContact O-N 3.2Å; E344-A348 VanDerWaalsContact O-CB 3.27Å; E344-A348 WeakPolarHBondContact O-CB 3.3Å; E344-A348 PolarHBondContact O-N 2.95Å
345Y53.5Low55.9Low131 Ų13186.5 Ų86.551%0.51444%0.439SS..Hα-helixtrans-63.1-44.3174.3-179.6-97.9000112.1P341 F342 A348 Q349P341-Y345 WeakPolarHBondContact O-CB 3.39Å; P341-Y345 PolarHBondContact O-N 3.45Å; F342-Y345 PolarHBondContact O-N 3.09Å; Y345-A348 PolarHBondContact O-N 3.42Å; Y345-Q349 HydrophobicContact CD1-CG 4.24Å; Y345-Q349 HydrophobicContact CE1-CG 3.89Å; Y345-Q349 HydrophobicContact CE2-CG 4.29Å; Y345-Q349 WeakPolarHBondContact O-CB 3.33Å; Y345-Q349 WeakPolarHBondContact O-CG 3.5Å; Y345-Q349 PolarHBondContact O-N 2.83Å; Y345-Q349 PolarHBondContact OH-NE2 2.89Å
346L55.7Low55.6Low26 Ų2691.2 Ų91.214%0.13647%0.467CS..Hα-helixtrans-63-42175.1-78.6173.4000112F314 F342 R343 K350F314-L346 HydrophobicContact CD1-CD2 3.23Å; F314-L346 HydrophobicContact CE1-CD2 3.38Å; F314-L346 HydrophobicContact CG-CD2 3.92Å; F314-L346 HydrophobicContact CZ-CD2 4.16Å; F342-L346 HydrophobicContact CD1-CD1 3.68Å; F342-L346 HydrophobicContact CD1-CG 4.33Å; F342-L346 HydrophobicContact CE1-CD1 3.41Å; F342-L346 VanDerWaalsContact CE1-CD1 3.41Å; F342-L346 HydrophobicContact CE1-CG 4.14Å; F342-L346 HydrophobicContact CZ-CD1 4.18Å; F342-L346 WeakPolarHBondContact O-CB 3.36Å; F342-L346 WeakPolarHBondContact O-CG 3.49Å; F342-L346 PolarHBondContact O-N 2.78Å; R343-L346 PolarHBondContact O-N 3.3Å; L346-K350 WeakPolarHBondContact O-CB 3.39Å; L346-K350 PolarHBondContact O-N 3.49Å
347E63.1Low55Low106 Ų10691.4 Ų91.450%0.49546%0.462SS..Hα-helixtrans-69-39178.4-74.8174.7-171.200111.8R343 E344 K350 A351R343-E347 IonicContact NE-OE1 3.4Å; R343-E347 PolarHBondContact NE-OE1 2.8Å; R343-E347 WeakPolarHBondContact O-CB 2.78Å; R343-E347 VanDerWaalsContact O-CG 3.3Å; R343-E347 WeakPolarHBondContact O-CG 3.16Å; R343-E347 PolarHBondContact O-N 3.3Å; E344-E347 PolarHBondContact O-N 3.2Å; E347-K350 PolarHBondContact O-N 2.84Å; E347-A351 WeakPolarHBondContact O-CB 3.25Å; E347-A351 PolarHBondContact O-N 3.36Å
348A60.2Low54.1Low53 Ų5390.4 Ų90.444%0.43846%0.457SS..Hα-helixtrans-67.6-40.4174.600000112.7E344 Y345 A351 K352E344-A348 VanDerWaalsContact O-CB 3.27Å; E344-A348 WeakPolarHBondContact O-CB 3.3Å; E344-A348 PolarHBondContact O-N 2.95Å; Y345-A348 PolarHBondContact O-N 3.42Å; A348-A351 PolarHBondContact O-N 3.41Å; A348-K352 WeakPolarHBondContact O-CG 3.23Å; A348-K352 PolarHBondContact O-N 3.48Å
349Q53.8Low53.4Low68 Ų6894.2 Ų94.232%0.31847%0.472SS..Hα-helixtrans-65.6-42.4173.3-75.3-78.7-24.600111.2Y345 K352 L353Y345-Q349 HydrophobicContact CD1-CG 4.24Å; Y345-Q349 HydrophobicContact CE1-CG 3.89Å; Y345-Q349 HydrophobicContact CE2-CG 4.29Å; Y345-Q349 WeakPolarHBondContact O-CB 3.33Å; Y345-Q349 WeakPolarHBondContact O-CG 3.5Å; Y345-Q349 PolarHBondContact O-N 2.83Å; Y345-Q349 PolarHBondContact OH-NE2 2.89Å; Q349-K352 PolarHBondContact O-N 3.33Å; Q349-L353 WeakPolarHBondContact O-CB 3.49Å; Q349-L353 PolarHBondContact O-N 2.94Å
350K60.7Low52.5Low57 Ų5794.3 Ų94.325%0.24850%0.496CS..Hα-helixtrans-59.4-46.5173.2174.4174.5165.4161.30111.2L149 E153 L346 E347 K352 L353 H354L149-K350 HydrophobicContact CD1-CB 4.47Å; E153-K350 WeakPolarHBondContact OE1-CE 3.37Å; E153-K350 IonicContact OE1-NZ 2.63Å; E153-K350 PolarHBondContact OE1-NZ 3.16Å; L346-K350 WeakPolarHBondContact O-CB 3.39Å; L346-K350 PolarHBondContact O-N 3.49Å; E347-K350 PolarHBondContact O-N 2.84Å; K350-K352 PolarHBondContact O-N 2.04Å; K350-L353 PolarHBondContact O-N 3.42Å; K350-H354 PolarHBondContact O-CD2 2.84Å; K350-H354 PolarHBondContact O-N 3.43Å
351A60Low51Low58 Ų5892 Ų9248%0.47950%0.495SS..Hα-helixtrans-63.1-40.317900000112.4E347 A348 L353 H354 H355E347-A351 WeakPolarHBondContact O-CB 3.25Å; E347-A351 PolarHBondContact O-N 3.36Å; A348-A351 PolarHBondContact O-N 3.41Å; A351-L353 VanDerWaalsContact C-N 3.33Å; A351-L353 PolarHBondContact O-N 3.37Å; A351-H354 PolarHBondContact O-N 3.18Å; A351-H355 PolarHBondContact O-N 3.29Å; A351-H355 VanDerWaalsContact O-N 3.11Å
352K57.6Low50.2Low152 Ų15294.8 Ų94.866%0.66151%0.513SS*.Hα-helixtrans-63.4-37.1173.9-77.1-175.5177.3-172.80112.8A348 Q349 K350 H355A348-K352 WeakPolarHBondContact O-CG 3.23Å; A348-K352 PolarHBondContact O-N 3.48Å; Q349-K352 PolarHBondContact O-N 3.33Å; K350-K352 PolarHBondContact O-N 2.04Å; K352-H355 PolarHBondContact O-N 3.11Å
353L51Low49.6Very low67 Ų6795.6 Ų95.635%0.35153%0.533SS..Hα-helixtrans-69.2-37.7178-16673000112.1A146 L149 Q349 K350 A351 H355 V356A146-L353 HydrophobicContact CB-CD1 3.8Å; A146-L353 HydrophobicContact CB-CD2 3.68Å; A146-L353 HydrophobicContact CB-CG 4.36Å; L149-L353 HydrophobicContact CD1-CD2 4.16Å; Q349-L353 WeakPolarHBondContact O-CB 3.49Å; Q349-L353 PolarHBondContact O-N 2.94Å; K350-L353 PolarHBondContact O-N 3.42Å; A351-L353 VanDerWaalsContact C-N 3.33Å; A351-L353 PolarHBondContact O-N 3.37Å; L353-H355 VanDerWaalsContact C-N 3.31Å; L353-H355 PolarHBondContact O-N 3.49Å; L353-V356 PolarHBondContact O-N 3.39Å
354H52.3Low48.8Very low86 Ų8697.6 Ų97.640%0.39855%0.548SS..Hα-helixtrans-72.7-20174.9-77.6-69.7000113.4E153 K350 A351 V356 T357E153-H354 IonicContact OE1-NE2 2.75Å; E153-H354 IonicContact OE2-CE1 3.75Å; E153-H354 PolarHBondContact OE2-CE1 3.33Å; E153-H354 IonicContact OE2-NE2 3.11Å; E153-H354 PolarHBondContact OE2-NE2 2.87Å; K350-H354 PolarHBondContact O-CD2 2.84Å; K350-H354 PolarHBondContact O-N 3.43Å; A351-H354 PolarHBondContact O-N 3.18Å; H354-V356 VanDerWaalsContact C-N 3.35Å; H354-T357 WeakPolarHBondContact CA-OG1 3.37Å; H354-T357 PolarHBondContact O-N 3.34Å; H354-T357 PolarHBondContact O-OG1 3.39Å
355H47.7Very low47.9Very low140 Ų14099.4 Ų99.465%0.64856%0.557SS**Hα-helixtrans-78.2-17.7174.3-130.7-67.2000113.7A351 K352 L353 T357A351-H355 PolarHBondContact O-N 3.29Å; A351-H355 VanDerWaalsContact O-N 3.11Å; K352-H355 PolarHBondContact O-N 3.11Å; L353-H355 VanDerWaalsContact C-N 3.31Å; L353-H355 PolarHBondContact O-N 3.49Å; H355-T357 VanDerWaalsContact C-N 3.26Å
356V47.7Very low48.5Very low103 Ų10398.5 Ų98.562%0.62456%0.561SS**THydrogen-bonded Turntrans-76.8-17.2171.5179.40000111.3L353 H354L353-V356 PolarHBondContact O-N 3.39Å; H354-V356 VanDerWaalsContact C-N 3.35Å
357T46.3Very low49.4Very low66 Ų66105.7 Ų105.741%0.40559%0.586SS.*SBendtrans-99.4-6.7-176.834.20000114.4H354 H355H354-T357 WeakPolarHBondContact CA-OG1 3.37Å; H354-T357 PolarHBondContact O-N 3.34Å; H354-T357 PolarHBondContact O-OG1 3.39Å; H355-T357 VanDerWaalsContact C-N 3.26Å
358G34.8Very low49.1Very low42 Ų42105.5 Ų105.543%0.43359%0.588SS.*SBendtrans-119113.5173.100000110.7
359E35.7Very low49Very low185 Ų185106.7 Ų106.786%0.86459%0.593SS**  trans41.3113.1172.5-74.2-178.6143.600116.4T361E359-T361 VanDerWaalsContact C-N 3.31Å; E359-T361 PolarHBondContact O-N 2.87Å
360G38.1Very low50.1Low87 Ų87109.9 Ų109.990%0.89760%0.602SS**  trans-57.190.7170.500000112.2
361T29.1Very low50.9Low105 Ų105110.8 Ų110.864%0.64461%0.61SS**PPolyproline II helixtrans-69.2131.5146.136.90000106.6E359 A363E359-T361 VanDerWaalsContact C-N 3.31Å; E359-T361 PolarHBondContact O-N 2.87Å; T361-A363 PolarHBondContact O-N 3.38Å
362P35.2Very low51Low124 Ų124113.4 Ų113.481%0.80561%0.61SS**PPolyproline II helixtrans-57117.417524.4-30.3000106E364P362-E364 PolarHBondContact O-N 2.85Å
363A39.8Very low51.7Low88 Ų88111 Ų11173%0.72760%0.601SS**PPolyproline II helixtrans-49.1116.4172.100000105.9T361 E365T361-A363 PolarHBondContact O-N 3.38Å; A363-E365 PolarHBondContact O-N 3.23Å
364E39.8Very low53.2Low178 Ų178111.6 Ų111.683%0.83260%0.601SS**  trans-49.1115.4167.7-75.7-171.4155.500105.1P362 N366P362-E364 PolarHBondContact O-N 2.85Å; E364-N366 VanDerWaalsContact C-N 3.29Å; E364-N366 PolarHBondContact O-N 2.68Å
365E43.1Very low54.3Low165 Ų165111.3 Ų111.377%0.77161%0.605SS**  trans-56.3102.9179.7-76.8-166.817100106.4A363 W367A363-E365 PolarHBondContact O-N 3.23Å; E365-W367 PolarHBondContact O-N 2.91Å
366N65.8Low55.2Low113 Ų113107.1 Ų107.160%0.60459%0.59SS**  trans-54.8119.2178-87.1-39.9000105.7E364 L368 S369 W370E364-N366 VanDerWaalsContact C-N 3.29Å; E364-N366 PolarHBondContact O-N 2.68Å; N366-L368 CarbonylContact O-C 3.48Å; N366-L368 PolarHBondContact O-N 3.48Å; N366-S369 WeakPolarHBondContact O-CA 3.19Å; N366-S369 VanDerWaalsContact O-CB 3.26Å; N366-S369 WeakPolarHBondContact O-CB 3.27Å; N366-S369 PolarHBondContact O-N 2.88Å; N366-W370 PolarHBondContact O-N 3.34Å
367W75.6Confident56.6Low176 Ų176105.7 Ų105.767%0.66758%0.581SS**Hα-helixtrans-50.4-29.2178.869-84.2000112.1E365 W370 L371E365-W367 PolarHBondContact O-N 2.91Å; W367-W370 PolarHBondContact O-N 2.88Å; W367-L371 HydrophobicContact CZ3-CD2 4.11Å; W367-L371 WeakPolarHBondContact O-CB 3.41Å; W367-L371 PolarHBondContact O-N 2.88Å
368L56.6Low58.2Low103 Ų103108.2 Ų108.254%0.53959%0.591SS.*Hα-helixtrans-62.4-42170.4-93.4154.9000113.7N366 F372N366-L368 CarbonylContact O-C 3.48Å; N366-L368 PolarHBondContact O-N 3.48Å; L368-F372 VanDerWaalsContact O-CB 3.23Å; L368-F372 WeakPolarHBondContact O-CB 3.08Å; L368-F372 PolarHBondContact O-N 2.79Å
369S57.4Low59.8Low77 Ų77110.7 Ų110.754%0.53859%0.592SS.*Hα-helixtrans-66-43.4174.9-1660000111.2N366 F372 E373N366-S369 WeakPolarHBondContact O-CA 3.19Å; N366-S369 VanDerWaalsContact O-CB 3.26Å; N366-S369 WeakPolarHBondContact O-CB 3.27Å; N366-S369 PolarHBondContact O-N 2.88Å; S369-F372 PolarHBondContact O-N 2.88Å; S369-E373 WeakPolarHBondContact O-CB 3.32Å; S369-E373 PolarHBondContact O-N 3.4Å
370W78.8Confident61.6Low135 Ų135105.4 Ų105.451%0.51157%0.572SS.*Hα-helixtrans-62.1-46.1174.8-179.889.8000111.7N366 W367 F372 E373 K374N366-W370 PolarHBondContact O-N 3.34Å; W367-W370 PolarHBondContact O-N 2.88Å; W370-F372 PolarHBondContact O-N 3.08Å; W370-E373 PolarHBondContact O-N 3.33Å; W370-K374 HydrophobicContact CD2-CG 4.38Å; W370-K374 HydrophobicContact CH2-CG 4.37Å; W370-K374 HydrophobicContact CZ2-CG 4.23Å; W370-K374 WeakPolarHBondContact O-CG 3.21Å; W370-K374 PolarHBondContact O-N 3.21Å; W370-K374 VanDerWaalsContact O-N 3.08Å
371L76.3Confident63.7Low77 Ų77104.6 Ų104.640%0.40355%0.552SS.*Hα-helixtrans-60.9-45175.9178.664.1000111.4W367 E373 K374 V375W367-L371 HydrophobicContact CZ3-CD2 4.11Å; W367-L371 WeakPolarHBondContact O-CB 3.41Å; W367-L371 PolarHBondContact O-N 2.88Å; L371-E373 PolarHBondContact O-N 3.14Å; L371-K374 PolarHBondContact O-N 3.47Å; L371-V375 WeakPolarHBondContact O-CG2 3.16Å; L371-V375 PolarHBondContact O-N 3.42Å
372F61.5Low66.3Low112 Ų112106 Ų10649%0.49155%0.55SS..Hα-helixtrans-62.4-42.9178.8-173.6-99.2000111.7L368 S369 W370 K374 V375 V376L368-F372 VanDerWaalsContact O-CB 3.23Å; L368-F372 WeakPolarHBondContact O-CB 3.08Å; L368-F372 PolarHBondContact O-N 2.79Å; S369-F372 PolarHBondContact O-N 2.88Å; W370-F372 PolarHBondContact O-N 3.08Å; F372-K374 VanDerWaalsContact C-N 3.32Å; F372-K374 PolarHBondContact O-N 2.99Å; F372-V375 PolarHBondContact O-N 3.02Å; F372-V376 HydrophobicContact CD1-CG2 4.07Å; F372-V376 HydrophobicContact CE1-CG2 3.72Å; F372-V376 HydrophobicContact CZ-CG2 4.02Å; F372-V376 WeakPolarHBondContact O-CG2 3.24Å; F372-V376 PolarHBondContact O-N 2.9Å
373E73.8Confident68.3Low102 Ų102106.4 Ų106.448%0.47754%0.539SS..Hα-helixtrans-56.9-45.6173.5-169.9-160.1123.400111.2S369 W370 L371 V375 V376 V377S369-E373 WeakPolarHBondContact O-CB 3.32Å; S369-E373 PolarHBondContact O-N 3.4Å; W370-E373 PolarHBondContact O-N 3.33Å; L371-E373 PolarHBondContact O-N 3.14Å; E373-V375 PolarHBondContact O-N 3.46Å; E373-V376 PolarHBondContact O-N 3.42Å; E373-V377 WeakPolarHBondContact O-CG2 3.37Å; E373-V377 PolarHBondContact O-N 3.43Å
374K81.8Confident70.4Confident79 Ų79106 Ų10634%0.34353%0.527SS..Hα-helixtrans-64.1-40.7177.1-62.1-46.2173.9-153.10112.7W370 L371 F372 V376 V377 I378W370-K374 HydrophobicContact CD2-CG 4.38Å; W370-K374 HydrophobicContact CH2-CG 4.37Å; W370-K374 HydrophobicContact CZ2-CG 4.23Å; W370-K374 WeakPolarHBondContact O-CG 3.21Å; W370-K374 PolarHBondContact O-N 3.21Å; W370-K374 VanDerWaalsContact O-N 3.08Å; L371-K374 PolarHBondContact O-N 3.47Å; F372-K374 VanDerWaalsContact C-N 3.32Å; F372-K374 PolarHBondContact O-N 2.99Å; K374-V376 VanDerWaalsContact C-N 3.34Å; K374-V376 PolarHBondContact O-N 3.42Å; K374-V377 PolarHBondContact O-N 2.97Å; K374-I378 VanDerWaalsContact O-CG1 3.26Å; K374-I378 WeakPolarHBondContact O-CG1 3.3Å; K374-I378 PolarHBondContact O-N 2.94Å
375V74.6Confident72.5Confident80 Ų8098.8 Ų98.849%0.48550%0.496SS..Hα-helixtrans-61.2-44.2175.2171.50000111L371 F372 E373 I378 M379L371-V375 WeakPolarHBondContact O-CG2 3.16Å; L371-V375 PolarHBondContact O-N 3.42Å; F372-V375 PolarHBondContact O-N 3.02Å; E373-V375 PolarHBondContact O-N 3.46Å; V375-I378 PolarHBondContact O-N 3.16Å; V375-M379 WeakPolarHBondContact O-CB 3.48Å; V375-M379 PolarHBondContact O-N 3.5Å
376V67.1Low74.3Confident53 Ų5393.7 Ų93.732%0.32148%0.478SS..Hα-helixtrans-62.2-45.1176.8172.30000110.9F372 E373 K374 I378 M379 V380F372-V376 HydrophobicContact CD1-CG2 4.07Å; F372-V376 HydrophobicContact CE1-CG2 3.72Å; F372-V376 HydrophobicContact CZ-CG2 4.02Å; F372-V376 WeakPolarHBondContact O-CG2 3.24Å; F372-V376 PolarHBondContact O-N 2.9Å; E373-V376 PolarHBondContact O-N 3.42Å; K374-V376 VanDerWaalsContact C-N 3.34Å; K374-V376 PolarHBondContact O-N 3.42Å; V376-I378 VanDerWaalsContact C-N 3.34Å; V376-I378 PolarHBondContact O-N 3.11Å; V376-M379 WeakPolarHBondContact O-CB 3.39Å; V376-M379 PolarHBondContact O-N 3.38Å; V376-V380 HydrophobicContact CG1-CG2 4.38Å; V376-V380 WeakPolarHBondContact O-CG2 3.46Å; V376-V380 PolarHBondContact O-N 3.37Å
377V77.4Confident75.2Confident73 Ų7391.8 Ų91.844%0.44247%0.468SS..Hα-helixtrans-60.4-43.7176.8171.90000111.1E373 K374 M379 V380 C381E373-V377 WeakPolarHBondContact O-CG2 3.37Å; E373-V377 PolarHBondContact O-N 3.43Å; K374-V377 PolarHBondContact O-N 2.97Å; V377-M379 VanDerWaalsContact C-N 3.34Å; V377-M379 PolarHBondContact O-N 3.44Å; V377-V380 PolarHBondContact O-N 3.02Å; V377-C381 WeakPolarHBondContact O-CB 3.38Å; V377-C381 PolarHBondContact O-N 3.36Å; V377-C381 PolarHBondContact O-SG 2.85Å
378I80.8Confident75.8Confident118 Ų11884.3 Ų84.361%0.60544%0.442SS*.Hα-helixtrans-60.6-44.7175.8-69.7165000110.8K374 V375 V376 V380 C381 F382K374-I378 VanDerWaalsContact O-CG1 3.26Å; K374-I378 WeakPolarHBondContact O-CG1 3.3Å; K374-I378 PolarHBondContact O-N 2.94Å; V375-I378 PolarHBondContact O-N 3.16Å; V376-I378 VanDerWaalsContact C-N 3.34Å; V376-I378 PolarHBondContact O-N 3.11Å; I378-V380 PolarHBondContact O-N 3.48Å; I378-C381 PolarHBondContact O-N 3.2Å; I378-F382 WeakPolarHBondContact O-CB 3.41Å; I378-F382 PolarHBondContact O-N 3.43Å
379M67.9Low77.2Confident95 Ų9580.2 Ų80.247%0.46842%0.42SS..Hα-helixtrans-61.7-43.3177.6-173-176.175.200111.8V375 V376 V377 F382 F383V375-M379 WeakPolarHBondContact O-CB 3.48Å; V375-M379 PolarHBondContact O-N 3.5Å; V376-M379 WeakPolarHBondContact O-CB 3.39Å; V376-M379 PolarHBondContact O-N 3.38Å; V377-M379 VanDerWaalsContact C-N 3.34Å; V377-M379 PolarHBondContact O-N 3.44Å; M379-F382 PolarHBondContact O-N 3.41Å; M379-F383 WeakPolarHBondContact O-CB 3.46Å; M379-F383 PolarHBondContact O-N 3.47Å
380V73.2Confident78.4Confident74 Ų7479.5 Ų79.545%0.44842%0.415SS..Hα-helixtrans-64-45.2176.1172.10000110.9V376 V377 I378 F382 F383 V384V376-V380 HydrophobicContact CG1-CG2 4.38Å; V376-V380 WeakPolarHBondContact O-CG2 3.46Å; V376-V380 PolarHBondContact O-N 3.37Å; V377-V380 PolarHBondContact O-N 3.02Å; I378-V380 PolarHBondContact O-N 3.48Å; V380-F382 VanDerWaalsContact C-N 3.33Å; V380-F382 PolarHBondContact O-N 2.86Å; V380-F383 WeakPolarHBondContact O-CB 3.19Å; V380-F383 PolarHBondContact O-N 3.31Å; V380-V384 HydrophobicContact CG1-CG2 4.49Å; V380-V384 WeakPolarHBondContact O-CG2 3.28Å; V380-V384 PolarHBondContact O-N 3.39Å
381C81.9Confident78.7Confident69 Ų6975 Ų7547%0.46640%0.4SS..Hα-helixtrans-59.2-45.1175.3-73.20000111.4V377 I378 F383 V384 C385V377-C381 WeakPolarHBondContact O-CB 3.38Å; V377-C381 PolarHBondContact O-N 3.36Å; V377-C381 PolarHBondContact O-SG 2.85Å; I378-C381 PolarHBondContact O-N 3.2Å; C381-F383 VanDerWaalsContact C-N 3.33Å; C381-F383 PolarHBondContact O-N 3.05Å; C381-V384 PolarHBondContact O-N 3.22Å; C381-C385 WeakPolarHBondContact O-CB 3.08Å; C381-C385 PolarHBondContact O-N 3.03Å; C381-C385 PolarHBondContact O-SG 3.24Å
382F83.9Confident79.2Confident136 Ų13671.3 Ų71.360%0.59638%0.381SS*.Hα-helixtrans-61.2-42.2176.1-177.3-95000111.9I378 M379 V380 C385 S386I378-F382 WeakPolarHBondContact O-CB 3.41Å; I378-F382 PolarHBondContact O-N 3.43Å; M379-F382 PolarHBondContact O-N 3.41Å; V380-F382 VanDerWaalsContact C-N 3.33Å; V380-F382 PolarHBondContact O-N 2.86Å; F382-C385 PolarHBondContact O-N 2.63Å; F382-S386 WeakPolarHBondContact O-CB 3.29Å; F382-S386 PolarHBondContact O-N 2.94Å
383F77.6Confident80.3Confident131 Ų13167.9 Ų67.958%0.57537%0.366SS*.Hα-helixtrans-62.2-44.8175.8-179.9-105000112.2M379 V380 C381 S386 I387M379-F383 WeakPolarHBondContact O-CB 3.46Å; M379-F383 PolarHBondContact O-N 3.47Å; V380-F383 WeakPolarHBondContact O-CB 3.19Å; V380-F383 PolarHBondContact O-N 3.31Å; C381-F383 VanDerWaalsContact C-N 3.33Å; C381-F383 PolarHBondContact O-N 3.05Å; F383-S386 WeakPolarHBondContact O-CB 3.18Å; F383-S386 PolarHBondContact O-N 3.24Å; F383-S386 VanDerWaalsContact O-N 3.17Å; F383-I387 HydrophobicContact CD1-CD1 3.84Å; F383-I387 HydrophobicContact CE1-CD1 3.41Å; F383-I387 VanDerWaalsContact CE1-CD1 3.41Å; F383-I387 HydrophobicContact CE1-CG1 4.3Å; F383-I387 HydrophobicContact CZ-CD1 3.85Å; F383-I387 HydrophobicContact CZ-CG1 4.34Å; F383-I387 WeakPolarHBondContact O-CG1 3.46Å; F383-I387 PolarHBondContact O-N 3.01Å
384V83.1Confident80.7Confident79 Ų7965.3 Ų65.348%0.47936%0.36SS..Hα-helixtrans-61.3-45.2174.81730000111V380 C381 S386 I387 V388V380-V384 HydrophobicContact CG1-CG2 4.49Å; V380-V384 WeakPolarHBondContact O-CG2 3.28Å; V380-V384 PolarHBondContact O-N 3.39Å; C381-V384 PolarHBondContact O-N 3.22Å; V384-S386 VanDerWaalsContact C-N 3.28Å; V384-S386 PolarHBondContact O-N 3.14Å; V384-I387 PolarHBondContact O-N 3.27Å; V384-V388 WeakPolarHBondContact O-CG2 3.16Å; V384-V388 PolarHBondContact O-N 3.34Å; V384-V388 VanDerWaalsContact O-N 3.1Å
385C85.3Confident80.8Confident28 Ų2863.5 Ų63.519%0.18935%0.351CS..Hα-helixtrans-60.3-38.6174.6-68.20000112L48 W49 C381 F382 V388 N389L48-C385 HydrophobicContact CD1-CB 3.94Å; W49-C385 HydrophobicContact CH2-CB 3.98Å; W49-C385 HydrophobicContact CZ2-CB 3.69Å; C381-C385 WeakPolarHBondContact O-CB 3.08Å; C381-C385 PolarHBondContact O-N 3.03Å; C381-C385 PolarHBondContact O-SG 3.24Å; F382-C385 PolarHBondContact O-N 2.63Å; C385-V388 PolarHBondContact O-N 3.39Å; C385-N389 WeakPolarHBondContact O-CB 3.42Å; C385-N389 PolarHBondContact O-N 2.91Å; C385-N389 PolarHBondContact O-ND2 2.9Å; C385-N389 PolarHBondContact O-OD1 3.24Å
386S80.2Confident81.2Confident57 Ų5760.1 Ų60.140%0.39933%0.331SS..Hα-helixtrans-62.9-42.4175.9-172.50000112F382 F383 V384 V388 N389 S390F382-S386 WeakPolarHBondContact O-CB 3.29Å; F382-S386 PolarHBondContact O-N 2.94Å; F383-S386 WeakPolarHBondContact O-CB 3.18Å; F383-S386 PolarHBondContact O-N 3.24Å; F383-S386 VanDerWaalsContact O-N 3.17Å; V384-S386 VanDerWaalsContact C-N 3.28Å; V384-S386 PolarHBondContact O-N 3.14Å; S386-V388 PolarHBondContact O-N 3.27Å; S386-N389 PolarHBondContact O-N 2.93Å; S386-S390 VanDerWaalsContact O-CB 3.28Å; S386-S390 WeakPolarHBondContact O-CB 3.46Å; S386-S390 PolarHBondContact O-N 3.5Å
387I83.9Confident81.8Confident73 Ų7360 Ų6037%0.37433%0.326SS..Hα-helixtrans-59.7-47.4174.7-68164000110.9F383 V384 N389 S390 M391F383-I387 HydrophobicContact CD1-CD1 3.84Å; F383-I387 HydrophobicContact CE1-CD1 3.41Å; F383-I387 VanDerWaalsContact CE1-CD1 3.41Å; F383-I387 HydrophobicContact CE1-CG1 4.3Å; F383-I387 HydrophobicContact CZ-CD1 3.85Å; F383-I387 HydrophobicContact CZ-CG1 4.34Å; F383-I387 WeakPolarHBondContact O-CG1 3.46Å; F383-I387 PolarHBondContact O-N 3.01Å; V384-I387 PolarHBondContact O-N 3.27Å; I387-N389 VanDerWaalsContact C-N 3.34Å; I387-N389 PolarHBondContact O-N 3.34Å; I387-S390 PolarHBondContact O-N 3.49Å; I387-M391 HydrophobicContact CG2-CG 4.43Å; I387-M391 HydrophobicContact CG2-SD 4.26Å; I387-M391 WeakPolarHBondContact O-CB 3.46Å; I387-M391 WeakPolarHBondContact O-CG 3.47Å; I387-M391 PolarHBondContact O-N 3.25Å
388V88.1Confident81.9Confident20 Ų2062.3 Ų62.312%0.12133%0.327CS..Hα-helixtrans-60.6-45.8179.7173.70000110.8L48 T55 L56 F59 V384 C385 S386 A392L48-V388 HydrophobicContact CD1-CB 3.76Å; L48-V388 HydrophobicContact CD1-CG1 3.69Å; L48-V388 HydrophobicContact CD1-CG2 4.44Å; L48-V388 HydrophobicContact CD2-CG1 4.4Å; L48-V388 HydrophobicContact CG-CG1 4.03Å; T55-V388 HydrophobicContact CG2-CG1 4.28Å; L56-V388 HydrophobicContact CD2-CG1 4.19Å; F59-V388 HydrophobicContact CB-CG1 4.07Å; F59-V388 HydrophobicContact CD2-CB 4.27Å; F59-V388 HydrophobicContact CD2-CG1 4.1Å; F59-V388 HydrophobicContact CD2-CG2 4.26Å; F59-V388 HydrophobicContact CE2-CG2 4.14Å; F59-V388 HydrophobicContact CG-CG1 3.99Å; F59-V388 HydrophobicContact CZ-CG2 4.46Å; V384-V388 WeakPolarHBondContact O-CG2 3.16Å; V384-V388 PolarHBondContact O-N 3.34Å; V384-V388 VanDerWaalsContact O-N 3.1Å; C385-V388 PolarHBondContact O-N 3.39Å; S386-V388 PolarHBondContact O-N 3.27Å; V388-A392 WeakPolarHBondContact O-CB 3.19Å; V388-A392 PolarHBondContact O-N 2.82Å
389N87.3Confident82Confident16 Ų1660.6 Ų60.69%0.08632%0.315CS..Hα-helixtrans-61.7-48.2177.3-65.2-18.4000111.4V47 L48 C385 S386 I387 M391 A392 Q393V47-N389 WeakPolarHBondContact CA-OD1 3.26Å; V47-N389 HydrophobicContact CG1-CB 4.49Å; L48-N389 PolarHBondContact N-OD1 2.69Å; C385-N389 WeakPolarHBondContact O-CB 3.42Å; C385-N389 PolarHBondContact O-N 2.91Å; C385-N389 PolarHBondContact O-ND2 2.9Å; C385-N389 PolarHBondContact O-OD1 3.24Å; S386-N389 PolarHBondContact O-N 2.93Å; I387-N389 VanDerWaalsContact C-N 3.34Å; I387-N389 PolarHBondContact O-N 3.34Å; N389-M391 PolarHBondContact O-N 3.35Å; N389-A392 PolarHBondContact O-N 3.47Å; N389-Q393 VanDerWaalsContact O-CB 3.3Å; N389-Q393 WeakPolarHBondContact O-CB 3.28Å; N389-Q393 VanDerWaalsContact O-CG 3.29Å; N389-Q393 WeakPolarHBondContact O-CG 3.39Å; N389-Q393 PolarHBondContact O-N 3.47Å
390S82.2Confident82.3Confident62 Ų6259.2 Ų59.243%0.43431%0.305SS..Hα-helixtrans-61.4-41.3-179.3176.80000112.6S386 I387 Q393 S394S386-S390 VanDerWaalsContact O-CB 3.28Å; S386-S390 WeakPolarHBondContact O-CB 3.46Å; S386-S390 PolarHBondContact O-N 3.5Å; I387-S390 PolarHBondContact O-N 3.49Å; S390-Q393 PolarHBondContact O-N 2.91Å; S390-S394 WeakPolarHBondContact O-CB 3.39Å; S390-S394 PolarHBondContact O-N 2.85Å; S390-S394 PolarHBondContact O-OG 3.01Å
391M85Confident82.3Confident40 Ų4061.5 Ų61.520%0.19731%0.311CS..Hα-helixtrans-68.5-41.4175.5-76-167.673.600112.3F59 E62 L63 I387 N389 Q393 S394 Y395F59-M391 HydrophobicContact CD2-CB 3.7Å; F59-M391 HydrophobicContact CD2-CG 4.37Å; F59-M391 HydrophobicContact CD2-SD 3.96Å; F59-M391 HydrophobicContact CE2-CB 4.27Å; F59-M391 HydrophobicContact CE2-CE 4.37Å; F59-M391 HydrophobicContact CE2-CG 4.46Å; F59-M391 HydrophobicContact CE2-SD 3.54Å; F59-M391 VanDerWaalsContact CE2-SD 3.54Å; E62-M391 HydrophobicContact CB-CE 4.28Å; E62-M391 HydrophobicContact CG-CB 4.45Å; E62-M391 HydrophobicContact CG-CE 4.09Å; E62-M391 WeakPolarHBondContact CG-O 3.19Å; L63-M391 HydrophobicContact CB-CE 4Å; L63-M391 HydrophobicContact CD1-CE 4.03Å; I387-M391 HydrophobicContact CG2-CG 4.43Å; I387-M391 HydrophobicContact CG2-SD 4.26Å; I387-M391 WeakPolarHBondContact O-CB 3.46Å; I387-M391 WeakPolarHBondContact O-CG 3.47Å; I387-M391 PolarHBondContact O-N 3.25Å; N389-M391 PolarHBondContact O-N 3.35Å; M391-Q393 VanDerWaalsContact C-N 3.32Å; M391-Q393 PolarHBondContact O-N 3.12Å; M391-S394 WeakPolarHBondContact O-CB 3.34Å; M391-S394 PolarHBondContact O-N 2.93Å; M391-Y395 PolarHBondContact O-N 3.37Å; M391-Y395 VanDerWaalsContact O-N 3.11Å
392A87.1Confident82Confident0 Ų063.2 Ų63.20%032%0.315CS..Hα-helixtrans-62.2-41.6175.500000112.1T55 F59 V388 N389 Y395 A396T55-A392 HydrophobicContact CG2-CB 3.59Å; T55-A392 VanDerWaalsContact O-CB 3.29Å; T55-A392 WeakPolarHBondContact O-CB 3.47Å; F59-A392 HydrophobicContact CB-CB 4.31Å; V388-A392 WeakPolarHBondContact O-CB 3.19Å; V388-A392 PolarHBondContact O-N 2.82Å; N389-A392 PolarHBondContact O-N 3.47Å; A392-Y395 PolarHBondContact O-N 2.87Å; A392-A396 PolarHBondContact O-N 3.04Å; A392-A396 VanDerWaalsContact O-N 3.14Å
393Q83.2Confident81.6Confident40 Ų4063.3 Ų63.319%0.18732%0.315CS..Hα-helixtrans-63.6-38.6174-80.2173.8-2.600112.3H43 L46 N389 S390 M391 Y395 A396 K397H43-Q393 WeakPolarHBondContact NE2-CB 3.27Å; H43-Q393 PolarHBondContact NE2-O 3.47Å; H43-Q393 PolarHBondContact O-NE2 2.92Å; L46-Q393 HydrophobicContact CB-CG 4.18Å; N389-Q393 VanDerWaalsContact O-CB 3.3Å; N389-Q393 WeakPolarHBondContact O-CB 3.28Å; N389-Q393 VanDerWaalsContact O-CG 3.29Å; N389-Q393 WeakPolarHBondContact O-CG 3.39Å; N389-Q393 PolarHBondContact O-N 3.47Å; S390-Q393 PolarHBondContact O-N 2.91Å; M391-Q393 VanDerWaalsContact C-N 3.32Å; M391-Q393 PolarHBondContact O-N 3.12Å; Q393-Y395 VanDerWaalsContact C-N 3.34Å; Q393-Y395 PolarHBondContact O-N 3.35Å; Q393-A396 PolarHBondContact O-N 3.11Å; Q393-K397 PolarHBondContact O-N 3.44Å
394S82.3Confident81.1Confident49 Ų4959.5 Ų59.534%0.34331%0.305SS..Hα-helixtrans-61.6-41.7175.3-61.80000111.8S390 M391 K397 R398S390-S394 WeakPolarHBondContact O-CB 3.39Å; S390-S394 PolarHBondContact O-N 2.85Å; S390-S394 PolarHBondContact O-OG 3.01Å; M391-S394 WeakPolarHBondContact O-CB 3.34Å; M391-S394 PolarHBondContact O-N 2.93Å; S394-K397 WeakPolarHBondContact O-CB 3.32Å; S394-K397 PolarHBondContact O-N 2.89Å; S394-R398 PolarHBondContact O-N 2.99Å
395Y84.4Confident80.2Confident41 Ų4158.4 Ų58.416%0.16130%0.301CS..Hα-helixtrans-64.9-42.5175.2-176.9-101.2000112.6Y58 L61 E62 I65 M391 A392 Q393 K397 R398 K399Y58-Y395 AromaticContact CD1-CD1 3.72Å; Y58-Y395 HydrophobicContact CD1-CD1 3.72Å; Y58-Y395 AromaticContact CD1-CE1 3.9Å; Y58-Y395 HydrophobicContact CD1-CE1 3.9Å; Y58-Y395 HydrophobicContact CD2-CD1 4.16Å; Y58-Y395 HydrophobicContact CE1-CD1 4.23Å; Y58-Y395 HydrophobicContact CE1-CE1 4.09Å; Y58-Y395 AromaticContact CG-CD1 3.68Å; Y58-Y395 HydrophobicContact CG-CD1 3.68Å; Y58-Y395 HydrophobicContact CG-CE1 4.34Å; L61-Y395 HydrophobicContact CB-CD2 4.33Å; L61-Y395 HydrophobicContact CB-CE2 4.22Å; L61-Y395 HydrophobicContact CD2-CD2 4.44Å; L61-Y395 HydrophobicContact CD2-CE1 3.72Å; L61-Y395 HydrophobicContact CD2-CE2 3.6Å; L61-Y395 WeakPolarHBondContact CD2-OH 3.32Å; L61-Y395 HydrophobicContact CG-CD2 4.15Å; L61-Y395 HydrophobicContact CG-CE1 4.41Å; L61-Y395 HydrophobicContact CG-CE2 3.58Å; E62-Y395 VanDerWaalsContact OE2-CA 3.3Å; E62-Y395 WeakPolarHBondContact OE2-CA 3.4Å; E62-Y395 WeakPolarHBondContact OE2-CB 3.4Å; E62-Y395 WeakPolarHBondContact OE2-CD2 2.99Å; I65-Y395 HydrophobicContact CD1-CD2 3.96Å; I65-Y395 HydrophobicContact CD1-CE2 3.65Å; M391-Y395 PolarHBondContact O-N 3.37Å; M391-Y395 VanDerWaalsContact O-N 3.11Å; A392-Y395 PolarHBondContact O-N 2.87Å; Q393-Y395 VanDerWaalsContact C-N 3.34Å; Q393-Y395 PolarHBondContact O-N 3.35Å; Y395-K397 VanDerWaalsContact C-N 3.27Å; Y395-K397 PolarHBondContact O-N 3.4Å; Y395-R398 PolarHBondContact O-N 2.92Å; Y395-K399 HydrophobicContact CE1-CD 4.41Å; Y395-K399 PolarHBondContact O-N 3.18Å
396A83.1Confident79.3Confident8 Ų862.2 Ų62.27%0.06632%0.319CS..Hα-helixtrans-58.6-41.3175.300000111.4L46 Y58 A392 Q393 K399 R400L46-A396 HydrophobicContact CD1-CB 3.62Å; Y58-A396 HydrophobicContact CD2-CB 4.3Å; Y58-A396 HydrophobicContact CE2-CB 4.31Å; A392-A396 PolarHBondContact O-N 3.04Å; A392-A396 VanDerWaalsContact O-N 3.14Å; Q393-A396 PolarHBondContact O-N 3.11Å; A396-K399 PolarHBondContact O-N 3.22Å; A396-R400 WeakPolarHBondContact O-CG 3.27Å; A396-R400 PolarHBondContact O-N 2.88Å; A396-R400 VanDerWaalsContact O-N 3.15Å
397K79.6Confident78.3Confident50 Ų5063 Ų6322%0.21733%0.325CS..Hα-helixtrans-61.2-45.5174-166.3-179.8-169.7-179.60112.1D223 D225 Q393 S394 Y395 R400 H401D223-K397 VanDerWaalsContact CG-NZ 3.33Å; D223-K397 IonicContact OD1-NZ 3.98Å; D223-K397 PolarHBondContact OD1-NZ 2.92Å; D223-K397 IonicContact OD2-NZ 3.38Å; D223-K397 PolarHBondContact OD2-NZ 3.23Å; D223-K397 VanDerWaalsContact OD2-NZ 3.11Å; D225-K397 IonicContact OD2-NZ 2.71Å; D225-K397 PolarHBondContact OD2-NZ 3.16Å; Q393-K397 PolarHBondContact O-N 3.44Å; S394-K397 WeakPolarHBondContact O-CB 3.32Å; S394-K397 PolarHBondContact O-N 2.89Å; Y395-K397 VanDerWaalsContact C-N 3.27Å; Y395-K397 PolarHBondContact O-N 3.4Å; K397-R400 WeakPolarHBondContact O-CB 3.37Å; K397-R400 PolarHBondContact O-N 2.99Å; K397-H401 PolarHBondContact O-N 3.37Å; K397-H401 VanDerWaalsContact O-N 3.08Å
398R80.4Confident76.9Confident122 Ų12267.4 Ų67.446%0.4634%0.341SS..Hα-helixtrans-59.5-48.4176-71.4-173.6-154.3-75.5-5.6112.3E62 S394 Y395 R400 H401 D402E62-R398 IonicContact OE1-CZ 3.33Å; E62-R398 IonicContact OE1-NE 2.82Å; E62-R398 PolarHBondContact OE1-NE 3.41Å; E62-R398 IonicContact OE1-NH2 3.29Å; E62-R398 PolarHBondContact OE1-NH2 3.34Å; E62-R398 IonicContact OE2-NE 2.84Å; E62-R398 PolarHBondContact OE2-NE 3.24Å; E62-R398 VanDerWaalsContact OE2-NE 3.15Å; S394-R398 PolarHBondContact O-N 2.99Å; Y395-R398 PolarHBondContact O-N 2.92Å; R398-R400 PolarHBondContact O-N 3.29Å; R398-H401 WeakPolarHBondContact O-CB 3.45Å; R398-H401 PolarHBondContact O-N 3.16Å; R398-D402 PolarHBondContact O-N 3.15Å
399K82.1Confident75.2Confident82 Ų8272.2 Ų72.236%0.35737%0.37SS..Hα-helixtrans-59.2-31.2179.5-172.9178179.5-179.90112.4Y395 A396 K403Y395-K399 HydrophobicContact CE1-CD 4.41Å; Y395-K399 PolarHBondContact O-N 3.18Å; A396-K399 PolarHBondContact O-N 3.22Å; K399-K403 WeakPolarHBondContact O-CG 3.37Å; K399-K403 PolarHBondContact O-N 2.94Å
400R73.5Confident73Confident66 Ų6682.1 Ų82.125%0.24942%0.416CS..Hα-helixtrans-70.4-46.7173.2-73.2175.9173.2166.94.4112.1D39 E224 A396 K397 R398 D402 K403 S404D39-R400 VanDerWaalsContact C-NH2 3.33Å; D39-R400 VanDerWaalsContact CA-NH2 3.32Å; D39-R400 PolarHBondContact O-NH1 2.77Å; D39-R400 PolarHBondContact O-NH2 3.36Å; D39-R400 IonicContact OD1-CZ 3.63Å; D39-R400 VanDerWaalsContact OD1-CZ 3.29Å; D39-R400 IonicContact OD1-NE 3.15Å; D39-R400 PolarHBondContact OD1-NE 3.28Å; D39-R400 IonicContact OD1-NH2 2.56Å; D39-R400 PolarHBondContact OD1-NH2 3.42Å; E224-R400 IonicContact OE1-NH1 3.33Å; A396-R400 WeakPolarHBondContact O-CG 3.27Å; A396-R400 PolarHBondContact O-N 2.88Å; A396-R400 VanDerWaalsContact O-N 3.15Å; K397-R400 WeakPolarHBondContact O-CB 3.37Å; K397-R400 PolarHBondContact O-N 2.99Å; R398-R400 PolarHBondContact O-N 3.29Å; R400-D402 VanDerWaalsContact C-N 3.31Å; R400-D402 PolarHBondContact O-N 3.04Å; R400-K403 PolarHBondContact O-N 3.39Å; R400-S404 PolarHBondContact O-N 2.81Å
401H73.4Confident72.5Confident123 Ų12383.2 Ų83.257%0.56942%0.416SS*.Hα-helixtrans-57.2-44.8176.2-100.5-81.2000112K397 R398 K403 S404 S405K397-H401 PolarHBondContact O-N 3.37Å; K397-H401 VanDerWaalsContact O-N 3.08Å; R398-H401 WeakPolarHBondContact O-CB 3.45Å; R398-H401 PolarHBondContact O-N 3.16Å; H401-K403 PolarHBondContact O-N 3.47Å; H401-S404 PolarHBondContact O-N 3.02Å; H401-S405 PolarHBondContact O-N 2.83Å; H401-S405 PolarHBondContact O-OG 3.28Å
402D76.6Confident71.9Confident104 Ų10485.4 Ų85.456%0.55643%0.427SS*.Hα-helixtrans-62.8-42.9178.5-68.7-13.1000111.7R398 R400 S404 S405 D406R398-D402 PolarHBondContact O-N 3.15Å; R400-D402 VanDerWaalsContact C-N 3.31Å; R400-D402 PolarHBondContact O-N 3.04Å; D402-S404 PolarHBondContact O-N 2.95Å; D402-S405 WeakPolarHBondContact CA-OG 3.45Å; D402-S405 PolarHBondContact O-N 2.98Å; D402-S405 PolarHBondContact O-OG 2.79Å; D402-D406 PolarHBondContact O-N 3.34Å
403K74.9Confident71Confident139 Ų13990.2 Ų90.260%0.60445%0.451SS*.Hα-helixtrans-63.9-40.2175.3-78.1-177.9173.6-168.30112.8K399 R400 H401 S407K399-K403 WeakPolarHBondContact O-CG 3.37Å; K399-K403 PolarHBondContact O-N 2.94Å; R400-K403 PolarHBondContact O-N 3.39Å; H401-K403 PolarHBondContact O-N 3.47Å; K403-S407 PolarHBondContact O-N 2.98Å; K403-S407 VanDerWaalsContact O-N 3.13Å; K403-S407 PolarHBondContact O-OG 3.44Å
404S68.1Low70.3Confident50 Ų5093.1 Ų93.135%0.3547%0.466SS..Hα-helixtrans-69.1-39178.3-1780000111.6R400 H401 D402 S407 K408R400-S404 PolarHBondContact O-N 2.81Å; H401-S404 PolarHBondContact O-N 3.02Å; D402-S404 PolarHBondContact O-N 2.95Å; S404-S407 WeakPolarHBondContact CA-OG 3.3Å; S404-S407 PolarHBondContact O-N 2.95Å; S404-S407 PolarHBondContact O-OG 3.39Å; S404-K408 WeakPolarHBondContact O-CG 3.18Å; S404-K408 PolarHBondContact O-N 3.11Å
405S64.5Low69.6Low57 Ų5795.9 Ų95.940%0.39947%0.474SS..Hα-helixtrans-63.1-45.2174.153.30000111.5H401 D402 S407 K408 T409H401-S405 PolarHBondContact O-N 2.83Å; H401-S405 PolarHBondContact O-OG 3.28Å; D402-S405 WeakPolarHBondContact CA-OG 3.45Å; D402-S405 PolarHBondContact O-N 2.98Å; D402-S405 PolarHBondContact O-OG 2.79Å; S405-S407 VanDerWaalsContact C-N 3.33Å; S405-S407 PolarHBondContact O-N 3.48Å; S405-K408 PolarHBondContact O-N 2.87Å; S405-K408 VanDerWaalsContact O-N 3.1Å; S405-T409 PolarHBondContact O-N 2.8Å; S405-T409 PolarHBondContact O-OG1 3.5Å
406D65.7Low68.6Low108 Ų10899.5 Ų99.558%0.57850%0.495SS*.Hα-helixtrans-59.5-45.3179.3-74.7-10.6000111D402 K408 T409 E410D402-D406 PolarHBondContact O-N 3.34Å; D406-K408 PolarHBondContact O-N 3.34Å; D406-T409 PolarHBondContact O-N 3.26Å; D406-T409 VanDerWaalsContact O-N 3.13Å; D406-T409 PolarHBondContact O-OG1 3.23Å; D406-E410 PolarHBondContact O-N 3.14Å
407S58.3Low67.5Low73 Ų73106.1 Ų106.151%0.5153%0.526SS..Hα-helixtrans-65.6-18.1177.467.40000115.8K403 S404 S405K403-S407 PolarHBondContact O-N 2.98Å; K403-S407 VanDerWaalsContact O-N 3.13Å; K403-S407 PolarHBondContact O-OG 3.44Å; S404-S407 WeakPolarHBondContact CA-OG 3.3Å; S404-S407 PolarHBondContact O-N 2.95Å; S404-S407 PolarHBondContact O-OG 3.39Å; S405-S407 VanDerWaalsContact C-N 3.33Å; S405-S407 PolarHBondContact O-N 3.48Å
408K55.8Low66.6Low166 Ų166110.4 Ų110.472%0.72255%0.549SS*.Hα-helixtrans-91.4-11.3176.5-75.4178.2-179.9176.50112.9S404 S405 D406S404-K408 WeakPolarHBondContact O-CG 3.18Å; S404-K408 PolarHBondContact O-N 3.11Å; S405-K408 PolarHBondContact O-N 2.87Å; S405-K408 VanDerWaalsContact O-N 3.1Å; D406-K408 PolarHBondContact O-N 3.34Å
409T52.2Low65.4Low120 Ų120109.4 Ų109.474%0.73656%0.557SS**Hα-helixtrans-100-11.2179.550000113.6S405 D406S405-T409 PolarHBondContact O-N 2.8Å; S405-T409 PolarHBondContact O-OG1 3.5Å; D406-T409 PolarHBondContact O-N 3.26Å; D406-T409 VanDerWaalsContact O-N 3.13Å; D406-T409 PolarHBondContact O-OG1 3.23Å
410E40.3Very low63.9Low225 Ų225111.9 Ų111.9100%1.05158%0.575SS**  trans-89.40165-66.9-173.1128.100110.7D406D406-E410 PolarHBondContact O-N 3.14Å

Retrieved 410 of 410 residues in 764.7 ms (Link to these results)