A0A096MYZ4_PAPAN Loading...

Peroxisomal biogenesis factor 19

Necessary for early peroxisomal biogenesis. Acts both as a cytosolic chaperone and as an import receptor for peroxisomal membrane proteins (PMPs). Binds and stabilizes newly synthesized PMPs in the cytoplasm by interacting with their hydrophobic membrane-spanning domains, and targets them to the peroxisome membrane by binding to the integral membrane protein PEX3. Excludes CDKN2A from the nucleus and prevents its interaction with MDM2, which results in active degradation of TP53.

AlphaFold DB , UniProt , Accession A0A096MYZ4, Species PAPAN (Papio anubis, Olive baboon), Gene PEX19, Length 299 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.4Very low44.9Very low251 Ų251132.1 Ų132.1100%1.23683%0.825SS**  0127.30-95173.5161.100106.4
2A36.9Very low45.6Very low100 Ų100127.2 Ų127.283%0.82681%0.807SS**  cis-168.4154.4-1600000104.4
3A42.8Very low46.4Very low99 Ų99126.9 Ų126.982%0.81879%0.789SS**  trans-77.5161.6-177.200000114.6
4A40.9Very low47.2Very low94 Ų94122.2 Ų122.278%0.77777%0.769SS**  trans172.4107.114400000106.5
5E51.2Low48.4Very low191 Ų191120.7 Ų120.789%0.89375%0.753SS**  52.4104.973.4-71.2-163.5109.600114.6
6E46.5Very low49.8Very low197 Ų197123.9 Ų123.992%0.92175%0.747SS**  trans162.8113147.5-91.1-170120.100106.5
7D41Very low50.8Low149 Ų149124.4 Ų124.480%0.79774%0.739SS**  -165.3112.489.4-172.4-101.8000108.9
8C45.8Very low51.9Low141 Ų141123.1 Ų123.195%0.95373%0.727SS**  trans-129.891.2177.1-173.20000106.6
9G52.1Low53Low55 Ų55123.2 Ų123.257%0.56772%0.72SS**  trans-155.40.1-172.600000118
10V49.9Very low54.3Low124 Ų124124.5 Ų124.575%0.75272%0.719SS**SBendtrans-117.9-18.4-174.9-172.90000113.9
11G49.8Very low55.2Low52 Ų52124.4 Ų124.454%0.53672%0.715SS.*Hα-helixtrans-82.6-28.717900000115.2D15G11-D15 PolarHBondContact O-N 2.9Å
12A54.3Low57Low73 Ų73117.9 Ų117.960%0.60368%0.684SS**Hα-helixtrans-79-23.6-168.600000114.7R16A12-R16 PolarHBondContact O-N 3.5Å
13E55.9Low58.8Low124 Ų124120.1 Ų120.158%0.57968%0.678SS**Hα-helixtrans-80.9-38.6177.9-71.6-83.111400111.2R16 E17E13-R16 WeakPolarHBondContact O-CB 3.47Å; E13-R16 PolarHBondContact O-N 3.28Å; E13-E17 PolarHBondContact O-N 3Å
14A56.8Low60.3Low61 Ų61119.4 Ų119.450%0.50467%0.667SS.*Hα-helixtrans-67.1-37.3178.100000112.6R16 L18A14-R16 VanDerWaalsContact C-N 3.33Å; A14-L18 WeakPolarHBondContact O-CB 3.33Å; A14-L18 PolarHBondContact O-N 3.22Å
15D65Low61.9Low100 Ų100117.4 Ų117.454%0.53565%0.65SS.*Hα-helixtrans-67.3-34.4172.9-92.8-40.7000111.7G11 L18 E19G11-D15 PolarHBondContact O-N 2.9Å; D15-L18 PolarHBondContact O-N 2.92Å; D15-E19 WeakPolarHBondContact O-CB 3.33Å; D15-E19 VanDerWaalsContact O-CG 3.29Å; D15-E19 WeakPolarHBondContact O-CG 3.42Å; D15-E19 PolarHBondContact O-N 2.92Å
16R71.6Confident62.6Low172 Ų172114 Ų11465%0.64964%0.637SS**Hα-helixtrans-68.5-43.1178.5-111.3-179.5144.9169.8-5.4113.3A12 E13 A14 L18 E19 E20A12-R16 PolarHBondContact O-N 3.5Å; E13-R16 WeakPolarHBondContact O-CB 3.47Å; E13-R16 PolarHBondContact O-N 3.28Å; A14-R16 VanDerWaalsContact C-N 3.33Å; R16-L18 VanDerWaalsContact C-N 3.28Å; R16-L18 PolarHBondContact O-N 2.74Å; R16-E19 PolarHBondContact O-N 3.46Å; R16-E20 PolarHBondContact O-N 2.99Å
17E66.8Low63.7Low131 Ų131110.5 Ų110.561%0.61263%0.625SS**Hα-helixtrans-66.4-34.3175.9-68.2-176.6146.700111.2E13 L21E13-E17 PolarHBondContact O-N 3Å; E17-L21 WeakPolarHBondContact O-CB 3.19Å; E17-L21 PolarHBondContact O-N 2.96Å
18L70.6Confident64.9Low101 Ų101108.8 Ų108.853%0.52962%0.616SS.*Hα-helixtrans-70.6-40.4175.3-147.778.8000111.9A14 D15 R16 L21 L22A14-L18 WeakPolarHBondContact O-CB 3.33Å; A14-L18 PolarHBondContact O-N 3.22Å; D15-L18 PolarHBondContact O-N 2.92Å; R16-L18 VanDerWaalsContact C-N 3.28Å; R16-L18 PolarHBondContact O-N 2.74Å; L18-L21 PolarHBondContact O-N 3.02Å; L18-L22 WeakPolarHBondContact O-CB 3.28Å; L18-L22 VanDerWaalsContact O-CG 3.23Å; L18-L22 WeakPolarHBondContact O-CG 3.38Å; L18-L22 PolarHBondContact O-N 3.48Å
19E73.5Confident65.6Low126 Ų126110.5 Ų110.559%0.58961%0.608SS**Hα-helixtrans-61.9-42.6174-78.4176.1-177.700111.4D15 R16 L22 E23D15-E19 WeakPolarHBondContact O-CB 3.33Å; D15-E19 VanDerWaalsContact O-CG 3.29Å; D15-E19 WeakPolarHBondContact O-CG 3.42Å; D15-E19 PolarHBondContact O-N 2.92Å; R16-E19 PolarHBondContact O-N 3.46Å; E19-L22 PolarHBondContact O-N 3.44Å; E19-E23 WeakPolarHBondContact O-CB 3.4Å; E19-E23 PolarHBondContact O-N 2.87Å
20E77.6Confident66Low149 Ų149113.9 Ų113.970%0.69661%0.613SS**Hα-helixtrans-67-37.6177.3-164.6173.5147.200112.1R16 E23 S24R16-E20 PolarHBondContact O-N 2.99Å; E20-E23 PolarHBondContact O-N 3.12Å; E20-S24 WeakPolarHBondContact O-CB 3.44Å; E20-S24 PolarHBondContact O-N 2.95Å
21L73.4Confident66.4Low122 Ų122116.3 Ų116.364%0.63961%0.613SS**Hα-helixtrans-67-37.5173.4-103.8148.1000112.7E17 L18 A25E17-L21 WeakPolarHBondContact O-CB 3.19Å; E17-L21 PolarHBondContact O-N 2.96Å; L18-L21 PolarHBondContact O-N 3.02Å; L21-A25 VanDerWaalsContact O-CB 3.31Å; L21-A25 WeakPolarHBondContact O-CB 3.25Å; L21-A25 PolarHBondContact O-N 3.46Å
22L74.9Confident66.5Low114 Ų114117.9 Ų117.960%0.59762%0.621SS**Hα-helixtrans-71.1-37.7176.1-73.1171000111.8L18 E19 A25 L26L18-L22 WeakPolarHBondContact O-CB 3.28Å; L18-L22 VanDerWaalsContact O-CG 3.23Å; L18-L22 WeakPolarHBondContact O-CG 3.38Å; L18-L22 PolarHBondContact O-N 3.48Å; E19-L22 PolarHBondContact O-N 3.44Å; L22-A25 PolarHBondContact O-N 3.4Å; L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 PolarHBondContact O-N 3.48Å
23E74.4Confident66Low148 Ų148122.9 Ų122.969%0.69263%0.629SS**Hα-helixtrans-69.5-41.4176.9-133.1166.6-14700111.2E19 E20 A25 L26 D27E19-E23 WeakPolarHBondContact O-CB 3.4Å; E19-E23 PolarHBondContact O-N 2.87Å; E20-E23 PolarHBondContact O-N 3.12Å; E23-A25 VanDerWaalsContact C-N 3.31Å; E23-A25 PolarHBondContact O-N 3.22Å; E23-L26 PolarHBondContact O-N 3.13Å; E23-D27 PolarHBondContact O-N 3.02Å; E23-D27 VanDerWaalsContact O-N 3.11Å
24S75.2Confident65.6Low83 Ų83123 Ų12358%0.5864%0.641SS**Hα-helixtrans-63.2-34.6172.4-179.60000113E20E20-S24 WeakPolarHBondContact O-CB 3.44Å; E20-S24 PolarHBondContact O-N 2.95Å
25A73.1Confident64.7Low52 Ų52125.7 Ų125.743%0.4366%0.656SS.*Hα-helixtrans-76.1-31.4177.200000112.4L21 L22 E23L21-A25 VanDerWaalsContact O-CB 3.31Å; L21-A25 WeakPolarHBondContact O-CB 3.25Å; L21-A25 PolarHBondContact O-N 3.46Å; L22-A25 PolarHBondContact O-N 3.4Å; E23-A25 VanDerWaalsContact C-N 3.31Å; E23-A25 PolarHBondContact O-N 3.22Å
26L67.3Low63.6Low119 Ų119126.6 Ų126.662%0.62367%0.667SS**Hα-helixtrans-71.6-36.6177.6-167.366.2000111.9L22 E23 D28 F29 D30L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 PolarHBondContact O-N 3.48Å; E23-L26 PolarHBondContact O-N 3.13Å; L26-D28 PolarHBondContact O-N 2.71Å; L26-F29 PolarHBondContact O-N 2.93Å; L26-D30 PolarHBondContact O-N 3.3Å
27D68.1Low62.2Low124 Ų124122.9 Ų122.966%0.66367%0.673SS**Hα-helixtrans-67.5-34178.9-139-90.8000112.3E23 F29 D30 K31E23-D27 PolarHBondContact O-N 3.02Å; E23-D27 VanDerWaalsContact O-N 3.11Å; D27-F29 VanDerWaalsContact C-N 3.3Å; D27-F29 PolarHBondContact O-N 3.03Å; D27-D30 PolarHBondContact O-N 3.15Å; D27-K31 PolarHBondContact O-N 3.02Å
28D67.8Low61.1Low114 Ų114122.3 Ų122.361%0.6168%0.681SS**Hα-helixtrans-69.9-26.9178.5-138.1-99.7000112.4L26L26-D28 PolarHBondContact O-N 2.71Å
29F59.8Low59.8Low177 Ų177122.9 Ų122.978%0.77669%0.691SS**Hα-helixtrans-76.3-31.3174.3-95.2-92.8000113.6L26 D27L26-F29 PolarHBondContact O-N 2.93Å; D27-F29 VanDerWaalsContact C-N 3.3Å; D27-F29 PolarHBondContact O-N 3.03Å
30D60.5Low57.8Low126 Ų126121.9 Ų121.967%0.67470%0.698SS**Hα-helixtrans-78.1-24.9177.9-120.2-78.6000112.2L26 D27 A32L26-D30 PolarHBondContact O-N 3.3Å; D27-D30 PolarHBondContact O-N 3.15Å; D30-A32 PolarHBondContact O-N 2.97Å
31K58.5Low55.5Low175 Ų175120.8 Ų120.876%0.76170%0.701SS**THydrogen-bonded Turntrans-67.8-12.1174.9-160.8169.7177.9-171.30113.8D27D27-K31 PolarHBondContact O-N 3.02Å
32A52.3Low53.3Low84 Ų84120.8 Ų120.869%0.69471%0.707SS**THydrogen-bonded Turntrans-10328.3-17800000114.6D30D30-A32 PolarHBondContact O-N 2.97Å
33K43.5Very low51.2Low178 Ų178121.7 Ų121.777%0.77472%0.717SS**  trans-117.3128.4173.2-129.6171-171.4166.70113
34P46.4Very low49.6Very low127 Ų127120 Ų12083%0.82572%0.719SS**  trans-77.8141.8-177.232.2-32.9000111.1
35S38.1Very low48.2Very low118 Ų118121.5 Ų121.583%0.82573%0.726SS**  trans-115.5151.7177.3-152.40000111.2
36P41.9Very low46Very low118 Ų118126.5 Ų126.577%0.76675%0.746SS**  trans-92.6160.1-152.537.1-34000115.3
37A42.7Very low44.5Very low95 Ų95124.5 Ų124.579%0.78575%0.746SS**  trans-72.3158.1177.600000114.4
38P42.7Very low42.9Very low119 Ų119124.3 Ų124.377%0.77376%0.755SS**  -158.3-165.8105.938.4-17.1000114.9
39P43.3Very low41.2Very low113 Ų113122.3 Ų122.373%0.73476%0.762SS**  -129.5160.3-53.435.7-18.4000116.6
40S33Very low40.3Very low105 Ų105119.4 Ų119.473%0.73476%0.761SS**  trans36.1129.2147.2-47.10000125.3
41T28.1Very low38.9Very low126 Ų126122.3 Ų122.377%0.77377%0.77SS**  158.8132.9102.238.60000116
42T27.8Very low38.1Very low122 Ų122123.8 Ų123.875%0.74878%0.776SS**  trans55.3132.3144.854.40000120.7
43T29.9Very low37.2Very low132 Ų132130.1 Ų130.181%0.8178%0.782SS**  cis-172.9168.830.15.50000110.5
44P42.3Very low37.1Very low113 Ų113125.4 Ų125.473%0.73477%0.772SS**  trans-93.8-168.5-171.441.9-35.9000113.5
45P44.8Very low36.8Very low114 Ų114124.7 Ų124.774%0.7477%0.767SS**  cis-127.5173.18.838.9-17.4000114.1
46D26.9Very low36.7Very low157 Ų157121.2 Ų121.284%0.8475%0.75SS**  -178.6168.878.8-163.1-99.4000111
47A36.2Very low36.5Very low77 Ų77120 Ų12064%0.63674%0.737SS**  trans-81.7147.8-151.800000117
48S34.1Very low36.5Very low120 Ų120120.2 Ų120.284%0.83973%0.728SS**  174.5128.9117.1-76.20000110.7
49G32.1Very low36.5Very low73 Ų73117.5 Ų117.575%0.75372%0.716SS**  trans-73.7-175.7168.100000112.4
50P40.8Very low36.3Very low116 Ų116118.7 Ų118.775%0.75371%0.71SS**  cis-138.8163.840.536-15.9000117.7
51Q32.4Very low36.6Very low186 Ų186118.6 Ų118.687%0.86970%0.701SS**  trans7799.1149.1-77.7173.9-7700121.9R53Q51-R53 PolarHBondContact O-N 3.16Å
52K41.2Very low37.3Very low206 Ų206115.2 Ų115.290%0.89669%0.686SS**  trans-22.9119.4142.5-100.3173.7167.1-177.60114.7
53R33.4Very low38.1Very low217 Ų217113.8 Ų113.882%0.81967%0.673SS**  trans-103.4136142.1-82.7-168.1-172.6-177.32.3108.5Q51Q51-R53 PolarHBondContact O-N 3.16Å
54S41.5Very low38.8Very low79 Ų79110.3 Ų110.355%0.55265%0.647SS**  trans-77.8151.4178.5-64.30000110.6G56S54-G56 PolarHBondContact O-N 3.39Å
55P39.8Very low39.1Very low113 Ų113107.1 Ų107.173%0.73463%0.63SS**Hα-helixtrans-65.9-4.9-177.5-17.530.3000115.7T58P55-T58 PolarHBondContact O-OG1 3.01Å
56G36.2Very low39.3Very low44 Ų44105.3 Ų105.345%0.45462%0.62SS.*Hα-helixtrans-85.9-18.6-176.900000115.1S54 K60S54-G56 PolarHBondContact O-N 3.39Å; G56-K60 WeakPolarHBondContact O-CG 3.5Å
57D37.6Very low40.4Very low94 Ų9499 Ų9950%0.50359%0.585SS.*Hα-helixtrans-77.8-40.4177.1-99.1-80.6000111.4A59 K60 D61D57-A59 VanDerWaalsContact C-N 3.29Å; D57-A59 PolarHBondContact O-N 3.26Å; D57-K60 PolarHBondContact O-N 2.92Å; D57-K60 VanDerWaalsContact O-N 3.16Å; D57-D61 PolarHBondContact O-N 3.27Å
58T43.2Very low40.9Very low98 Ų98100.2 Ų100.260%0.60158%0.578SS**Hα-helixtrans-66.6-27.3-179.7420000113.8P55 A62P55-T58 PolarHBondContact O-OG1 3.01Å; T58-A62 VanDerWaalsContact O-CB 3.28Å; T58-A62 WeakPolarHBondContact O-CB 3.23Å; T58-A62 PolarHBondContact O-N 2.93Å; T58-A62 VanDerWaalsContact O-N 3.15Å
59A42.3Very low41.7Very low63 Ų63101.7 Ų101.752%0.52157%0.569SS.*Hα-helixtrans-76.9-31.9175.300000112.2D57 L63D57-A59 VanDerWaalsContact C-N 3.29Å; D57-A59 PolarHBondContact O-N 3.26Å; A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 PolarHBondContact O-N 3.42Å
60K39.6Very low42.6Very low138 Ų138101 Ų10160%0.655%0.546SS*.Hα-helixtrans-75.8-41.6176.8-71.1179.1176.6-177.90111.7G56 D57 A62 L63 F64G56-K60 WeakPolarHBondContact O-CG 3.5Å; D57-K60 PolarHBondContact O-N 2.92Å; D57-K60 VanDerWaalsContact O-N 3.16Å; K60-A62 VanDerWaalsContact C-N 3.32Å; K60-L63 PolarHBondContact O-N 3.48Å; K60-F64 WeakPolarHBondContact O-CB 3.38Å; K60-F64 PolarHBondContact O-N 3.16Å
61D38.9Very low42.9Very low103 Ų10396.2 Ų96.255%0.55151%0.513SS*.Hα-helixtrans-61.1-39.7170.9-100.2-78.4000111.6D57 A65D57-D61 PolarHBondContact O-N 3.27Å; D61-A65 WeakPolarHBondContact O-CB 3.38Å; D61-A65 PolarHBondContact O-N 3.4Å
62A43.4Very low43.6Very low54 Ų5491.2 Ų91.245%0.44649%0.49SS..Hα-helixtrans-70.1-36.7177.100000112.7T58 K60 S66T58-A62 VanDerWaalsContact O-CB 3.28Å; T58-A62 WeakPolarHBondContact O-CB 3.23Å; T58-A62 PolarHBondContact O-N 2.93Å; T58-A62 VanDerWaalsContact O-N 3.15Å; K60-A62 VanDerWaalsContact C-N 3.32Å; A62-S66 VanDerWaalsContact O-CB 3.28Å; A62-S66 WeakPolarHBondContact O-CB 3.47Å; A62-S66 PolarHBondContact O-N 3.4Å; A62-S66 PolarHBondContact O-OG 2.91Å
63L42.5Very low44Very low93 Ų9387.7 Ų87.749%0.48748%0.476SS..Hα-helixtrans-68-45.7173.7-158.6178.7000110.2A59 K60 A65 S66 Q67A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 PolarHBondContact O-N 3.42Å; K60-L63 PolarHBondContact O-N 3.48Å; L63-A65 PolarHBondContact O-N 3.17Å; L63-S66 CarbonylContact O-C 3.58Å; L63-S66 PolarHBondContact O-N 2.75Å; L63-Q67 VanDerWaalsContact O-CB 3.28Å; L63-Q67 WeakPolarHBondContact O-CB 3.33Å; L63-Q67 PolarHBondContact O-N 3.47Å
64F45.9Very low44.6Very low59 Ų5978.9 Ų78.926%0.25945%0.445SS..Hα-helixtrans-62.3-42.2175-106.6-91.7000112.3K60 S66 Q67 E68 E249K60-F64 WeakPolarHBondContact O-CB 3.38Å; K60-F64 PolarHBondContact O-N 3.16Å; F64-S66 VanDerWaalsContact C-N 3.29Å; F64-S66 PolarHBondContact O-N 3.35Å; F64-Q67 CarbonylContact O-C 3.59Å; F64-Q67 PolarHBondContact O-N 2.79Å; F64-E68 WeakPolarHBondContact O-CB 3.26Å; F64-E68 PolarHBondContact O-N 3.12Å; F64-E249 WeakPolarHBondContact CE2-OE1 3.24Å
65A48.9Very low44.9Very low45 Ų4578.4 Ų78.437%0.37243%0.433SS..Hα-helixtrans-68-30.6175.600000112.2D61 L63 K69D61-A65 WeakPolarHBondContact O-CB 3.38Å; D61-A65 PolarHBondContact O-N 3.4Å; L63-A65 PolarHBondContact O-N 3.17Å; A65-K69 WeakPolarHBondContact O-CB 3.3Å; A65-K69 VanDerWaalsContact O-CG 3.25Å; A65-K69 WeakPolarHBondContact O-CG 3.32Å; A65-K69 PolarHBondContact O-N 2.76Å
66S49.3Very low45.3Very low76 Ų7678.7 Ų78.753%0.53143%0.429SS..Hα-helixtrans-76-35.5174.5-56.30000111.4A62 L63 F64 F70A62-S66 VanDerWaalsContact O-CB 3.28Å; A62-S66 WeakPolarHBondContact O-CB 3.47Å; A62-S66 PolarHBondContact O-N 3.4Å; A62-S66 PolarHBondContact O-OG 2.91Å; L63-S66 CarbonylContact O-C 3.58Å; L63-S66 PolarHBondContact O-N 2.75Å; F64-S66 VanDerWaalsContact C-N 3.29Å; F64-S66 PolarHBondContact O-N 3.35Å; S66-F70 WeakPolarHBondContact O-CB 3.37Å; S66-F70 PolarHBondContact O-N 3.49Å
67Q49.4Very low45.8Very low24 Ų2479.7 Ų79.711%0.11243%0.429CS..Hα-helixtrans-68.6-44.3172.6-178.3-178.99000110.7L63 F64 F70 F71 L252L63-Q67 VanDerWaalsContact O-CB 3.28Å; L63-Q67 WeakPolarHBondContact O-CB 3.33Å; L63-Q67 PolarHBondContact O-N 3.47Å; F64-Q67 CarbonylContact O-C 3.59Å; F64-Q67 PolarHBondContact O-N 2.79Å; Q67-F70 CarbonylContact O-C 3.57Å; Q67-F70 WeakPolarHBondContact O-CB 3.28Å; Q67-F70 PolarHBondContact O-N 2.8Å; Q67-F71 HydrophobicContact CG-CD2 3.88Å; Q67-F71 HydrophobicContact CG-CE2 3.42Å; Q67-F71 VanDerWaalsContact CG-CE2 3.42Å; Q67-F71 HydrophobicContact CG-CZ 3.97Å; Q67-F71 WeakPolarHBondContact O-CB 3.28Å; Q67-F71 WeakPolarHBondContact O-CD2 3.41Å; Q67-F71 WeakPolarHBondContact O-CG 3.16Å; Q67-F71 PolarHBondContact O-N 2.83Å; Q67-L252 HydrophobicContact CG-CD2 4.33Å; Q67-L252 VanDerWaalsContact NE2-CD2 3.31Å
68E45.9Very low46.1Very low103 Ų10381.7 Ų81.748%0.48144%0.435SS..Hα-helixtrans-67.2-38.5176.4-171.5169.2-158.700110.9F64 F71 Q72F64-E68 WeakPolarHBondContact O-CB 3.26Å; F64-E68 PolarHBondContact O-N 3.12Å; E68-F71 PolarHBondContact O-N 2.76Å; E68-Q72 VanDerWaalsContact O-CB 3.26Å; E68-Q72 WeakPolarHBondContact O-CB 3.3Å; E68-Q72 PolarHBondContact O-N 3.17Å
69K51.6Low46.2Very low152 Ų15279.7 Ų79.766%0.66142%0.421SS*.Hα-helixtrans-65.5-37.9169.1-83.4-172.7177-170.60113.2A65 F71 Q72 E73A65-K69 WeakPolarHBondContact O-CB 3.3Å; A65-K69 VanDerWaalsContact O-CG 3.25Å; A65-K69 WeakPolarHBondContact O-CG 3.32Å; A65-K69 PolarHBondContact O-N 2.76Å; K69-F71 VanDerWaalsContact C-N 3.34Å; K69-Q72 CarbonylContact O-C 3.59Å; K69-Q72 PolarHBondContact O-N 2.94Å; K69-E73 WeakPolarHBondContact O-CB 3.44Å; K69-E73 PolarHBondContact O-N 2.65Å
70F51.1Low46.5Very low58 Ų5878.5 Ų78.525%0.25441%0.411SS..Hα-helixtrans-66.1-39.3174.8174.3-105.7000111.2S66 Q67 E73 L74 Q256S66-F70 WeakPolarHBondContact O-CB 3.37Å; S66-F70 PolarHBondContact O-N 3.49Å; Q67-F70 CarbonylContact O-C 3.57Å; Q67-F70 WeakPolarHBondContact O-CB 3.28Å; Q67-F70 PolarHBondContact O-N 2.8Å; F70-E73 PolarHBondContact O-N 3.35Å; F70-L74 HydrophobicContact CD1-CD1 4.01Å; F70-L74 HydrophobicContact CD1-CG 4.48Å; F70-L74 HydrophobicContact CE1-CD1 3.24Å; F70-L74 HydrophobicContact CE1-CG 3.88Å; F70-L74 HydrophobicContact CE2-CD1 4.22Å; F70-L74 HydrophobicContact CE2-CD2 4.25Å; F70-L74 HydrophobicContact CE2-CG 3.95Å; F70-L74 HydrophobicContact CZ-CD1 3.32Å; F70-L74 HydrophobicContact CZ-CD2 3.86Å; F70-L74 HydrophobicContact CZ-CG 3.51Å; F70-L74 WeakPolarHBondContact O-CB 3.37Å; F70-L74 WeakPolarHBondContact O-CG 3.5Å; F70-L74 PolarHBondContact O-N 3Å; F70-Q256 HydrophobicContact CZ-CG 4.23Å
71F46.9Very low47Very low15 Ų1575.5 Ų75.57%0.06641%0.407CS..Hα-helixtrans-69.7-38.4175.5-78-141.6000110.4Q67 E68 K69 F75 M179 L252Q67-F71 HydrophobicContact CG-CD2 3.88Å; Q67-F71 HydrophobicContact CG-CE2 3.42Å; Q67-F71 VanDerWaalsContact CG-CE2 3.42Å; Q67-F71 HydrophobicContact CG-CZ 3.97Å; Q67-F71 WeakPolarHBondContact O-CB 3.28Å; Q67-F71 WeakPolarHBondContact O-CD2 3.41Å; Q67-F71 WeakPolarHBondContact O-CG 3.16Å; Q67-F71 PolarHBondContact O-N 2.83Å; E68-F71 PolarHBondContact O-N 2.76Å; K69-F71 VanDerWaalsContact C-N 3.34Å; F71-F75 VanDerWaalsContact O-CD2 3.26Å; F71-F75 WeakPolarHBondContact O-CD2 3.43Å; F71-F75 PolarHBondContact O-N 3.38Å; F71-M179 HydrophobicContact CD1-CE 4.35Å; F71-M179 HydrophobicContact CD1-SD 4.1Å; F71-M179 HydrophobicContact CE1-CE 4.22Å; F71-M179 HydrophobicContact CE1-SD 3.4Å; F71-M179 WeakPolarHBondContact CE1-SD 3.34Å; F71-M179 HydrophobicContact CZ-SD 3.67Å; F71-L252 HydrophobicContact CE2-CD2 3.99Å; F71-L252 HydrophobicContact CZ-CD1 4.36Å; F71-L252 HydrophobicContact CZ-CD2 3.74Å
72Q46.3Very low47.4Very low82 Ų8276 Ų7638%0.38341%0.406SS..Hα-helixtrans-62.1-51170.6-160.374.23800109E68 K69 L74 F75 D76E68-Q72 VanDerWaalsContact O-CB 3.26Å; E68-Q72 WeakPolarHBondContact O-CB 3.3Å; E68-Q72 PolarHBondContact O-N 3.17Å; K69-Q72 CarbonylContact O-C 3.59Å; K69-Q72 PolarHBondContact O-N 2.94Å; Q72-L74 PolarHBondContact O-N 3.48Å; Q72-F75 CarbonylContact O-C 3.6Å; Q72-F75 PolarHBondContact O-N 3.02Å; Q72-D76 HydrophobicContact CG-CB 4.27Å; Q72-D76 WeakPolarHBondContact O-CA 3.29Å; Q72-D76 WeakPolarHBondContact O-CB 3.27Å; Q72-D76 PolarHBondContact O-N 3.17Å
73E49.4Very low47.6Very low132 Ų13275.9 Ų75.962%0.61741%0.405SS*.Hα-helixtrans-64.3-36-177.4-168.9165.3-163.400113.4K69 F70 F75 S77K69-E73 WeakPolarHBondContact O-CB 3.44Å; K69-E73 PolarHBondContact O-N 2.65Å; F70-E73 PolarHBondContact O-N 3.35Å; E73-F75 VanDerWaalsContact C-N 3.27Å; E73-F75 PolarHBondContact O-N 3.04Å; E73-S77 WeakPolarHBondContact O-CB 3.43Å; E73-S77 PolarHBondContact O-N 3.26Å
74L47.1Very low48Very low32 Ų3275.5 Ų75.517%0.16841%0.407CS..Hα-helixtrans-62.8-29.2171.3-82.9-179.7000113.6F70 Q72 L285F70-L74 HydrophobicContact CD1-CD1 4.01Å; F70-L74 HydrophobicContact CD1-CG 4.48Å; F70-L74 HydrophobicContact CE1-CD1 3.24Å; F70-L74 HydrophobicContact CE1-CG 3.88Å; F70-L74 HydrophobicContact CE2-CD1 4.22Å; F70-L74 HydrophobicContact CE2-CD2 4.25Å; F70-L74 HydrophobicContact CE2-CG 3.95Å; F70-L74 HydrophobicContact CZ-CD1 3.32Å; F70-L74 HydrophobicContact CZ-CD2 3.86Å; F70-L74 HydrophobicContact CZ-CG 3.51Å; F70-L74 WeakPolarHBondContact O-CB 3.37Å; F70-L74 WeakPolarHBondContact O-CG 3.5Å; F70-L74 PolarHBondContact O-N 3Å; Q72-L74 PolarHBondContact O-N 3.48Å; L74-L285 HydrophobicContact CD2-CD1 3.95Å
75F47.9Very low48.2Very low69 Ų6975.3 Ų75.330%0.30342%0.416SS..Hα-helixtrans-105.6-32.7-176.2-81-93.6000113.2F71 Q72 E73 S77 A80 M175 M179F71-F75 VanDerWaalsContact O-CD2 3.26Å; F71-F75 WeakPolarHBondContact O-CD2 3.43Å; F71-F75 PolarHBondContact O-N 3.38Å; Q72-F75 CarbonylContact O-C 3.6Å; Q72-F75 PolarHBondContact O-N 3.02Å; E73-F75 VanDerWaalsContact C-N 3.27Å; E73-F75 PolarHBondContact O-N 3.04Å; F75-S77 VanDerWaalsContact C-N 3.31Å; F75-S77 PolarHBondContact O-N 3.37Å; F75-A80 WeakPolarHBondContact O-CB 3.26Å; F75-A80 PolarHBondContact O-N 3.45Å; F75-M175 HydrophobicContact CB-CE 4.19Å; F75-M175 HydrophobicContact CD1-CE 3.34Å; F75-M175 HydrophobicContact CD1-SD 4.12Å; F75-M175 HydrophobicContact CD2-CE 3.17Å; F75-M175 HydrophobicContact CE1-CE 3.36Å; F75-M175 HydrophobicContact CE1-SD 4.1Å; F75-M175 HydrophobicContact CE2-CE 3.18Å; F75-M175 HydrophobicContact CG-CE 3.26Å; F75-M175 HydrophobicContact CG-SD 4.46Å; F75-M175 HydrophobicContact CZ-CE 3.3Å; F75-M175 HydrophobicContact CZ-SD 4.44Å; F75-M179 HydrophobicContact CE2-CE 3.83Å; F75-M179 HydrophobicContact CZ-CE 4.38Å
76D47.1Very low48.1Very low119 Ų11978.6 Ų78.664%0.63642%0.424SS*.Hα-helixtrans-80.9-12.8-174.8-147.516.9000111.9Q72Q72-D76 HydrophobicContact CG-CB 4.27Å; Q72-D76 WeakPolarHBondContact O-CA 3.29Å; Q72-D76 WeakPolarHBondContact O-CB 3.27Å; Q72-D76 PolarHBondContact O-N 3.17Å
77S47.9Very low48.1Very low65 Ų6581.8 Ų81.846%0.45543%0.428SS..THydrogen-bonded Turntrans-95.996.1174.3-175.50000111.5E73 F75 L79E73-S77 WeakPolarHBondContact O-CB 3.43Å; E73-S77 PolarHBondContact O-N 3.26Å; F75-S77 VanDerWaalsContact C-N 3.31Å; F75-S77 PolarHBondContact O-N 3.37Å; S77-L79 PolarHBondContact O-N 2.88Å
78E43Very low48.3Very low135 Ų13587 Ų8763%0.63145%0.453SS*.THydrogen-bonded Turntrans64.7-33.1163.9-156.8158.7-171.200116.4S81 Q82E78-S81 CarbonylContact O-C 3.54Å; E78-S81 PolarHBondContact O-N 3.33Å; E78-S81 PolarHBondContact O-OG 2.95Å; E78-Q82 VanDerWaalsContact O-CB 3.28Å; E78-Q82 WeakPolarHBondContact O-CB 3.28Å; E78-Q82 PolarHBondContact O-N 3.19Å
79L46Very low49Very low57 Ų5788 Ų8830%0.29846%0.455SS..Hα-helixtrans-70.4-40.9177-173.667000112.9S77 S81 Q82 A83 L283S77-L79 PolarHBondContact O-N 2.88Å; L79-S81 VanDerWaalsContact C-N 3.28Å; L79-S81 PolarHBondContact O-N 3.46Å; L79-Q82 PolarHBondContact O-N 2.88Å; L79-A83 WeakPolarHBondContact O-CA 3.43Å; L79-A83 WeakPolarHBondContact O-CB 3.04Å; L79-A83 PolarHBondContact O-N 3.04Å; L79-L283 HydrophobicContact CD2-CD2 4.29Å
80A48.9Very low49.1Very low38 Ų3883.3 Ų83.331%0.31445%0.445SS..Hα-helixtrans-65.9-34.6170.300000111.3F75 T84F75-A80 WeakPolarHBondContact O-CB 3.26Å; F75-A80 PolarHBondContact O-N 3.45Å; A80-T84 WeakPolarHBondContact O-CB 3.49Å; A80-T84 PolarHBondContact O-N 3.31Å; A80-T84 PolarHBondContact O-OG1 2.94Å
81S49.2Very low49.1Very low75 Ų7583.6 Ų83.652%0.52445%0.448SS..Hα-helixtrans-68.7-38.5175.987.50000111.6E78 L79 A85E78-S81 CarbonylContact O-C 3.54Å; E78-S81 PolarHBondContact O-N 3.33Å; E78-S81 PolarHBondContact O-OG 2.95Å; L79-S81 VanDerWaalsContact C-N 3.28Å; L79-S81 PolarHBondContact O-N 3.46Å; S81-A85 WeakPolarHBondContact O-CB 3.25Å; S81-A85 PolarHBondContact O-N 2.89Å
82Q48.3Very low49.8Very low113 Ų11389.3 Ų89.353%0.52847%0.472SS..Hα-helixtrans-74.6-38.8177.9-171.6172.918.300111.3E78 L79 A85 E86E78-Q82 VanDerWaalsContact O-CB 3.28Å; E78-Q82 WeakPolarHBondContact O-CB 3.28Å; E78-Q82 PolarHBondContact O-N 3.19Å; L79-Q82 PolarHBondContact O-N 2.88Å; Q82-A85 PolarHBondContact O-N 3.4Å; Q82-E86 HydrophobicContact CG-CG 4.44Å; Q82-E86 WeakPolarHBondContact O-CB 3.49Å; Q82-E86 WeakPolarHBondContact O-CG 3.31Å; Q82-E86 PolarHBondContact O-N 2.72Å
83A47.9Very low50.4Low52 Ų5290.5 Ų90.543%0.4348%0.478SS..Hα-helixtrans-68.8-36.6172.700000111.3L79 F87L79-A83 WeakPolarHBondContact O-CA 3.43Å; L79-A83 WeakPolarHBondContact O-CB 3.04Å; L79-A83 PolarHBondContact O-N 3.04Å; A83-F87 WeakPolarHBondContact O-CA 3.18Å; A83-F87 WeakPolarHBondContact O-CB 3.34Å; A83-F87 PolarHBondContact O-N 3.21Å
84T49.1Very low50.5Low85 Ų8587.7 Ų87.752%0.52147%0.467SS..Hα-helixtrans-68.9-39.2172.5-560000110.5A80 F87 E88A80-T84 WeakPolarHBondContact O-CB 3.49Å; A80-T84 PolarHBondContact O-N 3.31Å; A80-T84 PolarHBondContact O-OG1 2.94Å; T84-F87 PolarHBondContact O-N 2.96Å; T84-E88 WeakPolarHBondContact O-CB 3.15Å; T84-E88 PolarHBondContact O-N 3.39Å
85A50.6Low51Low54 Ų5487.7 Ų87.745%0.44647%0.471SS..Hα-helixtrans-70.9-38.7175.900000112.6S81 Q82 K89S81-A85 WeakPolarHBondContact O-CB 3.25Å; S81-A85 PolarHBondContact O-N 2.89Å; Q82-A85 PolarHBondContact O-N 3.4Å; A85-K89 WeakPolarHBondContact O-CB 3.25Å; A85-K89 PolarHBondContact O-N 2.83Å
86E47.8Very low51.6Low115 Ų11591.4 Ų91.454%0.53749%0.49SS..Hα-helixtrans-67.3-39.8172.8-78.4-92.5134.300110.5Q82 K89 A90Q82-E86 HydrophobicContact CG-CG 4.44Å; Q82-E86 WeakPolarHBondContact O-CB 3.49Å; Q82-E86 WeakPolarHBondContact O-CG 3.31Å; Q82-E86 PolarHBondContact O-N 2.72Å; E86-K89 PolarHBondContact O-N 3.03Å; E86-A90 WeakPolarHBondContact O-CB 3.22Å; E86-A90 PolarHBondContact O-N 3.08Å
87F47.9Very low51.7Low143 Ų14393.2 Ų93.263%0.62749%0.494SS*.Hα-helixtrans-68.5-42.6174-178.3-96.7000111.7A83 T84 K89 A90 M91A83-F87 WeakPolarHBondContact O-CA 3.18Å; A83-F87 WeakPolarHBondContact O-CB 3.34Å; A83-F87 PolarHBondContact O-N 3.21Å; T84-F87 PolarHBondContact O-N 2.96Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-A90 PolarHBondContact O-N 3.25Å; F87-M91 HydrophobicContact CE1-SD 4.34Å; F87-M91 WeakPolarHBondContact O-CB 3.17Å; F87-M91 PolarHBondContact O-N 3.43Å
88E54.1Low51.9Low133 Ų13394.8 Ų94.862%0.62150%0.495SS*.Hα-helixtrans-65.4-40175.2-173.8-179.317300110.8T84 M91 K92T84-E88 WeakPolarHBondContact O-CB 3.15Å; T84-E88 PolarHBondContact O-N 3.39Å; E88-M91 PolarHBondContact O-N 2.83Å; E88-K92 WeakPolarHBondContact O-CB 3.39Å; E88-K92 PolarHBondContact O-N 3.44Å
89K60.7Low52.5Low124 Ų12492.1 Ų92.154%0.53949%0.489SS..Hα-helixtrans-65.8-45.8174.1-177.4-176.5170.8-162.70111.1A85 E86 F87 M91 K92 E93A85-K89 WeakPolarHBondContact O-CB 3.25Å; A85-K89 PolarHBondContact O-N 2.83Å; E86-K89 PolarHBondContact O-N 3.03Å; F87-K89 VanDerWaalsContact C-N 3.34Å; K89-M91 VanDerWaalsContact C-N 3.31Å; K89-M91 PolarHBondContact O-N 3.34Å; K89-K92 PolarHBondContact O-N 3.18Å; K89-E93 VanDerWaalsContact O-CB 3.28Å; K89-E93 WeakPolarHBondContact O-CB 2.88Å; K89-E93 PolarHBondContact O-N 3.28Å
90A54.4Low52.6Low53 Ų5395.6 Ų95.644%0.43850%0.503SS..Hα-helixtrans-63.3-38.2175.100000111.3E86 F87 K92 L94E86-A90 WeakPolarHBondContact O-CB 3.22Å; E86-A90 PolarHBondContact O-N 3.08Å; F87-A90 PolarHBondContact O-N 3.25Å; A90-K92 VanDerWaalsContact C-N 3.33Å; A90-L94 WeakPolarHBondContact O-CB 3.44Å; A90-L94 PolarHBondContact O-N 2.89Å
91M51Low52.8Low64 Ų6496.1 Ų96.132%0.31550%0.5SS..Hα-helixtrans-69.3-33.4176-164.2-177.2-164.500111.5F87 E88 K89 A95 F105F87-M91 HydrophobicContact CE1-SD 4.34Å; F87-M91 WeakPolarHBondContact O-CB 3.17Å; F87-M91 PolarHBondContact O-N 3.43Å; E88-M91 PolarHBondContact O-N 2.83Å; K89-M91 VanDerWaalsContact C-N 3.31Å; K89-M91 PolarHBondContact O-N 3.34Å; M91-A95 WeakPolarHBondContact O-CB 3.35Å; M91-A95 PolarHBondContact O-N 3.31Å; M91-F105 HydrophobicContact CE-CD1 3.55Å; M91-F105 HydrophobicContact CE-CE1 3.45Å; M91-F105 VanDerWaalsContact CE-CE1 3.45Å; M91-F105 HydrophobicContact CE-CG 4.2Å; M91-F105 HydrophobicContact CE-CZ 4.02Å
92K61.2Low53.1Low135 Ų13594.2 Ų94.259%0.58749%0.486SS*.Hα-helixtrans-75.3-39.2175.4-171.2175.8-177.31780112.4E88 K89 A90 A95 E96E88-K92 WeakPolarHBondContact O-CB 3.39Å; E88-K92 PolarHBondContact O-N 3.44Å; K89-K92 PolarHBondContact O-N 3.18Å; A90-K92 VanDerWaalsContact C-N 3.33Å; K92-A95 VanDerWaalsContact O-CB 3.3Å; K92-A95 WeakPolarHBondContact O-CB 3.41Å; K92-A95 PolarHBondContact O-N 2.91Å; K92-E96 WeakPolarHBondContact O-CG 3.42Å; K92-E96 PolarHBondContact O-N 2.71Å
93E59.3Low53.6Low108 Ų10893.2 Ų93.251%0.50548%0.481SS..Hα-helixtrans-67.2-40.6174.4-158.2163.4-154.900109.8K89 A95 E96 E97K89-E93 VanDerWaalsContact O-CB 3.28Å; K89-E93 WeakPolarHBondContact O-CB 2.88Å; K89-E93 PolarHBondContact O-N 3.28Å; E93-A95 VanDerWaalsContact C-N 3.33Å; E93-A95 PolarHBondContact O-N 3.47Å; E93-E96 PolarHBondContact O-N 2.77Å; E93-E96 VanDerWaalsContact O-N 3.16Å; E93-E97 PolarHBondContact O-N 2.9Å
94L50.5Low53.9Low73 Ų7394.5 Ų94.538%0.38248%0.478SS..Hα-helixtrans-65.8-31.7169.6-168.866.5000112.6A90 E96 E98 L101A90-L94 WeakPolarHBondContact O-CB 3.44Å; A90-L94 PolarHBondContact O-N 2.89Å; L94-E96 VanDerWaalsContact C-N 3.32Å; L94-E98 HydrophobicContact CD1-CB 4.28Å; L94-E98 HydrophobicContact CD1-CG 4.48Å; L94-E98 CarbonylContact O-C 3.34Å; L94-E98 VanDerWaalsContact O-CA 3.32Å; L94-E98 WeakPolarHBondContact O-CA 3.46Å; L94-E98 WeakPolarHBondContact O-CB 3.08Å; L94-E98 PolarHBondContact O-N 3.32Å; L94-L101 HydrophobicContact CD1-CD2 4.19Å; L94-L101 HydrophobicContact CD2-CD2 3.9Å; L94-L101 HydrophobicContact CG-CD2 4.13Å
95A58.6Low54.1Low31 Ų3196.1 Ų96.126%0.25648%0.478SS..Hα-helixtrans-67.5-32.9171.700000112.9M91 K92 E93 P99 V102M91-A95 WeakPolarHBondContact O-CB 3.35Å; M91-A95 PolarHBondContact O-N 3.31Å; K92-A95 VanDerWaalsContact O-CB 3.3Å; K92-A95 WeakPolarHBondContact O-CB 3.41Å; K92-A95 PolarHBondContact O-N 2.91Å; E93-A95 VanDerWaalsContact C-N 3.33Å; E93-A95 PolarHBondContact O-N 3.47Å; A95-P99 WeakPolarHBondContact O-CA 3.42Å; A95-V102 HydrophobicContact CB-CB 4Å; A95-V102 HydrophobicContact CB-CG1 4.01Å; A95-V102 HydrophobicContact CB-CG2 3.54Å
96E59.6Low54.3Low148 Ų14899.4 Ų99.469%0.69248%0.484SS*.Hα-helixtrans-81.4-39.5179.3-73.6-177.8159.600112K92 E93 L94K92-E96 WeakPolarHBondContact O-CG 3.42Å; K92-E96 PolarHBondContact O-N 2.71Å; E93-E96 PolarHBondContact O-N 2.77Å; E93-E96 VanDerWaalsContact O-N 3.16Å; L94-E96 VanDerWaalsContact C-N 3.32Å
97E50.2Low54.8Low156 Ų15699.3 Ų99.373%0.72948%0.482SS*.Hα-helixtrans-80.6-39178.1-71.2-159.8117.200113.1E93 P99E93-E97 PolarHBondContact O-N 2.9Å; E97-P99 VanDerWaalsContact C-CD 3.45Å; E97-P99 WeakPolarHBondContact O-CD 3.38Å
98E51.4Low55.1Low99 Ų9994.2 Ų94.246%0.46346%0.461SS..  trans-126.169-177.7-74.7-106.3100.400110.4L94 H100 L101 V102L94-E98 HydrophobicContact CD1-CB 4.28Å; L94-E98 HydrophobicContact CD1-CG 4.48Å; L94-E98 CarbonylContact O-C 3.34Å; L94-E98 VanDerWaalsContact O-CA 3.32Å; L94-E98 WeakPolarHBondContact O-CA 3.46Å; L94-E98 WeakPolarHBondContact O-CB 3.08Å; L94-E98 PolarHBondContact O-N 3.32Å; E98-H100 PolarHBondContact O-N 3.49Å; E98-L101 HydrophobicContact CB-CB 3.99Å; E98-L101 PolarHBondContact O-N 3.41Å; E98-V102 PolarHBondContact O-N 3.03Å
99P55.4Low54.8Low79 Ų7991.2 Ų91.251%0.51346%0.455SS..Hα-helixtrans-59.8-24.2-179.123.4-33.8000112.5A95 E97 E103A95-P99 WeakPolarHBondContact O-CA 3.42Å; E97-P99 VanDerWaalsContact C-CD 3.45Å; E97-P99 WeakPolarHBondContact O-CD 3.38Å; P99-E103 VanDerWaalsContact O-CB 3.3Å; P99-E103 WeakPolarHBondContact O-CB 3.4Å; P99-E103 PolarHBondContact O-N 3.24Å
100H49.2Very low54.4Low129 Ų12990.5 Ų90.560%0.59745%0.453SS*.Hα-helixtrans-68.9-33.7174.4-103.7-81.4000113.2E98 Q104E98-H100 PolarHBondContact O-N 3.49Å; H100-Q104 WeakPolarHBondContact O-CB 3.36Å; H100-Q104 WeakPolarHBondContact O-CG 3.46Å; H100-Q104 PolarHBondContact O-N 2.88Å
101L51.7Low54.3Low49 Ų4989.5 Ų89.526%0.25745%0.445SS..Hα-helixtrans-76.6-37.1-179.1-171.760.9000111.1L94 E98 Q104 F105L94-L101 HydrophobicContact CD1-CD2 4.19Å; L94-L101 HydrophobicContact CD2-CD2 3.9Å; L94-L101 HydrophobicContact CG-CD2 4.13Å; E98-L101 HydrophobicContact CB-CB 3.99Å; E98-L101 PolarHBondContact O-N 3.41Å; L101-Q104 WeakPolarHBondContact O-CB 2.99Å; L101-Q104 PolarHBondContact O-N 3.48Å; L101-F105 PolarHBondContact O-N 3.02Å
102V56.6Low54.3Low35 Ų3588.9 Ų88.921%0.21245%0.45CS..Hα-helixtrans-72.9-36.1173.8172.70000111.9A95 E98 Q104 F105 Q106A95-V102 HydrophobicContact CB-CB 4Å; A95-V102 HydrophobicContact CB-CG1 4.01Å; A95-V102 HydrophobicContact CB-CG2 3.54Å; E98-V102 PolarHBondContact O-N 3.03Å; V102-Q104 VanDerWaalsContact C-N 3.26Å; V102-Q104 PolarHBondContact O-N 3.26Å; V102-F105 PolarHBondContact O-N 2.95Å; V102-Q106 VanDerWaalsContact O-CB 3.26Å; V102-Q106 WeakPolarHBondContact O-CB 3.44Å; V102-Q106 PolarHBondContact O-N 3.39Å
103E58.5Low53.7Low92 Ų9285.8 Ų85.843%0.4346%0.457SS..Hα-helixtrans-62.7-34.5169.3-160.9-167.3170.800111.6P99 K107P99-E103 VanDerWaalsContact O-CB 3.3Å; P99-E103 WeakPolarHBondContact O-CB 3.4Å; P99-E103 PolarHBondContact O-N 3.24Å; E103-K107 VanDerWaalsContact CD-NZ 3.31Å; E103-K107 VanDerWaalsContact O-CB 3.27Å; E103-K107 WeakPolarHBondContact O-CB 3.35Å; E103-K107 VanDerWaalsContact O-CG 3.23Å; E103-K107 WeakPolarHBondContact O-CG 3.41Å; E103-K107 PolarHBondContact O-N 2.85Å; E103-K107 VanDerWaalsContact OE1-CE 3.31Å; E103-K107 WeakPolarHBondContact OE1-CE 3.3Å; E103-K107 IonicContact OE1-NZ 3.8Å; E103-K107 PolarHBondContact OE1-NZ 2.94Å; E103-K107 IonicContact OE2-NZ 3.57Å
104Q53.4Low53.3Low80 Ų8089.2 Ų89.237%0.37447%0.465SS..Hα-helixtrans-70.9-41.2174.7-78.6171.8-9.300112.7H100 L101 V102 K107 L108H100-Q104 WeakPolarHBondContact O-CB 3.36Å; H100-Q104 WeakPolarHBondContact O-CG 3.46Å; H100-Q104 PolarHBondContact O-N 2.88Å; L101-Q104 WeakPolarHBondContact O-CB 2.99Å; L101-Q104 PolarHBondContact O-N 3.48Å; V102-Q104 VanDerWaalsContact C-N 3.26Å; V102-Q104 PolarHBondContact O-N 3.26Å; Q104-K107 PolarHBondContact O-N 3.45Å; Q104-L108 VanDerWaalsContact O-CB 3.29Å; Q104-L108 WeakPolarHBondContact O-CB 3.39Å; Q104-L108 PolarHBondContact O-N 2.87Å
105F53.3Low53.1Low119 Ų11988.4 Ų88.452%0.52246%0.463SS..Hα-helixtrans-66.1-40.8174.5-171.7-95.6000111.6M91 L101 V102 L108 S109M91-F105 HydrophobicContact CE-CD1 3.55Å; M91-F105 HydrophobicContact CE-CE1 3.45Å; M91-F105 VanDerWaalsContact CE-CE1 3.45Å; M91-F105 HydrophobicContact CE-CG 4.2Å; M91-F105 HydrophobicContact CE-CZ 4.02Å; L101-F105 PolarHBondContact O-N 3.02Å; V102-F105 PolarHBondContact O-N 2.95Å; F105-L108 PolarHBondContact O-N 3.22Å; F105-S109 WeakPolarHBondContact O-CB 3.33Å; F105-S109 PolarHBondContact O-N 3.46Å
106Q56.2Low52.7Low122 Ų12289.2 Ų89.257%0.5747%0.474SS*.Hα-helixtrans-65.4-41.1174.6-159.893.463.300111.2V102 L108 S109 E110V102-Q106 VanDerWaalsContact O-CB 3.26Å; V102-Q106 WeakPolarHBondContact O-CB 3.44Å; V102-Q106 PolarHBondContact O-N 3.39Å; Q106-L108 VanDerWaalsContact C-N 3.34Å; Q106-S109 PolarHBondContact O-N 3.44Å; Q106-E110 WeakPolarHBondContact O-CB 3.33Å; Q106-E110 PolarHBondContact O-N 3.13Å
107K56.8Low52.3Low113 Ų11388.7 Ų88.749%0.49149%0.487SS..Hα-helixtrans-65.6-35.7173.3-81.3173.1-174.9161.90112.3E103 Q104 A111E103-K107 VanDerWaalsContact CD-NZ 3.31Å; E103-K107 VanDerWaalsContact O-CB 3.27Å; E103-K107 WeakPolarHBondContact O-CB 3.35Å; E103-K107 VanDerWaalsContact O-CG 3.23Å; E103-K107 WeakPolarHBondContact O-CG 3.41Å; E103-K107 PolarHBondContact O-N 2.85Å; E103-K107 VanDerWaalsContact OE1-CE 3.31Å; E103-K107 WeakPolarHBondContact OE1-CE 3.3Å; E103-K107 IonicContact OE1-NZ 3.8Å; E103-K107 PolarHBondContact OE1-NZ 2.94Å; E103-K107 IonicContact OE2-NZ 3.57Å; Q104-K107 PolarHBondContact O-N 3.45Å; K107-A111 WeakPolarHBondContact O-CB 3.41Å; K107-A111 PolarHBondContact O-N 3.37Å
108L55.3Low52.4Low36 Ų3685.7 Ų85.719%0.18848%0.476CS..Hα-helixtrans-68.3-41175.4-171.366.4000111Q104 F105 Q106 A112 F125 L129Q104-L108 VanDerWaalsContact O-CB 3.29Å; Q104-L108 WeakPolarHBondContact O-CB 3.39Å; Q104-L108 PolarHBondContact O-N 2.87Å; F105-L108 PolarHBondContact O-N 3.22Å; Q106-L108 VanDerWaalsContact C-N 3.34Å; L108-A112 VanDerWaalsContact O-CB 3.23Å; L108-A112 WeakPolarHBondContact O-CB 3.39Å; L108-A112 PolarHBondContact O-N 3.42Å; L108-F125 HydrophobicContact CD1-CD2 4.27Å; L108-F125 HydrophobicContact CD1-CE2 3.68Å; L108-F125 HydrophobicContact CD1-CZ 4.37Å; L108-F125 HydrophobicContact CG-CE2 4.44Å; L108-L129 HydrophobicContact CD1-CB 4.37Å; L108-L129 HydrophobicContact CD1-CD1 3.75Å; L108-L129 HydrophobicContact CD2-CD1 4.03Å; L108-L129 HydrophobicContact CG-CD1 4.5Å
109S48.3Very low52.3Low70 Ų7087.3 Ų87.349%0.4949%0.485SS..Hα-helixtrans-68.1-39174.7-176.50000112.4F105 Q106 A112 G113F105-S109 WeakPolarHBondContact O-CB 3.33Å; F105-S109 PolarHBondContact O-N 3.46Å; Q106-S109 PolarHBondContact O-N 3.44Å; S109-A112 PolarHBondContact O-N 2.9Å; S109-G113 PolarHBondContact O-N 3.16Å
110E52Low52.4Low109 Ų10987.7 Ų87.751%0.50949%0.486SS..Hα-helixtrans-73.3-34.3176.3-161.4-179.8124.700112.2Q106 R114Q106-E110 WeakPolarHBondContact O-CB 3.33Å; Q106-E110 PolarHBondContact O-N 3.13Å; E110-R114 PolarHBondContact O-N 3.08Å; E110-R114 IonicContact OE1-CZ 3.65Å; E110-R114 IonicContact OE1-NH1 3.8Å; E110-R114 PolarHBondContact OE1-NH1 3.42Å; E110-R114 IonicContact OE1-NH2 3.73Å
111A52.1Low52.7Low32 Ų3283.8 Ų83.826%0.26447%0.473SS..Hα-helixtrans-67.2-44.3171.200000110.8K107 G113 R114 V115 F125K107-A111 WeakPolarHBondContact O-CB 3.41Å; K107-A111 PolarHBondContact O-N 3.37Å; A111-G113 PolarHBondContact O-N 2.86Å; A111-R114 PolarHBondContact O-N 3.45Å; A111-V115 WeakPolarHBondContact O-CG2 3.41Å; A111-V115 PolarHBondContact O-N 3.01Å; A111-F125 HydrophobicContact CB-CD2 4.19Å
112A50.1Low52.7Low51 Ų5185.7 Ų85.742%0.42148%0.481SS..Hα-helixtrans-62.3-40.5174.500000112.2L108 S109 R114 V115 F125L108-A112 VanDerWaalsContact O-CB 3.23Å; L108-A112 WeakPolarHBondContact O-CB 3.39Å; L108-A112 PolarHBondContact O-N 3.42Å; S109-A112 PolarHBondContact O-N 2.9Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 3.32Å; A112-V115 PolarHBondContact O-N 3.46Å; A112-F125 HydrophobicContact CB-CE2 4.09Å
113G48.4Very low52.7Low70 Ų7091.2 Ų91.272%0.72250%0.504SS*.Hα-helixtrans-70-16.8176.600000114.9S109 A111S109-G113 PolarHBondContact O-N 3.16Å; A111-G113 PolarHBondContact O-N 2.86Å
114R51.4Low52.6Low181 Ų18193.1 Ų93.168%0.68351%0.513SS*.THydrogen-bonded Turntrans-97.7-3.7174.4-82.4-174172.2126.74.1114E110 A111 A112 G116E110-R114 PolarHBondContact O-N 3.08Å; E110-R114 IonicContact OE1-CZ 3.65Å; E110-R114 IonicContact OE1-NH1 3.8Å; E110-R114 PolarHBondContact OE1-NH1 3.42Å; E110-R114 IonicContact OE1-NH2 3.73Å; A111-R114 PolarHBondContact O-N 3.45Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 3.32Å; R114-G116 PolarHBondContact O-N 2.88Å
115V46.4Very low52.7Low56 Ų5691.9 Ų91.934%0.33951%0.507SS..  trans-73.174.9172.3174.10000108.8A111 A112 F125A111-V115 WeakPolarHBondContact O-CG2 3.41Å; A111-V115 PolarHBondContact O-N 3.01Å; A112-V115 PolarHBondContact O-N 3.46Å; V115-F125 HydrophobicContact CG2-CB 4.27Å; V115-F125 HydrophobicContact CG2-CG 4.5Å
116G51Low52.8Low48 Ų4890 Ų9050%0.49551%0.505SS..  trans-71.2155.9145.300000108.8R114 D118R114-G116 PolarHBondContact O-N 2.88Å; G116-D118 PolarHBondContact O-N 3.3Å
117S51.6Low52.9Low136 Ų13687.6 Ų87.695%0.95150%0.501SS*.SBendtrans-58.164.9-173.551.90000115.6
118D50.9Low52.8Low94 Ų9484.7 Ų84.750%0.50350%0.495SS..  trans-130.2130.4171.5-157.6-78.4000110.9G116 T120 S121 Q122G116-D118 PolarHBondContact O-N 3.3Å; D118-T120 PolarHBondContact O-N 3.42Å; D118-T120 PolarHBondContact OD1-N 2.87Å; D118-T120 PolarHBondContact OD1-OG1 3.07Å; D118-S121 PolarHBondContact O-N 3.25Å; D118-Q122 PolarHBondContact O-N 2.95Å
119M50.6Low52.7Low133 Ų13385.9 Ų85.966%0.65550%0.501SS*.Hα-helixtrans-60.6-30.4-174.1-97.4-82.4104.300113.3Q122 Q123M119-Q122 HydrophobicContact CE-CB 4.43Å; M119-Q123 PolarHBondContact O-N 3.24Å; M119-Q123 VanDerWaalsContact O-N 3.15Å
120T57.2Low53Low86 Ų8689.5 Ų89.553%0.52851%0.508SS..Hα-helixtrans-70.6-40.8-177.9-44.30000110.9D118 Q123 E124D118-T120 PolarHBondContact O-N 3.42Å; D118-T120 PolarHBondContact OD1-N 2.87Å; D118-T120 PolarHBondContact OD1-OG1 3.07Å; T120-Q123 PolarHBondContact O-N 3.27Å; T120-E124 PolarHBondContact O-N 3.43Å; T120-E124 VanDerWaalsContact O-N 3.1Å
121S54.4Low53.2Low47 Ų4791.4 Ų91.433%0.32952%0.517SS..Hα-helixtrans-70.8-32.7178.4-58.40000112.5D118 F125D118-S121 PolarHBondContact O-N 3.25Å; S121-F125 WeakPolarHBondContact O-CB 3.26Å; S121-F125 PolarHBondContact O-N 3.18Å
122Q53.2Low53.3Low90 Ų9091.4 Ų91.442%0.42151%0.514SS..Hα-helixtrans-70-34.3174.7-155.717970.100112D118 M119 T126D118-Q122 PolarHBondContact O-N 2.95Å; M119-Q122 HydrophobicContact CE-CB 4.43Å; Q122-T126 WeakPolarHBondContact O-CB 3.16Å; Q122-T126 PolarHBondContact O-N 3.17Å; Q122-T126 PolarHBondContact O-OG1 3.07Å
123Q56Low53.3Low150 Ų15093.8 Ų93.870%0.70152%0.519SS*.Hα-helixtrans-71.2-38.6175.5-171.1174.4-24.400112.2M119 T120 T126 S127M119-Q123 PolarHBondContact O-N 3.24Å; M119-Q123 VanDerWaalsContact O-N 3.15Å; T120-Q123 PolarHBondContact O-N 3.27Å; Q123-T126 PolarHBondContact O-N 2.91Å; Q123-S127 WeakPolarHBondContact O-CB 3.4Å; Q123-S127 PolarHBondContact O-N 3.28Å
124E56.5Low53.6Low133 Ų13393.7 Ų93.762%0.62151%0.507SS*.Hα-helixtrans-67.4-39.6173.6-71.9-178172.700111.8T120 S127 C128T120-E124 PolarHBondContact O-N 3.43Å; T120-E124 VanDerWaalsContact O-N 3.1Å; E124-S127 PolarHBondContact O-N 3.25Å; E124-C128 WeakPolarHBondContact O-CB 3.3Å; E124-C128 PolarHBondContact O-N 3.19Å
125F55Low53.7Low54 Ų5487 Ų8724%0.23749%0.494CS..Hα-helixtrans-59.4-47.9170.8174.1-102.2000111.7L108 A111 A112 V115 S121 S127 C128 L129L108-F125 HydrophobicContact CD1-CD2 4.27Å; L108-F125 HydrophobicContact CD1-CE2 3.68Å; L108-F125 HydrophobicContact CD1-CZ 4.37Å; L108-F125 HydrophobicContact CG-CE2 4.44Å; A111-F125 HydrophobicContact CB-CD2 4.19Å; A112-F125 HydrophobicContact CB-CE2 4.09Å; V115-F125 HydrophobicContact CG2-CB 4.27Å; V115-F125 HydrophobicContact CG2-CG 4.5Å; S121-F125 WeakPolarHBondContact O-CB 3.26Å; S121-F125 PolarHBondContact O-N 3.18Å; F125-S127 VanDerWaalsContact C-N 3.33Å; F125-S127 PolarHBondContact O-N 3.39Å; F125-C128 PolarHBondContact O-N 2.89Å; F125-L129 HydrophobicContact CE1-CD2 4.43Å; F125-L129 VanDerWaalsContact O-CB 3.23Å; F125-L129 WeakPolarHBondContact O-CB 3.3Å; F125-L129 PolarHBondContact O-N 2.89Å
126T56.6Low53.9Low79 Ų7989.2 Ų89.249%0.48550%0.504SS..Hα-helixtrans-63.2-39179.1-55.90000111.8Q122 Q123 K130Q122-T126 WeakPolarHBondContact O-CB 3.16Å; Q122-T126 PolarHBondContact O-N 3.17Å; Q122-T126 PolarHBondContact O-OG1 3.07Å; Q123-T126 PolarHBondContact O-N 2.91Å; T126-K130 WeakPolarHBondContact O-CB 3.41Å; T126-K130 PolarHBondContact O-N 3.22Å
127S57.3Low53.9Low71 Ų7189.1 Ų89.150%0.49750%0.498SS..Hα-helixtrans-68.9-40.8176.8-1650000111.9Q123 E124 F125 K130 E131Q123-S127 WeakPolarHBondContact O-CB 3.4Å; Q123-S127 PolarHBondContact O-N 3.28Å; E124-S127 PolarHBondContact O-N 3.25Å; F125-S127 VanDerWaalsContact C-N 3.33Å; F125-S127 PolarHBondContact O-N 3.39Å; S127-K130 PolarHBondContact O-N 2.94Å; S127-E131 PolarHBondContact O-N 3.48Å
128C53.5Low53.8Low53 Ų5390.7 Ų90.736%0.35849%0.488SS..Hα-helixtrans-67.8-44.3177.5-172.10000111.4E124 F125 K130 E131 T132E124-C128 WeakPolarHBondContact O-CB 3.3Å; E124-C128 PolarHBondContact O-N 3.19Å; F125-C128 PolarHBondContact O-N 2.89Å; C128-K130 VanDerWaalsContact C-N 3.32Å; C128-K130 PolarHBondContact O-N 3.23Å; C128-E131 PolarHBondContact O-N 2.89Å; C128-T132 PolarHBondContact O-N 3.36Å; C128-T132 PolarHBondContact O-OG1 2.63Å; C128-T132 VanDerWaalsContact O-OG1 3.1Å
129L53.8Low53.6Low60 Ų6092 Ų9231%0.31450%0.495SS..Hα-helixtrans-58.2-43.8173.8-17479.1000111.3L108 F125 E131 T132 L133L108-L129 HydrophobicContact CD1-CB 4.37Å; L108-L129 HydrophobicContact CD1-CD1 3.75Å; L108-L129 HydrophobicContact CD2-CD1 4.03Å; L108-L129 HydrophobicContact CG-CD1 4.5Å; F125-L129 HydrophobicContact CE1-CD2 4.43Å; F125-L129 VanDerWaalsContact O-CB 3.23Å; F125-L129 WeakPolarHBondContact O-CB 3.3Å; F125-L129 PolarHBondContact O-N 2.89Å; L129-E131 PolarHBondContact O-N 2.68Å; L129-T132 PolarHBondContact O-N 3.23Å; L129-L133 HydrophobicContact CG-CD1 4.18Å; L129-L133 WeakPolarHBondContact O-CB 3.44Å; L129-L133 PolarHBondContact O-N 3.24Å
130K55.8Low53.3Low147 Ų14787.7 Ų87.764%0.63948%0.481SS*.Hα-helixtrans-64.9-37.3177.9-178.8172.8-178.91650113T126 S127 C128 S134T126-K130 WeakPolarHBondContact O-CB 3.41Å; T126-K130 PolarHBondContact O-N 3.22Å; S127-K130 PolarHBondContact O-N 2.94Å; C128-K130 VanDerWaalsContact C-N 3.32Å; C128-K130 PolarHBondContact O-N 3.23Å; K130-S134 VanDerWaalsContact O-CB 3.27Å; K130-S134 WeakPolarHBondContact O-CB 3.42Å; K130-S134 PolarHBondContact O-N 3.26Å; K130-S134 PolarHBondContact O-OG 2.92Å
131E56.1Low52.7Low148 Ų14887.7 Ų87.769%0.69248%0.481SS*.Hα-helixtrans-71.4-39.6176.7-167.7127.2-16100111.1S127 C128 L129 S134 G135S127-E131 PolarHBondContact O-N 3.48Å; C128-E131 PolarHBondContact O-N 2.89Å; L129-E131 PolarHBondContact O-N 2.68Å; E131-S134 PolarHBondContact O-N 3.06Å; E131-G135 PolarHBondContact O-N 3.31Å
132T53.6Low52.3Low33 Ų3393.1 Ų93.120%0.20251%0.506CS..Hα-helixtrans-64.7-45.2172.9-60.10000111.9C128 L129 S134 G135 L136C128-T132 PolarHBondContact O-N 3.36Å; C128-T132 PolarHBondContact O-OG1 2.63Å; C128-T132 VanDerWaalsContact O-OG1 3.1Å; L129-T132 PolarHBondContact O-N 3.23Å; T132-S134 PolarHBondContact O-N 2.97Å; T132-G135 PolarHBondContact O-N 3.48Å; T132-L136 WeakPolarHBondContact O-CB 3.26Å; T132-L136 PolarHBondContact O-N 3.48Å
133L49.2Very low51.9Low100 Ų10095.8 Ų95.852%0.52452%0.522SS..Hα-helixtrans-63.8-38.3173.9-94.7160.1000112.2L129 G135 L136 A137L129-L133 HydrophobicContact CG-CD1 4.18Å; L129-L133 WeakPolarHBondContact O-CB 3.44Å; L129-L133 PolarHBondContact O-N 3.24Å; L133-G135 VanDerWaalsContact C-N 3.34Å; L133-L136 PolarHBondContact O-N 3.43Å; L133-A137 WeakPolarHBondContact O-CB 3.29Å; L133-A137 PolarHBondContact O-N 3.44Å
134S54.6Low51.2Low69 Ų6994.4 Ų94.448%0.48352%0.516SS..Hα-helixtrans-68.4-34.1175-65.60000112K130 E131 T132 K138K130-S134 VanDerWaalsContact O-CB 3.27Å; K130-S134 WeakPolarHBondContact O-CB 3.42Å; K130-S134 PolarHBondContact O-N 3.26Å; K130-S134 PolarHBondContact O-OG 2.92Å; E131-S134 PolarHBondContact O-N 3.06Å; T132-S134 PolarHBondContact O-N 2.97Å; S134-K138 VanDerWaalsContact O-CB 3.28Å; S134-K138 WeakPolarHBondContact O-CB 3.49Å; S134-K138 PolarHBondContact O-N 3.49Å; S134-K138 VanDerWaalsContact O-N 3.12Å
135G54.8Low50.7Low40 Ų4096.5 Ų96.541%0.41253%0.531SS..Hα-helixtrans-66.8-41.8172.200000112.5E131 T132 L133 K138 N139E131-G135 PolarHBondContact O-N 3.31Å; T132-G135 PolarHBondContact O-N 3.48Å; L133-G135 VanDerWaalsContact C-N 3.34Å; G135-K138 PolarHBondContact O-N 3.43Å; G135-N139 PolarHBondContact O-N 3.46Å
136L50.5Low50.2Low102 Ų10298.7 Ų98.753%0.53455%0.554SS.*Hα-helixtrans-69.8-43.7177.4-163.870.5000111.8T132 L133 K138 N139 A140T132-L136 WeakPolarHBondContact O-CB 3.26Å; T132-L136 PolarHBondContact O-N 3.48Å; L133-L136 PolarHBondContact O-N 3.43Å; L136-K138 PolarHBondContact O-N 2.94Å; L136-N139 CarbonylContact O-C 3.33Å; L136-N139 WeakPolarHBondContact O-CB 3.33Å; L136-N139 PolarHBondContact O-N 3.44Å; L136-N139 VanDerWaalsContact O-N 3.09Å; L136-A140 WeakPolarHBondContact O-CB 3.4Å; L136-A140 PolarHBondContact O-N 3.27Å
137A51.1Low49.5Very low46 Ų4698.4 Ų98.438%0.3857%0.566SS.*Hα-helixtrans-62.1-31.9175.600000112.6L133 N139 A140 T141L133-A137 WeakPolarHBondContact O-CB 3.29Å; L133-A137 PolarHBondContact O-N 3.44Å; A137-N139 VanDerWaalsContact C-N 3.34Å; A137-A140 CarbonylContact O-C 3.55Å; A137-A140 PolarHBondContact O-N 3.48Å; A137-T141 PolarHBondContact O-N 2.86Å; A137-T141 PolarHBondContact O-OG1 2.95Å
138K48.9Very low48.7Very low169 Ų169100.6 Ų100.674%0.73557%0.57SS**Hα-helixtrans-71.5-27.5175.7-159.6171.8-172.4166.40112.8S134 G135 L136S134-K138 VanDerWaalsContact O-CB 3.28Å; S134-K138 WeakPolarHBondContact O-CB 3.49Å; S134-K138 PolarHBondContact O-N 3.49Å; S134-K138 VanDerWaalsContact O-N 3.12Å; G135-K138 PolarHBondContact O-N 3.43Å; L136-K138 PolarHBondContact O-N 2.94Å
139N46.2Very low48.3Very low123 Ų123100.3 Ų100.366%0.65857%0.568SS**Hα-helixtrans-80.1-35.5167.3-104.8-71.3000111.7G135 L136 A137 T141G135-N139 PolarHBondContact O-N 3.46Å; L136-N139 CarbonylContact O-C 3.33Å; L136-N139 WeakPolarHBondContact O-CB 3.33Å; L136-N139 PolarHBondContact O-N 3.44Å; L136-N139 VanDerWaalsContact O-N 3.09Å; A137-N139 VanDerWaalsContact C-N 3.34Å; N139-T141 PolarHBondContact O-N 3.05Å
140A44.5Very low48Very low42 Ų42103.5 Ų103.535%0.34759%0.586SS.*Hα-helixtrans-72.8-10.1177.100000114.1L136 A137 D142 L143 Q144L136-A140 WeakPolarHBondContact O-CB 3.4Å; L136-A140 PolarHBondContact O-N 3.27Å; A137-A140 CarbonylContact O-C 3.55Å; A137-A140 PolarHBondContact O-N 3.48Å; A140-D142 PolarHBondContact O-N 2.78Å; A140-L143 WeakPolarHBondContact O-CA 3.15Å; A140-L143 PolarHBondContact O-N 3.06Å; A140-Q144 PolarHBondContact O-N 2.67Å
141T46.3Very low47.7Very low86 Ų86103.8 Ų103.853%0.52859%0.59SS.*THydrogen-bonded Turntrans-59.6-25.3174.6-58.90000111.9A137 N139 L143A137-T141 PolarHBondContact O-N 2.86Å; A137-T141 PolarHBondContact O-OG1 2.95Å; N139-T141 PolarHBondContact O-N 3.05Å; T141-L143 VanDerWaalsContact C-N 3.28Å; T141-L143 PolarHBondContact O-N 3.13Å
142D45.9Very low47.5Very low160 Ų160101.7 Ų101.786%0.85658%0.58SS**THydrogen-bonded Turntrans-71.4-18.5171.5-97.4-76.8000113.5A140A140-D142 PolarHBondContact O-N 2.78Å
143L43.5Very low47.3Very low147 Ų147104.8 Ų104.877%0.7759%0.594SS**THydrogen-bonded Turntrans-100.7-13.8179.4-148.869.2000113.2A140 T141 N145A140-L143 WeakPolarHBondContact O-CA 3.15Å; A140-L143 PolarHBondContact O-N 3.06Å; T141-L143 VanDerWaalsContact C-N 3.28Å; T141-L143 PolarHBondContact O-N 3.13Å; L143-N145 PolarHBondContact O-N 3.15Å
144Q42.5Very low47.5Very low121 Ų121103.1 Ų103.157%0.56559%0.588SS**G310 helixtrans-76.517.3-172.1-85.6-172.9-52.800116.5A140 S146A140-Q144 PolarHBondContact O-N 2.67Å; Q144-S146 PolarHBondContact O-N 3.18Å; Q144-S146 VanDerWaalsContact O-N 3.15Å
145N44.6Very low47.4Very low176 Ų176107.2 Ų107.294%0.94160%0.598SS**G310 helixtrans-73.53.9170.6-122.15.3000113.5L143L143-N145 PolarHBondContact O-N 3.15Å
146S45Very low47.3Very low101 Ų101107.6 Ų107.671%0.70660%0.597SS**G310 helixtrans-106.54.6-177.556.60000115.9Q144 M148Q144-S146 PolarHBondContact O-N 3.18Å; Q144-S146 VanDerWaalsContact O-N 3.15Å; S146-M148 PolarHBondContact O-N 3.3Å
147G41Very low47.3Very low73 Ų73107.1 Ų107.175%0.75359%0.593SS**  trans65.731.3159.400000117.4
148M42.4Very low47.3Very low117 Ų117112.1 Ų112.158%0.57661%0.609SS**  trans-90.1133.2170.8-167.6157.4176.700111S146 E152S146-M148 PolarHBondContact O-N 3.3Å; M148-E152 HydrophobicContact CE-CB 3.94Å; M148-E152 HydrophobicContact CG-CB 4.34Å
149S43.9Very low47.4Very low46 Ų46107.4 Ų107.432%0.32261%0.608SS.*  trans-86.1149.6-176.865.30000112.6E151 E152 L153S149-E151 PolarHBondContact O-N 3.11Å; S149-E152 PolarHBondContact N-OE2 3.5Å; S149-E152 VanDerWaalsContact N-OE2 3.15Å; S149-E152 PolarHBondContact O-N 3.35Å; S149-E152 VanDerWaalsContact OG-CD 3.31Å; S149-E152 WeakPolarHBondContact OG-CG 3.25Å; S149-E152 PolarHBondContact OG-OE2 3.29Å; S149-L153 PolarHBondContact O-N 2.95Å
150D48Very low47.4Very low128 Ų128104 Ų10468%0.68459%0.589SS**Hα-helixtrans-56.6-30.5180-165.3-114.3000112.6T154D150-T154 WeakPolarHBondContact O-CB 3.43Å; D150-T154 PolarHBondContact O-N 3.2Å; D150-T154 PolarHBondContact O-OG1 2.74Å
151E48.3Very low47.5Very low153 Ų153104.7 Ų104.772%0.71560%0.601SS**Hα-helixtrans-75.9-30.1179.1-70.4145.1164.900112.6S149 K155S149-E151 PolarHBondContact O-N 3.11Å; E151-K155 WeakPolarHBondContact O-CB 3.47Å; E151-K155 PolarHBondContact O-N 3.4Å
152E53.6Low47.5Very low103 Ų103106.7 Ų106.748%0.48161%0.606SS.*Hα-helixtrans-75.3-35174.4-73.3168.3127.200111.8M148 S149 A156M148-E152 HydrophobicContact CE-CB 3.94Å; M148-E152 HydrophobicContact CG-CB 4.34Å; S149-E152 PolarHBondContact N-OE2 3.5Å; S149-E152 VanDerWaalsContact N-OE2 3.15Å; S149-E152 PolarHBondContact O-N 3.35Å; S149-E152 VanDerWaalsContact OG-CD 3.31Å; S149-E152 WeakPolarHBondContact OG-CG 3.25Å; S149-E152 PolarHBondContact OG-OE2 3.29Å; E152-A156 VanDerWaalsContact O-CB 3.26Å; E152-A156 WeakPolarHBondContact O-CB 3.37Å; E152-A156 PolarHBondContact O-N 2.75Å
153L49.1Very low47.3Very low98 Ų98106.2 Ų106.251%0.51360%0.603SS.*Hα-helixtrans-67.6-45.5173.9-166.394.4000111.3S149 K155 A156 M157S149-L153 PolarHBondContact O-N 2.95Å; L153-K155 VanDerWaalsContact C-N 3.34Å; L153-K155 PolarHBondContact O-N 3.41Å; L153-A156 WeakPolarHBondContact O-CB 3.18Å; L153-A156 PolarHBondContact O-N 3.37Å; L153-M157 PolarHBondContact O-N 2.99Å
154T51.9Low47.5Very low65 Ų65108.2 Ų108.240%0.39961%0.609SS.*Hα-helixtrans-62.9-42.4177.9-54.60000111D150 M157 E158D150-T154 WeakPolarHBondContact O-CB 3.43Å; D150-T154 PolarHBondContact O-N 3.2Å; D150-T154 PolarHBondContact O-OG1 2.74Å; T154-M157 PolarHBondContact O-N 3.31Å; T154-E158 WeakPolarHBondContact O-CG 3.26Å; T154-E158 PolarHBondContact O-N 2.83Å
155K52.7Low47.4Very low155 Ų155105.8 Ų105.867%0.67462%0.616SS**Hα-helixtrans-70.3-31.1177.1-166.7174.4-173.6-178.70113E151 L153 G159E151-K155 WeakPolarHBondContact O-CB 3.47Å; E151-K155 PolarHBondContact O-N 3.4Å; L153-K155 VanDerWaalsContact C-N 3.34Å; L153-K155 PolarHBondContact O-N 3.41Å; K155-G159 PolarHBondContact O-N 2.91Å
156A54Low46.8Very low48 Ų48104.8 Ų104.840%0.39761%0.61SS.*Hα-helixtrans-66.4-40.7170.500000111E152 L153 G159 L160E152-A156 VanDerWaalsContact O-CB 3.26Å; E152-A156 WeakPolarHBondContact O-CB 3.37Å; E152-A156 PolarHBondContact O-N 2.75Å; L153-A156 WeakPolarHBondContact O-CB 3.18Å; L153-A156 PolarHBondContact O-N 3.37Å; A156-G159 PolarHBondContact O-N 3.38Å; A156-L160 WeakPolarHBondContact O-CD1 3.34Å; A156-L160 WeakPolarHBondContact O-CG 3.26Å; A156-L160 PolarHBondContact O-N 3.29Å
157M49.5Very low46.6Very low93 Ų93103.8 Ų103.846%0.45862%0.616SS.*Hα-helixtrans-67.6-41.2175.1-75-177.482.800113.1L153 T154 G159 L160 M162L153-M157 PolarHBondContact O-N 2.99Å; T154-M157 PolarHBondContact O-N 3.31Å; M157-G159 VanDerWaalsContact C-N 3.28Å; M157-G159 PolarHBondContact O-N 2.91Å; M157-L160 PolarHBondContact O-N 3.26Å; M157-L160 VanDerWaalsContact O-N 3.17Å; M157-M162 HydrophobicContact CE-CE 3.67Å; M157-M162 HydrophobicContact CE-SD 4.19Å
158E51.2Low46.5Very low151 Ų151108.1 Ų108.171%0.70662%0.617SS**Hα-helixtrans-64.4-34.1172.6-73.7178.3160.400111.7T154 L160T154-E158 WeakPolarHBondContact O-CG 3.26Å; T154-E158 PolarHBondContact O-N 2.83Å; E158-L160 VanDerWaalsContact C-N 3.29Å; E158-L160 PolarHBondContact O-N 2.72Å
159G51.3Low46.7Very low69 Ų69106 Ų10671%0.71163%0.626SS**Hα-helixtrans-72.3-17.217400000114.7K155 A156 M157 G161K155-G159 PolarHBondContact O-N 2.91Å; A156-G159 PolarHBondContact O-N 3.38Å; M157-G159 VanDerWaalsContact C-N 3.28Å; M157-G159 PolarHBondContact O-N 2.91Å; G159-G161 VanDerWaalsContact C-N 3.3Å
160L45.8Very low47.1Very low51 Ų51108.3 Ų108.327%0.26763%0.634SS.*THydrogen-bonded Turntrans-87.56.2178.5-73.7164.9000113.3A156 M157 E158 M162 I174A156-L160 WeakPolarHBondContact O-CD1 3.34Å; A156-L160 WeakPolarHBondContact O-CG 3.26Å; A156-L160 PolarHBondContact O-N 3.29Å; M157-L160 PolarHBondContact O-N 3.26Å; M157-L160 VanDerWaalsContact O-N 3.17Å; E158-L160 VanDerWaalsContact C-N 3.29Å; E158-L160 PolarHBondContact O-N 2.72Å; L160-M162 VanDerWaalsContact C-N 3.33Å; L160-M162 PolarHBondContact O-N 3.13Å; L160-I174 HydrophobicContact CD2-CB 4.5Å; L160-I174 HydrophobicContact CD2-CG1 4.22Å
161G46Very low47.3Very low58 Ų58107.4 Ų107.460%0.59863%0.628SS**THydrogen-bonded Turntrans70.426.5169.600000114.3G159 D163G159-G161 VanDerWaalsContact C-N 3.3Å; G161-D163 PolarHBondContact O-N 3.49Å
162M48.1Very low47.8Very low127 Ų127101.6 Ų101.663%0.62660%0.602SS**  trans-74.151.9166.3-72.2155.980.600110.2M157 L160M157-M162 HydrophobicContact CE-CE 3.67Å; M157-M162 HydrophobicContact CE-SD 4.19Å; L160-M162 VanDerWaalsContact C-N 3.33Å; L160-M162 PolarHBondContact O-N 3.13Å
163D40.9Very low48.2Very low150 Ų15099.4 Ų99.480%0.80260%0.597SS**  trans-71.4129.2167.8-169.458.4000108.3G161 G165G161-D163 PolarHBondContact O-N 3.49Å; D163-G165 PolarHBondContact O-N 3.07Å
164E47.2Very low48.9Very low190 Ų19097.6 Ų97.689%0.88859%0.587SS**SBendtrans-69.885.4-170.3-162.8-177.6112.300109.8
165G40.7Very low49.4Very low69 Ų6995.7 Ų95.771%0.71157%0.574SS**  trans149.364.8166.200000117.4D163D163-G165 PolarHBondContact O-N 3.07Å
166D33.1Very low49.9Very low155 Ų15591.8 Ų91.883%0.82956%0.558SS**  trans-160.8134.5134.2-155.832.7000109.4E168D166-E168 PolarHBondContact O-N 2.97Å
167G39.7Very low50.7Low81 Ų8191.5 Ų91.584%0.83555%0.553SS**SBendtrans-78.849.6-171.100000114.1
168E39.6Very low51.9Low163 Ų16391.9 Ų91.976%0.76256%0.556SS**  trans-134.994.9169.7-157.613112000107.1D166 N170D166-E168 PolarHBondContact O-N 2.97Å; E168-N170 PolarHBondContact O-N 3Å
169G46.4Very low52.8Low74 Ų7486.6 Ų86.676%0.76353%0.532SS*.  trans-65.180.5-178.100000110.8I171G169-I171 WeakPolarHBondContact O-CG1 3.34Å; G169-I171 PolarHBondContact O-N 3.36Å
170N51.2Low54Low94 Ų9487.6 Ų87.650%0.50352%0.518SS..  trans-73100.9-178.6-156.823.8000107.6E168 L172 P173E168-N170 PolarHBondContact O-N 3Å; N170-L172 PolarHBondContact O-N 3.43Å; N170-L172 VanDerWaalsContact OD1-CD1 3.27Å; N170-L172 WeakPolarHBondContact OD1-CD1 3.49Å; N170-L172 WeakPolarHBondContact OD1-CG 3.37Å; N170-P173 WeakPolarHBondContact O-CD 3.23Å
171I53.4Low55.6Low108 Ų10890 Ų9055%0.55453%0.531SS*.  trans-74-14.9179.2-34176.5000110.4G169 I174 M175G169-I171 WeakPolarHBondContact O-CG1 3.34Å; G169-I171 PolarHBondContact O-N 3.36Å; I171-I174 WeakPolarHBondContact O-CB 3.27Å; I171-I174 PolarHBondContact O-N 3.28Å; I171-I174 VanDerWaalsContact O-N 3.13Å; I171-M175 HydrophobicContact CB-SD 3.99Å; I171-M175 HydrophobicContact CG2-CG 4.23Å; I171-M175 HydrophobicContact CG2-SD 3.89Å; I171-M175 WeakPolarHBondContact O-CG 3.44Å; I171-M175 PolarHBondContact O-N 3.24Å
172L57.8Low57.2Low31 Ų3189 Ų8916%0.16251%0.512CS..Hα-helixtrans-53.3-45.5-178.7-66176.4000114.5N170 I174 M175 Q176N170-L172 PolarHBondContact O-N 3.43Å; N170-L172 VanDerWaalsContact OD1-CD1 3.27Å; N170-L172 WeakPolarHBondContact OD1-CD1 3.49Å; N170-L172 WeakPolarHBondContact OD1-CG 3.37Å; L172-I174 VanDerWaalsContact C-N 3.32Å; L172-I174 PolarHBondContact O-N 3.13Å; L172-M175 PolarHBondContact O-N 3.29Å; L172-Q176 WeakPolarHBondContact O-CB 3.43Å; L172-Q176 PolarHBondContact O-N 2.7Å
173P63.4Low58.8Low57 Ų5783.5 Ų83.537%0.3749%0.485SS..Hα-helixtrans-66.4-34.4178.6-18.333.8000112.6N170 S177N170-P173 WeakPolarHBondContact O-CD 3.23Å; P173-S177 WeakPolarHBondContact O-CB 3.13Å; P173-S177 PolarHBondContact O-N 3.4Å
174I62.9Low61Low61 Ų6178 Ų7831%0.31346%0.458SS..Hα-helixtrans-67.4-46.5177-55.9177.4000109.4L160 I171 L172 Q176 S177 I178L160-I174 HydrophobicContact CD2-CB 4.5Å; L160-I174 HydrophobicContact CD2-CG1 4.22Å; I171-I174 WeakPolarHBondContact O-CB 3.27Å; I171-I174 PolarHBondContact O-N 3.28Å; I171-I174 VanDerWaalsContact O-N 3.13Å; L172-I174 VanDerWaalsContact C-N 3.32Å; L172-I174 PolarHBondContact O-N 3.13Å; I174-Q176 VanDerWaalsContact C-N 3.35Å; I174-Q176 PolarHBondContact O-N 3.29Å; I174-S177 WeakPolarHBondContact O-CB 3.39Å; I174-S177 PolarHBondContact O-N 3.27Å; I174-I178 HydrophobicContact CG2-CD1 4.09Å; I174-I178 WeakPolarHBondContact O-CG1 3.45Å; I174-I178 PolarHBondContact O-N 3.04Å
175M61.5Low63Low25 Ų2572 Ų7212%0.12343%0.429CS..Hα-helixtrans-65.1-39.2178.6-68.316048.600112F75 I171 L172 S177 I178 M179F75-M175 HydrophobicContact CB-CE 4.19Å; F75-M175 HydrophobicContact CD1-CE 3.34Å; F75-M175 HydrophobicContact CD1-SD 4.12Å; F75-M175 HydrophobicContact CD2-CE 3.17Å; F75-M175 HydrophobicContact CE1-CE 3.36Å; F75-M175 HydrophobicContact CE1-SD 4.1Å; F75-M175 HydrophobicContact CE2-CE 3.18Å; F75-M175 HydrophobicContact CG-CE 3.26Å; F75-M175 HydrophobicContact CG-SD 4.46Å; F75-M175 HydrophobicContact CZ-CE 3.3Å; F75-M175 HydrophobicContact CZ-SD 4.44Å; I171-M175 HydrophobicContact CB-SD 3.99Å; I171-M175 HydrophobicContact CG2-CG 4.23Å; I171-M175 HydrophobicContact CG2-SD 3.89Å; I171-M175 WeakPolarHBondContact O-CG 3.44Å; I171-M175 PolarHBondContact O-N 3.24Å; L172-M175 PolarHBondContact O-N 3.29Å; M175-S177 VanDerWaalsContact C-N 3.29Å; M175-S177 PolarHBondContact O-N 2.94Å; M175-I178 PolarHBondContact O-N 3.42Å; M175-M179 WeakPolarHBondContact O-CG 3.36Å; M175-M179 PolarHBondContact O-N 3.35Å
176Q64.4Low65.2Low72 Ų7275.6 Ų75.634%0.33643%0.432SS..Hα-helixtrans-62.1-39173.8-164.1-176.840.700111.5L172 I174 Q180L172-Q176 WeakPolarHBondContact O-CB 3.43Å; L172-Q176 PolarHBondContact O-N 2.7Å; I174-Q176 VanDerWaalsContact C-N 3.35Å; I174-Q176 PolarHBondContact O-N 3.29Å; Q176-Q180 WeakPolarHBondContact O-CB 3.44Å; Q176-Q180 VanDerWaalsContact O-CG 3.29Å; Q176-Q180 WeakPolarHBondContact O-CG 3.34Å; Q176-Q180 PolarHBondContact O-N 2.91Å; Q176-Q180 PolarHBondContact O-NE2 2.92Å
177S71.3Confident67.7Low42 Ų4271.1 Ų71.129%0.29441%0.41SS..Hα-helixtrans-66-41.6175.1-174.80000112P173 I174 M175 Q180 N181P173-S177 WeakPolarHBondContact O-CB 3.13Å; P173-S177 PolarHBondContact O-N 3.4Å; I174-S177 WeakPolarHBondContact O-CB 3.39Å; I174-S177 PolarHBondContact O-N 3.27Å; M175-S177 VanDerWaalsContact C-N 3.29Å; M175-S177 PolarHBondContact O-N 2.94Å; S177-Q180 PolarHBondContact O-N 3.35Å; S177-N181 PolarHBondContact O-N 3.16Å; S177-N181 VanDerWaalsContact O-N 3.07Å; S177-N181 PolarHBondContact O-ND2 3.12Å
178I73.6Confident69.9Low102 Ų10267.4 Ų67.452%0.52337%0.371SS..Hα-helixtrans-62.6-48.2176.3-67.6165.9000110.7I174 M175 Q180 N181 L182I174-I178 HydrophobicContact CG2-CD1 4.09Å; I174-I178 WeakPolarHBondContact O-CG1 3.45Å; I174-I178 PolarHBondContact O-N 3.04Å; M175-I178 PolarHBondContact O-N 3.42Å; I178-Q180 PolarHBondContact O-N 3.15Å; I178-N181 PolarHBondContact O-N 2.74Å; I178-L182 WeakPolarHBondContact O-CB 3.49Å; I178-L182 PolarHBondContact O-N 3.39Å
179M70.3Confident72.3Confident39 Ų3962.3 Ų62.319%0.19235%0.345CS..Hα-helixtrans-62.9-40.3178.3-72.5-177.4-173.200112.2F71 F75 M175 N181 L182 L183F71-M179 HydrophobicContact CD1-CE 4.35Å; F71-M179 HydrophobicContact CD1-SD 4.1Å; F71-M179 HydrophobicContact CE1-CE 4.22Å; F71-M179 HydrophobicContact CE1-SD 3.4Å; F71-M179 WeakPolarHBondContact CE1-SD 3.34Å; F71-M179 HydrophobicContact CZ-SD 3.67Å; F75-M179 HydrophobicContact CE2-CE 3.83Å; F75-M179 HydrophobicContact CZ-CE 4.38Å; M175-M179 WeakPolarHBondContact O-CG 3.36Å; M175-M179 PolarHBondContact O-N 3.35Å; M179-N181 VanDerWaalsContact C-N 3.31Å; M179-N181 PolarHBondContact O-N 3.47Å; M179-L182 PolarHBondContact O-N 3.06Å; M179-L183 WeakPolarHBondContact O-CB 3.48Å; M179-L183 WeakPolarHBondContact O-CG 3.36Å; M179-L183 PolarHBondContact O-N 2.84Å
180Q76Confident74.4Confident91 Ų9162.1 Ų62.143%0.42533%0.331SS..Hα-helixtrans-59.7-41.5175.1-80.5172.788.800112.4Q176 S177 I178 S184 F248Q176-Q180 WeakPolarHBondContact O-CB 3.44Å; Q176-Q180 VanDerWaalsContact O-CG 3.29Å; Q176-Q180 WeakPolarHBondContact O-CG 3.34Å; Q176-Q180 PolarHBondContact O-N 2.91Å; Q176-Q180 PolarHBondContact O-NE2 2.92Å; S177-Q180 PolarHBondContact O-N 3.35Å; I178-Q180 PolarHBondContact O-N 3.15Å; Q180-S184 PolarHBondContact O-N 3Å; Q180-F248 HydrophobicContact CB-CE2 4.29Å; Q180-F248 HydrophobicContact CB-CZ 4.37Å; Q180-F248 HydrophobicContact CG-CD2 4.45Å; Q180-F248 HydrophobicContact CG-CE1 3.96Å; Q180-F248 HydrophobicContact CG-CE2 3.81Å; Q180-F248 HydrophobicContact CG-CZ 3.52Å
181N79.1Confident76.1Confident101 Ų10158.8 Ų58.854%0.5431%0.314SS..Hα-helixtrans-68.8-43.8175.9-82.1-79.7000111.9S177 I178 M179 S184 V187S177-N181 PolarHBondContact O-N 3.16Å; S177-N181 VanDerWaalsContact O-N 3.07Å; S177-N181 PolarHBondContact O-ND2 3.12Å; I178-N181 PolarHBondContact O-N 2.74Å; M179-N181 VanDerWaalsContact C-N 3.31Å; M179-N181 PolarHBondContact O-N 3.47Å; N181-S184 VanDerWaalsContact O-CB 3.25Å; N181-S184 WeakPolarHBondContact O-CB 3.4Å; N181-S184 PolarHBondContact O-N 3.28Å; N181-S184 PolarHBondContact O-OG 3.44Å; N181-V187 WeakPolarHBondContact O-CG2 3.24Å
182L79.7Confident77.8Confident37 Ų3754 Ų5419%0.19429%0.29CS..Hα-helixtrans-69-38.2-175.9-170.160.4000112.7I178 M179 S184 V187 P273 L276I178-L182 WeakPolarHBondContact O-CB 3.49Å; I178-L182 PolarHBondContact O-N 3.39Å; M179-L182 PolarHBondContact O-N 3.06Å; L182-S184 VanDerWaalsContact C-N 3.29Å; L182-V187 HydrophobicContact CD1-CG1 4.19Å; L182-P273 HydrophobicContact CD1-CB 4.19Å; L182-L276 HydrophobicContact CD1-CD1 4.11Å; L182-L276 HydrophobicContact CD1-CG 3.89Å; L182-L276 HydrophobicContact CD2-CD1 4.41Å; L182-L276 HydrophobicContact CD2-CD2 3.47Å; L182-L276 VanDerWaalsContact CD2-CD2 3.47Å; L182-L276 HydrophobicContact CD2-CG 3.6Å; L182-L276 HydrophobicContact CG-CD1 3.84Å; L182-L276 HydrophobicContact CG-CD2 3.77Å; L182-L276 HydrophobicContact CG-CG 3.56Å
183L83.3Confident79.4Confident12 Ų1255.1 Ų55.16%0.06329%0.294CS..THydrogen-bonded Turntrans-89.47.6176.5-56.4-179.9000112.7M179 L188 F232 F248 L252 M255 L276M179-L183 WeakPolarHBondContact O-CB 3.48Å; M179-L183 WeakPolarHBondContact O-CG 3.36Å; M179-L183 PolarHBondContact O-N 2.84Å; L183-L188 HydrophobicContact CB-CD2 4.42Å; L183-L188 HydrophobicContact CD2-CD2 3.78Å; L183-F232 WeakPolarHBondContact O-CE1 3.23Å; L183-F232 VanDerWaalsContact O-CZ 3.26Å; L183-F232 WeakPolarHBondContact O-CZ 3.5Å; L183-F248 HydrophobicContact CB-CE2 4.07Å; L183-F248 HydrophobicContact CD1-CE2 4.2Å; L183-L252 HydrophobicContact CD1-CD1 3.8Å; L183-M255 HydrophobicContact CD2-CG 4.02Å; L183-M255 HydrophobicContact CD2-SD 4.34Å; L183-L276 HydrophobicContact CD2-CD2 4.2Å
184S86.4Confident80.7Confident33 Ų3356.1 Ų56.123%0.23129%0.293CS..SBendtrans-65.3151.917471.30000110.4Q180 N181 L182 D186 V187 L188Q180-S184 PolarHBondContact O-N 3Å; N181-S184 VanDerWaalsContact O-CB 3.25Å; N181-S184 WeakPolarHBondContact O-CB 3.4Å; N181-S184 PolarHBondContact O-N 3.28Å; N181-S184 PolarHBondContact O-OG 3.44Å; L182-S184 VanDerWaalsContact C-N 3.29Å; S184-D186 PolarHBondContact O-N 3.16Å; S184-V187 PolarHBondContact O-N 3.4Å; S184-V187 WeakPolarHBondContact OG-CG2 3.34Å; S184-L188 WeakPolarHBondContact O-CB 3.43Å; S184-L188 PolarHBondContact O-N 3.42Å
185K88.6Confident82Confident64 Ų6453.3 Ų53.328%0.27828%0.279SS..Hα-helixtrans-53-44.5175.5178.9170.2175.6173.50111.5V187 Y189 F232 E235K185-V187 PolarHBondContact O-N 2.85Å; K185-Y189 HydrophobicContact CG-CG 4.4Å; K185-Y189 WeakPolarHBondContact O-CB 3.16Å; K185-Y189 PolarHBondContact O-N 3.07Å; K185-Y189 VanDerWaalsContact O-N 3.08Å; K185-F232 HydrophobicContact CB-CD1 3.61Å; K185-F232 HydrophobicContact CB-CE1 4.05Å; K185-F232 HydrophobicContact CB-CG 4.22Å; K185-F232 HydrophobicContact CD-CB 4.09Å; K185-F232 HydrophobicContact CD-CD1 4.49Å; K185-F232 VanDerWaalsContact CE-O 3.32Å; K185-F232 WeakPolarHBondContact CE-O 3.48Å; K185-F232 HydrophobicContact CG-CB 4.02Å; K185-F232 HydrophobicContact CG-CD1 4.07Å; K185-F232 HydrophobicContact CG-CG 4.21Å; K185-F232 PolarHBondContact NZ-O 2.84Å; K185-E235 VanDerWaalsContact CD-OE2 3.26Å; K185-E235 WeakPolarHBondContact CD-OE2 3.42Å
186D86.8Confident83.4Confident146 Ų14652.5 Ų52.578%0.78128%0.275SS*.Hα-helixtrans-65-28.3-174.6-63.7-49.3000113.6S184S184-D186 PolarHBondContact O-N 3.16Å
187V85.7Confident84.7Confident60 Ų6055.4 Ų55.436%0.36429%0.289SS..Hα-helixtrans-95.7-47.7-178178.80000111.6N181 L182 S184 K185 P273N181-V187 WeakPolarHBondContact O-CG2 3.24Å; L182-V187 HydrophobicContact CD1-CG1 4.19Å; S184-V187 PolarHBondContact O-N 3.4Å; S184-V187 WeakPolarHBondContact OG-CG2 3.34Å; K185-V187 PolarHBondContact O-N 2.85Å; V187-P273 HydrophobicContact CG1-CB 4.28Å; V187-P273 HydrophobicContact CG1-CG 4.19Å
188L87.1Confident85.7Confident3 Ų357.3 Ų57.32%0.01629%0.292CS..Hα-helixtrans-86.8-41.6-170.9-179.754.4000113.2L183 S184 S191 L192 F232 M255 L276L183-L188 HydrophobicContact CB-CD2 4.42Å; L183-L188 HydrophobicContact CD2-CD2 3.78Å; S184-L188 WeakPolarHBondContact O-CB 3.43Å; S184-L188 PolarHBondContact O-N 3.42Å; L188-S191 PolarHBondContact O-N 3.08Å; L188-L192 HydrophobicContact CD1-CB 4.12Å; L188-L192 HydrophobicContact CD1-CD1 3.91Å; L188-L192 HydrophobicContact CD2-CD1 4.34Å; L188-L192 HydrophobicContact CG-CB 4.33Å; L188-L192 HydrophobicContact CG-CD1 4.07Å; L188-L192 VanDerWaalsContact O-CB 3.25Å; L188-L192 WeakPolarHBondContact O-CB 3.08Å; L188-L192 PolarHBondContact O-N 3.41Å; L188-F232 HydrophobicContact CB-CE2 4.31Å; L188-F232 HydrophobicContact CB-CZ 4.32Å; L188-F232 HydrophobicContact CD2-CE2 3.96Å; L188-F232 HydrophobicContact CD2-CZ 3.98Å; L188-F232 HydrophobicContact CG-CE2 4.09Å; L188-F232 HydrophobicContact CG-CZ 4.39Å; L188-M255 HydrophobicContact CD1-CE 4.2Å; L188-M255 HydrophobicContact CD2-CE 3.56Å; L188-M255 HydrophobicContact CD2-SD 4.42Å; L188-M255 HydrophobicContact CG-CE 4.32Å; L188-L276 HydrophobicContact CD1-CD1 3.47Å; L188-L276 VanDerWaalsContact CD1-CD1 3.47Å; L188-L276 HydrophobicContact CG-CD1 4.49Å
189Y90.1Very high86.6Confident56 Ų5652.4 Ų52.422%0.2227%0.267CS..Hα-helixtrans-58.6-45.1-170.5175-104.3000114K185 S191 L192 K193 C229 F232 E233K185-Y189 HydrophobicContact CG-CG 4.4Å; K185-Y189 WeakPolarHBondContact O-CB 3.16Å; K185-Y189 PolarHBondContact O-N 3.07Å; K185-Y189 VanDerWaalsContact O-N 3.08Å; Y189-S191 PolarHBondContact O-N 3.29Å; Y189-L192 PolarHBondContact O-N 2.7Å; Y189-K193 HydrophobicContact CE2-CB 4.34Å; Y189-K193 HydrophobicContact CE2-CD 4.31Å; Y189-K193 WeakPolarHBondContact O-CB 3.45Å; Y189-K193 PolarHBondContact O-N 2.91Å; Y189-C229 HydrophobicContact CE2-CB 4.13Å; Y189-F232 HydrophobicContact CD2-CB 3.61Å; Y189-F232 AromaticContact CD2-CD2 3.93Å; Y189-F232 HydrophobicContact CD2-CD2 3.93Å; Y189-F232 HydrophobicContact CD2-CG 4.18Å; Y189-F232 HydrophobicContact CE2-CB 4.26Å; Y189-F232 HydrophobicContact CG-CB 4.13Å; Y189-F232 HydrophobicContact CG-CD2 4.37Å; Y189-E233 HydrophobicContact CE2-CG 3.68Å; Y189-E233 VanDerWaalsContact OH-CG 3.3Å; Y189-E233 WeakPolarHBondContact OH-CG 3.29Å; Y189-E233 PolarHBondContact OH-OE1 3.37Å
190P89.9Confident87.7Confident71 Ų7153.5 Ų53.546%0.46128%0.277SS..Hα-helixtrans-59.1-50.5-178-22.233.4000112K193 E194P190-K193 PolarHBondContact O-N 3.48Å; P190-E194 PolarHBondContact O-N 3.04Å; P190-E194 VanDerWaalsContact O-N 3.13Å
191S87.3Confident88.6Confident23 Ų2356.4 Ų56.416%0.16129%0.29CS..Hα-helixtrans-65.1-46.2-179.3-45.10000110.9L188 Y189 K193 E194 I195L188-S191 PolarHBondContact O-N 3.08Å; Y189-S191 PolarHBondContact O-N 3.29Å; S191-K193 VanDerWaalsContact C-N 3.35Å; S191-K193 PolarHBondContact O-N 3.3Å; S191-E194 PolarHBondContact O-N 3.15Å; S191-I195 WeakPolarHBondContact O-CD1 3.44Å; S191-I195 WeakPolarHBondContact O-CG1 3.35Å; S191-I195 PolarHBondContact O-N 2.96Å; S191-I195 VanDerWaalsContact O-N 3.15Å
192L89.1Confident89.3Confident7 Ų752.9 Ų52.94%0.03727%0.269CS..Hα-helixtrans-66.5-38.4-178.3-165.3142.7000111.9L188 Y189 I195 T196 M225 I228 C229 M255L188-L192 HydrophobicContact CD1-CB 4.12Å; L188-L192 HydrophobicContact CD1-CD1 3.91Å; L188-L192 HydrophobicContact CD2-CD1 4.34Å; L188-L192 HydrophobicContact CG-CB 4.33Å; L188-L192 HydrophobicContact CG-CD1 4.07Å; L188-L192 VanDerWaalsContact O-CB 3.25Å; L188-L192 WeakPolarHBondContact O-CB 3.08Å; L188-L192 PolarHBondContact O-N 3.41Å; Y189-L192 PolarHBondContact O-N 2.7Å; L192-I195 PolarHBondContact O-N 2.63Å; L192-T196 WeakPolarHBondContact O-CB 3.49Å; L192-T196 PolarHBondContact O-N 3.15Å; L192-T196 PolarHBondContact O-OG1 2.67Å; L192-M225 HydrophobicContact CD2-CB 3.94Å; L192-M225 HydrophobicContact CD2-CG 4.49Å; L192-M225 VanDerWaalsContact CD2-O 3.26Å; L192-M225 WeakPolarHBondContact CD2-O 3.29Å; L192-M225 HydrophobicContact CG-CB 4.46Å; L192-M225 HydrophobicContact CG-CE 4.04Å; L192-I228 HydrophobicContact CD1-CB 4.38Å; L192-I228 HydrophobicContact CD1-CD1 4.27Å; L192-I228 HydrophobicContact CD1-CG2 3.9Å; L192-I228 HydrophobicContact CD2-CB 4.17Å; L192-I228 HydrophobicContact CD2-CG2 4.14Å; L192-C229 WeakPolarHBondContact CD2-SG 3.37Å; L192-M255 HydrophobicContact CD1-CE 3.15Å
193K91.8Very high89.9Confident56 Ų5651.7 Ų51.724%0.24326%0.263CS..Hα-helixtrans-63.1-47.6176.9-175.267176.4-165.50111.5Y189 P190 S191 I195 T196 E197 C229 E233Y189-K193 HydrophobicContact CE2-CB 4.34Å; Y189-K193 HydrophobicContact CE2-CD 4.31Å; Y189-K193 WeakPolarHBondContact O-CB 3.45Å; Y189-K193 PolarHBondContact O-N 2.91Å; P190-K193 PolarHBondContact O-N 3.48Å; S191-K193 VanDerWaalsContact C-N 3.35Å; S191-K193 PolarHBondContact O-N 3.3Å; K193-I195 VanDerWaalsContact C-N 3.34Å; K193-I195 PolarHBondContact O-N 3.42Å; K193-T196 PolarHBondContact O-N 3.37Å; K193-E197 VanDerWaalsContact CE-OE1 3.31Å; K193-E197 WeakPolarHBondContact CE-OE1 3.34Å; K193-E197 WeakPolarHBondContact O-CG 3.31Å; K193-E197 PolarHBondContact O-N 3.39Å; K193-C229 HydrophobicContact CD-CB 4.34Å; K193-E233 IonicContact NZ-OE1 2.7Å; K193-E233 PolarHBondContact NZ-OE1 3.29Å
194E90.2Very high90.4Very high78 Ų7858.7 Ų58.736%0.36430%0.296SS..Hα-helixtrans-58.3-46.2178.8175.7164.2-16200111.8P190 S191 E197 K198P190-E194 PolarHBondContact O-N 3.04Å; P190-E194 VanDerWaalsContact O-N 3.13Å; S191-E194 PolarHBondContact O-N 3.15Å; E194-E197 PolarHBondContact O-N 3.02Å; E194-K198 HydrophobicContact CG-CD 4.38Å; E194-K198 WeakPolarHBondContact O-CG 3.18Å; E194-K198 PolarHBondContact O-N 3.48Å; E194-K198 WeakPolarHBondContact OE1-CE 3.44Å; E194-K198 IonicContact OE1-NZ 3.64Å; E194-K198 PolarHBondContact OE1-NZ 3.24Å
195I89.1Confident90.8Very high2 Ų261 Ų611%0.0131%0.311CS..Hα-helixtrans-64.4-45.7178.8-58.9167.2000109.8S191 L192 K193 E197 K198 Y199 M225 L268 M272S191-I195 WeakPolarHBondContact O-CD1 3.44Å; S191-I195 WeakPolarHBondContact O-CG1 3.35Å; S191-I195 PolarHBondContact O-N 2.96Å; S191-I195 VanDerWaalsContact O-N 3.15Å; L192-I195 PolarHBondContact O-N 2.63Å; K193-I195 VanDerWaalsContact C-N 3.34Å; K193-I195 PolarHBondContact O-N 3.42Å; I195-E197 VanDerWaalsContact C-N 3.27Å; I195-E197 PolarHBondContact O-N 3.37Å; I195-K198 PolarHBondContact O-N 3.02Å; I195-K198 VanDerWaalsContact O-N 3.08Å; I195-Y199 HydrophobicContact CG2-CD2 3.82Å; I195-Y199 HydrophobicContact CG2-CE2 3.57Å; I195-Y199 VanDerWaalsContact O-CD2 3.31Å; I195-Y199 WeakPolarHBondContact O-CD2 3.45Å; I195-Y199 PolarHBondContact O-N 3.26Å; I195-Y199 VanDerWaalsContact O-N 3.07Å; I195-M225 HydrophobicContact CB-CE 3.77Å; I195-M225 HydrophobicContact CG2-CE 3.59Å; I195-L268 WeakPolarHBondContact CG1-O 3.42Å; I195-L268 HydrophobicContact CG2-CB 3.99Å; I195-M272 HydrophobicContact CD1-CG 3.38Å; I195-M272 HydrophobicContact CD1-SD 4.25Å
196T91.1Very high90.9Very high8 Ų860.1 Ų60.15%0.04931%0.308CS..Hα-helixtrans-57.8-39.1178.8-55.30000111.9L192 K193 K198 Y199 P200 H222 M225 C226L192-T196 WeakPolarHBondContact O-CB 3.49Å; L192-T196 PolarHBondContact O-N 3.15Å; L192-T196 PolarHBondContact O-OG1 2.67Å; K193-T196 PolarHBondContact O-N 3.37Å; T196-K198 VanDerWaalsContact C-N 3.33Å; T196-K198 PolarHBondContact O-N 2.9Å; T196-Y199 PolarHBondContact O-N 3.33Å; T196-P200 VanDerWaalsContact O-CD 3.29Å; T196-P200 WeakPolarHBondContact O-CD 3Å; T196-H222 PolarHBondContact O-CD2 2.82Å; T196-H222 PolarHBondContact O-NE2 3.37Å; T196-M225 HydrophobicContact CG2-CB 4.43Å; T196-M225 WeakPolarHBondContact OG1-CB 3.48Å; T196-C226 HydrophobicContact CG2-CB 4.43Å; T196-C226 WeakPolarHBondContact CG2-SG 3.4Å
197E93Very high91Very high133 Ų13360.4 Ų60.462%0.62130%0.298SS*.Hα-helixtrans-69.6-29.4178.3-71.7-177.4160.400113.1K193 E194 I195K193-E197 VanDerWaalsContact CE-OE1 3.31Å; K193-E197 WeakPolarHBondContact CE-OE1 3.34Å; K193-E197 WeakPolarHBondContact O-CG 3.31Å; K193-E197 PolarHBondContact O-N 3.39Å; E194-E197 PolarHBondContact O-N 3.02Å; I195-E197 VanDerWaalsContact C-N 3.27Å; I195-E197 PolarHBondContact O-N 3.37Å
198K92Very high91.3Very high81 Ų8167 Ų6735%0.35233%0.325SS..Hα-helixtrans-82.1-23.9178.1-66.7174.1-172.3171.10113.3E194 I195 T196 E201 W202 L268 E271E194-K198 HydrophobicContact CG-CD 4.38Å; E194-K198 WeakPolarHBondContact O-CG 3.18Å; E194-K198 PolarHBondContact O-N 3.48Å; E194-K198 WeakPolarHBondContact OE1-CE 3.44Å; E194-K198 IonicContact OE1-NZ 3.64Å; E194-K198 PolarHBondContact OE1-NZ 3.24Å; I195-K198 PolarHBondContact O-N 3.02Å; I195-K198 VanDerWaalsContact O-N 3.08Å; T196-K198 VanDerWaalsContact C-N 3.33Å; T196-K198 PolarHBondContact O-N 2.9Å; K198-E201 PolarHBondContact O-N 3.12Å; K198-W202 PolarHBondContact O-N 3.07Å; K198-W202 VanDerWaalsContact O-N 3.16Å; K198-L268 HydrophobicContact CB-CD2 3.68Å; K198-E271 IonicContact NZ-OE1 2.72Å; K198-E271 IonicContact NZ-OE2 3.85Å; K198-E271 PolarHBondContact NZ-OE2 2.94Å
199Y92.4Very high91.5Very high0 Ų070.8 Ų70.80%035%0.352CS..Hα-helixtrans-55.5-46.9-176.5-108.9-85000115I195 T196 E201 W202 L203 Q221 H222 M225 P264 P265 L268I195-Y199 HydrophobicContact CG2-CD2 3.82Å; I195-Y199 HydrophobicContact CG2-CE2 3.57Å; I195-Y199 VanDerWaalsContact O-CD2 3.31Å; I195-Y199 WeakPolarHBondContact O-CD2 3.45Å; I195-Y199 PolarHBondContact O-N 3.26Å; I195-Y199 VanDerWaalsContact O-N 3.07Å; T196-Y199 PolarHBondContact O-N 3.33Å; Y199-E201 PolarHBondContact O-N 3.37Å; Y199-W202 PolarHBondContact O-N 3.48Å; Y199-L203 HydrophobicContact CD1-CD1 4.2Å; Y199-L203 HydrophobicContact CD1-CG 4.42Å; Y199-L203 WeakPolarHBondContact O-CB 3.45Å; Y199-L203 WeakPolarHBondContact O-CG 3.44Å; Y199-L203 PolarHBondContact O-N 3.44Å; Y199-Q221 PolarHBondContact OH-OE1 3.07Å; Y199-H222 WeakPolarHBondContact CB-CD2 3.27Å; Y199-H222 HydrophobicContact CD1-CB 3.83Å; Y199-H222 HydrophobicContact CE1-CB 4.43Å; Y199-H222 HydrophobicContact CG-CB 3.99Å; Y199-H222 AromaticContact CG-CD2 3.96Å; Y199-M225 HydrophobicContact CD2-CE 4.35Å; Y199-M225 HydrophobicContact CD2-SD 4.08Å; Y199-M225 HydrophobicContact CE2-CE 3.94Å; Y199-M225 HydrophobicContact CE2-SD 3.45Å; Y199-M225 WeakPolarHBondContact CE2-SD 3.47Å; Y199-P264 WeakPolarHBondContact OH-CA 3.41Å; Y199-P264 WeakPolarHBondContact OH-CB 3.37Å; Y199-P265 HydrophobicContact CE1-CG 4.3Å; Y199-P265 WeakPolarHBondContact OH-CD 3.31Å; Y199-L268 HydrophobicContact CD1-CD1 3.97Å; Y199-L268 HydrophobicContact CD2-CD1 3.74Å; Y199-L268 HydrophobicContact CE1-CD1 4.11Å; Y199-L268 HydrophobicContact CE2-CD1 3.87Å; Y199-L268 HydrophobicContact CG-CD1 3.79Å
200P93.6Very high91.5Very high62 Ų6269.9 Ų69.940%0.40335%0.351SS..Hα-helixtrans-61.3-41-177.4-26.435.2000113.4T196 Q204T196-P200 VanDerWaalsContact O-CD 3.29Å; T196-P200 WeakPolarHBondContact O-CD 3Å; P200-Q204 WeakPolarHBondContact O-CB 3.35Å; P200-Q204 PolarHBondContact O-N 3.33Å
201E93.9Very high91.7Very high152 Ų15270.2 Ų70.271%0.7135%0.353SS*.Hα-helixtrans-68.7-40.5178-174.3174.917900111.2K198 Y199 Q204 S205K198-E201 PolarHBondContact O-N 3.12Å; Y199-E201 PolarHBondContact O-N 3.37Å; E201-Q204 PolarHBondContact O-N 3.27Å; E201-S205 PolarHBondContact O-N 3.27Å; E201-S205 PolarHBondContact O-OG 2.96Å
202W93.8Very high91.9Very high26 Ų2673.9 Ų73.910%0.09838%0.376CS..Hα-helixtrans-64-44.5175.4-171.390.7000111.9K198 Y199 Q204 S205 H206 L210 Y218 P265 E267 L268K198-W202 PolarHBondContact O-N 3.07Å; K198-W202 VanDerWaalsContact O-N 3.16Å; Y199-W202 PolarHBondContact O-N 3.48Å; W202-Q204 VanDerWaalsContact C-N 3.35Å; W202-Q204 PolarHBondContact O-N 2.79Å; W202-S205 WeakPolarHBondContact CA-OG 3.48Å; W202-S205 PolarHBondContact O-N 3.02Å; W202-S205 PolarHBondContact O-OG 2.94Å; W202-H206 AromaticContact CD1-CE1 3.87Å; W202-H206 AromaticContact CD1-ND1 3.85Å; W202-H206 AromaticContact CD2-ND1 3.9Å; W202-H206 AromaticContact CE2-CE1 3.86Å; W202-H206 AromaticContact CE2-CG 3.86Å; W202-H206 AromaticContact CE2-ND1 3.59Å; W202-H206 HydrophobicContact CH2-CB 4.2Å; W202-H206 HydrophobicContact CZ2-CB 4.25Å; W202-H206 AromaticContact CZ2-CG 3.84Å; W202-H206 HydrophobicContact CZ3-CB 4.32Å; W202-H206 AromaticContact NE1-CE1 3.44Å; W202-H206 PolarHBondContact NE1-CE1 3.36Å; W202-H206 AromaticContact NE1-ND1 3.56Å; W202-H206 WeakPolarHBondContact O-CB 3.49Å; W202-H206 PolarHBondContact O-N 3.15Å; W202-H206 PolarHBondContact O-ND1 3.01Å; W202-H206 VanDerWaalsContact O-ND1 3.09Å; W202-L210 HydrophobicContact CH2-CD1 3.71Å; W202-L210 HydrophobicContact CH2-CD2 4.4Å; W202-L210 HydrophobicContact CZ3-CD1 3.71Å; W202-Y218 AromaticContact CH2-CD2 3.96Å; W202-Y218 HydrophobicContact CH2-CD2 3.96Å; W202-Y218 AromaticContact CH2-CE2 3.65Å; W202-Y218 HydrophobicContact CH2-CE2 3.65Å; W202-Y218 AromaticContact CZ3-CD2 3.61Å; W202-Y218 HydrophobicContact CZ3-CD2 3.61Å; W202-Y218 AromaticContact CZ3-CE2 3.82Å; W202-Y218 HydrophobicContact CZ3-CE2 3.82Å; W202-Y218 HydrophobicContact CZ3-CG 4.29Å; W202-P265 HydrophobicContact CD2-CB 4.06Å; W202-P265 HydrophobicContact CD2-CG 4.01Å; W202-P265 HydrophobicContact CE3-CB 4.22Å; W202-P265 HydrophobicContact CE3-CG 3.67Å; W202-P265 HydrophobicContact CH2-CB 3.66Å; W202-P265 HydrophobicContact CH2-CG 3.48Å; W202-P265 VanDerWaalsContact CH2-CG 3.48Å; W202-P265 HydrophobicContact CZ2-CB 3.48Å; W202-P265 VanDerWaalsContact CZ2-CB 3.48Å; W202-P265 HydrophobicContact CZ2-CG 3.85Å; W202-P265 HydrophobicContact CZ3-CB 4.03Å; W202-P265 HydrophobicContact CZ3-CG 3.39Å; W202-E267 PolarHBondContact NE1-OE1 2.94Å; W202-L268 HydrophobicContact CB-CD1 3.88Å; W202-L268 HydrophobicContact CB-CD2 4.17Å; W202-L268 HydrophobicContact CB-CG 4.33Å; W202-L268 HydrophobicContact CD2-CD1 4.18Å; W202-L268 HydrophobicContact CE3-CD1 4.49Å; W202-L268 HydrophobicContact CG-CD1 3.89Å; W202-L268 HydrophobicContact CG-CD2 4.3Å; W202-L268 HydrophobicContact CG-CG 4.1Å
203L92.7Very high92Very high12 Ų1280.9 Ų80.96%0.06341%0.409CS..Hα-helixtrans-61-44175.8-76.2167.8000111.4Y199 S205 H206 R207 F215 Q219Y199-L203 HydrophobicContact CD1-CD1 4.2Å; Y199-L203 HydrophobicContact CD1-CG 4.42Å; Y199-L203 WeakPolarHBondContact O-CB 3.45Å; Y199-L203 WeakPolarHBondContact O-CG 3.44Å; Y199-L203 PolarHBondContact O-N 3.44Å; L203-S205 VanDerWaalsContact C-N 3.34Å; L203-S205 PolarHBondContact O-N 3.33Å; L203-H206 PolarHBondContact O-N 3.45Å; L203-R207 WeakPolarHBondContact O-CB 3.41Å; L203-R207 PolarHBondContact O-N 3.13Å; L203-F215 HydrophobicContact CB-CE2 3.95Å; L203-F215 HydrophobicContact CB-CZ 4.32Å; L203-F215 HydrophobicContact CD2-CD2 4Å; L203-F215 HydrophobicContact CD2-CE2 3.78Å; L203-F215 HydrophobicContact CD2-CZ 4.37Å; L203-F215 HydrophobicContact CG-CE2 4.46Å; L203-F215 WeakPolarHBondContact O-CE2 3.46Å; L203-Q219 HydrophobicContact CD1-CG 4.07Å
204Q93.4Very high91.9Very high160 Ų16080.9 Ų80.975%0.74841%0.41SS*.Hα-helixtrans-63.8-40.4-180-173.8171.9-2.600112.2P200 E201 W202P200-Q204 WeakPolarHBondContact O-CB 3.35Å; P200-Q204 PolarHBondContact O-N 3.33Å; E201-Q204 PolarHBondContact O-N 3.27Å; W202-Q204 VanDerWaalsContact C-N 3.35Å; W202-Q204 PolarHBondContact O-N 2.79Å
205S94.3Very high92Very high80 Ų8078 Ų7856%0.55940%0.396SS*.Hα-helixtrans-72.2-28.5178.953.30000113.5E201 W202 L203E201-S205 PolarHBondContact O-N 3.27Å; E201-S205 PolarHBondContact O-OG 2.96Å; W202-S205 WeakPolarHBondContact CA-OG 3.48Å; W202-S205 PolarHBondContact O-N 3.02Å; W202-S205 PolarHBondContact O-OG 2.94Å; L203-S205 VanDerWaalsContact C-N 3.34Å; L203-S205 PolarHBondContact O-N 3.33Å
206H91.4Very high92.2Very high47 Ų4783.4 Ų83.422%0.21842%0.421CS..Hα-helixtrans-103.64.4-177.4-68.579.6000114.2W202 L203 E208 S209 L210 E267W202-H206 AromaticContact CD1-CE1 3.87Å; W202-H206 AromaticContact CD1-ND1 3.85Å; W202-H206 AromaticContact CD2-ND1 3.9Å; W202-H206 AromaticContact CE2-CE1 3.86Å; W202-H206 AromaticContact CE2-CG 3.86Å; W202-H206 AromaticContact CE2-ND1 3.59Å; W202-H206 HydrophobicContact CH2-CB 4.2Å; W202-H206 HydrophobicContact CZ2-CB 4.25Å; W202-H206 AromaticContact CZ2-CG 3.84Å; W202-H206 HydrophobicContact CZ3-CB 4.32Å; W202-H206 AromaticContact NE1-CE1 3.44Å; W202-H206 PolarHBondContact NE1-CE1 3.36Å; W202-H206 AromaticContact NE1-ND1 3.56Å; W202-H206 WeakPolarHBondContact O-CB 3.49Å; W202-H206 PolarHBondContact O-N 3.15Å; W202-H206 PolarHBondContact O-ND1 3.01Å; W202-H206 VanDerWaalsContact O-ND1 3.09Å; L203-H206 PolarHBondContact O-N 3.45Å; H206-E208 VanDerWaalsContact C-N 3.27Å; H206-E208 PolarHBondContact O-N 2.97Å; H206-S209 WeakPolarHBondContact CA-OG 3.32Å; H206-S209 PolarHBondContact O-N 3.1Å; H206-S209 VanDerWaalsContact O-N 3.15Å; H206-S209 PolarHBondContact O-OG 2.97Å; H206-L210 HydrophobicContact CB-CD1 3.71Å; H206-L210 HydrophobicContact CB-CG 4.05Å; H206-L210 WeakPolarHBondContact O-CB 3.49Å; H206-L210 VanDerWaalsContact O-CG 3.31Å; H206-L210 WeakPolarHBondContact O-CG 3.45Å; H206-L210 PolarHBondContact O-N 3.35Å; H206-E267 IonicContact CE1-OE1 2.63Å; H206-E267 IonicContact NE2-OE1 2.7Å
207R89.4Confident92.3Very high151 Ų15187.7 Ų87.757%0.5744%0.439SS*.THydrogen-bonded Turntrans-57.3-36.3-177.9-176.4175.8178.378.82113.8L203 F215L203-R207 WeakPolarHBondContact O-CB 3.41Å; L203-R207 PolarHBondContact O-N 3.13Å; R207-F215 HydrophobicContact CB-CD2 4.36Å; R207-F215 HydrophobicContact CB-CE2 3.86Å; R207-F215 HydrophobicContact CB-CZ 4.47Å; R207-F215 HydrophobicContact CG-CD2 4.35Å; R207-F215 HydrophobicContact CG-CE2 3.94Å; R207-F215 HydrophobicContact CG-CZ 4.18Å
208E91.4Very high92.3Very high199 Ų19982.2 Ų82.293%0.9341%0.413SS*.THydrogen-bonded Turntrans-86.7-19.7-179-60.1-163.915400113.3H206H206-E208 VanDerWaalsContact C-N 3.27Å; H206-E208 PolarHBondContact O-N 2.97Å
209S91.5Very high92.3Very high83 Ų8382.5 Ų82.558%0.5842%0.416SS*.THydrogen-bonded Turntrans-92.9-20.7-179.258.60000113.2H206H206-S209 WeakPolarHBondContact CA-OG 3.32Å; H206-S209 PolarHBondContact O-N 3.1Å; H206-S209 VanDerWaalsContact O-N 3.15Å; H206-S209 PolarHBondContact O-OG 2.97Å
210L90.9Very high92.5Very high36 Ų3687.5 Ų87.519%0.18844%0.439CS..SBendtrans-91.3143.7-178.5-69.5169.3000112.8W202 H206 Q214 F215 Y218W202-L210 HydrophobicContact CH2-CD1 3.71Å; W202-L210 HydrophobicContact CH2-CD2 4.4Å; W202-L210 HydrophobicContact CZ3-CD1 3.71Å; H206-L210 HydrophobicContact CB-CD1 3.71Å; H206-L210 HydrophobicContact CB-CG 4.05Å; H206-L210 WeakPolarHBondContact O-CB 3.49Å; H206-L210 VanDerWaalsContact O-CG 3.31Å; H206-L210 WeakPolarHBondContact O-CG 3.45Å; H206-L210 PolarHBondContact O-N 3.35Å; L210-Q214 HydrophobicContact CD2-CG 4.31Å; L210-F215 HydrophobicContact CB-CB 4.45Å; L210-F215 HydrophobicContact CD1-CD2 4.35Å; L210-Y218 HydrophobicContact CD1-CD2 3.88Å; L210-Y218 HydrophobicContact CD1-CE2 4.02Å; L210-Y218 HydrophobicContact CD2-CE2 4.05Å
211P93.7Very high92.4Very high78 Ų7884.6 Ų84.651%0.50642%0.42SS..  trans-57143.5164.7-22.233.1000111.1E213 Q214 F215P211-E213 VanDerWaalsContact C-N 3.28Å; P211-E213 PolarHBondContact O-N 3.31Å; P211-Q214 HydrophobicContact CB-CB 4.33Å; P211-Q214 HydrophobicContact CG-CB 4.48Å; P211-Q214 PolarHBondContact O-N 2.97Å; P211-Q214 VanDerWaalsContact O-N 3.07Å; P211-F215 PolarHBondContact O-N 3.27Å
212P91.4Very high92.4Very high100 Ų10079.3 Ų79.365%0.64940%0.395SS*.Hα-helixtrans-54.4-41.8179.9-26.534.1000113.6Q214 F215 E216P212-Q214 VanDerWaalsContact C-N 3.35Å; P212-Q214 PolarHBondContact O-N 3.45Å; P212-F215 WeakPolarHBondContact O-CB 3.38Å; P212-F215 PolarHBondContact O-N 2.89Å; P212-E216 WeakPolarHBondContact O-CG 3.02Å; P212-E216 PolarHBondContact O-N 3Å
213E91Very high92.5Very high155 Ų15580.6 Ų80.672%0.72441%0.408SS*.Hα-helixtrans-63-39.5178.6-62.3-178.4166.400112.3P211 E216 K217P211-E213 VanDerWaalsContact C-N 3.28Å; P211-E213 PolarHBondContact O-N 3.31Å; E213-E216 PolarHBondContact O-N 2.82Å; E213-K217 WeakPolarHBondContact O-CG 3.4Å; E213-K217 PolarHBondContact O-N 3.38Å; E213-K217 VanDerWaalsContact O-N 3.12Å
214Q89.8Confident92.6Very high56 Ų5680.4 Ų80.426%0.26241%0.407SS..Hα-helixtrans-71.8-37.2177.5-170.762.347.200111.3L210 P211 P212 E216 K217 Y218L210-Q214 HydrophobicContact CD2-CG 4.31Å; P211-Q214 HydrophobicContact CB-CB 4.33Å; P211-Q214 HydrophobicContact CG-CB 4.48Å; P211-Q214 PolarHBondContact O-N 2.97Å; P211-Q214 VanDerWaalsContact O-N 3.07Å; P212-Q214 VanDerWaalsContact C-N 3.35Å; P212-Q214 PolarHBondContact O-N 3.45Å; Q214-E216 VanDerWaalsContact C-N 3.34Å; Q214-K217 PolarHBondContact O-N 2.94Å; Q214-Y218 HydrophobicContact CG-CD2 3.97Å; Q214-Y218 HydrophobicContact CG-CE2 3.46Å; Q214-Y218 VanDerWaalsContact CG-CE2 3.46Å; Q214-Y218 PolarHBondContact NE2-OH 3.03Å; Q214-Y218 VanDerWaalsContact O-CD2 3.32Å; Q214-Y218 WeakPolarHBondContact O-CD2 3.2Å; Q214-Y218 PolarHBondContact O-N 3.42Å
215F92.6Very high92.5Very high18 Ų1873 Ų738%0.07937%0.373CS..Hα-helixtrans-63.2-40.4175.1-175.1-90.7000111.7L203 R207 L210 P211 P212 Y218 Q219L203-F215 HydrophobicContact CB-CE2 3.95Å; L203-F215 HydrophobicContact CB-CZ 4.32Å; L203-F215 HydrophobicContact CD2-CD2 4Å; L203-F215 HydrophobicContact CD2-CE2 3.78Å; L203-F215 HydrophobicContact CD2-CZ 4.37Å; L203-F215 HydrophobicContact CG-CE2 4.46Å; L203-F215 WeakPolarHBondContact O-CE2 3.46Å; R207-F215 HydrophobicContact CB-CD2 4.36Å; R207-F215 HydrophobicContact CB-CE2 3.86Å; R207-F215 HydrophobicContact CB-CZ 4.47Å; R207-F215 HydrophobicContact CG-CD2 4.35Å; R207-F215 HydrophobicContact CG-CE2 3.94Å; R207-F215 HydrophobicContact CG-CZ 4.18Å; L210-F215 HydrophobicContact CB-CB 4.45Å; L210-F215 HydrophobicContact CD1-CD2 4.35Å; P211-F215 PolarHBondContact O-N 3.27Å; P212-F215 WeakPolarHBondContact O-CB 3.38Å; P212-F215 PolarHBondContact O-N 2.89Å; F215-Y218 PolarHBondContact O-N 3.41Å; F215-Q219 HydrophobicContact CD1-CG 4.18Å; F215-Q219 HydrophobicContact CE1-CG 3.74Å; F215-Q219 HydrophobicContact CZ-CG 4.16Å; F215-Q219 WeakPolarHBondContact O-CG 3.46Å; F215-Q219 PolarHBondContact O-N 3.33Å
216E92.9Very high92.6Very high115 Ų11570.8 Ų70.854%0.53736%0.357SS..Hα-helixtrans-61.8-48173.2-75178.4-16600111.7P212 E213 Q214 Y218 Q219 E220P212-E216 WeakPolarHBondContact O-CG 3.02Å; P212-E216 PolarHBondContact O-N 3Å; E213-E216 PolarHBondContact O-N 2.82Å; Q214-E216 VanDerWaalsContact C-N 3.34Å; E216-Y218 VanDerWaalsContact C-N 3.34Å; E216-Y218 PolarHBondContact O-N 2.92Å; E216-Q219 WeakPolarHBondContact O-CB 3.46Å; E216-Q219 PolarHBondContact O-N 3.04Å; E216-Q219 VanDerWaalsContact O-N 3.12Å; E216-E220 PolarHBondContact O-N 2.82Å
217K92.4Very high92.8Very high97 Ų9772.7 Ų72.742%0.42237%0.365SS..Hα-helixtrans-55.6-46.7175-73.2-175.9178.5-173.70112.7E213 Q214 Q219 E220 Q221E213-K217 WeakPolarHBondContact O-CG 3.4Å; E213-K217 PolarHBondContact O-N 3.38Å; E213-K217 VanDerWaalsContact O-N 3.12Å; Q214-K217 PolarHBondContact O-N 2.94Å; K217-Q219 VanDerWaalsContact C-N 3.32Å; K217-Q219 PolarHBondContact O-N 2.87Å; K217-E220 PolarHBondContact O-N 3.09Å; K217-E220 VanDerWaalsContact O-N 3.16Å; K217-Q221 WeakPolarHBondContact O-CG 3.35Å; K217-Q221 PolarHBondContact O-N 2.88Å
218Y93.5Very high93Very high18 Ų1865.5 Ų65.57%0.07134%0.337CS..Hα-helixtrans-68-30.3179.4-66.5-38.7000113.5W202 L210 Q214 F215 E216 H222 H263 P265W202-Y218 AromaticContact CH2-CD2 3.96Å; W202-Y218 HydrophobicContact CH2-CD2 3.96Å; W202-Y218 AromaticContact CH2-CE2 3.65Å; W202-Y218 HydrophobicContact CH2-CE2 3.65Å; W202-Y218 AromaticContact CZ3-CD2 3.61Å; W202-Y218 HydrophobicContact CZ3-CD2 3.61Å; W202-Y218 AromaticContact CZ3-CE2 3.82Å; W202-Y218 HydrophobicContact CZ3-CE2 3.82Å; W202-Y218 HydrophobicContact CZ3-CG 4.29Å; L210-Y218 HydrophobicContact CD1-CD2 3.88Å; L210-Y218 HydrophobicContact CD1-CE2 4.02Å; L210-Y218 HydrophobicContact CD2-CE2 4.05Å; Q214-Y218 HydrophobicContact CG-CD2 3.97Å; Q214-Y218 HydrophobicContact CG-CE2 3.46Å; Q214-Y218 VanDerWaalsContact CG-CE2 3.46Å; Q214-Y218 PolarHBondContact NE2-OH 3.03Å; Q214-Y218 VanDerWaalsContact O-CD2 3.32Å; Q214-Y218 WeakPolarHBondContact O-CD2 3.2Å; Q214-Y218 PolarHBondContact O-N 3.42Å; F215-Y218 PolarHBondContact O-N 3.41Å; E216-Y218 VanDerWaalsContact C-N 3.34Å; E216-Y218 PolarHBondContact O-N 2.92Å; Y218-H222 WeakPolarHBondContact O-CB 3.23Å; Y218-H222 PolarHBondContact O-N 3.39Å; Y218-H263 WeakPolarHBondContact CE1-O 3.32Å; Y218-P265 HydrophobicContact CD1-CG 4.04Å; Y218-P265 HydrophobicContact CD2-CG 4.4Å; Y218-P265 HydrophobicContact CE1-CG 3.87Å; Y218-P265 HydrophobicContact CE2-CG 4.22Å; Y218-P265 HydrophobicContact CG-CG 4.3Å
219Q93.3Very high93.1Very high88 Ų8856.1 Ų56.141%0.41129%0.294SS..Hα-helixtrans-66.9-40.6170.3-74.6179.6109.900111.7L203 F215 E216 K217 H222 S223L203-Q219 HydrophobicContact CD1-CG 4.07Å; F215-Q219 HydrophobicContact CD1-CG 4.18Å; F215-Q219 HydrophobicContact CE1-CG 3.74Å; F215-Q219 HydrophobicContact CZ-CG 4.16Å; F215-Q219 WeakPolarHBondContact O-CG 3.46Å; F215-Q219 PolarHBondContact O-N 3.33Å; E216-Q219 WeakPolarHBondContact O-CB 3.46Å; E216-Q219 PolarHBondContact O-N 3.04Å; E216-Q219 VanDerWaalsContact O-N 3.12Å; K217-Q219 VanDerWaalsContact C-N 3.32Å; K217-Q219 PolarHBondContact O-N 2.87Å; Q219-H222 PolarHBondContact O-N 2.98Å; Q219-S223 PolarHBondContact O-N 3.44Å
220E94.7Very high93.3Very high105 Ų10557.7 Ų57.749%0.49129%0.292SS..Hα-helixtrans-65.4-43175.8-70.7-177.7172.700111.1E216 K217 H222 S223 V224 L261E216-E220 PolarHBondContact O-N 2.82Å; K217-E220 PolarHBondContact O-N 3.09Å; K217-E220 VanDerWaalsContact O-N 3.16Å; E220-H222 VanDerWaalsContact C-N 3.34Å; E220-H222 PolarHBondContact O-N 3.4Å; E220-S223 WeakPolarHBondContact O-CB 3.45Å; E220-S223 PolarHBondContact O-N 3.5Å; E220-S223 VanDerWaalsContact O-N 3.08Å; E220-V224 WeakPolarHBondContact O-CG2 3.46Å; E220-V224 PolarHBondContact O-N 2.88Å; E220-L261 HydrophobicContact CB-CD1 3.72Å; E220-L261 HydrophobicContact CB-CD2 3.9Å; E220-L261 HydrophobicContact CB-CG 4.48Å; E220-L261 WeakPolarHBondContact OE2-CD2 3.2Å
221Q92.3Very high93.4Very high1 Ų158.6 Ų58.61%0.00530%0.296CS..Hα-helixtrans-56.1-50.2174.5-71.8178.5600110.5Y199 K217 S223 V224 M225 L258 L261 G262 H263Y199-Q221 PolarHBondContact OH-OE1 3.07Å; K217-Q221 WeakPolarHBondContact O-CG 3.35Å; K217-Q221 PolarHBondContact O-N 2.88Å; Q221-S223 VanDerWaalsContact C-N 3.32Å; Q221-S223 PolarHBondContact O-N 3.04Å; Q221-V224 PolarHBondContact O-N 3.45Å; Q221-M225 VanDerWaalsContact O-CG 3.24Å; Q221-M225 WeakPolarHBondContact O-CG 3.41Å; Q221-M225 PolarHBondContact O-N 2.95Å; Q221-L258 HydrophobicContact CB-CD1 3.69Å; Q221-L258 HydrophobicContact CG-CD1 3.92Å; Q221-L261 HydrophobicContact CG-CB 3.56Å; Q221-L261 HydrophobicContact CG-CD1 4.05Å; Q221-L261 HydrophobicContact CG-CG 4.43Å; Q221-L261 PolarHBondContact NE2-O 2.88Å; Q221-G262 PolarHBondContact NE2-O 2.81Å; Q221-G262 VanDerWaalsContact NE2-O 3.13Å; Q221-H263 PolarHBondContact NE2-O 3.43Å; Q221-H263 VanDerWaalsContact NE2-O 3.15Å
222H94Very high93.4Very high41 Ų4155.3 Ų55.319%0.1927%0.273CS..Hα-helixtrans-57.4-43.8175.2173.7-108.1000112.1T196 Y199 Y218 Q219 E220 V224 M225 C226T196-H222 PolarHBondContact O-CD2 2.82Å; T196-H222 PolarHBondContact O-NE2 3.37Å; Y199-H222 WeakPolarHBondContact CB-CD2 3.27Å; Y199-H222 HydrophobicContact CD1-CB 3.83Å; Y199-H222 HydrophobicContact CE1-CB 4.43Å; Y199-H222 HydrophobicContact CG-CB 3.99Å; Y199-H222 AromaticContact CG-CD2 3.96Å; Y218-H222 WeakPolarHBondContact O-CB 3.23Å; Y218-H222 PolarHBondContact O-N 3.39Å; Q219-H222 PolarHBondContact O-N 2.98Å; E220-H222 VanDerWaalsContact C-N 3.34Å; E220-H222 PolarHBondContact O-N 3.4Å; H222-V224 PolarHBondContact O-N 3.42Å; H222-M225 PolarHBondContact O-N 3.37Å; H222-C226 VanDerWaalsContact CE1-SG 3.56Å; H222-C226 PolarHBondContact O-N 2.97Å; H222-C226 PolarHBondContact O-SG 2.79Å
223S95.4Very high93.5Very high53 Ų5354.8 Ų54.837%0.37126%0.262SS..Hα-helixtrans-62.4-41.9177.9-174.70000112.6Q219 E220 Q221 C226 K227Q219-S223 PolarHBondContact O-N 3.44Å; E220-S223 WeakPolarHBondContact O-CB 3.45Å; E220-S223 PolarHBondContact O-N 3.5Å; E220-S223 VanDerWaalsContact O-N 3.08Å; Q221-S223 VanDerWaalsContact C-N 3.32Å; Q221-S223 PolarHBondContact O-N 3.04Å; S223-C226 PolarHBondContact O-N 3.23Å; S223-K227 WeakPolarHBondContact O-CG 3.42Å; S223-K227 PolarHBondContact O-N 2.84Å; S223-K227 VanDerWaalsContact O-N 3.13Å
224V94.8Very high93.5Very high7 Ų750.2 Ų50.24%0.04225%0.251CS..Hα-helixtrans-64.9-44.5176.7173.20000110.4E220 Q221 H222 C226 K227 I228 L254 Q257 L258 L261E220-V224 WeakPolarHBondContact O-CG2 3.46Å; E220-V224 PolarHBondContact O-N 2.88Å; Q221-V224 PolarHBondContact O-N 3.45Å; H222-V224 PolarHBondContact O-N 3.42Å; V224-C226 PolarHBondContact O-N 3.29Å; V224-K227 WeakPolarHBondContact O-CB 3.23Å; V224-K227 PolarHBondContact O-N 2.86Å; V224-K227 VanDerWaalsContact O-N 3.16Å; V224-I228 HydrophobicContact CG1-CD1 4Å; V224-I228 WeakPolarHBondContact O-CG1 3.16Å; V224-I228 PolarHBondContact O-N 2.87Å; V224-L254 HydrophobicContact CG1-CB 4.09Å; V224-L254 HydrophobicContact CG1-CD2 4.22Å; V224-L254 WeakPolarHBondContact CG1-O 3.14Å; V224-Q257 HydrophobicContact CG1-CB 4.46Å; V224-Q257 HydrophobicContact CG2-CB 4.45Å; V224-L258 HydrophobicContact CB-CD1 4.36Å; V224-L258 HydrophobicContact CG1-CB 3.9Å; V224-L258 HydrophobicContact CG1-CD1 4.36Å; V224-L261 HydrophobicContact CG2-CD1 4.04Å
225M92.6Very high93.6Very high5 Ų550.7 Ų50.73%0.02525%0.253CS..Hα-helixtrans-61.5-42175.9-67.4171.973.800112.3L192 I195 T196 Y199 Q221 H222 K227 I228 C229 L258L192-M225 HydrophobicContact CD2-CB 3.94Å; L192-M225 HydrophobicContact CD2-CG 4.49Å; L192-M225 VanDerWaalsContact CD2-O 3.26Å; L192-M225 WeakPolarHBondContact CD2-O 3.29Å; L192-M225 HydrophobicContact CG-CB 4.46Å; L192-M225 HydrophobicContact CG-CE 4.04Å; I195-M225 HydrophobicContact CB-CE 3.77Å; I195-M225 HydrophobicContact CG2-CE 3.59Å; T196-M225 HydrophobicContact CG2-CB 4.43Å; T196-M225 WeakPolarHBondContact OG1-CB 3.48Å; Y199-M225 HydrophobicContact CD2-CE 4.35Å; Y199-M225 HydrophobicContact CD2-SD 4.08Å; Y199-M225 HydrophobicContact CE2-CE 3.94Å; Y199-M225 HydrophobicContact CE2-SD 3.45Å; Y199-M225 WeakPolarHBondContact CE2-SD 3.47Å; Q221-M225 VanDerWaalsContact O-CG 3.24Å; Q221-M225 WeakPolarHBondContact O-CG 3.41Å; Q221-M225 PolarHBondContact O-N 2.95Å; H222-M225 PolarHBondContact O-N 3.37Å; M225-K227 VanDerWaalsContact C-N 3.32Å; M225-K227 PolarHBondContact O-N 3.06Å; M225-I228 PolarHBondContact O-N 3.2Å; M225-C229 PolarHBondContact O-N 2.99Å; M225-L258 HydrophobicContact CG-CD1 3.75Å; M225-L258 HydrophobicContact CG-CD2 3.68Å; M225-L258 HydrophobicContact CG-CG 4.41Å; M225-L258 HydrophobicContact SD-CD1 4.23Å; M225-L258 HydrophobicContact SD-CD2 4.41Å
226C95.1Very high93.4Very high34 Ų3452.4 Ų52.423%0.2327%0.265CS..Hα-helixtrans-56.6-46.1172.6-68.50000111.8T196 H222 S223 V224 I228 C229 E230T196-C226 HydrophobicContact CG2-CB 4.43Å; T196-C226 WeakPolarHBondContact CG2-SG 3.4Å; H222-C226 VanDerWaalsContact CE1-SG 3.56Å; H222-C226 PolarHBondContact O-N 2.97Å; H222-C226 PolarHBondContact O-SG 2.79Å; S223-C226 PolarHBondContact O-N 3.23Å; V224-C226 PolarHBondContact O-N 3.29Å; C226-I228 VanDerWaalsContact C-N 3.29Å; C226-I228 PolarHBondContact O-N 3.5Å; C226-C229 WeakPolarHBondContact O-CB 3.25Å; C226-C229 PolarHBondContact O-N 3.39Å; C226-E230 WeakPolarHBondContact O-CG 3.14Å; C226-E230 PolarHBondContact O-N 3.38Å
227K95.4Very high93Very high86 Ų8653.4 Ų53.437%0.37428%0.281SS..Hα-helixtrans-60.8-39.4178.4-68.2169.4-172.41730111.6S223 V224 M225 E230 Q231 L254S223-K227 WeakPolarHBondContact O-CG 3.42Å; S223-K227 PolarHBondContact O-N 2.84Å; S223-K227 VanDerWaalsContact O-N 3.13Å; V224-K227 WeakPolarHBondContact O-CB 3.23Å; V224-K227 PolarHBondContact O-N 2.86Å; V224-K227 VanDerWaalsContact O-N 3.16Å; M225-K227 VanDerWaalsContact C-N 3.32Å; M225-K227 PolarHBondContact O-N 3.06Å; K227-E230 WeakPolarHBondContact O-CB 3.44Å; K227-E230 PolarHBondContact O-N 3.24Å; K227-Q231 WeakPolarHBondContact O-CG 3.13Å; K227-Q231 PolarHBondContact O-N 3.45Å; K227-L254 HydrophobicContact CB-CD1 3.93Å; K227-L254 HydrophobicContact CB-CD2 4.19Å; K227-L254 HydrophobicContact CD-CD2 3.98Å
228I93.2Very high92.9Very high0 Ų054.8 Ų54.80%030%0.298CS..Hα-helixtrans-64-46.7176.3-65.8155.8000110.6L192 V224 M225 C226 E230 Q231 F232 V251 L254 M255 L258L192-I228 HydrophobicContact CD1-CB 4.38Å; L192-I228 HydrophobicContact CD1-CD1 4.27Å; L192-I228 HydrophobicContact CD1-CG2 3.9Å; L192-I228 HydrophobicContact CD2-CB 4.17Å; L192-I228 HydrophobicContact CD2-CG2 4.14Å; V224-I228 HydrophobicContact CG1-CD1 4Å; V224-I228 WeakPolarHBondContact O-CG1 3.16Å; V224-I228 PolarHBondContact O-N 2.87Å; M225-I228 PolarHBondContact O-N 3.2Å; C226-I228 VanDerWaalsContact C-N 3.29Å; C226-I228 PolarHBondContact O-N 3.5Å; I228-E230 VanDerWaalsContact C-N 3.31Å; I228-E230 PolarHBondContact O-N 3.4Å; I228-Q231 WeakPolarHBondContact O-CB 3.2Å; I228-Q231 PolarHBondContact O-N 2.79Å; I228-F232 HydrophobicContact CG2-CD2 3.85Å; I228-F232 HydrophobicContact CG2-CE2 3.39Å; I228-F232 HydrophobicContact CG2-CZ 4.26Å; I228-F232 VanDerWaalsContact O-CD2 3.27Å; I228-F232 WeakPolarHBondContact O-CD2 3.37Å; I228-F232 PolarHBondContact O-N 3.47Å; I228-F232 VanDerWaalsContact O-N 3.12Å; I228-V251 HydrophobicContact CG2-CG1 4.19Å; I228-L254 HydrophobicContact CD1-CB 3.86Å; I228-L254 HydrophobicContact CG1-CB 3.51Å; I228-L254 HydrophobicContact CG1-CD1 3.85Å; I228-L254 HydrophobicContact CG1-CG 4.3Å; I228-M255 HydrophobicContact CD1-CE 3.49Å; I228-M255 VanDerWaalsContact CD1-CE 3.49Å; I228-M255 HydrophobicContact CD1-CG 4.36Å; I228-M255 HydrophobicContact CD1-SD 4.48Å; I228-M255 HydrophobicContact CG1-CE 4.47Å; I228-M255 HydrophobicContact CG2-CE 4.25Å; I228-L258 HydrophobicContact CD1-CD2 4.5Å
229C94.4Very high92.7Very high3 Ų355.3 Ų55.32%0.0230%0.302CS..Hα-helixtrans-55.7-46.1172.8-75.70000111.8Y189 L192 K193 M225 C226 Q231 F232 E233Y189-C229 HydrophobicContact CE2-CB 4.13Å; L192-C229 WeakPolarHBondContact CD2-SG 3.37Å; K193-C229 HydrophobicContact CD-CB 4.34Å; M225-C229 PolarHBondContact O-N 2.99Å; C226-C229 WeakPolarHBondContact O-CB 3.25Å; C226-C229 PolarHBondContact O-N 3.39Å; C229-Q231 VanDerWaalsContact C-N 3.31Å; C229-Q231 PolarHBondContact O-N 2.69Å; C229-F232 PolarHBondContact O-N 3.05Å; C229-F232 VanDerWaalsContact O-N 3.16Å; C229-E233 WeakPolarHBondContact O-CB 3.37Å; C229-E233 VanDerWaalsContact O-CG 3.28Å; C229-E233 WeakPolarHBondContact O-CG 2.91Å; C229-E233 PolarHBondContact O-N 2.87Å
230E95.3Very high92.7Very high115 Ų11554 Ų5454%0.53730%0.303SS..Hα-helixtrans-60.7-39.2178-71.9170.6-171.400112C226 K227 I228 F232 E233 A234C226-E230 WeakPolarHBondContact O-CG 3.14Å; C226-E230 PolarHBondContact O-N 3.38Å; K227-E230 WeakPolarHBondContact O-CB 3.44Å; K227-E230 PolarHBondContact O-N 3.24Å; I228-E230 VanDerWaalsContact C-N 3.31Å; I228-E230 PolarHBondContact O-N 3.4Å; E230-F232 VanDerWaalsContact C-N 3.34Å; E230-F232 PolarHBondContact O-N 3.05Å; E230-E233 PolarHBondContact O-N 2.94Å; E230-A234 WeakPolarHBondContact O-CB 3.12Å; E230-A234 PolarHBondContact O-N 3.23Å
231Q93.7Very high92.2Very high56 Ų5657 Ų5726%0.26232%0.317SS..Hα-helixtrans-60.7-44.2174.6-69.3-51.5-42.500111.5K227 I228 C229 E235 R247 M250 V251 L254K227-Q231 WeakPolarHBondContact O-CG 3.13Å; K227-Q231 PolarHBondContact O-N 3.45Å; I228-Q231 WeakPolarHBondContact O-CB 3.2Å; I228-Q231 PolarHBondContact O-N 2.79Å; C229-Q231 VanDerWaalsContact C-N 3.31Å; C229-Q231 PolarHBondContact O-N 2.69Å; Q231-E235 PolarHBondContact O-N 3.37Å; Q231-R247 HydrophobicContact CB-CG 4.23Å; Q231-R247 WeakPolarHBondContact O-CD 3.08Å; Q231-R247 PolarHBondContact O-NH1 2.93Å; Q231-M250 HydrophobicContact CG-CG 4.17Å; Q231-V251 HydrophobicContact CB-CG2 3.84Å; Q231-V251 HydrophobicContact CG-CG2 4.27Å; Q231-L254 HydrophobicContact CG-CD1 4.3Å
232F92.9Very high92Very high8 Ų861.9 Ų61.94%0.03535%0.347CS..Hα-helixtrans-69.8-39.2177.6-69.1-49.4000112.7L183 K185 L188 Y189 I228 C229 E230 A234 E235 V251L183-F232 WeakPolarHBondContact O-CE1 3.23Å; L183-F232 VanDerWaalsContact O-CZ 3.26Å; L183-F232 WeakPolarHBondContact O-CZ 3.5Å; K185-F232 HydrophobicContact CB-CD1 3.61Å; K185-F232 HydrophobicContact CB-CE1 4.05Å; K185-F232 HydrophobicContact CB-CG 4.22Å; K185-F232 HydrophobicContact CD-CB 4.09Å; K185-F232 HydrophobicContact CD-CD1 4.49Å; K185-F232 VanDerWaalsContact CE-O 3.32Å; K185-F232 WeakPolarHBondContact CE-O 3.48Å; K185-F232 HydrophobicContact CG-CB 4.02Å; K185-F232 HydrophobicContact CG-CD1 4.07Å; K185-F232 HydrophobicContact CG-CG 4.21Å; K185-F232 PolarHBondContact NZ-O 2.84Å; L188-F232 HydrophobicContact CB-CE2 4.31Å; L188-F232 HydrophobicContact CB-CZ 4.32Å; L188-F232 HydrophobicContact CD2-CE2 3.96Å; L188-F232 HydrophobicContact CD2-CZ 3.98Å; L188-F232 HydrophobicContact CG-CE2 4.09Å; L188-F232 HydrophobicContact CG-CZ 4.39Å; Y189-F232 HydrophobicContact CD2-CB 3.61Å; Y189-F232 AromaticContact CD2-CD2 3.93Å; Y189-F232 HydrophobicContact CD2-CD2 3.93Å; Y189-F232 HydrophobicContact CD2-CG 4.18Å; Y189-F232 HydrophobicContact CE2-CB 4.26Å; Y189-F232 HydrophobicContact CG-CB 4.13Å; Y189-F232 HydrophobicContact CG-CD2 4.37Å; I228-F232 HydrophobicContact CG2-CD2 3.85Å; I228-F232 HydrophobicContact CG2-CE2 3.39Å; I228-F232 HydrophobicContact CG2-CZ 4.26Å; I228-F232 VanDerWaalsContact O-CD2 3.27Å; I228-F232 WeakPolarHBondContact O-CD2 3.37Å; I228-F232 PolarHBondContact O-N 3.47Å; I228-F232 VanDerWaalsContact O-N 3.12Å; C229-F232 PolarHBondContact O-N 3.05Å; C229-F232 VanDerWaalsContact O-N 3.16Å; E230-F232 VanDerWaalsContact C-N 3.34Å; E230-F232 PolarHBondContact O-N 3.05Å; F232-A234 VanDerWaalsContact C-N 3.3Å; F232-A234 PolarHBondContact O-N 2.78Å; F232-E235 VanDerWaalsContact O-CB 3.24Å; F232-E235 WeakPolarHBondContact O-CB 3.43Å; F232-E235 PolarHBondContact O-N 2.88Å; F232-V251 HydrophobicContact CE1-CG1 4.39Å; F232-V251 HydrophobicContact CE1-CG2 4.16Å; F232-V251 HydrophobicContact CE2-CG1 4.38Å; F232-V251 HydrophobicContact CZ-CG1 3.77Å; F232-V251 HydrophobicContact CZ-CG2 4.18Å
233E93.6Very high91.8Very high90 Ų9062.8 Ų62.842%0.42136%0.355SS..Hα-helixtrans-66.9-33177.5-72.3171-159.700112Y189 K193 C229 E230 E235Y189-E233 HydrophobicContact CE2-CG 3.68Å; Y189-E233 VanDerWaalsContact OH-CG 3.3Å; Y189-E233 WeakPolarHBondContact OH-CG 3.29Å; Y189-E233 PolarHBondContact OH-OE1 3.37Å; K193-E233 IonicContact NZ-OE1 2.7Å; K193-E233 PolarHBondContact NZ-OE1 3.29Å; C229-E233 WeakPolarHBondContact O-CB 3.37Å; C229-E233 VanDerWaalsContact O-CG 3.28Å; C229-E233 WeakPolarHBondContact O-CG 2.91Å; C229-E233 PolarHBondContact O-N 2.87Å; E230-E233 PolarHBondContact O-N 2.94Å; E233-E235 PolarHBondContact O-N 3.49Å
234A92.2Very high91.3Very high58 Ų5864.4 Ų64.448%0.47936%0.357SS..THydrogen-bonded Turntrans-78.8-1.6175.900000114.1E230 F232 R247E230-A234 WeakPolarHBondContact O-CB 3.12Å; E230-A234 PolarHBondContact O-N 3.23Å; F232-A234 VanDerWaalsContact C-N 3.3Å; F232-A234 PolarHBondContact O-N 2.78Å; A234-R247 PolarHBondContact O-NH1 2.6Å; A234-R247 PolarHBondContact O-NH2 2.71Å; A234-R247 VanDerWaalsContact O-NH2 3.13Å
235E90.8Very high90.7Very high66 Ų6669.3 Ų69.331%0.30838%0.378SS..  trans-73.6130.3176.4-169178.7-18000111.5K185 Q231 F232 E233K185-E235 VanDerWaalsContact CD-OE2 3.26Å; K185-E235 WeakPolarHBondContact CD-OE2 3.42Å; Q231-E235 PolarHBondContact O-N 3.37Å; F232-E235 VanDerWaalsContact O-CB 3.24Å; F232-E235 WeakPolarHBondContact O-CB 3.43Å; F232-E235 PolarHBondContact O-N 2.88Å; E233-E235 PolarHBondContact O-N 3.49Å
236T89.3Confident90.6Very high54 Ų5471.4 Ų71.433%0.33140%0.396SS..  trans-121.7146.417880.70000111T238 D239T236-T238 PolarHBondContact O-N 3.48Å; T236-T238 PolarHBondContact OG1-OG1 3.22Å; T236-D239 PolarHBondContact N-OD2 2.85Å; T236-D239 VanDerWaalsContact O-CB 3.25Å; T236-D239 WeakPolarHBondContact O-CB 3.31Å; T236-D239 PolarHBondContact O-N 3.38Å; T236-D239 VanDerWaalsContact OG1-CG 3.32Å; T236-D239 PolarHBondContact OG1-N 2.87Å; T236-D239 PolarHBondContact OG1-OD1 3.17Å
237P83.8Confident90.3Very high136 Ų13671.1 Ų71.188%0.88339%0.39SS*.THydrogen-bonded Turntrans-66.7-7.7177.228.6-36.1000113.3
238T90.4Very high89.8Confident126 Ų12669.1 Ų69.177%0.77338%0.381SS*.THydrogen-bonded Turntrans-94.20.6174.948.40000113.3T236T236-T238 PolarHBondContact O-N 3.48Å; T236-T238 PolarHBondContact OG1-OG1 3.22Å
239D90.3Very high89.5Confident29 Ų2971.6 Ų71.616%0.15539%0.393CS..  trans-65.3135.3179.1-71.7-16.5000110.8T236 T243 Q244 R247T236-D239 PolarHBondContact N-OD2 2.85Å; T236-D239 VanDerWaalsContact O-CB 3.25Å; T236-D239 WeakPolarHBondContact O-CB 3.31Å; T236-D239 PolarHBondContact O-N 3.38Å; T236-D239 VanDerWaalsContact OG1-CG 3.32Å; T236-D239 PolarHBondContact OG1-N 2.87Å; T236-D239 PolarHBondContact OG1-OD1 3.17Å; D239-T243 HydrophobicContact CB-CG2 4.09Å; D239-Q244 HydrophobicContact CB-CG 4.05Å; D239-Q244 PolarHBondContact O-NE2 3.04Å; D239-R247 IonicContact OD2-CZ 2.73Å; D239-R247 IonicContact OD2-NE 3.88Å; D239-R247 IonicContact OD2-NH2 2.71Å; D239-R247 PolarHBondContact OD2-NH2 2.89Å
240S91.8Very high89.3Confident61 Ų6175.8 Ų75.843%0.42741%0.414SS..  trans-67.9155.8174.573.40000111.3T242 T243 Q244S240-T242 PolarHBondContact O-N 2.85Å; S240-T242 VanDerWaalsContact O-N 3.12Å; S240-T243 WeakPolarHBondContact O-CA 3.44Å; S240-T243 WeakPolarHBondContact O-CB 3.49Å; S240-T243 PolarHBondContact O-N 2.83Å; S240-T243 PolarHBondContact OG-N 3.19Å; S240-T243 PolarHBondContact OG-OG1 3.04Å; S240-Q244 PolarHBondContact O-N 3.22Å
241E85.2Confident89Confident168 Ų16870.4 Ų70.479%0.78539%0.388SS*.Hα-helixtrans-52.4-36.6174.8-68.3176.7-176.500112.3T243 Q244 K245E241-T243 VanDerWaalsContact C-N 3.34Å; E241-T243 PolarHBondContact O-N 3.28Å; E241-Q244 PolarHBondContact O-N 3.02Å; E241-K245 WeakPolarHBondContact O-CB 3.46Å; E241-K245 PolarHBondContact O-N 2.73Å
242T87.6Confident88.6Confident104 Ų10468.7 Ų68.764%0.63838%0.381SS*.Hα-helixtrans-65.9-37176.3-520000112.2S240 A246S240-T242 PolarHBondContact O-N 2.85Å; S240-T242 VanDerWaalsContact O-N 3.12Å; T242-A246 WeakPolarHBondContact O-CB 3.45Å; T242-A246 PolarHBondContact O-N 3.36Å
243T89.3Confident88.3Confident59 Ų5972.6 Ų72.636%0.36240%0.402SS..Hα-helixtrans-70.2-43.2176.9-54.10000111.1D239 S240 E241 A246 R247D239-T243 HydrophobicContact CB-CG2 4.09Å; S240-T243 WeakPolarHBondContact O-CA 3.44Å; S240-T243 WeakPolarHBondContact O-CB 3.49Å; S240-T243 PolarHBondContact O-N 2.83Å; S240-T243 PolarHBondContact OG-N 3.19Å; S240-T243 PolarHBondContact OG-OG1 3.04Å; E241-T243 VanDerWaalsContact C-N 3.34Å; E241-T243 PolarHBondContact O-N 3.28Å; T243-A246 PolarHBondContact O-N 2.9Å; T243-R247 WeakPolarHBondContact O-CB 3.28Å; T243-R247 PolarHBondContact O-N 2.84Å
244Q84.8Confident88.2Confident87 Ų8768.8 Ų68.841%0.40739%0.385SS..Hα-helixtrans-61.5-46.2176.7-65.4175.120.800110.8D239 S240 E241 R247 F248D239-Q244 HydrophobicContact CB-CG 4.05Å; D239-Q244 PolarHBondContact O-NE2 3.04Å; S240-Q244 PolarHBondContact O-N 3.22Å; E241-Q244 PolarHBondContact O-N 3.02Å; Q244-R247 PolarHBondContact O-N 3.5Å; Q244-F248 PolarHBondContact O-N 3.37Å
245K83.6Confident87.9Confident110 Ų11066.6 Ų66.648%0.47837%0.365SS..Hα-helixtrans-61.9-45.2176.5-169.9177.71781790112.4E241 R247 F248 E249E241-K245 WeakPolarHBondContact O-CB 3.46Å; E241-K245 PolarHBondContact O-N 2.73Å; K245-R247 VanDerWaalsContact C-N 3.31Å; K245-R247 PolarHBondContact O-N 3.15Å; K245-F248 WeakPolarHBondContact O-CB 3.28Å; K245-F248 PolarHBondContact O-N 3.32Å; K245-E249 VanDerWaalsContact CE-OE1 3.23Å; K245-E249 WeakPolarHBondContact CE-OE1 3.18Å; K245-E249 WeakPolarHBondContact O-CG 3.16Å; K245-E249 PolarHBondContact O-N 3.1Å
246A89.1Confident87.5Confident50 Ų5065.1 Ų65.141%0.41336%0.358SS..Hα-helixtrans-63.9-36177.400000112.7T242 T243 M250T242-A246 WeakPolarHBondContact O-CB 3.45Å; T242-A246 PolarHBondContact O-N 3.36Å; T243-A246 PolarHBondContact O-N 2.9Å; A246-M250 WeakPolarHBondContact O-CB 3.17Å; A246-M250 PolarHBondContact O-N 3.24Å
247R88.9Confident87.3Confident27 Ų2766 Ų6610%0.10236%0.358CS..Hα-helixtrans-66-44174.5-171.4-170.5-55.1-76.5-0.9111Q231 A234 D239 T243 Q244 K245 M250 V251Q231-R247 HydrophobicContact CB-CG 4.23Å; Q231-R247 WeakPolarHBondContact O-CD 3.08Å; Q231-R247 PolarHBondContact O-NH1 2.93Å; A234-R247 PolarHBondContact O-NH1 2.6Å; A234-R247 PolarHBondContact O-NH2 2.71Å; A234-R247 VanDerWaalsContact O-NH2 3.13Å; D239-R247 IonicContact OD2-CZ 2.73Å; D239-R247 IonicContact OD2-NE 3.88Å; D239-R247 IonicContact OD2-NH2 2.71Å; D239-R247 PolarHBondContact OD2-NH2 2.89Å; T243-R247 WeakPolarHBondContact O-CB 3.28Å; T243-R247 PolarHBondContact O-N 2.84Å; Q244-R247 PolarHBondContact O-N 3.5Å; K245-R247 VanDerWaalsContact C-N 3.31Å; K245-R247 PolarHBondContact O-N 3.15Å; R247-M250 WeakPolarHBondContact O-CB 3.15Å; R247-M250 PolarHBondContact O-N 3.33Å; R247-V251 WeakPolarHBondContact O-CG2 3.03Å; R247-V251 PolarHBondContact O-N 3.45Å
248F86.1Confident87.5Confident44 Ų4459.7 Ų59.719%0.19332%0.317CS..Hα-helixtrans-59.8-47.6174.8175-99.5000111.8Q180 L183 Q244 K245 M250 V251 L252Q180-F248 HydrophobicContact CB-CE2 4.29Å; Q180-F248 HydrophobicContact CB-CZ 4.37Å; Q180-F248 HydrophobicContact CG-CD2 4.45Å; Q180-F248 HydrophobicContact CG-CE1 3.96Å; Q180-F248 HydrophobicContact CG-CE2 3.81Å; Q180-F248 HydrophobicContact CG-CZ 3.52Å; L183-F248 HydrophobicContact CB-CE2 4.07Å; L183-F248 HydrophobicContact CD1-CE2 4.2Å; Q244-F248 PolarHBondContact O-N 3.37Å; K245-F248 WeakPolarHBondContact O-CB 3.28Å; K245-F248 PolarHBondContact O-N 3.32Å; F248-M250 VanDerWaalsContact C-N 3.28Å; F248-M250 PolarHBondContact O-N 3.47Å; F248-V251 PolarHBondContact O-N 3.04Å; F248-L252 HydrophobicContact CE1-CD2 4.43Å; F248-L252 WeakPolarHBondContact O-CB 3.48Å; F248-L252 PolarHBondContact O-N 2.83Å
249E86.6Confident87Confident53 Ų5355.4 Ų55.425%0.24829%0.288CS..Hα-helixtrans-58.2-40.3175.5-72.6168.8-167.700111.9F64 K245 L252 D253F64-E249 WeakPolarHBondContact CE2-OE1 3.24Å; K245-E249 VanDerWaalsContact CE-OE1 3.23Å; K245-E249 WeakPolarHBondContact CE-OE1 3.18Å; K245-E249 WeakPolarHBondContact O-CG 3.16Å; K245-E249 PolarHBondContact O-N 3.1Å; E249-L252 PolarHBondContact O-N 3.09Å; E249-D253 PolarHBondContact O-N 3.38Å
250M89.4Confident86.6Confident91 Ų9159.5 Ų59.545%0.44831%0.31SS..Hα-helixtrans-65.7-44175.2-175.267.459.800112.6Q231 A246 R247 F248 L252 D253 L254Q231-M250 HydrophobicContact CG-CG 4.17Å; A246-M250 WeakPolarHBondContact O-CB 3.17Å; A246-M250 PolarHBondContact O-N 3.24Å; R247-M250 WeakPolarHBondContact O-CB 3.15Å; R247-M250 PolarHBondContact O-N 3.33Å; F248-M250 VanDerWaalsContact C-N 3.28Å; F248-M250 PolarHBondContact O-N 3.47Å; M250-L252 VanDerWaalsContact C-N 3.31Å; M250-D253 PolarHBondContact O-N 3.12Å; M250-L254 HydrophobicContact CG-CD1 4.18Å; M250-L254 VanDerWaalsContact O-CG 3.3Å; M250-L254 WeakPolarHBondContact O-CG 3.23Å; M250-L254 PolarHBondContact O-N 3.31Å
251V89.5Confident86.4Confident1 Ų157.8 Ų57.81%0.00630%0.296CS..Hα-helixtrans-63.7-40.2177.6167.60000110.6I228 Q231 F232 R247 F248 L254 M255I228-V251 HydrophobicContact CG2-CG1 4.19Å; Q231-V251 HydrophobicContact CB-CG2 3.84Å; Q231-V251 HydrophobicContact CG-CG2 4.27Å; F232-V251 HydrophobicContact CE1-CG1 4.39Å; F232-V251 HydrophobicContact CE1-CG2 4.16Å; F232-V251 HydrophobicContact CE2-CG1 4.38Å; F232-V251 HydrophobicContact CZ-CG1 3.77Å; F232-V251 HydrophobicContact CZ-CG2 4.18Å; R247-V251 WeakPolarHBondContact O-CG2 3.03Å; R247-V251 PolarHBondContact O-N 3.45Å; F248-V251 PolarHBondContact O-N 3.04Å; V251-L254 PolarHBondContact O-N 2.73Å; V251-M255 WeakPolarHBondContact O-CB 3.27Å; V251-M255 VanDerWaalsContact O-CG 3.3Å; V251-M255 WeakPolarHBondContact O-CG 3.44Å; V251-M255 PolarHBondContact O-N 2.82Å
252L85.5Confident86.2Confident21 Ų2150.5 Ų50.511%0.1127%0.266CS..Hα-helixtrans-63.1-45176179.164000111.9Q67 F71 L183 F248 E249 M250 L254 M255 Q256Q67-L252 HydrophobicContact CG-CD2 4.33Å; Q67-L252 VanDerWaalsContact NE2-CD2 3.31Å; F71-L252 HydrophobicContact CE2-CD2 3.99Å; F71-L252 HydrophobicContact CZ-CD1 4.36Å; F71-L252 HydrophobicContact CZ-CD2 3.74Å; L183-L252 HydrophobicContact CD1-CD1 3.8Å; F248-L252 HydrophobicContact CE1-CD2 4.43Å; F248-L252 WeakPolarHBondContact O-CB 3.48Å; F248-L252 PolarHBondContact O-N 2.83Å; E249-L252 PolarHBondContact O-N 3.09Å; M250-L252 VanDerWaalsContact C-N 3.31Å; L252-L254 PolarHBondContact O-N 3.27Å; L252-M255 WeakPolarHBondContact O-CB 3.32Å; L252-M255 PolarHBondContact O-N 3.19Å; L252-Q256 PolarHBondContact O-N 3.42Å
253D87Confident85.8Confident90 Ų9049.3 Ų49.348%0.48125%0.253SS..Hα-helixtrans-62.9-40.7176.4-174.182.8000112.2E249 M250 Q256 Q257E249-D253 PolarHBondContact O-N 3.38Å; M250-D253 PolarHBondContact O-N 3.12Å; D253-Q256 WeakPolarHBondContact O-CB 3.16Å; D253-Q256 PolarHBondContact O-N 3.19Å; D253-Q257 WeakPolarHBondContact O-CG 3.4Å; D253-Q257 PolarHBondContact O-N 3.5Å; D253-Q257 PolarHBondContact OD2-NE2 2.79Å
254L90.7Very high85.4Confident9 Ų946.9 Ų46.95%0.04724%0.238CC..Hα-helixtrans-66.7-37.7174.6-70.9167.4000112V224 K227 I228 Q231 M250 V251 L252 Q256 Q257 L258V224-L254 HydrophobicContact CG1-CB 4.09Å; V224-L254 HydrophobicContact CG1-CD2 4.22Å; V224-L254 WeakPolarHBondContact CG1-O 3.14Å; K227-L254 HydrophobicContact CB-CD1 3.93Å; K227-L254 HydrophobicContact CB-CD2 4.19Å; K227-L254 HydrophobicContact CD-CD2 3.98Å; I228-L254 HydrophobicContact CD1-CB 3.86Å; I228-L254 HydrophobicContact CG1-CB 3.51Å; I228-L254 HydrophobicContact CG1-CD1 3.85Å; I228-L254 HydrophobicContact CG1-CG 4.3Å; Q231-L254 HydrophobicContact CG-CD1 4.3Å; M250-L254 HydrophobicContact CG-CD1 4.18Å; M250-L254 VanDerWaalsContact O-CG 3.3Å; M250-L254 WeakPolarHBondContact O-CG 3.23Å; M250-L254 PolarHBondContact O-N 3.31Å; V251-L254 PolarHBondContact O-N 2.73Å; L252-L254 PolarHBondContact O-N 3.27Å; L254-Q256 VanDerWaalsContact C-N 3.27Å; L254-Q256 PolarHBondContact O-N 3.48Å; L254-Q257 PolarHBondContact O-N 2.72Å; L254-L258 WeakPolarHBondContact O-CB 3.26Å; L254-L258 PolarHBondContact O-N 3.37Å
255M85.4Confident85.3Confident12 Ų1242.9 Ų42.96%0.05922%0.22CC..Hα-helixtrans-62.1-38.2173.4-82.6-75.5149.600111.7L183 L188 L192 I228 V251 L252 L258 Q259 F278L183-M255 HydrophobicContact CD2-CG 4.02Å; L183-M255 HydrophobicContact CD2-SD 4.34Å; L188-M255 HydrophobicContact CD1-CE 4.2Å; L188-M255 HydrophobicContact CD2-CE 3.56Å; L188-M255 HydrophobicContact CD2-SD 4.42Å; L188-M255 HydrophobicContact CG-CE 4.32Å; L192-M255 HydrophobicContact CD1-CE 3.15Å; I228-M255 HydrophobicContact CD1-CE 3.49Å; I228-M255 VanDerWaalsContact CD1-CE 3.49Å; I228-M255 HydrophobicContact CD1-CG 4.36Å; I228-M255 HydrophobicContact CD1-SD 4.48Å; I228-M255 HydrophobicContact CG1-CE 4.47Å; I228-M255 HydrophobicContact CG2-CE 4.25Å; V251-M255 WeakPolarHBondContact O-CB 3.27Å; V251-M255 VanDerWaalsContact O-CG 3.3Å; V251-M255 WeakPolarHBondContact O-CG 3.44Å; V251-M255 PolarHBondContact O-N 2.82Å; L252-M255 WeakPolarHBondContact O-CB 3.32Å; L252-M255 PolarHBondContact O-N 3.19Å; M255-L258 HydrophobicContact CE-CD2 4.17Å; M255-L258 WeakPolarHBondContact O-CB 3.17Å; M255-L258 PolarHBondContact O-N 2.77Å; M255-L258 HydrophobicContact SD-CD2 4.34Å; M255-Q259 PolarHBondContact O-N 2.73Å; M255-F278 HydrophobicContact SD-CE1 4.42Å; M255-F278 HydrophobicContact SD-CZ 3.94Å
256Q82.4Confident85.1Confident35 Ų3546 Ų4616%0.16423%0.233CC..Hα-helixtrans-63.1-48.2174.2-172.654.539.700111.8F70 L252 D253 L254 L258 Q259 D260F70-Q256 HydrophobicContact CZ-CG 4.23Å; L252-Q256 PolarHBondContact O-N 3.42Å; D253-Q256 WeakPolarHBondContact O-CB 3.16Å; D253-Q256 PolarHBondContact O-N 3.19Å; L254-Q256 VanDerWaalsContact C-N 3.27Å; L254-Q256 PolarHBondContact O-N 3.48Å; Q256-L258 PolarHBondContact O-N 2.81Å; Q256-Q259 WeakPolarHBondContact O-CB 3.06Å; Q256-Q259 PolarHBondContact O-N 3.32Å; Q256-Q259 VanDerWaalsContact O-N 3.07Å; Q256-D260 PolarHBondContact NE2-OD1 2.75Å; Q256-D260 PolarHBondContact O-N 3.39Å
257Q86.6Confident84.8Confident73 Ų7350.3 Ų50.334%0.34125%0.245SC..Hα-helixtrans-58.1-39.1175.6-69.2174.160.700111.4V224 D253 L254 Q259 D260 L261V224-Q257 HydrophobicContact CG1-CB 4.46Å; V224-Q257 HydrophobicContact CG2-CB 4.45Å; D253-Q257 WeakPolarHBondContact O-CG 3.4Å; D253-Q257 PolarHBondContact O-N 3.5Å; D253-Q257 PolarHBondContact OD2-NE2 2.79Å; L254-Q257 PolarHBondContact O-N 2.72Å; Q257-Q259 VanDerWaalsContact C-N 3.33Å; Q257-Q259 PolarHBondContact O-N 2.75Å; Q257-D260 PolarHBondContact O-N 2.75Å; Q257-L261 VanDerWaalsContact O-CG 3.23Å; Q257-L261 WeakPolarHBondContact O-CG 3.28Å; Q257-L261 PolarHBondContact O-N 3.49Å; Q257-L261 VanDerWaalsContact O-N 3.13Å
258L86.8Confident84.4Confident4 Ų449.6 Ų49.62%0.02124%0.243CC..Hα-helixtrans-63.2-40.5176.8-170.662.4000111.7Q221 V224 M225 I228 L254 M255 Q256 L261 F278Q221-L258 HydrophobicContact CB-CD1 3.69Å; Q221-L258 HydrophobicContact CG-CD1 3.92Å; V224-L258 HydrophobicContact CB-CD1 4.36Å; V224-L258 HydrophobicContact CG1-CB 3.9Å; V224-L258 HydrophobicContact CG1-CD1 4.36Å; M225-L258 HydrophobicContact CG-CD1 3.75Å; M225-L258 HydrophobicContact CG-CD2 3.68Å; M225-L258 HydrophobicContact CG-CG 4.41Å; M225-L258 HydrophobicContact SD-CD1 4.23Å; M225-L258 HydrophobicContact SD-CD2 4.41Å; I228-L258 HydrophobicContact CD1-CD2 4.5Å; L254-L258 WeakPolarHBondContact O-CB 3.26Å; L254-L258 PolarHBondContact O-N 3.37Å; M255-L258 HydrophobicContact CE-CD2 4.17Å; M255-L258 WeakPolarHBondContact O-CB 3.17Å; M255-L258 PolarHBondContact O-N 2.77Å; M255-L258 HydrophobicContact SD-CD2 4.34Å; Q256-L258 PolarHBondContact O-N 2.81Å; L258-L261 PolarHBondContact O-N 3.5Å; L258-F278 HydrophobicContact CD2-CE2 3.9Å; L258-F278 HydrophobicContact CD2-CZ 3.77Å; L258-F278 HydrophobicContact CG-CZ 4.38Å
259Q80.8Confident83.6Confident36 Ų3648.2 Ų48.217%0.16824%0.24CC..Hα-helixtrans-66.8-41.7176-175.8177.8-11.600112.2M255 Q256 Q257 L261 G262M255-Q259 PolarHBondContact O-N 2.73Å; Q256-Q259 WeakPolarHBondContact O-CB 3.06Å; Q256-Q259 PolarHBondContact O-N 3.32Å; Q256-Q259 VanDerWaalsContact O-N 3.07Å; Q257-Q259 VanDerWaalsContact C-N 3.33Å; Q257-Q259 PolarHBondContact O-N 2.75Å; Q259-L261 PolarHBondContact O-N 2.84Å; Q259-G262 WeakPolarHBondContact O-CA 3.32Å; Q259-G262 PolarHBondContact O-N 3.39Å
260D82.7Confident82.3Confident114 Ų11449 Ų4961%0.6126%0.262SS*.Hα-helixtrans-64.3-29.5178.1-66.2-19.4000112.2Q256 Q257 G262Q256-D260 PolarHBondContact NE2-OD1 2.75Å; Q256-D260 PolarHBondContact O-N 3.39Å; Q257-D260 PolarHBondContact O-N 2.75Å; D260-G262 PolarHBondContact O-N 2.87Å
261L85.6Confident80.9Confident26 Ų2648.9 Ų48.914%0.13626%0.26CS..THydrogen-bonded Turntrans-73.4-9.1173.2-67.9168.6000113.2E220 Q221 V224 Q257 L258 Q259E220-L261 HydrophobicContact CB-CD1 3.72Å; E220-L261 HydrophobicContact CB-CD2 3.9Å; E220-L261 HydrophobicContact CB-CG 4.48Å; E220-L261 WeakPolarHBondContact OE2-CD2 3.2Å; Q221-L261 HydrophobicContact CG-CB 3.56Å; Q221-L261 HydrophobicContact CG-CD1 4.05Å; Q221-L261 HydrophobicContact CG-CG 4.43Å; Q221-L261 PolarHBondContact NE2-O 2.88Å; V224-L261 HydrophobicContact CG2-CD1 4.04Å; Q257-L261 VanDerWaalsContact O-CG 3.23Å; Q257-L261 WeakPolarHBondContact O-CG 3.28Å; Q257-L261 PolarHBondContact O-N 3.49Å; Q257-L261 VanDerWaalsContact O-N 3.13Å; L258-L261 PolarHBondContact O-N 3.5Å; Q259-L261 PolarHBondContact O-N 2.84Å
262G82.1Confident79.5Confident15 Ų1549.9 Ų49.916%0.15527%0.265CS..  trans92.1-168.9177.200000114Q221 Q259 D260Q221-G262 PolarHBondContact NE2-O 2.81Å; Q221-G262 VanDerWaalsContact NE2-O 3.13Å; Q259-G262 WeakPolarHBondContact O-CA 3.32Å; Q259-G262 PolarHBondContact O-N 3.39Å; D260-G262 PolarHBondContact O-N 2.87Å
263H78.6Confident78.2Confident78 Ų7849.6 Ų49.636%0.36126%0.264SS..PPolyproline II helixtrans-70.8144-175.759.5-91.2000111.9Y218 Q221 F278Y218-H263 WeakPolarHBondContact CE1-O 3.32Å; Q221-H263 PolarHBondContact NE2-O 3.43Å; Q221-H263 VanDerWaalsContact NE2-O 3.15Å; H263-F278 WeakPolarHBondContact CB-O 3.3Å
264P80.9Confident76.7Confident8 Ų851 Ų515%0.05228%0.278CS..PPolyproline II helixtrans-66156.7166.228.2-32.8000110.6Y199 K266 A269 M272 F278Y199-P264 WeakPolarHBondContact OH-CA 3.41Å; Y199-P264 WeakPolarHBondContact OH-CB 3.37Å; P264-K266 PolarHBondContact O-N 3.01Å; P264-A269 HydrophobicContact CB-CB 4.44Å; P264-A269 HydrophobicContact CG-CB 3.79Å; P264-M272 HydrophobicContact CG-CE 4.17Å; P264-F278 HydrophobicContact CG-CD2 3.87Å
265P83.3Confident75.1Confident3 Ų353.9 Ų53.92%0.01931%0.31CS..PPolyproline II helixtrans-52.3132.6175.6-26.334.8000111.7Y199 W202 Y218 E267 L268 A269Y199-P265 HydrophobicContact CE1-CG 4.3Å; Y199-P265 WeakPolarHBondContact OH-CD 3.31Å; W202-P265 HydrophobicContact CD2-CB 4.06Å; W202-P265 HydrophobicContact CD2-CG 4.01Å; W202-P265 HydrophobicContact CE3-CB 4.22Å; W202-P265 HydrophobicContact CE3-CG 3.67Å; W202-P265 HydrophobicContact CH2-CB 3.66Å; W202-P265 HydrophobicContact CH2-CG 3.48Å; W202-P265 VanDerWaalsContact CH2-CG 3.48Å; W202-P265 HydrophobicContact CZ2-CB 3.48Å; W202-P265 VanDerWaalsContact CZ2-CB 3.48Å; W202-P265 HydrophobicContact CZ2-CG 3.85Å; W202-P265 HydrophobicContact CZ3-CB 4.03Å; W202-P265 HydrophobicContact CZ3-CG 3.39Å; Y218-P265 HydrophobicContact CD1-CG 4.04Å; Y218-P265 HydrophobicContact CD2-CG 4.4Å; Y218-P265 HydrophobicContact CE1-CG 3.87Å; Y218-P265 HydrophobicContact CE2-CG 4.22Å; Y218-P265 HydrophobicContact CG-CG 4.3Å; P265-E267 PolarHBondContact O-N 3.27Å; P265-L268 HydrophobicContact CB-CB 4.42Å; P265-L268 HydrophobicContact CB-CD1 4.21Å; P265-L268 HydrophobicContact CB-CG 4.21Å; P265-L268 HydrophobicContact CG-CD1 4.01Å; P265-L268 CarbonylContact O-C 3.6Å; P265-L268 WeakPolarHBondContact O-CA 3.07Å; P265-L268 WeakPolarHBondContact O-CB 3.45Å; P265-L268 PolarHBondContact O-N 2.9Å; P265-A269 PolarHBondContact O-N 2.78Å
266K78.9Confident73.9Confident176 Ų17654.1 Ų54.177%0.76531%0.312SS*.Hα-helixtrans-56.2-30.7-175.2-66.3-173.1178.3-173.50113.6P264 L268P264-K266 PolarHBondContact O-N 3.01Å; K266-L268 PolarHBondContact O-N 2.8Å
267E83Confident72.7Confident141 Ų14156.4 Ų56.466%0.65933%0.325SS*.Hα-helixtrans-68.2-24.4176.2-63.6177.8-83.900113.1W202 H206 P265W202-E267 PolarHBondContact NE1-OE1 2.94Å; H206-E267 IonicContact CE1-OE1 2.63Å; H206-E267 IonicContact NE2-OE1 2.7Å; P265-E267 PolarHBondContact O-N 3.27Å
268L80.9Confident71.2Confident11 Ų1154.4 Ų54.46%0.05832%0.315CS..Hα-helixtrans-100-27.9178.3-60.1-177.6000112.3I195 K198 Y199 W202 P265 K266 G270I195-L268 WeakPolarHBondContact CG1-O 3.42Å; I195-L268 HydrophobicContact CG2-CB 3.99Å; K198-L268 HydrophobicContact CB-CD2 3.68Å; Y199-L268 HydrophobicContact CD1-CD1 3.97Å; Y199-L268 HydrophobicContact CD2-CD1 3.74Å; Y199-L268 HydrophobicContact CE1-CD1 4.11Å; Y199-L268 HydrophobicContact CE2-CD1 3.87Å; Y199-L268 HydrophobicContact CG-CD1 3.79Å; W202-L268 HydrophobicContact CB-CD1 3.88Å; W202-L268 HydrophobicContact CB-CD2 4.17Å; W202-L268 HydrophobicContact CB-CG 4.33Å; W202-L268 HydrophobicContact CD2-CD1 4.18Å; W202-L268 HydrophobicContact CE3-CD1 4.49Å; W202-L268 HydrophobicContact CG-CD1 3.89Å; W202-L268 HydrophobicContact CG-CD2 4.3Å; W202-L268 HydrophobicContact CG-CG 4.1Å; P265-L268 HydrophobicContact CB-CB 4.42Å; P265-L268 HydrophobicContact CB-CD1 4.21Å; P265-L268 HydrophobicContact CB-CG 4.21Å; P265-L268 HydrophobicContact CG-CD1 4.01Å; P265-L268 CarbonylContact O-C 3.6Å; P265-L268 WeakPolarHBondContact O-CA 3.07Å; P265-L268 WeakPolarHBondContact O-CB 3.45Å; P265-L268 PolarHBondContact O-N 2.9Å; K266-L268 PolarHBondContact O-N 2.8Å; L268-G270 VanDerWaalsContact C-N 3.33Å; L268-G270 PolarHBondContact O-N 3.19Å
269A68.7Low69.4Low16 Ų1658.5 Ų58.513%0.13234%0.337CS..Hα-helixtrans-72.2-20.2-173.300000114.8P264 P265 E271 M272P264-A269 HydrophobicContact CB-CB 4.44Å; P264-A269 HydrophobicContact CG-CB 3.79Å; P265-A269 PolarHBondContact O-N 2.78Å; A269-E271 PolarHBondContact O-N 3.46Å; A269-M272 PolarHBondContact O-N 2.83Å
270G59Low67.5Low68 Ų6859.7 Ų59.770%0.70134%0.344SS*.THydrogen-bonded Turntrans-67.42.7-169.800000116.9L268L268-G270 VanDerWaalsContact C-N 3.33Å; L268-G270 PolarHBondContact O-N 3.19Å
271E60.6Low65.5Low89 Ų8961.1 Ų61.142%0.41635%0.352SS..THydrogen-bonded Turntrans-117.88.7-177.3-67.1-175.8134.400113.8K198 A269K198-E271 IonicContact NZ-OE1 2.72Å; K198-E271 IonicContact NZ-OE2 3.85Å; K198-E271 PolarHBondContact NZ-OE2 2.94Å; A269-E271 PolarHBondContact O-N 3.46Å
272M60.8Low63.5Low23 Ų2363.1 Ų63.111%0.11337%0.372CS..SBendtrans-78151.6179.1-71.3-160-67.200113.7I195 P264 A269 L276 F278I195-M272 HydrophobicContact CD1-CG 3.38Å; I195-M272 HydrophobicContact CD1-SD 4.25Å; P264-M272 HydrophobicContact CG-CE 4.17Å; A269-M272 PolarHBondContact O-N 2.83Å; M272-L276 WeakPolarHBondContact CE-O 3.32Å; M272-F278 HydrophobicContact CE-CB 4.4Å; M272-F278 HydrophobicContact CE-CD2 3.16Å; M272-F278 HydrophobicContact CE-CE2 3.57Å; M272-F278 HydrophobicContact CE-CG 3.99Å; M272-F278 HydrophobicContact SD-CD2 3.66Å; M272-F278 HydrophobicContact SD-CE2 3.34Å; M272-F278 WeakPolarHBondContact SD-CE2 3.3Å; M272-F278 HydrophobicContact SD-CZ 4.29Å
273P57.5Low61.5Low14 Ų1465.5 Ų65.59%0.09138%0.381CS..PPolyproline II helixtrans-54.5145.5175.1-22.933000112L182 V187 G275 L276L182-P273 HydrophobicContact CD1-CB 4.19Å; V187-P273 HydrophobicContact CG1-CB 4.28Å; V187-P273 HydrophobicContact CG1-CG 4.19Å; P273-G275 PolarHBondContact O-N 2.85Å; P273-L276 HydrophobicContact CB-CD1 4.49Å; P273-L276 HydrophobicContact CG-CD1 4.21Å; P273-L276 PolarHBondContact O-N 3.41Å
274P54.6Low59.5Low120 Ų12065.4 Ų65.478%0.77938%0.383SS*.THydrogen-bonded Turntrans-52.4131.3169.4-22.532.3000110.4
275G57.5Low57.7Low69 Ų6969.7 Ų69.771%0.71141%0.405SS*.THydrogen-bonded Turntrans91.8-11.5-175.200000115.5P273P273-G275 PolarHBondContact O-N 2.85Å
276L61.1Low55.6Low18 Ų1874.3 Ų74.39%0.09444%0.437CS..  trans-110.87.1169.9-68.4-177.4000113.5L182 L183 L188 M272 P273 F278L182-L276 HydrophobicContact CD1-CD1 4.11Å; L182-L276 HydrophobicContact CD1-CG 3.89Å; L182-L276 HydrophobicContact CD2-CD1 4.41Å; L182-L276 HydrophobicContact CD2-CD2 3.47Å; L182-L276 VanDerWaalsContact CD2-CD2 3.47Å; L182-L276 HydrophobicContact CD2-CG 3.6Å; L182-L276 HydrophobicContact CG-CD1 3.84Å; L182-L276 HydrophobicContact CG-CD2 3.77Å; L182-L276 HydrophobicContact CG-CG 3.56Å; L183-L276 HydrophobicContact CD2-CD2 4.2Å; L188-L276 HydrophobicContact CD1-CD1 3.47Å; L188-L276 VanDerWaalsContact CD1-CD1 3.47Å; L188-L276 HydrophobicContact CG-CD1 4.49Å; M272-L276 WeakPolarHBondContact CE-O 3.32Å; P273-L276 HydrophobicContact CB-CD1 4.49Å; P273-L276 HydrophobicContact CG-CD1 4.21Å; P273-L276 PolarHBondContact O-N 3.41Å; L276-F278 PolarHBondContact O-N 3.33Å
277N57.2Low53.4Low82 Ų8268 Ų6844%0.43942%0.423SS..  trans-61.9107.2169.3-85.3-91.1000107.2D279N277-D279 PolarHBondContact O-N 3.4Å
278F54.4Low51Low31 Ų3166.5 Ų66.514%0.13643%0.425CS..  trans-68.346.2176.1-58.2-67.3000110.9M255 L258 H263 P264 M272 L276 L280M255-F278 HydrophobicContact SD-CE1 4.42Å; M255-F278 HydrophobicContact SD-CZ 3.94Å; L258-F278 HydrophobicContact CD2-CE2 3.9Å; L258-F278 HydrophobicContact CD2-CZ 3.77Å; L258-F278 HydrophobicContact CG-CZ 4.38Å; H263-F278 WeakPolarHBondContact CB-O 3.3Å; P264-F278 HydrophobicContact CG-CD2 3.87Å; M272-F278 HydrophobicContact CE-CB 4.4Å; M272-F278 HydrophobicContact CE-CD2 3.16Å; M272-F278 HydrophobicContact CE-CE2 3.57Å; M272-F278 HydrophobicContact CE-CG 3.99Å; M272-F278 HydrophobicContact SD-CD2 3.66Å; M272-F278 HydrophobicContact SD-CE2 3.34Å; M272-F278 WeakPolarHBondContact SD-CE2 3.3Å; M272-F278 HydrophobicContact SD-CZ 4.29Å; L276-F278 PolarHBondContact O-N 3.33Å; F278-L280 PolarHBondContact O-N 2.91Å
279D48.3Very low48.9Very low90 Ų9072.5 Ų72.548%0.48147%0.465SS..  trans-69.788.5171.3-164.2-92.7000106.9N277 D281 A282 L283N277-D279 PolarHBondContact O-N 3.4Å; D279-D281 PolarHBondContact O-N 3.46Å; D279-A282 PolarHBondContact O-N 2.83Å; D279-A282 PolarHBondContact OD1-N 3.39Å; D279-L283 PolarHBondContact O-N 3Å
280L41.6Very low47.3Very low62 Ų6275.1 Ų75.133%0.32549%0.493SS..THydrogen-bonded Turntrans-63.9-15.6-178.3-173.262.7000111.7F278 L283 N284F278-L280 PolarHBondContact O-N 2.91Å; L280-L283 CarbonylContact O-C 3.56Å; L280-L283 PolarHBondContact O-N 3.04Å; L280-N284 WeakPolarHBondContact O-CA 3.31Å; L280-N284 WeakPolarHBondContact O-CB 3.37Å; L280-N284 PolarHBondContact O-N 2.84Å
281D41.5Very low46.1Very low144 Ų14476.6 Ų76.677%0.7750%0.499SS*.THydrogen-bonded Turntrans-71.1-31.6171.4-95.5-75.2000112D279D279-D281 PolarHBondContact O-N 3.46Å
282A42.1Very low45.2Very low67 Ų6778.8 Ų78.855%0.55452%0.524SS*.THydrogen-bonded Turntrans-81.9-17.6170.800000113.5D279D279-A282 PolarHBondContact O-N 2.83Å; D279-A282 PolarHBondContact OD1-N 3.39Å
283L40.1Very low43.7Very low66 Ų6680.5 Ų80.535%0.34655%0.548SS..SBendtrans-117.121.6-178.6-63.4175.8000113L79 D279 L280 L285L79-L283 HydrophobicContact CD2-CD2 4.29Å; D279-L283 PolarHBondContact O-N 3Å; L280-L283 CarbonylContact O-C 3.56Å; L280-L283 PolarHBondContact O-N 3.04Å; L283-L285 PolarHBondContact O-N 2.7Å
284N37.8Very low42.9Very low75 Ų7587.7 Ų87.740%0.40158%0.58SS.*  trans-69.190.9-170.6-166.29000111.4L280 S286L280-N284 WeakPolarHBondContact O-CA 3.31Å; L280-N284 WeakPolarHBondContact O-CB 3.37Å; L280-N284 PolarHBondContact O-N 2.84Å; N284-S286 PolarHBondContact ND2-O 2.85Å; N284-S286 PolarHBondContact O-N 3.19Å; N284-S286 WeakPolarHBondContact OD1-CA 3.41Å; N284-S286 VanDerWaalsContact OD1-CB 3.25Å; N284-S286 WeakPolarHBondContact OD1-CB 3.39Å; N284-S286 PolarHBondContact OD1-N 2.98Å
285L43.1Very low42.1Very low98 Ų9889.8 Ų89.851%0.51358%0.579SS.*  trans-70.83.7166.9-68166000112.7L74 L283L74-L285 HydrophobicContact CD2-CD1 3.95Å; L283-L285 PolarHBondContact O-N 2.7Å
286S39Very low41Very low100 Ų10092.5 Ų92.570%0.69959%0.586SS**SBendtrans-10669.7173.6-66.30000111.7N284N284-S286 PolarHBondContact ND2-O 2.85Å; N284-S286 PolarHBondContact O-N 3.19Å; N284-S286 WeakPolarHBondContact OD1-CA 3.41Å; N284-S286 VanDerWaalsContact OD1-CB 3.25Å; N284-S286 WeakPolarHBondContact OD1-CB 3.39Å; N284-S286 PolarHBondContact OD1-N 2.98Å
287G32.6Very low40Very low45 Ų4599.6 Ų99.646%0.46462%0.623SS.*  trans66.6157.8157.200000117
288P31.8Very low39Very low108 Ų108102.8 Ų102.870%0.70164%0.639SS**  trans-64.2142.7-173.924.4-32.4000111.8G290P288-G290 PolarHBondContact O-N 3.16Å
289P37.1Very low38.1Very low138 Ų138113.2 Ų113.290%0.89669%0.691SS**SBendtrans-72.790.4175.530.7-31.9000108.7
290G35.1Very low37.6Very low70 Ų70114.4 Ų114.472%0.72270%0.701SS**  trans-170.539.3-175.300000115.7P288P288-G290 PolarHBondContact O-N 3.16Å
291A34.5Very low37.4Very low99 Ų99117.2 Ų117.282%0.81872%0.721SS**  trans-150.433.6174.300000115
292S40.8Very low37.2Very low136 Ų136115.7 Ų115.795%0.95172%0.718SS**SBendtrans-132.588.9159.7-88.90000109.1
293G30.2Very low36.9Very low59 Ų59118.5 Ų118.561%0.60873%0.728SS**  trans174.980.6-17800000109.1
294E39.8Very low36.7Very low165 Ų165121.8 Ų121.877%0.77175%0.752SS**  trans36.1135.9138.663-174.893.400121.2
295Q39.7Very low36.7Very low163 Ų163124.9 Ų124.976%0.76278%0.775SS**  trans97.898.8158.5-55.9170.645.500116.9
296C34.1Very low36.2Very low126 Ų126126.9 Ų126.985%0.85179%0.794SS**  -164.191.8111.7-95.10000110.3
297L39.6Very low36Very low168 Ų168128.9 Ų128.988%0.8880%0.802SS**  trans-58129.5135.4-77.8161.9000106.7
298I35.5Very low36.3Very low149 Ų149135.9 Ų135.976%0.76483%0.83SS**  trans179126.4134.1-87.9149.5000109.1
299M37Very low36.7Very low250 Ų250138.5 Ų138.5100%1.23284%0.841SS**  trans9.40154.5-68.6178.4-77.700120.2

Retrieved 299 of 299 residues in 77.2 ms (Link to these results)