A0A077Z4K0_TRITR Loading...

POU domain protein

AlphaFold DB , UniProt , Accession A0A077Z4K0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 349 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
1M46.3Very low52.1Low249 Ų249170.6 Ų170.6100%1.22784%0.844SS**  097.10-73.1-173.3154.100108.5
2Q43Very low51.4Low187 Ų187168.8 Ų168.887%0.87485%0.849SS**  trans-91133.2175.2-97.1153.4-2800108.7
3T55.3Low51.2Low142 Ų142160.7 Ų160.787%0.87184%0.835SS**  trans-125.589.4164.652.10000108
4Q46.3Very low51Low162 Ų162159.4 Ų159.476%0.75784%0.837SS**  trans-80120.5162-77.9-157.35.600108.1F6Q4-F6 PolarHBondContact O-N 3.38Å
5R58.6Low51.1Low208 Ų208158 Ų15879%0.78583%0.829SS**  trans-82.7108.6165.4-80.3-163179.2173.73108.9Y7R5-Y7 HydrophobicContact CB-CE2 4.31Å
6F53.5Low51.3Low189 Ų189155.4 Ų155.483%0.82982%0.824SS**  trans-67126.7161.4-93.1-99.8000109.4Q4Q4-F6 PolarHBondContact O-N 3.38Å
7Y54.5Low51Low191 Ų191157.7 Ų157.775%0.74983%0.832SS**  trans-110.2123.6159.4-74.7-80.7000108.1R5R5-Y7 HydrophobicContact CB-CE2 4.31Å
8S56.7Low50.7Low106 Ų106151.7 Ų151.774%0.74181%0.814SS**PPolyproline II helixtrans-65.4145.4179.8-52.80000112.1
9P58.2Low50.6Low127 Ų127157.1 Ų157.183%0.82582%0.822SS**PPolyproline II helixtrans-76.5133.9172.730.2-30.1000110.8
10F45.9Very low50.2Low201 Ų201159.7 Ų159.788%0.88282%0.822SS**PPolyproline II helixtrans-71.9147.3172.7-87.5-89.6000111.4
11P55.2Low49.8Very low115 Ų115155 Ų15575%0.74780%0.803SS**PPolyproline II helixtrans-75.1142-171.230.2-33.2000112.8G13P11-G13 PolarHBondContact O-N 3.15Å
12T43.7Very low50.1Low148 Ų148148.3 Ų148.391%0.90878%0.778SS**  trans-63.4108.7170.8-3.80000110.3
13G48.2Very low50.8Low64 Ų64142 Ų14266%0.6675%0.754SS**  trans-102.8112166.200000110P11 I15P11-G13 PolarHBondContact O-N 3.15Å; G13-I15 PolarHBondContact O-N 2.78Å; G13-I15 VanDerWaalsContact O-N 3.15Å
14T48.3Very low50.8Low142 Ų142142.1 Ų142.187%0.87175%0.745SS**  trans-68104.4174.9-41.20000109.3
15I52.6Low51Low139 Ų139143.1 Ų143.171%0.71374%0.744SS**  trans-88.9128170.7-62.8-169.1000108.5G13 M17G13-I15 PolarHBondContact O-N 2.78Å; G13-I15 VanDerWaalsContact O-N 3.15Å; I15-M17 PolarHBondContact O-N 3.26Å
16P55.3Low51.2Low116 Ų116135.9 Ų135.975%0.75373%0.728SS**  trans-64.8130.2175.926.5-31.7000109.7G18P16-G18 VanDerWaalsContact C-N 3.25Å; P16-G18 PolarHBondContact O-N 2.76Å
17M44.7Very low51.4Low195 Ų195133.6 Ų133.696%0.96171%0.714SS**  trans-6479.9177.2-71.4-85.6-88.100110.9I15I15-M17 PolarHBondContact O-N 3.26Å
18G46.3Very low52Low49 Ų49127.6 Ų127.651%0.50570%0.7SS.*  trans-71.7136.2158.700000108.8P16 Y20P16-G18 VanDerWaalsContact C-N 3.25Å; P16-G18 PolarHBondContact O-N 2.76Å; G18-Y20 WeakPolarHBondContact O-CD2 3.35Å; G18-Y20 PolarHBondContact O-N 3.11Å
19R48.8Very low52.5Low255 Ų255124.2 Ų124.296%0.96268%0.678SS**  trans-57.192-178.6-64.1-176.6-170.8-171.43.2111S21R19-S21 PolarHBondContact O-N 2.95Å; R19-S21 VanDerWaalsContact O-N 3.11Å
20Y42.6Very low52.8Low209 Ų209119.9 Ų119.982%0.8265%0.653SS**  trans-68.3105.2170.2-92.4-92.4000108.4G18 P22G18-Y20 WeakPolarHBondContact O-CD2 3.35Å; G18-Y20 PolarHBondContact O-N 3.11Å; Y20-P22 WeakPolarHBondContact O-CD 3.4Å
21S42.5Very low53.8Low60 Ų60115.2 Ų115.242%0.4263%0.634SS.*  trans-90.9110.2166-179.20000108.5R19 S23 Q24R19-S21 PolarHBondContact O-N 2.95Å; R19-S21 VanDerWaalsContact O-N 3.11Å; S21-S23 PolarHBondContact O-N 2.85Å; S21-S23 PolarHBondContact OG-OG 3.46Å; S21-Q24 PolarHBondContact O-N 3.33Å
22P51.4Low54.4Low109 Ų109115.8 Ų115.871%0.70863%0.627SS**Hα-helixtrans-55.9-19.4178.9-26.735.9000114.1Y20 A26Y20-P22 WeakPolarHBondContact O-CD 3.4Å; P22-A26 WeakPolarHBondContact O-CB 3.45Å; P22-A26 PolarHBondContact O-N 3.46Å
23S59Low55.4Low54 Ų54115 Ų11538%0.37861%0.614SS.*Hα-helixtrans-69.9-29.8-178.671.10000114.3S21 R27S21-S23 PolarHBondContact O-N 2.85Å; S21-S23 PolarHBondContact OG-OG 3.46Å; S23-R27 WeakPolarHBondContact O-CG 3.26Å; S23-R27 PolarHBondContact O-N 3.3Å
24Q53.7Low56.2Low145 Ų145115.5 Ų115.568%0.67860%0.596SS**Hα-helixtrans-77.9-40.3-179.6-71.1-169.30.800111.6S21 R27 S28S21-Q24 PolarHBondContact O-N 3.33Å; Q24-R27 PolarHBondContact O-N 3.25Å; Q24-S28 PolarHBondContact O-N 3.2Å
25Y52.3Low57.1Low184 Ų184118.2 Ų118.272%0.72259%0.59SS**Hα-helixtrans-66.8-39.4177.1-149.4-88.3000111.6R27 S28 A29Y25-R27 VanDerWaalsContact C-N 3.34Å; Y25-R27 PolarHBondContact O-N 2.86Å; Y25-S28 PolarHBondContact O-N 3.27Å; Y25-A29 VanDerWaalsContact O-CB 3.3Å; Y25-A29 WeakPolarHBondContact O-CB 3.3Å; Y25-A29 PolarHBondContact O-N 2.89Å
26A61.1Low57.4Low55 Ų55118.7 Ų118.746%0.45559%0.59SS.*Hα-helixtrans-62-40.4174.600000112.2P22 A30P22-A26 WeakPolarHBondContact O-CB 3.45Å; P22-A26 PolarHBondContact O-N 3.46Å; A26-A30 WeakPolarHBondContact O-CB 3.49Å; A26-A30 PolarHBondContact O-N 2.91Å
27R57.7Low57.4Low141 Ų141118.1 Ų118.153%0.53259%0.587SS.*Hα-helixtrans-65.2-48.2173.2-79.1-172.8176109-9.2111.7S23 Q24 Y25 A29 A30 E31S23-R27 WeakPolarHBondContact O-CG 3.26Å; S23-R27 PolarHBondContact O-N 3.3Å; Q24-R27 PolarHBondContact O-N 3.25Å; Y25-R27 VanDerWaalsContact C-N 3.34Å; Y25-R27 PolarHBondContact O-N 2.86Å; R27-A29 VanDerWaalsContact C-N 3.32Å; R27-A29 PolarHBondContact O-N 2.92Å; R27-A30 PolarHBondContact O-N 3.41Å; R27-E31 WeakPolarHBondContact O-CB 3.25Å; R27-E31 PolarHBondContact O-N 3.25Å
28S68.4Low58Low65 Ų65115.4 Ų115.446%0.45558%0.575SS.*Hα-helixtrans-61.1-39.5178.9-172.40000112.7Q24 Y25 E31 Q32Q24-S28 PolarHBondContact O-N 3.2Å; Y25-S28 PolarHBondContact O-N 3.27Å; S28-E31 WeakPolarHBondContact O-CB 3.38Å; S28-E31 PolarHBondContact O-N 3.04Å; S28-Q32 WeakPolarHBondContact O-CB 3.49Å; S28-Q32 PolarHBondContact O-N 3.41Å
29A67.2Low57.9Low36 Ų36116 Ų11630%0.29858%0.581SS.*Hα-helixtrans-68.3-40.1176.500000111.7Y25 R27 Q32 M33Y25-A29 VanDerWaalsContact O-CB 3.3Å; Y25-A29 WeakPolarHBondContact O-CB 3.3Å; Y25-A29 PolarHBondContact O-N 2.89Å; R27-A29 VanDerWaalsContact C-N 3.32Å; R27-A29 PolarHBondContact O-N 2.92Å; A29-Q32 PolarHBondContact O-N 3.38Å; A29-M33 WeakPolarHBondContact O-CG 3.48Å; A29-M33 PolarHBondContact O-N 3.37Å
30A64.9Low57.6Low35 Ų35110.5 Ų110.529%0.28957%0.571SS.*Hα-helixtrans-64.3-41.3173.100000111.8A26 R27 M33 R34A26-A30 WeakPolarHBondContact O-CB 3.49Å; A26-A30 PolarHBondContact O-N 2.91Å; R27-A30 PolarHBondContact O-N 3.41Å; A30-M33 PolarHBondContact O-N 3.31Å; A30-R34 WeakPolarHBondContact O-CB 3.44Å; A30-R34 PolarHBondContact O-N 2.91Å
31E66.9Low57.2Low103 Ų103104.2 Ų104.248%0.48157%0.57SS.*Hα-helixtrans-61.2-45.3176-154.279.2-152.700111.6R27 S28 R34 R35R27-E31 WeakPolarHBondContact O-CB 3.25Å; R27-E31 PolarHBondContact O-N 3.25Å; S28-E31 WeakPolarHBondContact O-CB 3.38Å; S28-E31 PolarHBondContact O-N 3.04Å; E31-R34 WeakPolarHBondContact O-CB 3.35Å; E31-R34 PolarHBondContact O-N 3.16Å; E31-R35 PolarHBondContact O-N 3.04Å
32Q65.9Low57Low127 Ų127106.3 Ų106.359%0.59359%0.591SS**Hα-helixtrans-62.7-43.9176-88.2-178.1-26.100112S28 A29 R34 R35 Q36S28-Q32 WeakPolarHBondContact O-CB 3.49Å; S28-Q32 PolarHBondContact O-N 3.41Å; A29-Q32 PolarHBondContact O-N 3.38Å; Q32-R34 VanDerWaalsContact C-N 3.29Å; Q32-R34 PolarHBondContact O-N 3.48Å; Q32-R35 PolarHBondContact O-N 2.88Å; Q32-Q36 WeakPolarHBondContact O-CG 3.49Å; Q32-Q36 PolarHBondContact O-N 3.11Å
33M65.1Low57Low131 Ų131108 Ų10865%0.64559%0.591SS**Hα-helixtrans-62.4-38.2174.7-74.7-175.8174.500111.6A29 A30 Q36 C37A29-M33 WeakPolarHBondContact O-CG 3.48Å; A29-M33 PolarHBondContact O-N 3.37Å; A30-M33 PolarHBondContact O-N 3.31Å; M33-Q36 PolarHBondContact O-N 3.42Å; M33-C37 PolarHBondContact O-N 3.28Å; M33-C37 PolarHBondContact O-SG 3.43Å
34R65.3Low56.8Low75 Ų75110.1 Ų110.128%0.28360%0.603SS.*Hα-helixtrans-63.1-45.8177.6-149.6-179.6-166.3163.60.5111.7A30 E31 Q32 Q36 C37 I38 E187A30-R34 WeakPolarHBondContact O-CB 3.44Å; A30-R34 PolarHBondContact O-N 2.91Å; E31-R34 WeakPolarHBondContact O-CB 3.35Å; E31-R34 PolarHBondContact O-N 3.16Å; Q32-R34 VanDerWaalsContact C-N 3.29Å; Q32-R34 PolarHBondContact O-N 3.48Å; R34-Q36 VanDerWaalsContact C-N 3.32Å; R34-Q36 PolarHBondContact O-N 2.96Å; R34-C37 PolarHBondContact O-N 3.46Å; R34-I38 HydrophobicContact CG-CD1 4.47Å; R34-I38 WeakPolarHBondContact O-CG1 3.49Å; R34-I38 PolarHBondContact O-N 3.36Å; R34-E187 IonicContact CZ-OE1 2.76Å; R34-E187 IonicContact NH1-OE1 2.86Å; R34-E187 PolarHBondContact NH1-OE1 3.44Å
35R66.7Low56.9Low199 Ų199108.9 Ų108.975%0.75161%0.608SS**Hα-helixtrans-61.6-36.7177.6-74.9-175.4164.7-132.1-3.3113.2E31 Q32 C37E31-R35 PolarHBondContact O-N 3.04Å; Q32-R35 PolarHBondContact O-N 2.88Å; R35-C37 VanDerWaalsContact C-N 3.32Å; R35-C37 PolarHBondContact O-N 3.43Å
36Q59.3Low56.3Low150 Ų150105.4 Ų105.470%0.70160%0.602SS**Hα-helixtrans-73-23.3178.7-70.7178.42.700113.4Q32 M33 R34Q32-Q36 WeakPolarHBondContact O-CG 3.49Å; Q32-Q36 PolarHBondContact O-N 3.11Å; M33-Q36 PolarHBondContact O-N 3.42Å; R34-Q36 VanDerWaalsContact C-N 3.32Å; R34-Q36 PolarHBondContact O-N 2.96Å
37C55.3Low56Low103 Ų103110.7 Ų110.770%0.69662%0.615SS**Hα-helixtrans-89.1-17.9-178.3-62.60000113.9M33 R34 R35M33-C37 PolarHBondContact O-N 3.28Å; M33-C37 PolarHBondContact O-SG 3.43Å; R34-C37 PolarHBondContact O-N 3.46Å; R35-C37 VanDerWaalsContact C-N 3.32Å; R35-C37 PolarHBondContact O-N 3.43Å
38I57Low55.5Low139 Ų139112.1 Ų112.171%0.71363%0.625SS**Hα-helixtrans-81.9-18.7179.3-64.8168.9000111.5R34R34-I38 HydrophobicContact CG-CD1 4.47Å; R34-I38 WeakPolarHBondContact O-CG1 3.49Å; R34-I38 PolarHBondContact O-N 3.36Å
39G44Very low54.1Low61 Ų61114.7 Ų114.763%0.62964%0.643SS**SBendtrans-85.7-9.4-174.600000117.4
40N43.4Very low52.6Low139 Ų139116.4 Ų116.474%0.74367%0.665SS**  trans-125.399.8-176.2-82.7-4.3000111.6
41G34.8Very low51.8Low78 Ų78120.7 Ų120.780%0.80468%0.681SS**  trans-63.5155.6170.800000113.1
42A36.7Very low50.6Low103 Ų103121.4 Ų121.485%0.85169%0.688SS**  trans84.377.3177.900000116.9
43M51.8Low49.4Very low145 Ų145124 Ų12471%0.71470%0.7SS**  trans-125.3135.1156.6-76.4-78.2-93.600110
44P56.2Low48.1Very low98 Ų98121.5 Ų121.564%0.63670%0.696SS**PPolyproline II helixtrans-71.3153.9-174.130.1-34.9000111.9N46P44-N46 PolarHBondContact O-N 3.18Å
45P54.1Low47.1Very low119 Ų119123.8 Ų123.877%0.77371%0.713SS**PPolyproline II helixtrans-66.2134.2-172.627.3-32.9000111
46N40.8Very low45.9Very low111 Ų111123.2 Ų123.259%0.59472%0.717SS**PPolyproline II helixtrans-73.7126.6-180-72.1-70.4000110.6P44 F48P44-N46 PolarHBondContact O-N 3.18Å; N46-F48 PolarHBondContact O-N 2.94Å
47F53.8Low44.8Very low166 Ų166121.4 Ų121.473%0.72872%0.72SS**THydrogen-bonded Turntrans5.24.4149.5-135-100.2000123.9
48F47.5Very low43.9Very low172 Ų172121.8 Ų121.875%0.75472%0.719SS**THydrogen-bonded Turntrans-115.44.7174.7-102-83.2000113.9N46 G50 I51N46-F48 PolarHBondContact O-N 2.94Å; F48-G50 PolarHBondContact O-N 3.49Å; F48-I51 HydrophobicContact CD1-CD1 4.19Å
49S38.9Very low42.8Very low118 Ų118125.6 Ų125.683%0.82573%0.725SS**THydrogen-bonded Turntrans-72.329.8-175.3-160.60000115.6
50G35.9Very low42.2Very low73 Ų73127.2 Ų127.275%0.75373%0.732SS**THydrogen-bonded Turntrans-130.815.8-174.200000115.1F48F48-G50 PolarHBondContact O-N 3.49Å
51I49.4Very low41.4Very low124 Ų124129.6 Ų129.664%0.63674%0.739SS**SBendtrans-97.194.8168.3-9.4174.2000106F48 E53F48-I51 HydrophobicContact CD1-CD1 4.19Å; I51-E53 PolarHBondContact O-N 3.44Å
52D41.1Very low41.3Very low118 Ų118129.6 Ų129.663%0.63173%0.731SS**  trans-47.5126.5-173.9-147.6-84.1000112.6S54 L55D52-S54 PolarHBondContact O-N 3.03Å; D52-S54 WeakPolarHBondContact OD1-CB 3.38Å; D52-S54 PolarHBondContact OD1-N 2.82Å; D52-L55 PolarHBondContact O-N 3.43Å
53E40.1Very low40.9Very low181 Ų181129.7 Ų129.785%0.84673%0.732SS**G310 helixtrans-53-14.6172.1-96.7-139.8106.600113.4I51 L55I51-E53 PolarHBondContact O-N 3.44Å; E53-L55 VanDerWaalsContact C-N 3.26Å; E53-L55 PolarHBondContact O-N 3.27Å
54S39Very low39.9Very low79 Ų79131.5 Ų131.555%0.55274%0.736SS**G310 helixtrans-70.5-13.4177.8-1690000114.7D52D52-S54 PolarHBondContact O-N 3.03Å; D52-S54 WeakPolarHBondContact OD1-CB 3.38Å; D52-S54 PolarHBondContact OD1-N 2.82Å
55L43.2Very low38.5Very low124 Ų124133.5 Ų133.565%0.64975%0.746SS**G310 helixtrans-88.3-18.8-176.8-150.476.4000114.1D52 E53D52-L55 PolarHBondContact O-N 3.43Å; E53-L55 VanDerWaalsContact C-N 3.26Å; E53-L55 PolarHBondContact O-N 3.27Å
56F40.6Very low37.5Very low187 Ų187131.5 Ų131.582%0.8274%0.74SS**SBendtrans-96.9-6.4-174.4-76-78.2000114.5
57S37.5Very low37.1Very low111 Ų111131.3 Ų131.378%0.77675%0.747SS**SBendtrans-106.96.2-179.1-157.50000115.1
58V36.6Very low36.3Very low112 Ų112130.6 Ų130.668%0.67975%0.749SS**SBendtrans-118.912.6-167.1-178.70000114.9
59R33.1Very low35.8Very low218 Ų218129.1 Ų129.182%0.82375%0.75SS**  trans-15157176.1-143161.9178.1148.8-2.2115.8
60A31Very low35.6Very low95 Ų95133.4 Ų133.479%0.78575%0.748SS**SBendtrans-85.3140140.700000106.8
61E28.1Very low35.6Very low190 Ų190135 Ų13589%0.88875%0.753SS**  trans84.788-171.2-51.9-148.1155.300116.6
62A32.1Very low34.9Very low77 Ų77133.3 Ų133.364%0.63676%0.758SS**  trans-159.778.3143.100000108.6F64A62-F64 PolarHBondContact O-N 3.37Å
63A27.7Very low34.6Very low106 Ų106133.7 Ų133.788%0.87676%0.764SS**  trans-65.6115.3155.100000107.7
64F31.7Very low34.2Very low183 Ų183128.5 Ų128.580%0.80376%0.76SS**  trans-143.6112.2159.4-164.9-106.7000110.5A62 A66A62-F64 PolarHBondContact O-N 3.37Å; F64-A66 HydrophobicContact CD1-CB 3.92Å; F64-A66 HydrophobicContact CE1-CB 3.41Å; F64-A66 VanDerWaalsContact CE1-CB 3.41Å; F64-A66 HydrophobicContact CZ-CB 4.24Å
65V27.1Very low34.2Very low139 Ų139129.3 Ų129.384%0.84277%0.771SS**  trans-72.9121.5164.5171.60000107.5
66A33.4Very low34.1Very low77 Ų77131.8 Ų131.864%0.63678%0.779SS**  trans-162110.8154.900000112.1F64F64-A66 HydrophobicContact CD1-CB 3.92Å; F64-A66 HydrophobicContact CE1-CB 3.41Å; F64-A66 VanDerWaalsContact CE1-CB 3.41Å; F64-A66 HydrophobicContact CZ-CB 4.24Å
67S30.6Very low34Very low108 Ų108130 Ų13076%0.75578%0.778SS**  trans-68.8174.4153.8178.80000110.7
68I37.7Very low34.1Very low150 Ų150129.4 Ų129.477%0.76977%0.774SS**  trans102.4122.4171.2-54.4160.4000112.2
69D36.8Very low34.3Very low142 Ų142131.3 Ų131.376%0.75978%0.777SS**  cis-145.7133.145.4-120.5-25.1000110
70R35.5Very low34.9Very low208 Ų208127.3 Ų127.379%0.78577%0.771SS**  59.285.157.5-136.8-168.4-164.9147.94.1115.3
71A35Very low35.2Very low105 Ų105131.1 Ų131.187%0.86877%0.77SS**  trans-120.988.515700000108.7
72A34.8Very low35.9Very low89 Ų89127.3 Ų127.374%0.73676%0.76SS**  trans168.482155.600000111
73V34.7Very low36.2Very low126 Ų126130 Ų13076%0.76476%0.764SS**  trans-147.5121.8151.7-178.60000108.7
74G32.7Very low37.1Very low73 Ų73134.1 Ų134.175%0.75377%0.767SS**  trans118.897.815800000114.9
75A37.8Very low37.8Very low95 Ų95134 Ų13479%0.78577%0.772SS**  163.5117.4110.100000112.6
76Q42.3Very low38.9Very low176 Ų176132.2 Ų132.282%0.82276%0.763SS**  trans88.9112.3145.1-43.9-145.3-50.900122
77N37.5Very low39.1Very low150 Ų150133.4 Ų133.480%0.80276%0.762SS**  67.8108127.4-76-1.3000122.2
78S40.1Very low39.7Very low98 Ų98138.6 Ų138.669%0.68577%0.767SS**  133115.6103.1-157.70000116.1
79M40.4Very low39.8Very low152 Ų152136.5 Ų136.575%0.74976%0.761SS**  trans72.2108.4138.2-77.2169.661.500123.3
80L45.2Very low40.4Very low134 Ų134138.6 Ų138.670%0.70277%0.766SS**  72.7109121.9-60.4168.2000118.9
81K39Very low40.4Very low175 Ų175136.1 Ų136.176%0.76177%0.767SS**  93.8126.887.9-148.2-178.6176.8168.60109.5
82T41.8Very low40.8Very low111 Ų111137.2 Ų137.268%0.68176%0.764SS**  175.4141.672.6-53.40000109.6
83D39.3Very low41Very low132 Ų132139.8 Ų139.871%0.70677%0.771SS**  trans9.8139.3156.8-59.9-97.2000124.1
84M45.6Very low41.3Very low193 Ų193137.6 Ų137.695%0.95177%0.773SS**  179.3140.7100.7-91.9-168150.200113.3
85M45.7Very low41.6Very low181 Ų181137.5 Ų137.589%0.89277%0.772SS**  trans-110.3-167.7-176.7-84.7-89.2169.300110.4
86P50.3Low41.9Very low102 Ų102142.9 Ų142.966%0.66278%0.781SS**  -131.1-169-89.537.1-15000114.8
87T39Very low42Very low101 Ų101142.9 Ų142.962%0.6278%0.781SS**  trans101.1124.5150.5-38.10000118.8
88Y41.8Very low42.5Very low217 Ų217141.4 Ų141.485%0.85178%0.779SS**  -179.5134.4111-101-81.6000112.7
89T40.1Very low42.6Very low106 Ų106144.3 Ų144.365%0.6578%0.782SS**  trans-77.7156.7179.8-270000112.4
90H49.4Very low42.7Very low187 Ų187142.9 Ų142.987%0.86678%0.782SS**  trans-170.5127.7136.5-99.9-72.4000112.4
91L36.1Very low42.5Very low155 Ų155140.2 Ų140.281%0.81279%0.787SS**  trans-93.8145.5166.5-99.274.3000109.9
92T42.6Very low42.8Very low129 Ų129139.7 Ų139.779%0.79179%0.789SS**  trans-173.2112.1145.3159.60000114.8
93T39.7Very low43Very low143 Ų143140.2 Ų140.288%0.87779%0.792SS**  trans18.3141136.6-38.30000125.1
94G41.6Very low43.4Very low80 Ų80139.5 Ų139.583%0.82580%0.797SS**  trans119.9134.1148.600000113.6
95G37.8Very low43.5Very low71 Ų71136.4 Ų136.473%0.73279%0.792SS**  cis167.3163.22.700000108.1
96Q45Very low44.2Very low207 Ų207136.9 Ų136.997%0.96779%0.794SS**  trans91.8121.3159.3-53.4-176.6-8.800120.8
97H43.1Very low43.7Very low176 Ų176139 Ų13982%0.81580%0.8SS**  trans-115.3149.1159.8-149.9-99.6000105
98P48.8Very low44Very low119 Ų119143.4 Ų143.477%0.77381%0.811SS**  -156.9155.291.237.5-15.7000118.4
99Q42.2Very low44Very low159 Ų159141.2 Ų141.274%0.74381%0.808SS**  trans37.3138.2140.4-99.8-155.7-18.400126.3
100V42.1Very low44Very low123 Ų123143.8 Ų143.875%0.74582%0.817SS**  trans75.3123.8144.6-59.30000122.2
101G41.2Very low43.6Very low78 Ų78143.8 Ų143.880%0.80482%0.818SS**  trans-175.2131.8165.500000111.3
102M46.1Very low43.8Very low163 Ų163143.4 Ų143.480%0.80382%0.816SS**  trans-94.1151.5-159-69.8-84.8152.800114.2
103T44.6Very low43.8Very low122 Ų122141.1 Ų141.175%0.74881%0.811SS**  trans54.3122142.162.20000121.3
104S48.7Very low44Very low117 Ų117139 Ų13982%0.81880%0.799SS**  trans-176.1126.9130.7-78.50000110.9
105P48.1Very low44Very low129 Ų129143.3 Ų143.384%0.83880%0.8SS**  trans-105.5134.1159.233.2-21.3000110.5
106M60.2Low44.3Very low191 Ų191145.1 Ų145.194%0.94180%0.801SS**  trans-95.9122.2171.7-72-74.3-103.400109.4
107D40.7Very low44Very low147 Ų147140.8 Ų140.879%0.78679%0.794SS**  trans-103.9176.5167-124.4-48.6000109.3
108F44.7Very low44.2Very low193 Ų193140.9 Ų140.985%0.84680%0.797SS**  trans87.2124.3-174.8-57.7-81.7000113.7
109H41.5Very low43.6Very low171 Ų171140.4 Ų140.479%0.79280%0.796SS**  cis-159.3143.338.3-153.2-145.8000111
110L39.8Very low43.7Very low159 Ų159137.7 Ų137.783%0.83280%0.795SS**  trans-86.5123.5176175.773.9000109.4
111E40.8Very low43.9Very low188 Ų188139.8 Ų139.888%0.87980%0.798SS**  trans-150.9150154.9-161.514210300111.3
112N40.3Very low44.3Very low146 Ų146143.5 Ų143.578%0.78180%0.798SS**  trans-114.2137.8-149-179.768.5000111.3
113A43.8Very low44.1Very low82 Ų82142.5 Ų142.568%0.67880%0.796SS**  trans70.9165.3155.700000119
114P44.2Very low44.1Very low97 Ų97141.9 Ų141.963%0.6379%0.794SS**  cis-134.2169.7-32.430.5-10.1000114.6
115M40Very low43.9Very low172 Ų172144.6 Ų144.685%0.84779%0.794SS**  trans8.4122.7157.466.7-151.971.900119.9
116S44.2Very low43.6Very low109 Ų109148 Ų14876%0.76280%0.798SS**  trans-142.4120.1157-75.30000110.8
117S40.2Very low42.8Very low115 Ų115147.1 Ų147.180%0.80479%0.794SS**  trans-66.4135.5175.2-167.90000110.4
118M46Very low42.6Very low178 Ų178143.5 Ų143.588%0.87779%0.785SS**  trans-133.493.6168.4-59.3-166.8179.100109.3
119S35.7Very low42.8Very low110 Ų110143 Ų14377%0.76979%0.787SS**  trans-73.3134.9156.4-68.90000109.3
120S44.6Very low42.5Very low101 Ų101139.2 Ų139.271%0.70679%0.786SS**  trans178.2154.7138.846.30000112.8
121M46.6Very low42.5Very low167 Ų167136.5 Ų136.582%0.82379%0.786SS**  trans86.786.2164-47.6-168.5-173.900115
122I49.4Very low42.6Very low157 Ų157132.5 Ų132.581%0.80578%0.779SS**  62.7105.865.7-53.9170.8000112.8P124I122-P124 HydrophobicContact CG2-CG 4.42Å
123D41.5Very low43Very low141 Ų141134.3 Ų134.375%0.75479%0.785SS**  trans-148.4112.7151.1-163.7-74.5000108.7
124P44.7Very low42.9Very low110 Ų110134.1 Ų134.171%0.71479%0.791SS**  trans-122.3107.1170.133.2-16.5000110.9I122I122-P124 HydrophobicContact CG2-CG 4.42Å
125H45.7Very low42.9Very low173 Ų173137.4 Ų137.480%0.80180%0.798SS**  trans-11093.8165.7-102.8-76.5000110.8
126Q40.2Very low43Very low201 Ų201137.4 Ų137.494%0.93980%0.796SS**  trans-148.5107.7148.7-82.2-162.159.400108.6
127M43.3Very low42.9Very low172 Ų172138.7 Ų138.785%0.84779%0.789SS**  trans-105.9133.2167.5-171.872.1-176.800108.4
128A38Very low42.6Very low72 Ų72139.4 Ų139.460%0.59578%0.783SS**  trans-51.8157.3178.600000115.4
129M47.9Very low42.6Very low181 Ų181136.9 Ų136.989%0.89278%0.778SS**  -153.8136.3120-83.9-46.7166.100110.7
130A35Very low42.6Very low93 Ų93138.5 Ų138.577%0.76977%0.773SS**  trans-101.8169.2-175.600000112.4
131A39.5Very low42.9Very low101 Ų101144.4 Ų144.484%0.83578%0.782SS**  trans77.9119.915800000118.8
132S43.9Very low42.9Very low105 Ų105140.2 Ų140.273%0.73477%0.767SS**  165.8111.9122.1-178.40000113.3
133M48.6Very low43Very low183 Ų183141.5 Ų141.590%0.90177%0.769SS**  trans71.3118132.7-62.1-160.3159.900124.9
134G41Very low43.1Very low79 Ų79138.1 Ų138.181%0.81477%0.768SS**  69.1156126.500000119
135H44.5Very low43.4Very low166 Ų166138.5 Ų138.577%0.76977%0.77SS**  cis-176142.4-7.6-160.195.7000105.8
136H43Very low43.5Very low172 Ų172139 Ų13980%0.79678%0.777SS**  trans147.3109150.186.9-75000109.8
137Q41Very low43.7Very low135 Ų135132.5 Ų132.563%0.63176%0.763SS**  63.496.466.3-64.6-90.742.400112.1
138L35.4Very low43.7Very low130 Ų130132 Ų13268%0.68176%0.764SS**  90.5116.783-153.8161.6000110.8
139V44.3Very low44.4Very low126 Ų126137.5 Ų137.576%0.76478%0.78SS**  trans-172.1143.5135.6170.50000109.4Y141V139-Y141 HydrophobicContact CG1-CD2 4.46Å; V139-Y141 HydrophobicContact CG1-CE2 4.08Å
140Q36.4Very low44.3Very low143 Ų143132.5 Ų132.567%0.66878%0.775SS**  trans-130.7139.6-152.4169.8179.1-5.700107.1
141Y51.1Low45.2Very low226 Ų226134.4 Ų134.489%0.88678%0.779SS**  trans-145123.9160.1-81.4-74.1000110.7V139V139-Y141 HydrophobicContact CG1-CD2 4.46Å; V139-Y141 HydrophobicContact CG1-CE2 4.08Å
142P46.9Very low45.5Very low78 Ų78134.5 Ų134.551%0.50678%0.78SS.*  trans-114.2177.217418.74.4000113.5
143H50.8Low45.5Very low185 Ų185134.1 Ų134.186%0.85678%0.783SS**  trans87.1134.7164-44.6-70.5000116.6
144G44.2Very low45.6Very low70 Ų70133.4 Ų133.472%0.72278%0.782SS**  cis-170172.24.700000112.3
145P50.4Low46Very low118 Ų118135.2 Ų135.277%0.76678%0.78SS**  trans-101.5168.7-177.638.7-30.3000112.6
146I48.7Very low46Very low184 Ų184132.8 Ų132.894%0.94478%0.777SS**  trans156.6136.6160.5-84151.5000105.4
147G44.1Very low46.3Very low63 Ų63133.9 Ų133.965%0.64978%0.782SS**  cis175.4121.22.700000104.5
148N43.1Very low46.4Very low161 Ų161135.4 Ų135.486%0.86179%0.788SS**  54.7109.6102.4-14477.2000115.6
149M52.4Low47.2Very low188 Ų188138 Ų13893%0.92680%0.797SS**  trans-175.797.6137.1-83.6-122.5-176.100112
150G45.2Very low47.6Very low77 Ų77136.7 Ų136.779%0.79479%0.791SS**  52.7157.912300000125.7
151P55.5Low48Very low133 Ų133134.8 Ų134.886%0.86479%0.793SS**  trans-124.6164-152.439.1-21.3000116
152A44.8Very low47.7Very low102 Ų102133.5 Ų133.584%0.84379%0.793SS**  trans172.5153.9160.600000108
153A43.7Very low48Very low98 Ų98133.9 Ų133.981%0.8180%0.802SS**  cis-169.3158.5-15.300000105.8
154L50.4Low48.1Very low167 Ų167131.3 Ų131.387%0.87480%0.802SS**  trans-54.1176.1177.3-70.6163.6000114.5
155P50.9Low48.2Very low118 Ų118131.3 Ų131.377%0.76680%0.802SS**  cis-149.6-17828.938.6-13.3000119.3
156T42.7Very low48.1Very low114 Ų114133.1 Ų133.170%0.69981%0.805SS**  trans-47145.5173.737.10000118.8
157H49.7Very low48Very low196 Ų196130 Ų13091%0.90779%0.794SS**  trans-151.7132.1148.8-101-65.3000113.3
158H43.3Very low48.6Very low166 Ų166135 Ų13577%0.76980%0.803SS**  trans-94.3149.2171.4-66.8-68.7000111.4
159H53Low48.7Very low186 Ų186132.9 Ų132.986%0.86180%0.797SS**  trans166.8165.5135.2-107.5-101.5000112.3
160P52.6Low48.5Very low97 Ų97128.8 Ų128.863%0.6379%0.793SS**  -131.9-179.8-125.632.8-7.4000116.4
161S44.8Very low48.7Very low103 Ų103131 Ų13172%0.7279%0.791SS**  trans66.7149.3144.8-67.50000124.3
162F44.3Very low48Very low200 Ų200130.2 Ų130.288%0.87779%0.789SS**  trans89.496.4170.2-68.1-85.9000116.6
163A53.8Low48.1Very low85 Ų85136.3 Ų136.370%0.70279%0.79SS**  90.4160.366.700000112.8
164P53.1Low48.1Very low132 Ų132137 Ų13786%0.85779%0.787SS**  cis-132.5165.3-49.436.2-20.7000112.2
165G45.6Very low47.8Very low69 Ų69137 Ų13771%0.71179%0.787SS**  trans177.7121.4169.500000115.6
166N47.6Very low47.6Very low156 Ų156137.7 Ų137.783%0.83479%0.788SS**  trans89.783159.2-68.833.8000120.7
167V48.2Very low47.6Very low119 Ų119137.2 Ų137.272%0.72179%0.79SS**  14.9120.3127.8-68.50000119.9
168M55.4Low47.3Very low169 Ų169136.4 Ų136.483%0.83379%0.787SS**  -167.4139.5124.9-89.3-50127.200109.6
169P46Very low47.9Very low115 Ų115133.6 Ų133.675%0.74778%0.783SS**  trans-88.4111.1-174.833.7-28.6000110.8V171P169-V171 PolarHBondContact O-N 2.96Å
170A47.3Very low48.1Very low102 Ų102132.8 Ų132.884%0.84378%0.78SS**  trans-82.999171.300000109.7S172A170-S172 PolarHBondContact O-N 3.46Å
171V49.3Very low49.1Very low123 Ų123129.8 Ų129.875%0.74576%0.759SS**  trans-42.3123.1169167.70000111.7P169 R173P169-V171 PolarHBondContact O-N 2.96Å; V171-R173 PolarHBondContact O-N 3.19Å
172S42.5Very low50.7Low118 Ų118127.2 Ų127.283%0.82574%0.738SS**  trans-51110.9164.3-45.40000110.5A170A170-S172 PolarHBondContact O-N 3.46Å
173R46.4Very low52.6Low229 Ų229120 Ų12086%0.86471%0.71SS**  trans-103.8127.8163.5-78.6179.479.2-173.54108.8V171 L175V171-R173 PolarHBondContact O-N 3.19Å; R173-L175 PolarHBondContact O-N 3.02Å
174P42.8Very low54.2Low114 Ų114124.4 Ų124.474%0.7471%0.709SS**  trans-66.5130.4-177.627.4-31000109.2V176P174-V176 PolarHBondContact O-N 3.05Å
175L44.1Very low56Low167 Ų167122.7 Ų122.787%0.87469%0.689SS**  trans-54.3107165.6-178.769.3000107.2R173 S177R173-L175 PolarHBondContact O-N 3.02Å; L175-S177 PolarHBondContact O-N 3.37Å
176V48Very low58.2Low131 Ų131119.5 Ų119.579%0.79466%0.656SS**  trans-65.5107.7178.8-163.90000106.5P174 E178P174-V176 PolarHBondContact O-N 3.05Å; V176-E178 PolarHBondContact O-N 3.09Å; V176-E178 VanDerWaalsContact O-N 3.08Å
177S41.4Very low60.4Low104 Ų104115.1 Ų115.173%0.72763%0.631SS**  trans-51.9112.3168.1-38.10000107.6L175 P179L175-S177 PolarHBondContact O-N 3.37Å; S177-P179 VanDerWaalsContact O-N 3.17Å
178E44.1Very low62.6Low180 Ų180113.4 Ų113.484%0.84162%0.624SS**  trans-50.1124.7166.9-131.1-147.6113.900106.5V176 E180V176-E178 PolarHBondContact O-N 3.09Å; V176-E178 VanDerWaalsContact O-N 3.08Å; E178-E180 VanDerWaalsContact C-N 3.32Å; E178-E180 PolarHBondContact O-N 3.23Å
179P55.2Low64.6Low106 Ų106106.4 Ų106.469%0.68859%0.589SS**  trans-65.7100-177.726.3-31.8000107.3S177 T181S177-P179 VanDerWaalsContact O-N 3.17Å; P179-T181 VanDerWaalsContact C-N 3.31Å; P179-T181 PolarHBondContact O-N 3.44Å
180E58.2Low67Low170 Ų170100.9 Ų100.979%0.79455%0.553SS**  trans-49.5103.3165.6-167.7-173.4-174.600105.6E178 D182E178-E180 VanDerWaalsContact C-N 3.32Å; E178-E180 PolarHBondContact O-N 3.23Å; E180-D182 PolarHBondContact O-N 3.4Å
181T72.7Confident69.3Low33 Ų3399.7 Ų99.720%0.20253%0.533CS..  trans-57.1111.7-171.6-63.50000107.7P179 P183 L186 H237P179-T181 VanDerWaalsContact C-N 3.31Å; P179-T181 PolarHBondContact O-N 3.44Å; T181-P183 WeakPolarHBondContact O-CD 3.34Å; T181-L186 HydrophobicContact CG2-CD1 4.32Å; T181-L186 HydrophobicContact CG2-CD2 4.28Å; T181-L186 HydrophobicContact CG2-CG 3.93Å; T181-H237 PolarHBondContact O-CE1 3Å
182D79Confident71.5Confident50 Ų5097.3 Ų97.327%0.26751%0.513SS..  trans-54.2126-172.1-178.5-11.9000108.4E180 R184 E185 L186E180-D182 PolarHBondContact O-N 3.4Å; D182-R184 PolarHBondContact O-N 3.35Å; D182-R184 PolarHBondContact OD1-N 2.69Å; D182-R184 IonicContact OD1-NE 3.21Å; D182-R184 IonicContact OD1-NH2 3.24Å; D182-R184 IonicContact OD2-CZ 3.63Å; D182-R184 IonicContact OD2-NE 2.87Å; D182-R184 PolarHBondContact OD2-NE 2.98Å; D182-R184 IonicContact OD2-NH2 2.69Å; D182-R184 PolarHBondContact OD2-NH2 3.06Å; D182-E185 HydrophobicContact CB-CG 4.23Å; D182-E185 WeakPolarHBondContact O-CB 3.34Å; D182-E185 PolarHBondContact O-N 3.47Å; D182-L186 PolarHBondContact O-N 3.32Å
183P83.5Confident74.1Confident47 Ų4791.7 Ų91.731%0.30547%0.474SS..Hα-helixtrans-39.3-38170.5-35.537.9000114.5T181 L186 E187T181-P183 WeakPolarHBondContact O-CD 3.34Å; P183-L186 PolarHBondContact O-N 2.81Å; P183-E187 WeakPolarHBondContact O-CG 3.3Å; P183-E187 PolarHBondContact O-N 3.35Å; P183-E187 VanDerWaalsContact O-N 3.13Å
184R87.4Confident76.5Confident178 Ų17884.4 Ų84.467%0.67245%0.448SS*.Hα-helixtrans-66.6-35.2178.2-73.2-179-72.7-122.2-4.6113.6D182 L186 E187 S188D182-R184 PolarHBondContact O-N 3.35Å; D182-R184 PolarHBondContact OD1-N 2.69Å; D182-R184 IonicContact OD1-NE 3.21Å; D182-R184 IonicContact OD1-NH2 3.24Å; D182-R184 IonicContact OD2-CZ 3.63Å; D182-R184 IonicContact OD2-NE 2.87Å; D182-R184 PolarHBondContact OD2-NE 2.98Å; D182-R184 IonicContact OD2-NH2 2.69Å; D182-R184 PolarHBondContact OD2-NH2 3.06Å; R184-L186 VanDerWaalsContact C-N 3.34Å; R184-E187 PolarHBondContact O-N 2.74Å; R184-S188 WeakPolarHBondContact O-CB 3.27Å; R184-S188 PolarHBondContact O-N 3.29Å
185E91.4Very high79Confident96 Ų9685 Ų8545%0.44944%0.441SS..Hα-helixtrans-67.8-38.5176-70.5-174.1-161.600111.8D182 E187 S188 F189 R244D182-E185 HydrophobicContact CB-CG 4.23Å; D182-E185 WeakPolarHBondContact O-CB 3.34Å; D182-E185 PolarHBondContact O-N 3.47Å; E185-E187 VanDerWaalsContact C-N 3.31Å; E185-S188 PolarHBondContact O-N 2.93Å; E185-F189 VanDerWaalsContact O-CB 3.3Å; E185-F189 WeakPolarHBondContact O-CB 3.42Å; E185-F189 PolarHBondContact O-N 3.43Å; E185-R244 IonicContact OE2-CZ 3.51Å; E185-R244 IonicContact OE2-NH1 2.96Å; E185-R244 PolarHBondContact OE2-NH1 2.91Å; E185-R244 IonicContact OE2-NH2 3.08Å; E185-R244 PolarHBondContact OE2-NH2 2.87Å; E185-R244 VanDerWaalsContact OE2-NH2 3.08Å
186L92.8Very high81.4Confident3 Ų380.9 Ų80.92%0.01641%0.414CS..Hα-helixtrans-64.6-39.1176.2-75.3168.8000111.4T181 D182 P183 R184 F189 A190 H237 M240 I241 R244T181-L186 HydrophobicContact CG2-CD1 4.32Å; T181-L186 HydrophobicContact CG2-CD2 4.28Å; T181-L186 HydrophobicContact CG2-CG 3.93Å; D182-L186 PolarHBondContact O-N 3.32Å; P183-L186 PolarHBondContact O-N 2.81Å; R184-L186 VanDerWaalsContact C-N 3.34Å; L186-F189 PolarHBondContact O-N 2.76Å; L186-A190 WeakPolarHBondContact O-CB 3.47Å; L186-A190 PolarHBondContact O-N 3.06Å; L186-H237 WeakPolarHBondContact CD1-CE1 3.3Å; L186-H237 VanDerWaalsContact CD1-ND1 3.34Å; L186-H237 WeakPolarHBondContact CD1-ND1 3.17Å; L186-M240 HydrophobicContact CD1-CB 4.03Å; L186-M240 HydrophobicContact CD2-CB 4.12Å; L186-I241 HydrophobicContact CD1-CG1 4.12Å; L186-R244 HydrophobicContact CD2-CB 4.26Å; L186-R244 HydrophobicContact CD2-CG 4.47Å
187E94.1Very high83.6Confident64 Ų6475.3 Ų75.330%0.29938%0.379SS..Hα-helixtrans-62.8-50.4175.1-72.1169.8-164.300111.1R34 P183 R184 E185 F189 A190 D191 L233R34-E187 IonicContact CZ-OE1 2.76Å; R34-E187 IonicContact NH1-OE1 2.86Å; R34-E187 PolarHBondContact NH1-OE1 3.44Å; P183-E187 WeakPolarHBondContact O-CG 3.3Å; P183-E187 PolarHBondContact O-N 3.35Å; P183-E187 VanDerWaalsContact O-N 3.13Å; R184-E187 PolarHBondContact O-N 2.74Å; E185-E187 VanDerWaalsContact C-N 3.31Å; E187-F189 VanDerWaalsContact C-N 3.32Å; E187-F189 PolarHBondContact O-N 2.6Å; E187-A190 PolarHBondContact O-N 2.88Å; E187-D191 PolarHBondContact O-N 2.98Å; E187-L233 HydrophobicContact CB-CD1 4.3Å; E187-L233 HydrophobicContact CG-CD1 3.62Å; E187-L233 HydrophobicContact CG-CD2 4.23Å
188S94.1Very high86Confident83 Ų8375.3 Ų75.358%0.5837%0.37SS*.Hα-helixtrans-58.7-42.1175.5-177.10000112.2R184 E185 H192R184-S188 WeakPolarHBondContact O-CB 3.27Å; R184-S188 PolarHBondContact O-N 3.29Å; E185-S188 PolarHBondContact O-N 2.93Å; S188-H192 VanDerWaalsContact O-CB 3.27Å; S188-H192 WeakPolarHBondContact O-CB 3.49Å; S188-H192 PolarHBondContact O-N 3.3Å
189F96.7Very high88.2Confident21 Ų2174.7 Ų74.79%0.09236%0.364CS..Hα-helixtrans-66.6-44.9178176.5-93.3000111.7E185 L186 E187 D191 H192 F193 F230 R244 L247E185-F189 VanDerWaalsContact O-CB 3.3Å; E185-F189 WeakPolarHBondContact O-CB 3.42Å; E185-F189 PolarHBondContact O-N 3.43Å; L186-F189 PolarHBondContact O-N 2.76Å; E187-F189 VanDerWaalsContact C-N 3.32Å; E187-F189 PolarHBondContact O-N 2.6Å; F189-D191 VanDerWaalsContact C-N 3.33Å; F189-D191 PolarHBondContact O-N 3.26Å; F189-H192 PolarHBondContact O-N 3.26Å; F189-F193 HydrophobicContact CE1-CB 4.3Å; F189-F193 HydrophobicContact CZ-CB 4.46Å; F189-F193 HydrophobicContact CZ-CD2 4.48Å; F189-F193 WeakPolarHBondContact O-CB 3.37Å; F189-F193 PolarHBondContact O-N 3.08Å; F189-F230 AromaticContact CD1-CE1 3.8Å; F189-F230 HydrophobicContact CD1-CE1 3.8Å; F189-F230 AromaticContact CD1-CZ 3.59Å; F189-F230 HydrophobicContact CD1-CZ 3.59Å; F189-F230 AromaticContact CE1-CE1 3.68Å; F189-F230 HydrophobicContact CE1-CE1 3.68Å; F189-F230 AromaticContact CE1-CZ 3.47Å; F189-F230 HydrophobicContact CE1-CZ 3.47Å; F189-F230 VanDerWaalsContact CE1-CZ 3.47Å; F189-R244 HydrophobicContact CD1-CG 4.05Å; F189-R244 HydrophobicContact CD2-CG 4.43Å; F189-R244 HydrophobicContact CE1-CG 4.12Å; F189-R244 HydrophobicContact CE2-CG 4.49Å; F189-R244 HydrophobicContact CG-CG 4.21Å; F189-R244 HydrophobicContact CZ-CG 4.34Å; F189-L247 HydrophobicContact CE1-CB 4.13Å; F189-L247 HydrophobicContact CZ-CB 4.08Å
190A96.8Very high89.8Confident0 Ų072.2 Ų72.20%035%0.345CS..Hα-helixtrans-61.8-41.8179.900000111.7L186 E187 K194 F230 L233L186-A190 WeakPolarHBondContact O-CB 3.47Å; L186-A190 PolarHBondContact O-N 3.06Å; E187-A190 PolarHBondContact O-N 2.88Å; A190-K194 VanDerWaalsContact O-CB 3.3Å; A190-K194 WeakPolarHBondContact O-CB 3.34Å; A190-K194 PolarHBondContact O-N 3.36Å; A190-F230 HydrophobicContact CB-CD1 4.42Å; A190-F230 HydrophobicContact CB-CE1 4.06Å; A190-L233 HydrophobicContact CB-CD2 3.76Å; A190-L233 HydrophobicContact CB-CG 4.29Å
191D95.4Very high91.3Very high77 Ų7767.2 Ų67.241%0.41234%0.339SS..Hα-helixtrans-67.9-44.9175.8-84.1-21.9000112.1E187 F189 K194 Q195E187-D191 PolarHBondContact O-N 2.98Å; F189-D191 VanDerWaalsContact C-N 3.33Å; F189-D191 PolarHBondContact O-N 3.26Å; D191-K194 PolarHBondContact O-N 3.03Å; D191-Q195 WeakPolarHBondContact O-CB 3.46Å; D191-Q195 VanDerWaalsContact O-CG 3.26Å; D191-Q195 WeakPolarHBondContact O-CG 3.32Å; D191-Q195 PolarHBondContact O-N 3.41Å
192H95.6Very high92.1Very high73 Ų7367.5 Ų67.534%0.33834%0.34SS..Hα-helixtrans-60.8-47.7176.1175.2-114.5000111.9S188 F189 K194 Q195 R196S188-H192 VanDerWaalsContact O-CB 3.27Å; S188-H192 WeakPolarHBondContact O-CB 3.49Å; S188-H192 PolarHBondContact O-N 3.3Å; F189-H192 PolarHBondContact O-N 3.26Å; H192-K194 VanDerWaalsContact C-N 3.33Å; H192-K194 PolarHBondContact O-N 3Å; H192-Q195 PolarHBondContact O-N 3.05Å; H192-R196 PolarHBondContact NE2-NE 3.45Å; H192-R196 WeakPolarHBondContact O-CB 3.09Å; H192-R196 WeakPolarHBondContact O-CG 3.26Å; H192-R196 PolarHBondContact O-N 2.93Å
193F97.4Very high92.8Very high0 Ų068.6 Ų68.60%035%0.349CS..Hα-helixtrans-55.2-48.2175.3173.3-91.1000111.4F189 R196 R197 V207 I227 E231 L247 W250 L251F189-F193 HydrophobicContact CE1-CB 4.3Å; F189-F193 HydrophobicContact CZ-CB 4.46Å; F189-F193 HydrophobicContact CZ-CD2 4.48Å; F189-F193 WeakPolarHBondContact O-CB 3.37Å; F189-F193 PolarHBondContact O-N 3.08Å; F193-R196 PolarHBondContact O-N 3.47Å; F193-R197 VanDerWaalsContact O-CB 3.3Å; F193-R197 WeakPolarHBondContact O-CB 3.3Å; F193-R197 PolarHBondContact O-N 3.4Å; F193-V207 HydrophobicContact CZ-CG1 3.88Å; F193-V207 HydrophobicContact CZ-CG2 4.41Å; F193-I227 HydrophobicContact CE1-CG2 4.15Å; F193-E231 HydrophobicContact CD1-CG 4.2Å; F193-E231 HydrophobicContact CE1-CG 4.36Å; F193-L247 HydrophobicContact CD2-CB 4.04Å; F193-L247 HydrophobicContact CE2-CB 3.8Å; F193-L247 HydrophobicContact CE2-CD2 4.04Å; F193-L247 HydrophobicContact CE2-CG 4.33Å; F193-L247 HydrophobicContact CZ-CB 4.43Å; F193-L247 HydrophobicContact CZ-CD1 4.41Å; F193-L247 HydrophobicContact CZ-CD2 3.94Å; F193-L247 HydrophobicContact CZ-CG 4.5Å; F193-W250 AromaticContact CE2-CE3 3.64Å; F193-W250 HydrophobicContact CE2-CE3 3.64Å; F193-W250 AromaticContact CE2-CZ3 3.83Å; F193-W250 HydrophobicContact CE2-CZ3 3.83Å; F193-W250 HydrophobicContact CZ-CE3 4.19Å; F193-W250 HydrophobicContact CZ-CZ3 4.14Å; F193-L251 HydrophobicContact CD2-CB 4.36Å; F193-L251 HydrophobicContact CD2-CD2 4.35Å
194K96.8Very high93.4Very high75 Ų7568.3 Ų68.333%0.32634%0.344SS..Hα-helixtrans-61.5-47.3178.8-179.9-177.4-179.9-177.80111.7A190 D191 H192 R197 I198 E231A190-K194 VanDerWaalsContact O-CB 3.3Å; A190-K194 WeakPolarHBondContact O-CB 3.34Å; A190-K194 PolarHBondContact O-N 3.36Å; D191-K194 PolarHBondContact O-N 3.03Å; H192-K194 VanDerWaalsContact C-N 3.33Å; H192-K194 PolarHBondContact O-N 3Å; K194-R197 PolarHBondContact O-N 3.19Å; K194-I198 HydrophobicContact CG-CD1 3.92Å; K194-I198 VanDerWaalsContact O-CG1 3.25Å; K194-I198 WeakPolarHBondContact O-CG1 3.5Å; K194-I198 PolarHBondContact O-N 2.59Å; K194-E231 WeakPolarHBondContact CA-OE1 3.41Å; K194-E231 HydrophobicContact CB-CG 4.15Å; K194-E231 HydrophobicContact CD-CB 4.36Å; K194-E231 HydrophobicContact CG-CG 4.45Å
195Q94.6Very high93.6Very high127 Ų12761.5 Ų61.559%0.59333%0.325SS*.Hα-helixtrans-59.8-48178.6-73.3173.51700111.2D191 H192 I198 K199D191-Q195 WeakPolarHBondContact O-CB 3.46Å; D191-Q195 VanDerWaalsContact O-CG 3.26Å; D191-Q195 WeakPolarHBondContact O-CG 3.32Å; D191-Q195 PolarHBondContact O-N 3.41Å; H192-Q195 PolarHBondContact O-N 3.05Å; Q195-I198 PolarHBondContact O-N 2.88Å; Q195-K199 WeakPolarHBondContact O-CB 3.3Å; Q195-K199 PolarHBondContact O-N 2.97Å
196R93.9Very high93.7Very high80 Ų8059.8 Ų59.830%0.30232%0.319SS..Hα-helixtrans-66.6-42.4-179.7-67-57.1-173.9128-5.5112.5H192 F193 I198 K199 L200 L251 E255H192-R196 PolarHBondContact NE2-NE 3.45Å; H192-R196 WeakPolarHBondContact O-CB 3.09Å; H192-R196 WeakPolarHBondContact O-CG 3.26Å; H192-R196 PolarHBondContact O-N 2.93Å; F193-R196 PolarHBondContact O-N 3.47Å; R196-I198 VanDerWaalsContact C-N 3.34Å; R196-I198 PolarHBondContact O-N 3.01Å; R196-K199 WeakPolarHBondContact O-CB 3.35Å; R196-K199 PolarHBondContact O-N 2.98Å; R196-K199 VanDerWaalsContact O-N 3.16Å; R196-L200 WeakPolarHBondContact O-CB 3.35Å; R196-L200 VanDerWaalsContact O-CG 3.3Å; R196-L200 WeakPolarHBondContact O-CG 3.45Å; R196-L200 PolarHBondContact O-N 3.4Å; R196-L251 HydrophobicContact CB-CD1 3.54Å; R196-L251 HydrophobicContact CB-CD2 4.4Å; R196-L251 HydrophobicContact CG-CD1 4.33Å; R196-L251 HydrophobicContact CG-CD2 4.48Å; R196-E255 WeakPolarHBondContact CD-OE1 3.42Å; R196-E255 VanDerWaalsContact CG-OE1 3.26Å; R196-E255 WeakPolarHBondContact CG-OE1 3.45Å; R196-E255 IonicContact CZ-OE1 2.6Å; R196-E255 VanDerWaalsContact CZ-OE1 3.24Å; R196-E255 IonicContact NE-OE1 3.35Å; R196-E255 PolarHBondContact NE-OE1 3.15Å; R196-E255 IonicContact NH1-OE1 3.62Å; R196-E255 PolarHBondContact NH1-OE1 3.01Å; R196-E255 IonicContact NH1-OE2 3.06Å
197R95Very high93.7Very high15 Ų1559.6 Ų59.66%0.05732%0.319CS..Hα-helixtrans-57.4-46.8174.5-173.7-153.263.1-154.7-13.3111.8F193 K194 K199 L200 G201 V202 V207 E231 W250F193-R197 VanDerWaalsContact O-CB 3.3Å; F193-R197 WeakPolarHBondContact O-CB 3.3Å; F193-R197 PolarHBondContact O-N 3.4Å; K194-R197 PolarHBondContact O-N 3.19Å; R197-K199 VanDerWaalsContact C-N 3.34Å; R197-L200 PolarHBondContact O-N 2.96Å; R197-G201 PolarHBondContact O-N 3.22Å; R197-V202 WeakPolarHBondContact CD-O 3.37Å; R197-V202 HydrophobicContact CG-CB 3.94Å; R197-V202 HydrophobicContact CG-CG1 4.36Å; R197-V202 VanDerWaalsContact CG-O 3.28Å; R197-V202 WeakPolarHBondContact CG-O 3.41Å; R197-V202 PolarHBondContact NE-O 3.44Å; R197-V202 PolarHBondContact O-N 3.4Å; R197-V202 VanDerWaalsContact O-N 3.11Å; R197-V207 VanDerWaalsContact CD-CG2 3.42Å; R197-V207 HydrophobicContact CG-CG2 3.64Å; R197-E231 VanDerWaalsContact CZ-CD 3.46Å; R197-E231 IonicContact CZ-OE1 2.88Å; R197-E231 IonicContact CZ-OE2 2.93Å; R197-E231 IonicContact NE-OE1 3.88Å; R197-E231 IonicContact NH1-OE1 3.01Å; R197-E231 PolarHBondContact NH1-OE1 2.81Å; R197-E231 IonicContact NH1-OE2 3.86Å; R197-E231 PolarHBondContact NH1-OE2 2.82Å; R197-E231 IonicContact NH2-OE1 3.6Å; R197-E231 PolarHBondContact NH2-OE1 3.35Å; R197-E231 IonicContact NH2-OE2 3.39Å; R197-E231 PolarHBondContact NH2-OE2 3.48Å; R197-W250 HydrophobicContact CG-CH2 4.17Å; R197-W250 HydrophobicContact CG-CZ3 4.47Å
198I91.2Very high93.6Very high103 Ų10356.6 Ų56.653%0.52831%0.305SS..Hα-helixtrans-62.2-43.5176.9-66.7166.8000110.3K194 Q195 R196 L200 G201K194-I198 HydrophobicContact CG-CD1 3.92Å; K194-I198 VanDerWaalsContact O-CG1 3.25Å; K194-I198 WeakPolarHBondContact O-CG1 3.5Å; K194-I198 PolarHBondContact O-N 2.59Å; Q195-I198 PolarHBondContact O-N 2.88Å; R196-I198 VanDerWaalsContact C-N 3.34Å; R196-I198 PolarHBondContact O-N 3.01Å; I198-L200 VanDerWaalsContact C-N 3.29Å; I198-L200 PolarHBondContact O-N 3.37Å; I198-G201 PolarHBondContact O-N 3.39Å
199K89.9Confident93.3Very high168 Ų16858.8 Ų58.873%0.7330%0.304SS*.Hα-helixtrans-62.1-34177.5-172.8173.4-177.3174.70113.2Q195 R196 R197 G201Q195-K199 WeakPolarHBondContact O-CB 3.3Å; Q195-K199 PolarHBondContact O-N 2.97Å; R196-K199 WeakPolarHBondContact O-CB 3.35Å; R196-K199 PolarHBondContact O-N 2.98Å; R196-K199 VanDerWaalsContact O-N 3.16Å; R197-K199 VanDerWaalsContact C-N 3.34Å; K199-G201 PolarHBondContact O-N 2.85Å
200L89Confident92.9Very high54 Ų5459.2 Ų59.228%0.28331%0.311SS..THydrogen-bonded Turntrans-77.2-5.1174.1-67.8171.8000113.2R196 R197 I198 V202 A254 A258R196-L200 WeakPolarHBondContact O-CB 3.35Å; R196-L200 VanDerWaalsContact O-CG 3.3Å; R196-L200 WeakPolarHBondContact O-CG 3.45Å; R196-L200 PolarHBondContact O-N 3.4Å; R197-L200 PolarHBondContact O-N 2.96Å; I198-L200 VanDerWaalsContact C-N 3.29Å; I198-L200 PolarHBondContact O-N 3.37Å; L200-V202 VanDerWaalsContact C-N 3.27Å; L200-V202 HydrophobicContact CB-CG2 3.89Å; L200-V202 PolarHBondContact O-N 3.4Å; L200-A254 HydrophobicContact CD1-CB 3.78Å; L200-A258 HydrophobicContact CD2-CB 3.4Å
201G89.2Confident92.5Very high65 Ų6559.3 Ų59.367%0.6731%0.312SS*.THydrogen-bonded Turntrans70.220.9-177.700000114R197 I198 K199R197-G201 PolarHBondContact O-N 3.22Å; I198-G201 PolarHBondContact O-N 3.39Å; K199-G201 PolarHBondContact O-N 2.85Å
202V90.6Very high91.9Very high38 Ų3857.7 Ų57.723%0.2331%0.309CS..  trans-94.5131.2-174.7-177.80000110.5R197 L200 D206 V207 W250R197-V202 WeakPolarHBondContact CD-O 3.37Å; R197-V202 HydrophobicContact CG-CB 3.94Å; R197-V202 HydrophobicContact CG-CG1 4.36Å; R197-V202 VanDerWaalsContact CG-O 3.28Å; R197-V202 WeakPolarHBondContact CG-O 3.41Å; R197-V202 PolarHBondContact NE-O 3.44Å; R197-V202 PolarHBondContact O-N 3.4Å; R197-V202 VanDerWaalsContact O-N 3.11Å; L200-V202 VanDerWaalsContact C-N 3.27Å; L200-V202 HydrophobicContact CB-CG2 3.89Å; L200-V202 PolarHBondContact O-N 3.4Å; V202-D206 HydrophobicContact CG1-CB 3.73Å; V202-V207 HydrophobicContact CG1-CG2 3.79Å; V202-W250 HydrophobicContact CB-CH2 4.28Å; V202-W250 HydrophobicContact CG1-CH2 4.05Å; V202-W250 HydrophobicContact CG1-CZ2 3.92Å; V202-W250 HydrophobicContact CG2-CH2 4.41Å; V202-W250 HydrophobicContact CG2-CZ2 4.46Å
203T94.5Very high91Very high74 Ų7460.4 Ų60.445%0.45433%0.326SS..  trans-77.9158.1175.878.70000111.5A205 D206 V207T203-A205 PolarHBondContact O-N 3Å; T203-A205 PolarHBondContact OG1-N 2.95Å; T203-D206 WeakPolarHBondContact CB-OD2 3.33Å; T203-D206 WeakPolarHBondContact CG2-OD2 3.28Å; T203-D206 PolarHBondContact O-N 3.22Å; T203-D206 PolarHBondContact OG1-N 3.35Å; T203-D206 VanDerWaalsContact OG1-N 3.15Å; T203-D206 PolarHBondContact OG1-OD2 3.04Å; T203-V207 PolarHBondContact O-N 2.92Å
204Q94.3Very high89.8Confident41 Ų4161.8 Ų61.819%0.19233%0.333CS..Hα-helixtrans-59.6-31.8177.2-26.3-169.4-72.400112.3G208 Q224 I227 E231Q204-G208 PolarHBondContact O-N 2.94Å; Q204-Q224 HydrophobicContact CB-CG 3.94Å; Q204-I227 HydrophobicContact CB-CB 4.12Å; Q204-I227 HydrophobicContact CB-CG2 3.91Å; Q204-E231 PolarHBondContact NE2-OE2 3.39Å
205A93Very high88.4Confident34 Ų3467.3 Ų67.328%0.28136%0.357SS..Hα-helixtrans-69.1-38.3175.200000111.4T203 G208 K209 Q224T203-A205 PolarHBondContact O-N 3Å; T203-A205 PolarHBondContact OG1-N 2.95Å; A205-G208 PolarHBondContact O-N 3.17Å; A205-K209 VanDerWaalsContact O-CG 3.3Å; A205-K209 WeakPolarHBondContact O-CG 3.25Å; A205-K209 PolarHBondContact O-N 3.13Å; A205-Q224 HydrophobicContact CB-CB 4.18Å
206D92.8Very high87.3Confident60 Ų6063.8 Ų63.832%0.32134%0.342SS..Hα-helixtrans-71.6-34.8-179.8-59.5-35000112.2V202 T203 K209 A210V202-D206 HydrophobicContact CG1-CB 3.73Å; T203-D206 WeakPolarHBondContact CB-OD2 3.33Å; T203-D206 WeakPolarHBondContact CG2-OD2 3.28Å; T203-D206 PolarHBondContact O-N 3.22Å; T203-D206 PolarHBondContact OG1-N 3.35Å; T203-D206 VanDerWaalsContact OG1-N 3.15Å; T203-D206 PolarHBondContact OG1-OD2 3.04Å; D206-K209 PolarHBondContact O-N 3.34Å; D206-K209 IonicContact OD1-NZ 2.95Å; D206-K209 PolarHBondContact OD1-NZ 3.44Å; D206-A210 WeakPolarHBondContact O-CB 3.42Å; D206-A210 PolarHBondContact O-N 2.88Å
207V93.5Very high85.9Confident0 Ų065.4 Ų65.40%036%0.363CS..Hα-helixtrans-55.4-53.6166.4178.60000110.1F193 R197 V202 T203 K209 A210 L211 I227 L247 W250F193-V207 HydrophobicContact CZ-CG1 3.88Å; F193-V207 HydrophobicContact CZ-CG2 4.41Å; R197-V207 VanDerWaalsContact CD-CG2 3.42Å; R197-V207 HydrophobicContact CG-CG2 3.64Å; V202-V207 HydrophobicContact CG1-CG2 3.79Å; T203-V207 PolarHBondContact O-N 2.92Å; V207-K209 PolarHBondContact O-N 2.84Å; V207-A210 PolarHBondContact O-N 2.91Å; V207-A210 VanDerWaalsContact O-N 3.12Å; V207-L211 HydrophobicContact CG1-CD1 4.09Å; V207-L211 HydrophobicContact CG1-CG 4.34Å; V207-L211 VanDerWaalsContact O-CG 3.31Å; V207-L211 WeakPolarHBondContact O-CG 3.36Å; V207-L211 PolarHBondContact O-N 3.26Å; V207-I227 HydrophobicContact CB-CG1 4.42Å; V207-I227 HydrophobicContact CG1-CD1 3.91Å; V207-I227 HydrophobicContact CG1-CG1 4.28Å; V207-L247 HydrophobicContact CG1-CD2 4.29Å; V207-W250 HydrophobicContact CB-CZ2 4.36Å; V207-W250 HydrophobicContact CG1-CD2 4.09Å; V207-W250 HydrophobicContact CG1-CE3 4.19Å; V207-W250 HydrophobicContact CG1-CZ2 4.44Å; V207-W250 HydrophobicContact CG1-CZ3 4.4Å; V207-W250 HydrophobicContact CG2-CH2 3.6Å; V207-W250 HydrophobicContact CG2-CZ2 3.82Å; V207-W250 HydrophobicContact CG2-CZ3 4.01Å
208G91.9Very high84.5Confident1 Ų169 Ų691%0.0141%0.405CS..Hα-helixtrans-58-35.4-177.900000113.5Q204 A205 S221 L222Q204-G208 PolarHBondContact O-N 2.94Å; A205-G208 PolarHBondContact O-N 3.17Å; G208-S221 WeakPolarHBondContact O-CA 3.47Å; G208-L222 CarbonylContact C-O 3.47Å; G208-L222 WeakPolarHBondContact CA-O 3.41Å; G208-L222 PolarHBondContact O-N 2.93Å
209K87.2Confident83.4Confident128 Ų12865.6 Ų65.656%0.55739%0.389SS*.Hα-helixtrans-72.1-48.7173.1-65.9168.3-162.3161.70111.8A205 D206 V207 L211 A212A205-K209 VanDerWaalsContact O-CG 3.3Å; A205-K209 WeakPolarHBondContact O-CG 3.25Å; A205-K209 PolarHBondContact O-N 3.13Å; D206-K209 PolarHBondContact O-N 3.34Å; D206-K209 IonicContact OD1-NZ 2.95Å; D206-K209 PolarHBondContact OD1-NZ 3.44Å; V207-K209 PolarHBondContact O-N 2.84Å; K209-L211 VanDerWaalsContact C-N 3.26Å; K209-L211 PolarHBondContact O-N 2.93Å; K209-A212 VanDerWaalsContact O-CB 3.32Å; K209-A212 WeakPolarHBondContact O-CB 3.49Å; K209-A212 PolarHBondContact O-N 2.98Å
210A88.6Confident82.8Confident31 Ų3159 Ų5926%0.25637%0.369SS..Hα-helixtrans-63.6-32.2-176.200000112.4D206 V207 A212 N213 L214 W250D206-A210 WeakPolarHBondContact O-CB 3.42Å; D206-A210 PolarHBondContact O-N 2.88Å; V207-A210 PolarHBondContact O-N 2.91Å; V207-A210 VanDerWaalsContact O-N 3.12Å; A210-A212 PolarHBondContact O-N 2.95Å; A210-N213 WeakPolarHBondContact O-CB 3.46Å; A210-N213 PolarHBondContact O-N 3.16Å; A210-L214 PolarHBondContact O-N 3.31Å; A210-W250 VanDerWaalsContact CB-NE1 3.27Å
211L88.6Confident82.4Confident1 Ų158.9 Ų58.91%0.00537%0.372CS..Hα-helixtrans-57.2-32.6172.6-76172000113.5V207 K209 N213 L214 L222 I227 I246 L247 W250V207-L211 HydrophobicContact CG1-CD1 4.09Å; V207-L211 HydrophobicContact CG1-CG 4.34Å; V207-L211 VanDerWaalsContact O-CG 3.31Å; V207-L211 WeakPolarHBondContact O-CG 3.36Å; V207-L211 PolarHBondContact O-N 3.26Å; K209-L211 VanDerWaalsContact C-N 3.26Å; K209-L211 PolarHBondContact O-N 2.93Å; L211-N213 PolarHBondContact O-N 3.43Å; L211-L214 HydrophobicContact CD2-CD1 3.76Å; L211-L214 PolarHBondContact O-N 2.94Å; L211-L222 HydrophobicContact CD1-CB 4.03Å; L211-L222 HydrophobicContact CD1-CD1 3.46Å; L211-L222 VanDerWaalsContact CD1-CD1 3.46Å; L211-L222 HydrophobicContact CD1-CG 3.76Å; L211-I227 HydrophobicContact CD1-CD1 4.25Å; L211-I246 HydrophobicContact CD1-CG2 4.47Å; L211-I246 HydrophobicContact CD2-CG2 3.69Å; L211-L247 HydrophobicContact CD1-CD2 3.78Å; L211-W250 HydrophobicContact CD2-CB 3.53Å; L211-W250 HydrophobicContact CD2-CG 3.89Å; L211-W250 HydrophobicContact CG-CB 4.49Å; L211-W250 HydrophobicContact CG-CG 4.37Å
212A81.9Confident82.4Confident43 Ų4357.6 Ų57.636%0.35535%0.35SS..Hα-helixtrans-67.6-25.5175.800000112.6K209 A210K209-A212 VanDerWaalsContact O-CB 3.32Å; K209-A212 WeakPolarHBondContact O-CB 3.49Å; K209-A212 PolarHBondContact O-N 2.98Å; A210-A212 PolarHBondContact O-N 2.95Å
213N76.9Confident82.5Confident130 Ų13058.5 Ų58.570%0.69536%0.358SS*.Hα-helixtrans-81.8-18.9-179.6-62.3-18.6000112.6A210 L211 K215A210-N213 WeakPolarHBondContact O-CB 3.46Å; A210-N213 PolarHBondContact O-N 3.16Å; L211-N213 PolarHBondContact O-N 3.43Å; N213-K215 PolarHBondContact O-N 2.87Å; N213-K215 VanDerWaalsContact O-N 3.13Å
214L73.1Confident82.4Confident30 Ų3059.5 Ų59.516%0.15736%0.358CS..THydrogen-bonded Turntrans-68.1-7.8179.5-64.8-176.4000114A210 L211 L216 W250 Q253A210-L214 PolarHBondContact O-N 3.31Å; L211-L214 HydrophobicContact CD2-CD1 3.76Å; L211-L214 PolarHBondContact O-N 2.94Å; L214-L216 HydrophobicContact CB-CD1 4.44Å; L214-L216 HydrophobicContact CB-CG 4.13Å; L214-L216 HydrophobicContact CD1-CD1 4.44Å; L214-L216 PolarHBondContact O-N 3.36Å; L214-W250 HydrophobicContact CD1-CB 3.63Å; L214-W250 HydrophobicContact CD1-CG 4.16Å; L214-Q253 HydrophobicContact CD2-CB 4.48Å; L214-Q253 HydrophobicContact CD2-CG 4.48Å
215K66.9Low82.5Confident190 Ų19060 Ų6083%0.82637%0.366SS*.  trans47.428.9178.6-66.9180177179.80114N213N213-K215 PolarHBondContact O-N 2.87Å; N213-K215 VanDerWaalsContact O-N 3.13Å
216L70.9Confident82.6Confident54 Ų5460.2 Ų60.228%0.28336%0.363SS..  trans-66.2123.6172.9-65.5175000108L214 G218 V219 A249L214-L216 HydrophobicContact CB-CD1 4.44Å; L214-L216 HydrophobicContact CB-CG 4.13Å; L214-L216 HydrophobicContact CD1-CD1 4.44Å; L214-L216 PolarHBondContact O-N 3.36Å; L216-G218 PolarHBondContact O-N 3.38Å; L216-V219 HydrophobicContact CB-CB 3.98Å; L216-V219 HydrophobicContact CB-CG2 3.82Å; L216-V219 HydrophobicContact CD1-CG2 4.49Å; L216-V219 PolarHBondContact O-N 2.86Å; L216-V219 VanDerWaalsContact O-N 3.08Å; L216-A249 HydrophobicContact CD1-CB 4.3Å
217P66.1Low82.7Confident113 Ų11357.4 Ų57.473%0.73435%0.348SS*.THydrogen-bonded Turntrans-58.4127.1-177.722.3-31.5000110V219P217-V219 VanDerWaalsContact C-N 3.34Å; P217-V219 PolarHBondContact O-N 3.5Å
218G64.4Low82.9Confident90 Ų9059.8 Ų59.893%0.92836%0.364SS*.THydrogen-bonded Turntrans86.4-10.1-18000000116L216L216-G218 PolarHBondContact O-N 3.38Å
219V68.7Low83.1Confident33 Ų3366 Ų6620%0.239%0.388CS..  trans-97.3113.5178.7-175.50000110L216 P217 I246L216-V219 HydrophobicContact CB-CB 3.98Å; L216-V219 HydrophobicContact CB-CG2 3.82Å; L216-V219 HydrophobicContact CD1-CG2 4.49Å; L216-V219 PolarHBondContact O-N 2.86Å; L216-V219 VanDerWaalsContact O-N 3.08Å; P217-V219 VanDerWaalsContact C-N 3.34Å; P217-V219 PolarHBondContact O-N 3.5Å; V219-I246 HydrophobicContact CG1-CD1 4.11Å; V219-I246 HydrophobicContact CG1-CG1 4.46Å; V219-I246 HydrophobicContact CG1-CG2 3.62Å; V219-I246 HydrophobicContact CG2-CD1 3.63Å; V219-I246 HydrophobicContact CG2-CG1 3.83Å; V219-I246 HydrophobicContact CG2-CG2 4.42Å
220G76Confident83.6Confident30 Ų3060 Ų6031%0.30936%0.362SS..  trans-88-17617200000112.8L222G220-L222 PolarHBondContact O-N 3.26Å
221S82.4Confident84Confident51 Ų5159.1 Ų59.136%0.35735%0.352SS..PPolyproline II helixtrans-58.8129165.936.30000110.4G208G208-S221 WeakPolarHBondContact O-CA 3.47Å
222L89.1Confident84.4Confident37 Ų3761.3 Ų61.319%0.19437%0.367CS..PPolyproline II helixtrans-87.2152.9170-62.3-173.5000109.9G208 L211 G220 T226 I227 L243 L247G208-L222 CarbonylContact C-O 3.47Å; G208-L222 WeakPolarHBondContact CA-O 3.41Å; G208-L222 PolarHBondContact O-N 2.93Å; L211-L222 HydrophobicContact CD1-CB 4.03Å; L211-L222 HydrophobicContact CD1-CD1 3.46Å; L211-L222 VanDerWaalsContact CD1-CD1 3.46Å; L211-L222 HydrophobicContact CD1-CG 3.76Å; G220-L222 PolarHBondContact O-N 3.26Å; L222-T226 HydrophobicContact CD1-CG2 4.43Å; L222-T226 HydrophobicContact CD2-CG2 4.5Å; L222-I227 HydrophobicContact CB-CD1 4.23Å; L222-I227 HydrophobicContact CD1-CD1 4.05Å; L222-L243 HydrophobicContact CD1-CD2 3.58Å; L222-L243 HydrophobicContact CD2-CD2 4.26Å; L222-L247 HydrophobicContact CD1-CD2 4.45Å
223S91.9Very high85Confident58 Ų5861.7 Ų61.741%0.40636%0.363SS..PPolyproline II helixtrans-83.8154.1177.378.50000111.4S225 T226 I227S223-S225 PolarHBondContact O-N 3.45Å; S223-S225 PolarHBondContact OG-N 3.46Å; S223-T226 WeakPolarHBondContact O-CA 3.3Å; S223-T226 VanDerWaalsContact O-CB 3.32Å; S223-T226 WeakPolarHBondContact O-CB 3.33Å; S223-T226 PolarHBondContact O-N 2.88Å; S223-T226 PolarHBondContact OG-N 3.5Å; S223-T226 PolarHBondContact OG-OG1 2.99Å; S223-I227 PolarHBondContact O-N 3.45Å; S223-I227 VanDerWaalsContact O-N 3.14Å
224Q93.1Very high85.9Confident95 Ų9558.7 Ų58.744%0.44435%0.35SS..Hα-helixtrans-52.9-41.1169.6172.1-88.1-25.100111.5Q204 A205 T226 I227 C228Q204-Q224 HydrophobicContact CB-CG 3.94Å; A205-Q224 HydrophobicContact CB-CB 4.18Å; Q224-T226 VanDerWaalsContact C-N 3.29Å; Q224-T226 PolarHBondContact O-N 3.01Å; Q224-I227 PolarHBondContact O-N 2.88Å; Q224-C228 WeakPolarHBondContact O-CB 3.16Å; Q224-C228 PolarHBondContact O-N 3.27Å
225S95.3Very high86.8Confident52 Ų5258.9 Ų58.936%0.36435%0.351SS..Hα-helixtrans-60.4-38.5176.6-174.90000112.1S223 C228 R229S223-S225 PolarHBondContact O-N 3.45Å; S223-S225 PolarHBondContact OG-N 3.46Å; S225-C228 PolarHBondContact O-N 3.24Å; S225-R229 WeakPolarHBondContact O-CB 3.48Å; S225-R229 VanDerWaalsContact O-CG 3.29Å; S225-R229 WeakPolarHBondContact O-CG 3.35Å; S225-R229 PolarHBondContact O-N 3.26Å
226T95.5Very high88.1Confident38 Ų3853 Ų5323%0.23333%0.333CS..Hα-helixtrans-63-48.2176.1-52.10000111.2L222 S223 Q224 C228 R229 F230 L235 L243L222-T226 HydrophobicContact CD1-CG2 4.43Å; L222-T226 HydrophobicContact CD2-CG2 4.5Å; S223-T226 WeakPolarHBondContact O-CA 3.3Å; S223-T226 VanDerWaalsContact O-CB 3.32Å; S223-T226 WeakPolarHBondContact O-CB 3.33Å; S223-T226 PolarHBondContact O-N 2.88Å; S223-T226 PolarHBondContact OG-N 3.5Å; S223-T226 PolarHBondContact OG-OG1 2.99Å; Q224-T226 VanDerWaalsContact C-N 3.29Å; Q224-T226 PolarHBondContact O-N 3.01Å; T226-C228 PolarHBondContact O-N 3.38Å; T226-R229 PolarHBondContact O-N 3.26Å; T226-F230 PolarHBondContact O-N 2.94Å; T226-L235 HydrophobicContact CG2-CD1 4.39Å; T226-L243 HydrophobicContact CG2-CD1 3.9Å
227I95.7Very high89.1Confident1 Ų152.9 Ų52.91%0.00533%0.331CS..Hα-helixtrans-62.8-43.5177.9-56-56000110.6F193 Q204 V207 L211 L222 S223 Q224 R229 F230 E231 L247F193-I227 HydrophobicContact CE1-CG2 4.15Å; Q204-I227 HydrophobicContact CB-CB 4.12Å; Q204-I227 HydrophobicContact CB-CG2 3.91Å; V207-I227 HydrophobicContact CB-CG1 4.42Å; V207-I227 HydrophobicContact CG1-CD1 3.91Å; V207-I227 HydrophobicContact CG1-CG1 4.28Å; L211-I227 HydrophobicContact CD1-CD1 4.25Å; L222-I227 HydrophobicContact CB-CD1 4.23Å; L222-I227 HydrophobicContact CD1-CD1 4.05Å; S223-I227 PolarHBondContact O-N 3.45Å; S223-I227 VanDerWaalsContact O-N 3.14Å; Q224-I227 PolarHBondContact O-N 2.88Å; I227-R229 VanDerWaalsContact C-N 3.35Å; I227-R229 PolarHBondContact O-N 3.22Å; I227-F230 WeakPolarHBondContact O-CB 3.24Å; I227-F230 PolarHBondContact O-N 3.12Å; I227-F230 VanDerWaalsContact O-N 3.16Å; I227-E231 WeakPolarHBondContact O-CG 3.47Å; I227-E231 PolarHBondContact O-N 3Å; I227-L247 HydrophobicContact CD1-CD2 3.78Å
228C96.7Very high90.3Very high49 Ų4952.1 Ų52.133%0.33132%0.321SS..Hα-helixtrans-59.4-44.3176.6-176.20000112.4Q224 S225 T226 F230 E231 S232Q224-C228 WeakPolarHBondContact O-CB 3.16Å; Q224-C228 PolarHBondContact O-N 3.27Å; S225-C228 PolarHBondContact O-N 3.24Å; T226-C228 PolarHBondContact O-N 3.38Å; C228-F230 VanDerWaalsContact C-N 3.3Å; C228-F230 PolarHBondContact O-N 3.14Å; C228-E231 PolarHBondContact O-N 3.26Å; C228-S232 WeakPolarHBondContact O-CB 3.29Å; C228-S232 PolarHBondContact O-N 3.4Å; C228-S232 PolarHBondContact O-OG 3.08Å
229R97.2Very high91.6Very high133 Ų13351.9 Ų51.950%0.50230%0.298SS..Hα-helixtrans-66.9-32.9176.8-71-179.1-179.4-161.3-1.9112.6S225 T226 I227 S232 L233 T234 L235S225-R229 WeakPolarHBondContact O-CB 3.48Å; S225-R229 VanDerWaalsContact O-CG 3.29Å; S225-R229 WeakPolarHBondContact O-CG 3.35Å; S225-R229 PolarHBondContact O-N 3.26Å; T226-R229 PolarHBondContact O-N 3.26Å; I227-R229 VanDerWaalsContact C-N 3.35Å; I227-R229 PolarHBondContact O-N 3.22Å; R229-S232 WeakPolarHBondContact CA-OG 3.32Å; R229-S232 PolarHBondContact O-OG 2.96Å; R229-L233 PolarHBondContact O-N 3.13Å; R229-L233 VanDerWaalsContact O-N 3.09Å; R229-T234 VanDerWaalsContact CA-OG1 3.24Å; R229-T234 WeakPolarHBondContact CA-OG1 3.37Å; R229-T234 WeakPolarHBondContact CB-OG1 3.29Å; R229-T234 WeakPolarHBondContact CG-OG1 3.5Å; R229-T234 PolarHBondContact O-N 3.28Å; R229-T234 PolarHBondContact O-OG1 2.96Å; R229-L235 HydrophobicContact CB-CD1 4.33Å; R229-L235 HydrophobicContact CB-CD2 3.5Å; R229-L235 HydrophobicContact CB-CG 3.65Å; R229-L235 HydrophobicContact CG-CD2 4.26Å
230F97.1Very high92.8Very high2 Ų250.6 Ų50.61%0.00929%0.29CS..Hα-helixtrans-63.8-50.7173.6-174.1-78.9000112.1F189 A190 T226 I227 C228 S232 L233 L235 M240 L243 L247F189-F230 AromaticContact CD1-CE1 3.8Å; F189-F230 HydrophobicContact CD1-CE1 3.8Å; F189-F230 AromaticContact CD1-CZ 3.59Å; F189-F230 HydrophobicContact CD1-CZ 3.59Å; F189-F230 AromaticContact CE1-CE1 3.68Å; F189-F230 HydrophobicContact CE1-CE1 3.68Å; F189-F230 AromaticContact CE1-CZ 3.47Å; F189-F230 HydrophobicContact CE1-CZ 3.47Å; F189-F230 VanDerWaalsContact CE1-CZ 3.47Å; A190-F230 HydrophobicContact CB-CD1 4.42Å; A190-F230 HydrophobicContact CB-CE1 4.06Å; T226-F230 PolarHBondContact O-N 2.94Å; I227-F230 WeakPolarHBondContact O-CB 3.24Å; I227-F230 PolarHBondContact O-N 3.12Å; I227-F230 VanDerWaalsContact O-N 3.16Å; C228-F230 VanDerWaalsContact C-N 3.3Å; C228-F230 PolarHBondContact O-N 3.14Å; F230-S232 PolarHBondContact O-N 3.46Å; F230-L233 PolarHBondContact O-N 3.2Å; F230-L235 HydrophobicContact CB-CD1 4.33Å; F230-M240 HydrophobicContact CB-CE 3.96Å; F230-M240 HydrophobicContact CD2-CE 3.04Å; F230-M240 HydrophobicContact CD2-SD 4.46Å; F230-M240 HydrophobicContact CE2-CE 3.52Å; F230-M240 HydrophobicContact CG-CE 3.68Å; F230-M240 HydrophobicContact CZ-CE 4.5Å; F230-L243 HydrophobicContact CD2-CB 3.66Å; F230-L243 HydrophobicContact CD2-CD1 3.9Å; F230-L243 HydrophobicContact CD2-CG 4.45Å; F230-L243 HydrophobicContact CE2-CB 3.65Å; F230-L247 HydrophobicContact CB-CD1 4.36Å; F230-L247 HydrophobicContact CD1-CD1 3.47Å; F230-L247 VanDerWaalsContact CD1-CD1 3.47Å; F230-L247 HydrophobicContact CD2-CD1 3.46Å; F230-L247 VanDerWaalsContact CD2-CD1 3.46Å; F230-L247 HydrophobicContact CE1-CD1 3.53Å; F230-L247 HydrophobicContact CE2-CD1 3.57Å; F230-L247 HydrophobicContact CG-CD1 3.48Å; F230-L247 VanDerWaalsContact CG-CD1 3.48Å; F230-L247 HydrophobicContact CZ-CD1 3.62Å
231E97.4Very high93.7Very high11 Ų1152.1 Ų52.15%0.05129%0.291CS..Hα-helixtrans-67.9-21179.5-67.5-173.615500114.6F193 K194 R197 Q204 I227 C228F193-E231 HydrophobicContact CD1-CG 4.2Å; F193-E231 HydrophobicContact CE1-CG 4.36Å; K194-E231 WeakPolarHBondContact CA-OE1 3.41Å; K194-E231 HydrophobicContact CB-CG 4.15Å; K194-E231 HydrophobicContact CD-CB 4.36Å; K194-E231 HydrophobicContact CG-CG 4.45Å; R197-E231 VanDerWaalsContact CZ-CD 3.46Å; R197-E231 IonicContact CZ-OE1 2.88Å; R197-E231 IonicContact CZ-OE2 2.93Å; R197-E231 IonicContact NE-OE1 3.88Å; R197-E231 IonicContact NH1-OE1 3.01Å; R197-E231 PolarHBondContact NH1-OE1 2.81Å; R197-E231 IonicContact NH1-OE2 3.86Å; R197-E231 PolarHBondContact NH1-OE2 2.82Å; R197-E231 IonicContact NH2-OE1 3.6Å; R197-E231 PolarHBondContact NH2-OE1 3.35Å; R197-E231 IonicContact NH2-OE2 3.39Å; R197-E231 PolarHBondContact NH2-OE2 3.48Å; Q204-E231 PolarHBondContact NE2-OE2 3.39Å; I227-E231 WeakPolarHBondContact O-CG 3.47Å; I227-E231 PolarHBondContact O-N 3Å; C228-E231 PolarHBondContact O-N 3.26Å
232S96.1Very high94.1Very high47 Ų4752.3 Ų52.333%0.32930%0.296SS..THydrogen-bonded Turntrans-97.22.3174.855.30000113C228 R229 F230 T234C228-S232 WeakPolarHBondContact O-CB 3.29Å; C228-S232 PolarHBondContact O-N 3.4Å; C228-S232 PolarHBondContact O-OG 3.08Å; R229-S232 WeakPolarHBondContact CA-OG 3.32Å; R229-S232 PolarHBondContact O-OG 2.96Å; F230-S232 PolarHBondContact O-N 3.46Å; S232-T234 WeakPolarHBondContact O-CG2 3.3Å; S232-T234 PolarHBondContact O-N 2.9Å; S232-T234 PolarHBondContact OG-OG1 3.32Å
233L95Very high94.3Very high52 Ų5251.5 Ų51.527%0.27229%0.291SS..THydrogen-bonded Turntrans5633.1-179.9-58.2157.2000113.3E187 A190 R229 F230 M240E187-L233 HydrophobicContact CB-CD1 4.3Å; E187-L233 HydrophobicContact CG-CD1 3.62Å; E187-L233 HydrophobicContact CG-CD2 4.23Å; A190-L233 HydrophobicContact CB-CD2 3.76Å; A190-L233 HydrophobicContact CB-CG 4.29Å; R229-L233 PolarHBondContact O-N 3.13Å; R229-L233 VanDerWaalsContact O-N 3.09Å; F230-L233 PolarHBondContact O-N 3.2Å; L233-M240 HydrophobicContact CD2-SD 4.27Å
234T95.6Very high94.4Very high67 Ų6751.9 Ų51.941%0.41128%0.284SS..  trans-100.84.6-176.954.50000112.9R229 S232R229-T234 VanDerWaalsContact CA-OG1 3.24Å; R229-T234 WeakPolarHBondContact CA-OG1 3.37Å; R229-T234 WeakPolarHBondContact CB-OG1 3.29Å; R229-T234 WeakPolarHBondContact CG-OG1 3.5Å; R229-T234 PolarHBondContact O-N 3.28Å; R229-T234 PolarHBondContact O-OG1 2.96Å; S232-T234 WeakPolarHBondContact O-CG2 3.3Å; S232-T234 PolarHBondContact O-N 2.9Å; S232-T234 PolarHBondContact OG-OG1 3.32Å
235L92.9Very high94.3Very high34 Ų3451.1 Ų51.118%0.17829%0.287CS..SBendtrans-85.5158.4167.8-61.3-177.6000110.1T226 R229 F230 N239 M240 L243T226-L235 HydrophobicContact CG2-CD1 4.39Å; R229-L235 HydrophobicContact CB-CD1 4.33Å; R229-L235 HydrophobicContact CB-CD2 3.5Å; R229-L235 HydrophobicContact CB-CG 3.65Å; R229-L235 HydrophobicContact CG-CD2 4.26Å; F230-L235 HydrophobicContact CB-CD1 4.33Å; L235-N239 HydrophobicContact CB-CB 4.04Å; L235-N239 HydrophobicContact CD1-CB 4.46Å; L235-M240 HydrophobicContact CB-CE 3.55Å; L235-M240 HydrophobicContact CB-CG 4.27Å; L235-M240 HydrophobicContact CB-SD 3.89Å; L235-M240 HydrophobicContact CD1-CE 3.59Å; L235-M240 HydrophobicContact CG-CE 3.9Å; L235-L243 HydrophobicContact CD1-CD1 3.42Å; L235-L243 VanDerWaalsContact CD1-CD1 3.42Å
236S93.8Very high94.2Very high66 Ų6650.1 Ų50.146%0.46228%0.277SS..  trans-62.6150.2171.9640000110.8N238 N239 M240S236-N238 VanDerWaalsContact C-N 3.28Å; S236-N238 PolarHBondContact O-N 2.97Å; S236-N239 WeakPolarHBondContact O-CA 3.32Å; S236-N239 WeakPolarHBondContact O-CB 3.31Å; S236-N239 PolarHBondContact O-N 2.98Å; S236-N239 PolarHBondContact OG-ND2 3.3Å; S236-M240 WeakPolarHBondContact O-CG 3.34Å; S236-M240 PolarHBondContact O-N 3.37Å
237H91Very high94.2Very high52 Ų5248.3 Ų48.324%0.24127%0.266CS..Hα-helixtrans-51.4-44.5-179.3-17567.8000112.9T181 L186 N239 M240 I241T181-H237 PolarHBondContact O-CE1 3Å; L186-H237 WeakPolarHBondContact CD1-CE1 3.3Å; L186-H237 VanDerWaalsContact CD1-ND1 3.34Å; L186-H237 WeakPolarHBondContact CD1-ND1 3.17Å; H237-N239 VanDerWaalsContact C-N 3.31Å; H237-N239 PolarHBondContact O-N 2.9Å; H237-M240 WeakPolarHBondContact O-CA 3.34Å; H237-M240 WeakPolarHBondContact O-CB 3.34Å; H237-M240 PolarHBondContact O-N 3.28Å; H237-I241 VanDerWaalsContact NE2-CD1 3.34Å; H237-I241 WeakPolarHBondContact NE2-CD1 3.21Å; H237-I241 PolarHBondContact O-N 2.89Å
238N91.2Very high94.1Very high97 Ų9750.7 Ų50.752%0.51928%0.283SS..Hα-helixtrans-58.9-38.6175.3-63.6-13.6000113.4S236 M240 A242S236-N238 VanDerWaalsContact C-N 3.28Å; S236-N238 PolarHBondContact O-N 2.97Å; N238-M240 VanDerWaalsContact C-N 3.34Å; N238-A242 WeakPolarHBondContact O-CB 3.44Å; N238-A242 PolarHBondContact O-N 3.2Å
239N92.8Very high93.9Very high84 Ų8449.6 Ų49.645%0.44928%0.277SS..Hα-helixtrans-70.6-33.5174.6-79.8-55.6000111.3L235 S236 H237 L243L235-N239 HydrophobicContact CB-CB 4.04Å; L235-N239 HydrophobicContact CD1-CB 4.46Å; S236-N239 WeakPolarHBondContact O-CA 3.32Å; S236-N239 WeakPolarHBondContact O-CB 3.31Å; S236-N239 PolarHBondContact O-N 2.98Å; S236-N239 PolarHBondContact OG-ND2 3.3Å; H237-N239 VanDerWaalsContact C-N 3.31Å; H237-N239 PolarHBondContact O-N 2.9Å; N239-L243 VanDerWaalsContact O-CB 3.3Å; N239-L243 WeakPolarHBondContact O-CB 3.48Å; N239-L243 VanDerWaalsContact O-CG 3.25Å; N239-L243 WeakPolarHBondContact O-CG 3.34Å; N239-L243 PolarHBondContact O-N 2.91Å
240M94.4Very high93.7Very high7 Ų743.9 Ų43.93%0.03426%0.256CS..Hα-helixtrans-64-47.9175.1-53.5-82.255.700111.4L186 F230 L233 L235 S236 H237 N238 A242 L243 R244L186-M240 HydrophobicContact CD1-CB 4.03Å; L186-M240 HydrophobicContact CD2-CB 4.12Å; F230-M240 HydrophobicContact CB-CE 3.96Å; F230-M240 HydrophobicContact CD2-CE 3.04Å; F230-M240 HydrophobicContact CD2-SD 4.46Å; F230-M240 HydrophobicContact CE2-CE 3.52Å; F230-M240 HydrophobicContact CG-CE 3.68Å; F230-M240 HydrophobicContact CZ-CE 4.5Å; L233-M240 HydrophobicContact CD2-SD 4.27Å; L235-M240 HydrophobicContact CB-CE 3.55Å; L235-M240 HydrophobicContact CB-CG 4.27Å; L235-M240 HydrophobicContact CB-SD 3.89Å; L235-M240 HydrophobicContact CD1-CE 3.59Å; L235-M240 HydrophobicContact CG-CE 3.9Å; S236-M240 WeakPolarHBondContact O-CG 3.34Å; S236-M240 PolarHBondContact O-N 3.37Å; H237-M240 WeakPolarHBondContact O-CA 3.34Å; H237-M240 WeakPolarHBondContact O-CB 3.34Å; H237-M240 PolarHBondContact O-N 3.28Å; N238-M240 VanDerWaalsContact C-N 3.34Å; M240-A242 PolarHBondContact O-N 3.48Å; M240-L243 PolarHBondContact O-N 2.88Å; M240-R244 WeakPolarHBondContact O-CB 3.41Å; M240-R244 PolarHBondContact O-N 3.35Å
241I93.9Very high93.5Very high61 Ų6144.1 Ų44.131%0.31326%0.257SS..Hα-helixtrans-59.6-47.1175.6-66.8175.5000110.6L186 H237 L243 R244 P245L186-I241 HydrophobicContact CD1-CG1 4.12Å; H237-I241 VanDerWaalsContact NE2-CD1 3.34Å; H237-I241 WeakPolarHBondContact NE2-CD1 3.21Å; H237-I241 PolarHBondContact O-N 2.89Å; I241-L243 VanDerWaalsContact C-N 3.31Å; I241-L243 PolarHBondContact O-N 3.44Å; I241-R244 PolarHBondContact O-N 3.36Å; I241-P245 WeakPolarHBondContact O-CD 3.41Å
242A91.3Very high93.3Very high56 Ų5650.3 Ų50.346%0.46329%0.286SS..Hα-helixtrans-63.9-33.518000000113.5N238 M240N238-A242 WeakPolarHBondContact O-CB 3.44Å; N238-A242 PolarHBondContact O-N 3.2Å; M240-A242 PolarHBondContact O-N 3.48Å
243L93.1Very high92.9Very high19 Ų1952.7 Ų52.710%0.09929%0.292CS..Hα-helixtrans-84.1-26.7179.7-72.5174.7000113.5L222 T226 F230 L235 N239 M240 I241 I246 L247L222-L243 HydrophobicContact CD1-CD2 3.58Å; L222-L243 HydrophobicContact CD2-CD2 4.26Å; T226-L243 HydrophobicContact CG2-CD1 3.9Å; F230-L243 HydrophobicContact CD2-CB 3.66Å; F230-L243 HydrophobicContact CD2-CD1 3.9Å; F230-L243 HydrophobicContact CD2-CG 4.45Å; F230-L243 HydrophobicContact CE2-CB 3.65Å; L235-L243 HydrophobicContact CD1-CD1 3.42Å; L235-L243 VanDerWaalsContact CD1-CD1 3.42Å; N239-L243 VanDerWaalsContact O-CB 3.3Å; N239-L243 WeakPolarHBondContact O-CB 3.48Å; N239-L243 VanDerWaalsContact O-CG 3.25Å; N239-L243 WeakPolarHBondContact O-CG 3.34Å; N239-L243 PolarHBondContact O-N 2.91Å; M240-L243 PolarHBondContact O-N 2.88Å; I241-L243 VanDerWaalsContact C-N 3.31Å; I241-L243 PolarHBondContact O-N 3.44Å; L243-I246 HydrophobicContact CD2-CD1 4.39Å; L243-I246 PolarHBondContact O-N 3.12Å; L243-L247 HydrophobicContact CB-CD1 4.4Å; L243-L247 WeakPolarHBondContact O-CG 3.44Å; L243-L247 PolarHBondContact O-N 2.98Å
244R93.6Very high92.7Very high67 Ų6751.3 Ų51.325%0.25329%0.288SS..Hα-helixtrans-50.3-54.5-179.5-177.8-178.7178.5163.3-7.3113.2E185 L186 F189 M240 I241 I246 L247 S248E185-R244 IonicContact OE2-CZ 3.51Å; E185-R244 IonicContact OE2-NH1 2.96Å; E185-R244 PolarHBondContact OE2-NH1 2.91Å; E185-R244 IonicContact OE2-NH2 3.08Å; E185-R244 PolarHBondContact OE2-NH2 2.87Å; E185-R244 VanDerWaalsContact OE2-NH2 3.08Å; L186-R244 HydrophobicContact CD2-CB 4.26Å; L186-R244 HydrophobicContact CD2-CG 4.47Å; F189-R244 HydrophobicContact CD1-CG 4.05Å; F189-R244 HydrophobicContact CD2-CG 4.43Å; F189-R244 HydrophobicContact CE1-CG 4.12Å; F189-R244 HydrophobicContact CE2-CG 4.49Å; F189-R244 HydrophobicContact CG-CG 4.21Å; F189-R244 HydrophobicContact CZ-CG 4.34Å; M240-R244 WeakPolarHBondContact O-CB 3.41Å; M240-R244 PolarHBondContact O-N 3.35Å; I241-R244 PolarHBondContact O-N 3.36Å; R244-I246 VanDerWaalsContact C-N 3.3Å; R244-I246 PolarHBondContact O-N 2.95Å; R244-L247 PolarHBondContact O-N 3.38Å; R244-S248 VanDerWaalsContact O-CB 3.27Å; R244-S248 WeakPolarHBondContact O-CB 3.25Å; R244-S248 PolarHBondContact O-N 2.8Å
245P91.7Very high92.4Very high79 Ų7949.9 Ų49.951%0.51328%0.277SS..Hα-helixtrans-64.9-35.6-177.124.9-33.6000112.3I241 S248 A249I241-P245 WeakPolarHBondContact O-CD 3.41Å; P245-S248 PolarHBondContact O-N 3.33Å; P245-A249 WeakPolarHBondContact O-CB 3.3Å; P245-A249 PolarHBondContact O-N 3.26Å
246I92.6Very high92.2Very high31 Ų3151.1 Ų51.116%0.15929%0.292CS..Hα-helixtrans-64.6-48.6179.1-60.9170.6000110.7L211 V219 L243 R244 S248 W250L211-I246 HydrophobicContact CD1-CG2 4.47Å; L211-I246 HydrophobicContact CD2-CG2 3.69Å; V219-I246 HydrophobicContact CG1-CD1 4.11Å; V219-I246 HydrophobicContact CG1-CG1 4.46Å; V219-I246 HydrophobicContact CG1-CG2 3.62Å; V219-I246 HydrophobicContact CG2-CD1 3.63Å; V219-I246 HydrophobicContact CG2-CG1 3.83Å; V219-I246 HydrophobicContact CG2-CG2 4.42Å; L243-I246 HydrophobicContact CD2-CD1 4.39Å; L243-I246 PolarHBondContact O-N 3.12Å; R244-I246 VanDerWaalsContact C-N 3.3Å; R244-I246 PolarHBondContact O-N 2.95Å; I246-S248 VanDerWaalsContact C-N 3.34Å; I246-W250 PolarHBondContact O-N 3.2Å; I246-W250 VanDerWaalsContact O-N 3.14Å
247L95Very high91.8Very high0 Ų050.4 Ų50.40%029%0.289CS..Hα-helixtrans-71.4-32-180-65.6179.9000111.9F189 F193 V207 L211 L222 I227 F230 L243 R244 W250 L251F189-L247 HydrophobicContact CE1-CB 4.13Å; F189-L247 HydrophobicContact CZ-CB 4.08Å; F193-L247 HydrophobicContact CD2-CB 4.04Å; F193-L247 HydrophobicContact CE2-CB 3.8Å; F193-L247 HydrophobicContact CE2-CD2 4.04Å; F193-L247 HydrophobicContact CE2-CG 4.33Å; F193-L247 HydrophobicContact CZ-CB 4.43Å; F193-L247 HydrophobicContact CZ-CD1 4.41Å; F193-L247 HydrophobicContact CZ-CD2 3.94Å; F193-L247 HydrophobicContact CZ-CG 4.5Å; V207-L247 HydrophobicContact CG1-CD2 4.29Å; L211-L247 HydrophobicContact CD1-CD2 3.78Å; L222-L247 HydrophobicContact CD1-CD2 4.45Å; I227-L247 HydrophobicContact CD1-CD2 3.78Å; F230-L247 HydrophobicContact CB-CD1 4.36Å; F230-L247 HydrophobicContact CD1-CD1 3.47Å; F230-L247 VanDerWaalsContact CD1-CD1 3.47Å; F230-L247 HydrophobicContact CD2-CD1 3.46Å; F230-L247 VanDerWaalsContact CD2-CD1 3.46Å; F230-L247 HydrophobicContact CE1-CD1 3.53Å; F230-L247 HydrophobicContact CE2-CD1 3.57Å; F230-L247 HydrophobicContact CG-CD1 3.48Å; F230-L247 VanDerWaalsContact CG-CD1 3.48Å; F230-L247 HydrophobicContact CZ-CD1 3.62Å; L243-L247 HydrophobicContact CB-CD1 4.4Å; L243-L247 WeakPolarHBondContact O-CG 3.44Å; L243-L247 PolarHBondContact O-N 2.98Å; R244-L247 PolarHBondContact O-N 3.38Å; L247-W250 PolarHBondContact O-N 3.14Å; L247-L251 VanDerWaalsContact O-CB 3.29Å; L247-L251 WeakPolarHBondContact O-CB 3.49Å; L247-L251 PolarHBondContact O-N 2.98Å
248S93.8Very high91.3Very high51 Ų5149.3 Ų49.336%0.35729%0.289SS..Hα-helixtrans-65-48174.5-1670000111R244 P245 I246 W250 L251 E252R244-S248 VanDerWaalsContact O-CB 3.27Å; R244-S248 WeakPolarHBondContact O-CB 3.25Å; R244-S248 PolarHBondContact O-N 2.8Å; P245-S248 PolarHBondContact O-N 3.33Å; I246-S248 VanDerWaalsContact C-N 3.34Å; S248-W250 VanDerWaalsContact C-N 3.3Å; S248-W250 PolarHBondContact O-N 3.46Å; S248-L251 PolarHBondContact O-N 2.95Å; S248-L251 VanDerWaalsContact O-N 3.12Å; S248-E252 PolarHBondContact O-N 3.26Å
249A91.5Very high90.7Very high25 Ų2553.1 Ų53.121%0.20730%0.297CS..Hα-helixtrans-60.4-40.5177.300000112L216 P245 Q253L216-A249 HydrophobicContact CD1-CB 4.3Å; P245-A249 WeakPolarHBondContact O-CB 3.3Å; P245-A249 PolarHBondContact O-N 3.26Å; A249-Q253 WeakPolarHBondContact O-CG 3.34Å; A249-Q253 PolarHBondContact O-N 3.33Å
250W93.6Very high89.5Confident13 Ų1351.1 Ų51.15%0.04930%0.296CS..Hα-helixtrans-62.8-45.2173.3179.779.5000112.4F193 R197 V202 V207 A210 L211 L214 I246 L247 S248 Q253 A254F193-W250 AromaticContact CE2-CE3 3.64Å; F193-W250 HydrophobicContact CE2-CE3 3.64Å; F193-W250 AromaticContact CE2-CZ3 3.83Å; F193-W250 HydrophobicContact CE2-CZ3 3.83Å; F193-W250 HydrophobicContact CZ-CE3 4.19Å; F193-W250 HydrophobicContact CZ-CZ3 4.14Å; R197-W250 HydrophobicContact CG-CH2 4.17Å; R197-W250 HydrophobicContact CG-CZ3 4.47Å; V202-W250 HydrophobicContact CB-CH2 4.28Å; V202-W250 HydrophobicContact CG1-CH2 4.05Å; V202-W250 HydrophobicContact CG1-CZ2 3.92Å; V202-W250 HydrophobicContact CG2-CH2 4.41Å; V202-W250 HydrophobicContact CG2-CZ2 4.46Å; V207-W250 HydrophobicContact CB-CZ2 4.36Å; V207-W250 HydrophobicContact CG1-CD2 4.09Å; V207-W250 HydrophobicContact CG1-CE3 4.19Å; V207-W250 HydrophobicContact CG1-CZ2 4.44Å; V207-W250 HydrophobicContact CG1-CZ3 4.4Å; V207-W250 HydrophobicContact CG2-CH2 3.6Å; V207-W250 HydrophobicContact CG2-CZ2 3.82Å; V207-W250 HydrophobicContact CG2-CZ3 4.01Å; A210-W250 VanDerWaalsContact CB-NE1 3.27Å; L211-W250 HydrophobicContact CD2-CB 3.53Å; L211-W250 HydrophobicContact CD2-CG 3.89Å; L211-W250 HydrophobicContact CG-CB 4.49Å; L211-W250 HydrophobicContact CG-CG 4.37Å; L214-W250 HydrophobicContact CD1-CB 3.63Å; L214-W250 HydrophobicContact CD1-CG 4.16Å; I246-W250 PolarHBondContact O-N 3.2Å; I246-W250 VanDerWaalsContact O-N 3.14Å; L247-W250 PolarHBondContact O-N 3.14Å; S248-W250 VanDerWaalsContact C-N 3.3Å; S248-W250 PolarHBondContact O-N 3.46Å; W250-Q253 PolarHBondContact O-N 3.06Å; W250-A254 HydrophobicContact CD2-CB 4.46Å; W250-A254 HydrophobicContact CH2-CB 4.16Å; W250-A254 HydrophobicContact CZ2-CB 4.06Å; W250-A254 HydrophobicContact CZ3-CB 4.42Å; W250-A254 VanDerWaalsContact O-CB 3.3Å; W250-A254 WeakPolarHBondContact O-CB 3.4Å; W250-A254 PolarHBondContact O-N 2.8Å
251L94.1Very high87.8Confident8 Ų856.7 Ų56.74%0.04232%0.32CS..Hα-helixtrans-63.4-44.9-176.8-17863.3000111F193 R196 L247 S248 Q253 A254 E255F193-L251 HydrophobicContact CD2-CB 4.36Å; F193-L251 HydrophobicContact CD2-CD2 4.35Å; R196-L251 HydrophobicContact CB-CD1 3.54Å; R196-L251 HydrophobicContact CB-CD2 4.4Å; R196-L251 HydrophobicContact CG-CD1 4.33Å; R196-L251 HydrophobicContact CG-CD2 4.48Å; L247-L251 VanDerWaalsContact O-CB 3.29Å; L247-L251 WeakPolarHBondContact O-CB 3.49Å; L247-L251 PolarHBondContact O-N 2.98Å; S248-L251 PolarHBondContact O-N 2.95Å; S248-L251 VanDerWaalsContact O-N 3.12Å; L251-Q253 PolarHBondContact O-N 3.16Å; L251-A254 PolarHBondContact O-N 3.07Å; L251-E255 HydrophobicContact CD1-CG 4.3Å; L251-E255 WeakPolarHBondContact O-CB 3.38Å; L251-E255 WeakPolarHBondContact O-CG 3.36Å; L251-E255 PolarHBondContact O-N 3.28Å
252E91.6Very high85.9Confident140 Ų14061 Ų6165%0.65434%0.342SS*.Hα-helixtrans-57.8-47.2176.4-175.6177.4-172.400111.8S248 E255 A256S248-E252 PolarHBondContact O-N 3.26Å; E252-E255 PolarHBondContact O-N 2.84Å; E252-A256 WeakPolarHBondContact O-CB 3.27Å; E252-A256 PolarHBondContact O-N 3.24Å
253Q88.2Confident84.1Confident98 Ų9867.4 Ų67.446%0.45836%0.359SS..Hα-helixtrans-66.1-39.8177.5-69.2-175.439.900112.6L214 A249 W250 L251 A256 A257L214-Q253 HydrophobicContact CD2-CB 4.48Å; L214-Q253 HydrophobicContact CD2-CG 4.48Å; A249-Q253 WeakPolarHBondContact O-CG 3.34Å; A249-Q253 PolarHBondContact O-N 3.33Å; W250-Q253 PolarHBondContact O-N 3.06Å; L251-Q253 PolarHBondContact O-N 3.16Å; Q253-A256 PolarHBondContact O-N 2.89Å; Q253-A257 VanDerWaalsContact O-CB 3.32Å; Q253-A257 WeakPolarHBondContact O-CB 3.39Å; Q253-A257 PolarHBondContact O-N 3.47Å
254A90.1Very high81.8Confident22 Ų2274.3 Ų74.318%0.18239%0.391CS..Hα-helixtrans-66.3-38.2177.600000111.6L200 W250 L251 A258L200-A254 HydrophobicContact CD1-CB 3.78Å; W250-A254 HydrophobicContact CD2-CB 4.46Å; W250-A254 HydrophobicContact CH2-CB 4.16Å; W250-A254 HydrophobicContact CZ2-CB 4.06Å; W250-A254 HydrophobicContact CZ3-CB 4.42Å; W250-A254 VanDerWaalsContact O-CB 3.3Å; W250-A254 WeakPolarHBondContact O-CB 3.4Å; W250-A254 PolarHBondContact O-N 2.8Å; L251-A254 PolarHBondContact O-N 3.07Å; A254-A258 WeakPolarHBondContact O-CB 3.41Å; A254-A258 PolarHBondContact O-N 3.14Å
255E90.2Very high79.1Confident38 Ų3876 Ų7618%0.17841%0.413CS..Hα-helixtrans-70.3-41.1174.5-71.8-161.9161.100112.6R196 L251 E252 A258 R259R196-E255 WeakPolarHBondContact CD-OE1 3.42Å; R196-E255 VanDerWaalsContact CG-OE1 3.26Å; R196-E255 WeakPolarHBondContact CG-OE1 3.45Å; R196-E255 IonicContact CZ-OE1 2.6Å; R196-E255 VanDerWaalsContact CZ-OE1 3.24Å; R196-E255 IonicContact NE-OE1 3.35Å; R196-E255 PolarHBondContact NE-OE1 3.15Å; R196-E255 IonicContact NH1-OE1 3.62Å; R196-E255 PolarHBondContact NH1-OE1 3.01Å; R196-E255 IonicContact NH1-OE2 3.06Å; L251-E255 HydrophobicContact CD1-CG 4.3Å; L251-E255 WeakPolarHBondContact O-CB 3.38Å; L251-E255 WeakPolarHBondContact O-CG 3.36Å; L251-E255 PolarHBondContact O-N 3.28Å; E252-E255 PolarHBondContact O-N 2.84Å; E255-A258 PolarHBondContact O-N 3.23Å; E255-R259 WeakPolarHBondContact O-CG 3.42Å; E255-R259 PolarHBondContact O-N 3.4Å
256A88.2Confident76.4Confident60 Ų6079.9 Ų79.950%0.49643%0.429SS..Hα-helixtrans-61-45.1174.400000111.3E252 Q253 A258 R259 G260E252-A256 WeakPolarHBondContact O-CB 3.27Å; E252-A256 PolarHBondContact O-N 3.24Å; Q253-A256 PolarHBondContact O-N 2.89Å; A256-A258 VanDerWaalsContact C-N 3.34Å; A256-A258 PolarHBondContact O-N 3.15Å; A256-R259 PolarHBondContact O-N 3.32Å; A256-G260 PolarHBondContact O-N 2.91Å; A256-G260 VanDerWaalsContact O-N 3.08Å
257A85Confident73.7Confident50 Ų5081.4 Ų81.441%0.41345%0.453SS..Hα-helixtrans-63.3-38.2175.300000112.3Q253 G260 K261Q253-A257 VanDerWaalsContact O-CB 3.32Å; Q253-A257 WeakPolarHBondContact O-CB 3.39Å; Q253-A257 PolarHBondContact O-N 3.47Å; A257-G260 PolarHBondContact O-N 3.13Å; A257-K261 VanDerWaalsContact O-CG 3.25Å; A257-K261 WeakPolarHBondContact O-CG 3.32Å; A257-K261 PolarHBondContact O-N 3.34Å
258A81.5Confident71.2Confident29 Ų2989.5 Ų89.524%0.2450%0.495CS..Hα-helixtrans-67.9-37.5176.500000112.6L200 A254 E255 A256 G260 K261 I262L200-A258 HydrophobicContact CD2-CB 3.4Å; A254-A258 WeakPolarHBondContact O-CB 3.41Å; A254-A258 PolarHBondContact O-N 3.14Å; E255-A258 PolarHBondContact O-N 3.23Å; A256-A258 VanDerWaalsContact C-N 3.34Å; A256-A258 PolarHBondContact O-N 3.15Å; A258-G260 VanDerWaalsContact C-N 3.34Å; A258-K261 PolarHBondContact O-N 3.45Å; A258-I262 WeakPolarHBondContact O-CG1 3.17Å; A258-I262 PolarHBondContact O-N 3.13Å
259R79Confident69.2Low178 Ų17893.7 Ų93.767%0.67251%0.512SS*.Hα-helixtrans-63.4-39.3173.6-71.6172.4-174.2-89.35.6111.8E255 A256E255-R259 WeakPolarHBondContact O-CG 3.42Å; E255-R259 PolarHBondContact O-N 3.4Å; A256-R259 PolarHBondContact O-N 3.32Å
260G66.9Low67.1Low42 Ų4298.4 Ų98.443%0.43354%0.541SS..Hα-helixtrans-65.2-41.8174.600000113.1A256 A257 A258 I262 K263 E264A256-G260 PolarHBondContact O-N 2.91Å; A256-G260 VanDerWaalsContact O-N 3.08Å; A257-G260 PolarHBondContact O-N 3.13Å; A258-G260 VanDerWaalsContact C-N 3.34Å; G260-I262 VanDerWaalsContact C-N 3.32Å; G260-I262 PolarHBondContact O-N 3.35Å; G260-K263 WeakPolarHBondContact O-CB 3.48Å; G260-K263 PolarHBondContact O-N 3.36Å; G260-E264 PolarHBondContact O-N 3.24Å
261K58.3Low64.5Low124 Ų124101.2 Ų101.254%0.53957%0.574SS.*Hα-helixtrans-69.8-22.1-178.4-71.7172.7-176.8-1710114.8A257 A258 K263 E264A257-K261 VanDerWaalsContact O-CG 3.25Å; A257-K261 WeakPolarHBondContact O-CG 3.32Å; A257-K261 PolarHBondContact O-N 3.34Å; A258-K261 PolarHBondContact O-N 3.45Å; K261-K263 PolarHBondContact O-N 3.3Å; K261-E264 CarbonylContact O-C 3.57Å; K261-E264 PolarHBondContact O-N 3.14Å
262I53.9Low62.3Low151 Ų151106 Ų10677%0.77461%0.608SS**THydrogen-bonded Turntrans-69.5-22.7171.8-66.9166.3000110.9A258 G260A258-I262 WeakPolarHBondContact O-CG1 3.17Å; A258-I262 PolarHBondContact O-N 3.13Å; G260-I262 VanDerWaalsContact C-N 3.32Å; G260-I262 PolarHBondContact O-N 3.35Å
263K53.5Low59.8Low191 Ų191108 Ų10883%0.8362%0.618SS**THydrogen-bonded Turntrans-88.2-21.5177.6-159174.9-179.8-176.20113.4G260 K261G260-K263 WeakPolarHBondContact O-CB 3.48Å; G260-K263 PolarHBondContact O-N 3.36Å; K261-K263 PolarHBondContact O-N 3.3Å
264E45.8Very low57.9Low163 Ų163113.4 Ų113.476%0.76264%0.639SS**SBendtrans-129.280.6-178-63.7-171.7-179.500109.7G260 K261 N266G260-E264 PolarHBondContact O-N 3.24Å; K261-E264 CarbonylContact O-C 3.57Å; K261-E264 PolarHBondContact O-N 3.14Å; E264-N266 PolarHBondContact O-N 2.77Å
265S37.2Very low55.7Low102 Ų102121.9 Ų121.971%0.71367%0.672SS**  trans-66.3108.4175.3540000111.1
266N33.6Very low54Low161 Ų161130.2 Ų130.286%0.86170%0.702SS**  trans140.1112.9146.4-78.9-0.4000111.4E264E264-N266 PolarHBondContact O-N 2.77Å
267G36.3Very low52.1Low64 Ų64136.7 Ų136.766%0.6672%0.719SS**  trans144.881.7158.800000117.4
268I42.8Very low50.7Low170 Ų170145.7 Ų145.787%0.87274%0.742SS**  trans16.2119.8132.2-55.8133.7000117.3
269L52.5Low50.2Low139 Ų139147.8 Ų147.873%0.72875%0.752SS**PPolyproline II helixtrans-102.4132.1170.7-69176.7000111.8
270P47.9Very low49.5Very low123 Ų123144.5 Ų144.580%0.79976%0.757SS**PPolyproline II helixtrans-91.5151.6176.835-31.3000113.1
271G39Very low49.9Very low72 Ų72144.8 Ų144.874%0.74275%0.747SS**PPolyproline II helixtrans-100.6160.9178.300000114.6
272S47.5Very low51.2Low109 Ų109141 Ų14176%0.76274%0.74SS**  trans177.1104.9149.537.50000108.2
273E39.2Very low52.5Low183 Ų183137.5 Ų137.586%0.85573%0.733SS**  74.298.199-71.1-165.297.900115.7
274K48.3Very low54Low211 Ų211133.2 Ų133.292%0.91772%0.723SS**  trans-169.684.2145.7-99.5153.9-171.1177.10110.4
275K44.3Very low56.1Low200 Ų200127.8 Ų127.887%0.8770%0.698SS**  trans-79.5128.6175.7-177.4175.1176.6-179.50110K277K275-K277 PolarHBondContact O-N 3.08Å
276R53.6Low58.5Low212 Ų212127.9 Ų127.980%0.869%0.685SS**  trans-69.4115.4167.7-81.7-176.9-176167.42.9109.1
277K47.2Very low61.2Low197 Ų197128.6 Ų128.686%0.85768%0.676SS**PPolyproline II helixtrans-74.7134.9173-151.8168.9-177-179.50108.4K275 T279K275-K277 PolarHBondContact O-N 3.08Å; K277-T279 PolarHBondContact O-N 3.42Å
278R56.8Low63.8Low238 Ų238127.5 Ų127.590%0.89866%0.658SS**PPolyproline II helixtrans-55.3128.8168.1-178.5-179.1-178.4-165.90.8107.8S280R278-S280 PolarHBondContact O-N 3.37Å; R278-S280 VanDerWaalsContact O-N 3.14Å
279T69.8Low66.2Low73 Ų73119.4 Ų119.445%0.44862%0.617SS.*PPolyproline II helixtrans-61.4117.3174.3-50.30000108.8K277 V317K277-T279 PolarHBondContact O-N 3.42Å; T279-V317 HydrophobicContact CG2-CG2 4.36Å
280S66.2Low68.1Low110 Ų110116.1 Ų116.177%0.76960%0.598SS**PPolyproline II helixtrans-80.9118.7169.8-171.80000107.4R278R278-S280 PolarHBondContact O-N 3.37Å; R278-S280 VanDerWaalsContact O-N 3.14Å
281I74.9Confident70.2Confident47 Ų47113 Ų11324%0.24158%0.583CS.*PPolyproline II helixtrans-85.3124.8173.3-60.7173.2000106.4E285 K286 L289 L313 V317 W321I281-E285 WeakPolarHBondContact CA-OE2 3.35Å; I281-E285 HydrophobicContact CG2-CB 3.67Å; I281-E285 WeakPolarHBondContact CG2-OE2 3.04Å; I281-K286 HydrophobicContact CG2-CB 4.2Å; I281-L289 HydrophobicContact CD1-CD1 4.47Å; I281-L289 HydrophobicContact CG2-CD1 4.23Å; I281-L313 HydrophobicContact CG2-CD1 4.41Å; I281-V317 HydrophobicContact CD1-CG1 3.95Å; I281-V317 HydrophobicContact CG1-CG1 4.2Å; I281-W321 HydrophobicContact CD1-CG 4.47Å
282A84Confident72.7Confident45 Ų45112 Ų11237%0.37256%0.557SS.*PPolyproline II helixtrans-63.4154.317900000111.1T284 E285 K286A282-T284 PolarHBondContact O-N 3.43Å; A282-E285 HydrophobicContact CB-CG 4.11Å; A282-E285 PolarHBondContact N-OE2 3.28Å; A282-E285 PolarHBondContact O-N 3.18Å; A282-K286 WeakPolarHBondContact O-CB 3.19Å; A282-K286 PolarHBondContact O-N 3.26Å
283A81.9Confident74.9Confident78 Ų78107.7 Ų107.765%0.64552%0.524SS*.Hα-helixtrans-59-36.2-178.800000112.5K286 R287A283-K286 PolarHBondContact O-N 3.32Å; A283-R287 PolarHBondContact O-N 3.01Å
284T85.8Confident77.3Confident101 Ų101104.8 Ų104.862%0.6252%0.519SS*.Hα-helixtrans-64.5-48.5176-48.20000111.7A282 K286 R287 S288A282-T284 PolarHBondContact O-N 3.43Å; T284-K286 VanDerWaalsContact C-N 3.32Å; T284-K286 PolarHBondContact O-N 3.12Å; T284-R287 PolarHBondContact O-N 3.36Å; T284-S288 PolarHBondContact O-N 3.04Å; T284-S288 PolarHBondContact O-OG 3.08Å
285E88.5Confident79.3Confident48 Ų48101.1 Ų101.122%0.22451%0.507CS..Hα-helixtrans-61.2-41.8177.2-64.6159.6-172.100111.4I281 A282 R287 S288 L289 L313I281-E285 WeakPolarHBondContact CA-OE2 3.35Å; I281-E285 HydrophobicContact CG2-CB 3.67Å; I281-E285 WeakPolarHBondContact CG2-OE2 3.04Å; A282-E285 HydrophobicContact CB-CG 4.11Å; A282-E285 PolarHBondContact N-OE2 3.28Å; A282-E285 PolarHBondContact O-N 3.18Å; E285-R287 PolarHBondContact O-N 3.25Å; E285-S288 PolarHBondContact O-N 3.48Å; E285-L289 WeakPolarHBondContact O-CG 3.41Å; E285-L289 PolarHBondContact O-N 2.94Å; E285-L313 HydrophobicContact CB-CD1 4.32Å
286K88.5Confident81.3Confident104 Ų10496.2 Ų96.245%0.45249%0.487SS..Hα-helixtrans-60.3-43.9176.7-175.1-173.8171.3-161.20111.5I281 A282 A283 T284 L289 E290I281-K286 HydrophobicContact CG2-CB 4.2Å; A282-K286 WeakPolarHBondContact O-CB 3.19Å; A282-K286 PolarHBondContact O-N 3.26Å; A283-K286 PolarHBondContact O-N 3.32Å; T284-K286 VanDerWaalsContact C-N 3.32Å; T284-K286 PolarHBondContact O-N 3.12Å; K286-L289 PolarHBondContact O-N 3.46Å; K286-E290 VanDerWaalsContact CE-OE1 3.22Å; K286-E290 WeakPolarHBondContact CE-OE1 3.01Å; K286-E290 WeakPolarHBondContact O-CG 3.31Å; K286-E290 PolarHBondContact O-N 2.86Å
287R90.1Very high83Confident176 Ų17688.8 Ų88.866%0.66447%0.466SS*.Hα-helixtrans-62.7-42.1177-170.3-175.5-66.7148.8-1.9111.5A283 T284 E285 E290 A291A283-R287 PolarHBondContact O-N 3.01Å; T284-R287 PolarHBondContact O-N 3.36Å; E285-R287 PolarHBondContact O-N 3.25Å; R287-E290 PolarHBondContact O-N 3.16Å; R287-A291 PolarHBondContact O-N 3.32Å
288S91.7Very high85.1Confident42 Ų4289.2 Ų89.229%0.29446%0.462SS..Hα-helixtrans-64.4-42.5175.8-61.90000112.3T284 E285 E290 A291 Y292T284-S288 PolarHBondContact O-N 3.04Å; T284-S288 PolarHBondContact O-OG 3.08Å; E285-S288 PolarHBondContact O-N 3.48Å; S288-E290 VanDerWaalsContact C-N 3.32Å; S288-E290 PolarHBondContact O-N 2.85Å; S288-A291 PolarHBondContact O-N 2.99Å; S288-Y292 WeakPolarHBondContact O-CD2 2.92Å; S288-Y292 PolarHBondContact O-N 3.46Å
289L92.5Very high86.7Confident0 Ų078.8 Ų78.80%043%0.425CS..Hα-helixtrans-61.4-40.5174.8-74.1168.1000111.9I281 E285 K286 Y292 F293 I307 L311 L313 V318 W321 F322I281-L289 HydrophobicContact CD1-CD1 4.47Å; I281-L289 HydrophobicContact CG2-CD1 4.23Å; E285-L289 WeakPolarHBondContact O-CG 3.41Å; E285-L289 PolarHBondContact O-N 2.94Å; K286-L289 PolarHBondContact O-N 3.46Å; L289-Y292 PolarHBondContact O-N 2.81Å; L289-F293 WeakPolarHBondContact O-CB 3.4Å; L289-F293 PolarHBondContact O-N 2.89Å; L289-I307 HydrophobicContact CD2-CG2 3.86Å; L289-L311 HydrophobicContact CD1-CD1 4.4Å; L289-L311 HydrophobicContact CD2-CD1 3.61Å; L289-L311 HydrophobicContact CG-CD1 3.59Å; L289-L313 HydrophobicContact CD1-CD1 4.2Å; L289-V318 HydrophobicContact CD2-CG1 4.01Å; L289-W321 HydrophobicContact CB-CD2 3.89Å; L289-W321 HydrophobicContact CB-CE3 3.88Å; L289-W321 HydrophobicContact CB-CH2 3.58Å; L289-W321 HydrophobicContact CB-CZ2 3.53Å; L289-W321 HydrophobicContact CB-CZ3 3.75Å; L289-W321 HydrophobicContact CD1-CD2 3.82Å; L289-W321 HydrophobicContact CD1-CE3 4.39Å; L289-W321 HydrophobicContact CD1-CG 3.83Å; L289-W321 HydrophobicContact CD2-CD2 4.35Å; L289-W321 HydrophobicContact CD2-CE3 4.11Å; L289-W321 HydrophobicContact CG-CD2 4.24Å; L289-W321 HydrophobicContact CG-CE3 4.35Å; L289-W321 VanDerWaalsContact O-CH2 3.24Å; L289-W321 WeakPolarHBondContact O-CH2 3.39Å; L289-W321 WeakPolarHBondContact O-CZ3 3.37Å; L289-F322 HydrophobicContact CD2-CE2 4.03Å
290E92.4Very high87.7Confident70 Ų7078.6 Ų78.633%0.32743%0.427SS..Hα-helixtrans-62.4-42.1174.3-72.7170.8172.600111.8K286 R287 S288 F293 T294 W321K286-E290 VanDerWaalsContact CE-OE1 3.22Å; K286-E290 WeakPolarHBondContact CE-OE1 3.01Å; K286-E290 WeakPolarHBondContact O-CG 3.31Å; K286-E290 PolarHBondContact O-N 2.86Å; R287-E290 PolarHBondContact O-N 3.16Å; S288-E290 VanDerWaalsContact C-N 3.32Å; S288-E290 PolarHBondContact O-N 2.85Å; E290-F293 WeakPolarHBondContact O-CB 3.16Å; E290-F293 PolarHBondContact O-N 3.08Å; E290-T294 PolarHBondContact O-N 3.06Å; E290-T294 VanDerWaalsContact O-N 3.14Å; E290-T294 PolarHBondContact O-OG1 3.2Å; E290-W321 HydrophobicContact CG-CH2 4.21Å; E290-W321 HydrophobicContact CG-CZ2 3.94Å
291A92.2Very high89Confident58 Ų5875.6 Ų75.648%0.47941%0.413SS..Hα-helixtrans-62.4-44.817500000112.5R287 S288 F293 T294 M295R287-A291 PolarHBondContact O-N 3.32Å; S288-A291 PolarHBondContact O-N 2.99Å; A291-F293 VanDerWaalsContact C-N 3.3Å; A291-F293 PolarHBondContact O-N 3.22Å; A291-T294 PolarHBondContact O-N 3.49Å; A291-M295 PolarHBondContact O-N 2.94Å
292Y92Very high89.9Confident50 Ų5081.1 Ų81.120%0.19644%0.438CS..Hα-helixtrans-63-36.2175-78.1-62.3000112.6S288 L289 M295 H296 I307 K310S288-Y292 WeakPolarHBondContact O-CD2 2.92Å; S288-Y292 PolarHBondContact O-N 3.46Å; L289-Y292 PolarHBondContact O-N 2.81Å; Y292-M295 PolarHBondContact O-N 3.25Å; Y292-H296 PolarHBondContact O-N 3.24Å; Y292-I307 HydrophobicContact CD1-CD1 4.1Å; Y292-I307 HydrophobicContact CD1-CG1 4.18Å; Y292-I307 HydrophobicContact CD2-CD1 4.31Å; Y292-I307 HydrophobicContact CD2-CG1 4.11Å; Y292-I307 HydrophobicContact CD2-CG2 4.06Å; Y292-I307 HydrophobicContact CE1-CG1 4.31Å; Y292-I307 HydrophobicContact CE2-CG1 4.25Å; Y292-I307 HydrophobicContact CE2-CG2 4.35Å; Y292-I307 HydrophobicContact CG-CD1 3.91Å; Y292-I307 HydrophobicContact CG-CG1 4.1Å; Y292-K310 VanDerWaalsContact OH-CD 3.29Å; Y292-K310 WeakPolarHBondContact OH-CD 3.41Å; Y292-K310 PolarHBondContact OH-NZ 3.48Å; Y292-K310 VanDerWaalsContact OH-NZ 3.13Å
293F92.5Very high90.3Very high18 Ų1883.2 Ų83.28%0.07944%0.439CS..Hα-helixtrans-65.6-38.6179.1-173.3-98.1000112.8L289 E290 A291 M295 H296 P297 W321 F322 Q325 R326L289-F293 WeakPolarHBondContact O-CB 3.4Å; L289-F293 PolarHBondContact O-N 2.89Å; E290-F293 WeakPolarHBondContact O-CB 3.16Å; E290-F293 PolarHBondContact O-N 3.08Å; A291-F293 VanDerWaalsContact C-N 3.3Å; A291-F293 PolarHBondContact O-N 3.22Å; F293-M295 VanDerWaalsContact C-N 3.31Å; F293-M295 PolarHBondContact O-N 2.79Å; F293-H296 CarbonylContact O-C 3.47Å; F293-P297 HydrophobicContact CD2-CB 4.35Å; F293-P297 HydrophobicContact CE1-CB 4.47Å; F293-P297 HydrophobicContact CE2-CB 3.98Å; F293-P297 HydrophobicContact CZ-CB 4.05Å; F293-P297 WeakPolarHBondContact O-CA 3.42Å; F293-P297 WeakPolarHBondContact O-CD 3.39Å; F293-W321 HydrophobicContact CB-CH2 3.93Å; F293-W321 HydrophobicContact CB-CZ3 3.94Å; F293-W321 HydrophobicContact CD2-CZ3 4.15Å; F293-W321 HydrophobicContact CG-CH2 4.38Å; F293-W321 HydrophobicContact CG-CZ3 4.32Å; F293-F322 HydrophobicContact CB-CE1 4.14Å; F293-F322 AromaticContact CD2-CD1 3.69Å; F293-F322 HydrophobicContact CD2-CD1 3.69Å; F293-F322 AromaticContact CD2-CE1 3.9Å; F293-F322 HydrophobicContact CD2-CE1 3.9Å; F293-F322 HydrophobicContact CE2-CD1 4.39Å; F293-Q325 HydrophobicContact CD1-CG 3.85Å; F293-Q325 HydrophobicContact CD2-CB 4.05Å; F293-Q325 HydrophobicContact CD2-CG 3.69Å; F293-Q325 HydrophobicContact CE1-CG 3.79Å; F293-Q325 HydrophobicContact CE2-CB 3.84Å; F293-Q325 HydrophobicContact CE2-CG 3.65Å; F293-Q325 HydrophobicContact CG-CG 3.79Å; F293-Q325 HydrophobicContact CZ-CB 4.23Å; F293-Q325 HydrophobicContact CZ-CG 3.71Å; F293-R326 HydrophobicContact CE2-CB 4.49Å
294T90.8Very high90.9Very high122 Ų12280.2 Ų80.275%0.74841%0.412SS*.Hα-helixtrans-62.2-39.1176.3-56.60000111.8E290 A291E290-T294 PolarHBondContact O-N 3.06Å; E290-T294 VanDerWaalsContact O-N 3.14Å; E290-T294 PolarHBondContact O-OG1 3.2Å; A291-T294 PolarHBondContact O-N 3.49Å
295M89Confident91.3Very high135 Ų13577.1 Ų77.167%0.66540%0.397SS*.Hα-helixtrans-78-43.8178.8-62-177.272.100112.5A291 Y292 F293A291-M295 PolarHBondContact O-N 2.94Å; Y292-M295 PolarHBondContact O-N 3.25Å; F293-M295 VanDerWaalsContact C-N 3.31Å; F293-M295 PolarHBondContact O-N 2.79Å
296H87.9Confident91.6Very high96 Ų9677.3 Ų77.344%0.44441%0.406SS..  trans-139.587.1-174.2-60.6-56.4000110.2Y292 F293 R298 P299Y292-H296 PolarHBondContact O-N 3.24Å; F293-H296 CarbonylContact O-C 3.47Å; H296-R298 PolarHBondContact O-N 3.01Å; H296-R298 VanDerWaalsContact O-N 3.17Å; H296-P299 WeakPolarHBondContact O-CD 3.39Å
297P89.3Confident91.8Very high57 Ų5772.6 Ų72.637%0.3739%0.386SS..SBendtrans-69.6-12.9-179.226.2-34.4000113.4F293F293-P297 HydrophobicContact CD2-CB 4.35Å; F293-P297 HydrophobicContact CE1-CB 4.47Å; F293-P297 HydrophobicContact CE2-CB 3.98Å; F293-P297 HydrophobicContact CZ-CB 4.05Å; F293-P297 WeakPolarHBondContact O-CA 3.42Å; F293-P297 WeakPolarHBondContact O-CD 3.39Å
298R90.4Very high92Very high205 Ų20564.5 Ų64.577%0.77436%0.357SS*.SBendtrans-129.471.9175.1-64.3-174.4180-167.81.2110.4H296H296-R298 PolarHBondContact O-N 3.01Å; H296-R298 VanDerWaalsContact O-N 3.17Å
299P90.3Very high92Very high19 Ų1970 Ų7012%0.12338%0.378CS..  trans-66.6144.1178.829.7-34.5000110.9H296 K303 I304 F322H296-P299 WeakPolarHBondContact O-CD 3.39Å; P299-K303 HydrophobicContact CB-CB 4.03Å; P299-K303 HydrophobicContact CB-CG 4.05Å; P299-I304 HydrophobicContact CB-CG1 4Å; P299-I304 HydrophobicContact CG-CD1 4.18Å; P299-I304 HydrophobicContact CG-CG1 3.66Å; P299-F322 VanDerWaalsContact CD-CD1 3.47Å; P299-F322 HydrophobicContact CG-CD1 3.59Å; P299-F322 HydrophobicContact CG-CD2 3.97Å; P299-F322 HydrophobicContact CG-CE1 3.64Å; P299-F322 HydrophobicContact CG-CE2 4.03Å; P299-F322 HydrophobicContact CG-CG 3.79Å; P299-F322 HydrophobicContact CG-CZ 3.88Å
300S91.8Very high92Very high70 Ų7077.1 Ų77.149%0.4941%0.409SS..  trans-64.1162.5173.368.90000111.5E302 K303 I304S300-E302 PolarHBondContact O-N 3.05Å; S300-K303 PolarHBondContact O-N 3.39Å; S300-K303 VanDerWaalsContact O-N 3.11Å; S300-K303 WeakPolarHBondContact OG-CB 3.49Å; S300-K303 PolarHBondContact OG-N 3.46Å; S300-K303 VanDerWaalsContact OG-N 3.17Å; S300-I304 VanDerWaalsContact O-CG1 3.31Å; S300-I304 WeakPolarHBondContact O-CG1 3.43Å; S300-I304 PolarHBondContact O-N 2.86Å
301G92.4Very high91.9Very high46 Ų4674.7 Ų74.747%0.47440%0.398SS..Hα-helixtrans-58.2-32.417800000113.8A305 K315G301-A305 PolarHBondContact O-N 3.44Å; G301-K315 WeakPolarHBondContact O-CE 3.22Å
302E93.8Very high91.8Very high164 Ų16480.7 Ų80.777%0.76642%0.416SS*.Hα-helixtrans-70.1-47.9173.1-174.4-175.6175.500111.4S300 I304 A305 A306S300-E302 PolarHBondContact O-N 3.05Å; E302-I304 VanDerWaalsContact C-N 3.27Å; E302-I304 PolarHBondContact O-N 3.24Å; E302-A305 WeakPolarHBondContact O-CA 3.4Å; E302-A305 WeakPolarHBondContact O-CB 3.38Å; E302-A305 PolarHBondContact O-N 3.39Å; E302-A306 PolarHBondContact O-N 3.49Å
303K92.1Very high91.6Very high88 Ų8879.3 Ų79.338%0.38341%0.412SS..Hα-helixtrans-61.6-36.6176.8-166.368.7171.2-171.10112.1P299 S300 A305 A306 I307P299-K303 HydrophobicContact CB-CB 4.03Å; P299-K303 HydrophobicContact CB-CG 4.05Å; S300-K303 PolarHBondContact O-N 3.39Å; S300-K303 VanDerWaalsContact O-N 3.11Å; S300-K303 WeakPolarHBondContact OG-CB 3.49Å; S300-K303 PolarHBondContact OG-N 3.46Å; S300-K303 VanDerWaalsContact OG-N 3.17Å; K303-A305 VanDerWaalsContact C-N 3.3Å; K303-A305 PolarHBondContact O-N 3.28Å; K303-A306 PolarHBondContact O-N 2.68Å; K303-I307 HydrophobicContact CG-CD1 4.19Å; K303-I307 VanDerWaalsContact O-CG1 3.27Å; K303-I307 WeakPolarHBondContact O-CG1 3.29Å; K303-I307 PolarHBondContact O-N 3Å
304I94.4Very high91.5Very high15 Ų1586 Ų868%0.07744%0.441CS..Hα-helixtrans-61.6-39.4173.3-68.4170.5000110.9P299 S300 E302 A308 K315 V318 R319P299-I304 HydrophobicContact CB-CG1 4Å; P299-I304 HydrophobicContact CG-CD1 4.18Å; P299-I304 HydrophobicContact CG-CG1 3.66Å; S300-I304 VanDerWaalsContact O-CG1 3.31Å; S300-I304 WeakPolarHBondContact O-CG1 3.43Å; S300-I304 PolarHBondContact O-N 2.86Å; E302-I304 VanDerWaalsContact C-N 3.27Å; E302-I304 PolarHBondContact O-N 3.24Å; I304-A308 VanDerWaalsContact O-CB 3.25Å; I304-A308 WeakPolarHBondContact O-CB 3.42Å; I304-A308 PolarHBondContact O-N 3.36Å; I304-K315 HydrophobicContact CG2-CG 4.01Å; I304-V318 HydrophobicContact CG2-CB 4.18Å; I304-V318 HydrophobicContact CG2-CG1 4.02Å; I304-R319 HydrophobicContact CD1-CB 4.44Å; I304-R319 HydrophobicContact CD1-CG 4.17Å; I304-R319 HydrophobicContact CG2-CB 4.2Å
305A94.7Very high91.5Very high37 Ų3785.1 Ų85.131%0.30643%0.427SS..Hα-helixtrans-66.1-45.5176.600000111.3G301 E302 K303 I307 A308 E309 K315G301-A305 PolarHBondContact O-N 3.44Å; E302-A305 WeakPolarHBondContact O-CA 3.4Å; E302-A305 WeakPolarHBondContact O-CB 3.38Å; E302-A305 PolarHBondContact O-N 3.39Å; K303-A305 VanDerWaalsContact C-N 3.3Å; K303-A305 PolarHBondContact O-N 3.28Å; A305-I307 PolarHBondContact O-N 3.41Å; A305-A308 WeakPolarHBondContact O-CB 3.24Å; A305-A308 PolarHBondContact O-N 3.06Å; A305-A308 VanDerWaalsContact O-N 3.14Å; A305-E309 PolarHBondContact O-N 3.48Å; A305-K315 HydrophobicContact CB-CD 4.28Å
306A94.5Very high91.6Very high51 Ų5183.2 Ų83.242%0.42142%0.42SS..Hα-helixtrans-62.1-39.3177.100000113.1E302 K303 K310E302-A306 PolarHBondContact O-N 3.49Å; K303-A306 PolarHBondContact O-N 2.68Å; A306-K310 WeakPolarHBondContact O-CB 3.3Å; A306-K310 PolarHBondContact O-N 3.37Å; A306-K310 VanDerWaalsContact O-N 3.07Å
307I93Very high91.8Very high5 Ų579.8 Ų79.83%0.02641%0.405CS..Hα-helixtrans-66.5-40.3174.4-66.9165.7000110.7L289 Y292 K303 A305 K310 L311 V318 F322L289-I307 HydrophobicContact CD2-CG2 3.86Å; Y292-I307 HydrophobicContact CD1-CD1 4.1Å; Y292-I307 HydrophobicContact CD1-CG1 4.18Å; Y292-I307 HydrophobicContact CD2-CD1 4.31Å; Y292-I307 HydrophobicContact CD2-CG1 4.11Å; Y292-I307 HydrophobicContact CD2-CG2 4.06Å; Y292-I307 HydrophobicContact CE1-CG1 4.31Å; Y292-I307 HydrophobicContact CE2-CG1 4.25Å; Y292-I307 HydrophobicContact CE2-CG2 4.35Å; Y292-I307 HydrophobicContact CG-CD1 3.91Å; Y292-I307 HydrophobicContact CG-CG1 4.1Å; K303-I307 HydrophobicContact CG-CD1 4.19Å; K303-I307 VanDerWaalsContact O-CG1 3.27Å; K303-I307 WeakPolarHBondContact O-CG1 3.29Å; K303-I307 PolarHBondContact O-N 3Å; A305-I307 PolarHBondContact O-N 3.41Å; I307-K310 PolarHBondContact O-N 3.37Å; I307-L311 HydrophobicContact CG2-CD1 3.69Å; I307-L311 HydrophobicContact CG2-CG 4.28Å; I307-L311 WeakPolarHBondContact O-CB 3.34Å; I307-L311 WeakPolarHBondContact O-CG 3.24Å; I307-L311 PolarHBondContact O-N 2.96Å; I307-V318 HydrophobicContact CB-CG1 4.28Å; I307-V318 HydrophobicContact CG2-CG1 3.87Å; I307-F322 HydrophobicContact CD1-CE2 4.05Å; I307-F322 HydrophobicContact CD1-CZ 3.95Å
308A94Very high91.9Very high6 Ų677.1 Ų77.15%0.0539%0.388CS..Hα-helixtrans-63-43.2179.200000111.9I304 A305 E312 L313 K315 V318I304-A308 VanDerWaalsContact O-CB 3.25Å; I304-A308 WeakPolarHBondContact O-CB 3.42Å; I304-A308 PolarHBondContact O-N 3.36Å; A305-A308 WeakPolarHBondContact O-CB 3.24Å; A305-A308 PolarHBondContact O-N 3.06Å; A305-A308 VanDerWaalsContact O-N 3.14Å; A308-E312 PolarHBondContact O-N 3.15Å; A308-L313 CarbonylContact C-O 3.47Å; A308-L313 WeakPolarHBondContact CB-O 3.39Å; A308-L313 PolarHBondContact O-N 3.44Å; A308-K315 HydrophobicContact CB-CB 4.41Å; A308-V318 HydrophobicContact CB-CB 4.43Å; A308-V318 HydrophobicContact CB-CG2 3.82Å
309E92.7Very high92.1Very high158 Ų15871.1 Ų71.174%0.73837%0.365SS*.Hα-helixtrans-62.9-49.8174.6-174.4175.9-16700111.6A305 L311 E312A305-E309 PolarHBondContact O-N 3.48Å; E309-L311 VanDerWaalsContact C-N 3.25Å; E309-L311 PolarHBondContact O-N 3.36Å; E309-E312 PolarHBondContact O-N 3.43Å; E309-E312 VanDerWaalsContact O-N 3.14Å
310K91.9Very high92.2Very high149 Ų14973.2 Ų73.265%0.64838%0.378SS*.Hα-helixtrans-63.5-28.5-179.1-169.3177.4179.5-177.40114Y292 A306 I307Y292-K310 VanDerWaalsContact OH-CD 3.29Å; Y292-K310 WeakPolarHBondContact OH-CD 3.41Å; Y292-K310 PolarHBondContact OH-NZ 3.48Å; Y292-K310 VanDerWaalsContact OH-NZ 3.13Å; A306-K310 WeakPolarHBondContact O-CB 3.3Å; A306-K310 PolarHBondContact O-N 3.37Å; A306-K310 VanDerWaalsContact O-N 3.07Å; I307-K310 PolarHBondContact O-N 3.37Å
311L90.1Very high92.3Very high20 Ų2071.2 Ų71.211%0.10536%0.359CS..THydrogen-bonded Turntrans-99.42.6179.5-61-179.3000113.3L289 I307 E309 L313L289-L311 HydrophobicContact CD1-CD1 4.4Å; L289-L311 HydrophobicContact CD2-CD1 3.61Å; L289-L311 HydrophobicContact CG-CD1 3.59Å; I307-L311 HydrophobicContact CG2-CD1 3.69Å; I307-L311 HydrophobicContact CG2-CG 4.28Å; I307-L311 WeakPolarHBondContact O-CB 3.34Å; I307-L311 WeakPolarHBondContact O-CG 3.24Å; I307-L311 PolarHBondContact O-N 2.96Å; E309-L311 VanDerWaalsContact C-N 3.25Å; E309-L311 PolarHBondContact O-N 3.36Å; L311-L313 HydrophobicContact CB-CD1 4.14Å; L311-L313 HydrophobicContact CB-CG 4.15Å; L311-L313 HydrophobicContact CD1-CD1 4.49Å; L311-L313 PolarHBondContact O-N 2.84Å
312E90.4Very high92.4Very high183 Ų18369.2 Ų69.286%0.85534%0.338SS*.THydrogen-bonded Turntrans5434.4-175.7-57.7-176.7174.600113.5A308 E309A308-E312 PolarHBondContact O-N 3.15Å; E309-E312 PolarHBondContact O-N 3.43Å; E309-E312 VanDerWaalsContact O-N 3.14Å
313L88.6Confident92.3Very high21 Ų2162.4 Ų62.411%0.1131%0.308CS..  trans-108.8154.3179.3-68.1178.2000111.5I281 E285 L289 A308 L311 K315 V318I281-L313 HydrophobicContact CG2-CD1 4.41Å; E285-L313 HydrophobicContact CB-CD1 4.32Å; L289-L313 HydrophobicContact CD1-CD1 4.2Å; A308-L313 CarbonylContact C-O 3.47Å; A308-L313 WeakPolarHBondContact CB-O 3.39Å; A308-L313 PolarHBondContact O-N 3.44Å; L311-L313 HydrophobicContact CB-CD1 4.14Å; L311-L313 HydrophobicContact CB-CG 4.15Å; L311-L313 HydrophobicContact CD1-CD1 4.49Å; L311-L313 PolarHBondContact O-N 2.84Å; L313-K315 PolarHBondContact O-N 3.4Å; L313-V318 HydrophobicContact CB-CG2 3.93Å; L313-V318 HydrophobicContact CD1-CG2 4.36Å
314K88.5Confident92.3Very high159 Ų15962.3 Ų62.369%0.69131%0.311SS*.  trans-65.5137.1172.6-67.9-177172.171.30110.3N316 V317 V318K314-N316 PolarHBondContact O-N 3Å; K314-V317 HydrophobicContact CB-CB 4.49Å; K314-V317 HydrophobicContact CB-CG2 4.03Å; K314-V317 WeakPolarHBondContact O-CA 3.41Å; K314-V317 WeakPolarHBondContact O-CB 3.33Å; K314-V317 PolarHBondContact O-N 2.96Å; K314-V318 PolarHBondContact O-N 3.46Å
315K91Very high92.2Very high104 Ų10463.4 Ų63.445%0.45232%0.316SS..Hα-helixtrans-47.5-37.3173.5-171.5178.8-178.7174.60112.9G301 I304 A305 A308 L313 R319G301-K315 WeakPolarHBondContact O-CE 3.22Å; I304-K315 HydrophobicContact CG2-CG 4.01Å; A305-K315 HydrophobicContact CB-CD 4.28Å; A308-K315 HydrophobicContact CB-CB 4.41Å; L313-K315 PolarHBondContact O-N 3.4Å; K315-R319 WeakPolarHBondContact O-CB 3.39Å; K315-R319 PolarHBondContact O-N 2.89Å
316N91.6Very high92.1Very high95 Ų9565.8 Ų65.851%0.50832%0.317SS..Hα-helixtrans-64.7-40.3176.5-167.865.4000113.5K314 R319 V320K314-N316 PolarHBondContact O-N 3Å; N316-R319 PolarHBondContact OD1-NH1 2.68Å; N316-V320 WeakPolarHBondContact O-CB 3.47Å; N316-V320 VanDerWaalsContact O-CG2 3.24Å; N316-V320 WeakPolarHBondContact O-CG2 3.15Å; N316-V320 PolarHBondContact O-N 3.22Å
317V91.7Very high91.6Very high24 Ų2468.4 Ų68.415%0.14532%0.321CS..Hα-helixtrans-66.2-46.5179.7174.90000110T279 I281 K314 V320 W321T279-V317 HydrophobicContact CG2-CG2 4.36Å; I281-V317 HydrophobicContact CD1-CG1 3.95Å; I281-V317 HydrophobicContact CG1-CG1 4.2Å; K314-V317 HydrophobicContact CB-CB 4.49Å; K314-V317 HydrophobicContact CB-CG2 4.03Å; K314-V317 WeakPolarHBondContact O-CA 3.41Å; K314-V317 WeakPolarHBondContact O-CB 3.33Å; K314-V317 PolarHBondContact O-N 2.96Å; V317-V320 PolarHBondContact O-N 2.81Å; V317-W321 VanDerWaalsContact O-CB 3.3Å; V317-W321 WeakPolarHBondContact O-CB 3.47Å; V317-W321 PolarHBondContact O-N 3.28Å
318V92.9Very high91.3Very high0 Ų071.8 Ų71.80%034%0.335CS..Hα-helixtrans-61.9-47.2177.8-179.80000111L289 I304 I307 A308 L313 K314 V320 W321 F322L289-V318 HydrophobicContact CD2-CG1 4.01Å; I304-V318 HydrophobicContact CG2-CB 4.18Å; I304-V318 HydrophobicContact CG2-CG1 4.02Å; I307-V318 HydrophobicContact CB-CG1 4.28Å; I307-V318 HydrophobicContact CG2-CG1 3.87Å; A308-V318 HydrophobicContact CB-CB 4.43Å; A308-V318 HydrophobicContact CB-CG2 3.82Å; L313-V318 HydrophobicContact CB-CG2 3.93Å; L313-V318 HydrophobicContact CD1-CG2 4.36Å; K314-V318 PolarHBondContact O-N 3.46Å; V318-V320 PolarHBondContact O-N 3.33Å; V318-W321 WeakPolarHBondContact O-CB 3.42Å; V318-W321 PolarHBondContact O-N 3.33Å; V318-W321 VanDerWaalsContact O-N 3.15Å; V318-F322 HydrophobicContact CG1-CD2 3.78Å; V318-F322 HydrophobicContact CG1-CE2 3.69Å; V318-F322 WeakPolarHBondContact O-CD2 3.36Å; V318-F322 PolarHBondContact O-N 3.47Å
319R94.2Very high90.8Very high79 Ų7976.1 Ų76.130%0.29836%0.355SS..Hα-helixtrans-58.3-48.5177.3-167.7-171.8-26.891.9-1.3112.4I304 K315 N316 W321 F322 C323I304-R319 HydrophobicContact CD1-CB 4.44Å; I304-R319 HydrophobicContact CD1-CG 4.17Å; I304-R319 HydrophobicContact CG2-CB 4.2Å; K315-R319 WeakPolarHBondContact O-CB 3.39Å; K315-R319 PolarHBondContact O-N 2.89Å; N316-R319 PolarHBondContact OD1-NH1 2.68Å; R319-W321 VanDerWaalsContact C-N 3.28Å; R319-W321 PolarHBondContact O-N 3.07Å; R319-F322 PolarHBondContact O-N 3.23Å; R319-C323 PolarHBondContact O-N 3.43Å; R319-C323 PolarHBondContact O-SG 3.37Å
320V92.3Very high90.4Very high64 Ų6472.9 Ų72.939%0.38834%0.338SS..Hα-helixtrans-63.1-37.3177.5170.80000110.7N316 V317 V318 C323 N324N316-V320 WeakPolarHBondContact O-CB 3.47Å; N316-V320 VanDerWaalsContact O-CG2 3.24Å; N316-V320 WeakPolarHBondContact O-CG2 3.15Å; N316-V320 PolarHBondContact O-N 3.22Å; V317-V320 PolarHBondContact O-N 2.81Å; V318-V320 PolarHBondContact O-N 3.33Å; V320-C323 PolarHBondContact O-N 3.31Å; V320-N324 WeakPolarHBondContact O-CB 3.48Å; V320-N324 VanDerWaalsContact O-CG 3.23Å; V320-N324 PolarHBondContact O-N 3.26Å
321W94.2Very high89.9Confident28 Ų2873.5 Ų73.511%0.10634%0.336CS..Hα-helixtrans-61-49.6175.6-174.398.4000111.6I281 L289 E290 F293 V317 V318 R319 C323 N324 Q325I281-W321 HydrophobicContact CD1-CG 4.47Å; L289-W321 HydrophobicContact CB-CD2 3.89Å; L289-W321 HydrophobicContact CB-CE3 3.88Å; L289-W321 HydrophobicContact CB-CH2 3.58Å; L289-W321 HydrophobicContact CB-CZ2 3.53Å; L289-W321 HydrophobicContact CB-CZ3 3.75Å; L289-W321 HydrophobicContact CD1-CD2 3.82Å; L289-W321 HydrophobicContact CD1-CE3 4.39Å; L289-W321 HydrophobicContact CD1-CG 3.83Å; L289-W321 HydrophobicContact CD2-CD2 4.35Å; L289-W321 HydrophobicContact CD2-CE3 4.11Å; L289-W321 HydrophobicContact CG-CD2 4.24Å; L289-W321 HydrophobicContact CG-CE3 4.35Å; L289-W321 VanDerWaalsContact O-CH2 3.24Å; L289-W321 WeakPolarHBondContact O-CH2 3.39Å; L289-W321 WeakPolarHBondContact O-CZ3 3.37Å; E290-W321 HydrophobicContact CG-CH2 4.21Å; E290-W321 HydrophobicContact CG-CZ2 3.94Å; F293-W321 HydrophobicContact CB-CH2 3.93Å; F293-W321 HydrophobicContact CB-CZ3 3.94Å; F293-W321 HydrophobicContact CD2-CZ3 4.15Å; F293-W321 HydrophobicContact CG-CH2 4.38Å; F293-W321 HydrophobicContact CG-CZ3 4.32Å; V317-W321 VanDerWaalsContact O-CB 3.3Å; V317-W321 WeakPolarHBondContact O-CB 3.47Å; V317-W321 PolarHBondContact O-N 3.28Å; V318-W321 WeakPolarHBondContact O-CB 3.42Å; V318-W321 PolarHBondContact O-N 3.33Å; V318-W321 VanDerWaalsContact O-N 3.15Å; R319-W321 VanDerWaalsContact C-N 3.28Å; R319-W321 PolarHBondContact O-N 3.07Å; W321-C323 VanDerWaalsContact C-N 3.32Å; W321-C323 PolarHBondContact O-N 3.17Å; W321-N324 PolarHBondContact O-N 2.99Å; W321-Q325 HydrophobicContact CE3-CB 4.25Å; W321-Q325 HydrophobicContact CH2-CB 4.11Å; W321-Q325 HydrophobicContact CH2-CG 3.75Å; W321-Q325 HydrophobicContact CZ2-CB 4.45Å; W321-Q325 HydrophobicContact CZ2-CG 4.19Å; W321-Q325 HydrophobicContact CZ3-CB 4.03Å; W321-Q325 HydrophobicContact CZ3-CG 4.07Å; W321-Q325 VanDerWaalsContact O-CB 3.29Å; W321-Q325 WeakPolarHBondContact O-CB 3.43Å; W321-Q325 PolarHBondContact O-N 3.17Å
322F94.9Very high89.2Confident4 Ų478.7 Ų78.72%0.01836%0.356CS..Hα-helixtrans-62.1-37.5177.1-86-86.9000112.5L289 F293 P299 I307 V318 R319 R326L289-F322 HydrophobicContact CD2-CE2 4.03Å; F293-F322 HydrophobicContact CB-CE1 4.14Å; F293-F322 AromaticContact CD2-CD1 3.69Å; F293-F322 HydrophobicContact CD2-CD1 3.69Å; F293-F322 AromaticContact CD2-CE1 3.9Å; F293-F322 HydrophobicContact CD2-CE1 3.9Å; F293-F322 HydrophobicContact CE2-CD1 4.39Å; P299-F322 VanDerWaalsContact CD-CD1 3.47Å; P299-F322 HydrophobicContact CG-CD1 3.59Å; P299-F322 HydrophobicContact CG-CD2 3.97Å; P299-F322 HydrophobicContact CG-CE1 3.64Å; P299-F322 HydrophobicContact CG-CE2 4.03Å; P299-F322 HydrophobicContact CG-CG 3.79Å; P299-F322 HydrophobicContact CG-CZ 3.88Å; I307-F322 HydrophobicContact CD1-CE2 4.05Å; I307-F322 HydrophobicContact CD1-CZ 3.95Å; V318-F322 HydrophobicContact CG1-CD2 3.78Å; V318-F322 HydrophobicContact CG1-CE2 3.69Å; V318-F322 WeakPolarHBondContact O-CD2 3.36Å; V318-F322 PolarHBondContact O-N 3.47Å; R319-F322 PolarHBondContact O-N 3.23Å; F322-R326 WeakPolarHBondContact O-CB 3.31Å; F322-R326 PolarHBondContact O-N 3.47Å; F322-R326 PolarHBondContact O-NH1 3.14Å
323C91.3Very high88.3Confident21 Ų2173.5 Ų73.514%0.14234%0.339CS..Hα-helixtrans-63.1-49.2173.8-74.40000112.1R319 V320 W321 Q325 R326 Q327R319-C323 PolarHBondContact O-N 3.43Å; R319-C323 PolarHBondContact O-SG 3.37Å; V320-C323 PolarHBondContact O-N 3.31Å; W321-C323 VanDerWaalsContact C-N 3.32Å; W321-C323 PolarHBondContact O-N 3.17Å; C323-Q325 VanDerWaalsContact C-N 3.32Å; C323-Q325 PolarHBondContact O-N 3.46Å; C323-R326 PolarHBondContact O-N 3.37Å; C323-R326 PolarHBondContact SG-NH2 2.93Å; C323-Q327 WeakPolarHBondContact O-CG 3.14Å; C323-Q327 PolarHBondContact O-N 3.42Å
324N92Very high87.1Confident85 Ų8577.9 Ų77.946%0.45536%0.355SS..Hα-helixtrans-64-38.6178.3-71.6-10.4000111.8V320 W321 Q327 K328V320-N324 WeakPolarHBondContact O-CB 3.48Å; V320-N324 VanDerWaalsContact O-CG 3.23Å; V320-N324 PolarHBondContact O-N 3.26Å; W321-N324 PolarHBondContact O-N 2.99Å; N324-Q327 PolarHBondContact O-N 3.25Å; N324-K328 WeakPolarHBondContact O-CB 3.39Å; N324-K328 PolarHBondContact O-N 2.9Å
325Q91.9Very high86Confident38 Ų3873.8 Ų73.818%0.17834%0.343CS..Hα-helixtrans-66.5-41.8178.9-167.568-400111.2F293 W321 C323 K328 Q329F293-Q325 HydrophobicContact CD1-CG 3.85Å; F293-Q325 HydrophobicContact CD2-CB 4.05Å; F293-Q325 HydrophobicContact CD2-CG 3.69Å; F293-Q325 HydrophobicContact CE1-CG 3.79Å; F293-Q325 HydrophobicContact CE2-CB 3.84Å; F293-Q325 HydrophobicContact CE2-CG 3.65Å; F293-Q325 HydrophobicContact CG-CG 3.79Å; F293-Q325 HydrophobicContact CZ-CB 4.23Å; F293-Q325 HydrophobicContact CZ-CG 3.71Å; W321-Q325 HydrophobicContact CE3-CB 4.25Å; W321-Q325 HydrophobicContact CH2-CB 4.11Å; W321-Q325 HydrophobicContact CH2-CG 3.75Å; W321-Q325 HydrophobicContact CZ2-CB 4.45Å; W321-Q325 HydrophobicContact CZ2-CG 4.19Å; W321-Q325 HydrophobicContact CZ3-CB 4.03Å; W321-Q325 HydrophobicContact CZ3-CG 4.07Å; W321-Q325 VanDerWaalsContact O-CB 3.29Å; W321-Q325 WeakPolarHBondContact O-CB 3.43Å; W321-Q325 PolarHBondContact O-N 3.17Å; C323-Q325 VanDerWaalsContact C-N 3.32Å; C323-Q325 PolarHBondContact O-N 3.46Å; Q325-K328 WeakPolarHBondContact O-CB 3.25Å; Q325-K328 PolarHBondContact O-N 3.06Å; Q325-K328 VanDerWaalsContact O-N 3.16Å; Q325-Q329 PolarHBondContact O-N 3Å
326R92.1Very high84.6Confident87 Ų8773.2 Ų73.233%0.32835%0.345SS..Hα-helixtrans-63.5-40.6172.8-174.3173.663.6-96.70.5112.4F293 F322 C323 K328 Q329 K330F293-R326 HydrophobicContact CE2-CB 4.49Å; F322-R326 WeakPolarHBondContact O-CB 3.31Å; F322-R326 PolarHBondContact O-N 3.47Å; F322-R326 PolarHBondContact O-NH1 3.14Å; C323-R326 PolarHBondContact O-N 3.37Å; C323-R326 PolarHBondContact SG-NH2 2.93Å; R326-K328 VanDerWaalsContact C-N 3.3Å; R326-K328 PolarHBondContact O-N 3.18Å; R326-Q329 PolarHBondContact O-N 3.39Å; R326-K330 WeakPolarHBondContact O-CB 3.35Å; R326-K330 PolarHBondContact O-N 3Å
327Q85Confident83Confident107 Ų10771.2 Ų71.250%0.534%0.342SS..Hα-helixtrans-62.7-38.4172.7-71.6176.55.700111.7C323 N324 R331C323-Q327 WeakPolarHBondContact O-CG 3.14Å; C323-Q327 PolarHBondContact O-N 3.42Å; N324-Q327 PolarHBondContact O-N 3.25Å; Q327-R331 WeakPolarHBondContact O-CG 3.33Å; Q327-R331 PolarHBondContact O-N 3.4Å
328K86.4Confident81.2Confident75 Ų7579.5 Ų79.533%0.32637%0.371SS..Hα-helixtrans-64.3-46.5175.2-168.1-174.2-177.9-1660111.4N324 Q325 R326 K330 R331 Y332N324-K328 WeakPolarHBondContact O-CB 3.39Å; N324-K328 PolarHBondContact O-N 2.9Å; Q325-K328 WeakPolarHBondContact O-CB 3.25Å; Q325-K328 PolarHBondContact O-N 3.06Å; Q325-K328 VanDerWaalsContact O-N 3.16Å; R326-K328 VanDerWaalsContact C-N 3.3Å; R326-K328 PolarHBondContact O-N 3.18Å; K328-K330 PolarHBondContact O-N 3.25Å; K328-R331 PolarHBondContact O-N 3Å; K328-Y332 HydrophobicContact CD-CE2 4.05Å; K328-Y332 VanDerWaalsContact CE-OH 3.31Å; K328-Y332 WeakPolarHBondContact CE-OH 3.45Å; K328-Y332 HydrophobicContact CG-CD2 4.17Å; K328-Y332 HydrophobicContact CG-CE2 3.59Å; K328-Y332 WeakPolarHBondContact O-CD2 3.39Å; K328-Y332 PolarHBondContact O-N 3.48Å; K328-Y332 VanDerWaalsContact O-N 3.12Å
329Q83.6Confident79.5Confident98 Ų9886 Ų8646%0.45841%0.405SS..Hα-helixtrans-59.8-45.7175.3-175.9178.8-13.700111.6Q325 R326 R331 Y332 S333Q325-Q329 PolarHBondContact O-N 3Å; R326-Q329 PolarHBondContact O-N 3.39Å; Q329-R331 VanDerWaalsContact C-N 3.3Å; Q329-R331 PolarHBondContact O-N 3.14Å; Q329-Y332 PolarHBondContact O-N 3.04Å; Q329-Y332 VanDerWaalsContact O-N 3.08Å; Q329-S333 PolarHBondContact O-N 3.45Å; Q329-S333 PolarHBondContact O-OG 2.93Å
330K83.7Confident77.6Confident90 Ų9091.7 Ų91.739%0.39143%0.428SS..Hα-helixtrans-59.4-40177.5-160.8-175176.4-172.20111.8R326 K328 S333 Y334R326-K330 WeakPolarHBondContact O-CB 3.35Å; R326-K330 PolarHBondContact O-N 3Å; K328-K330 PolarHBondContact O-N 3.25Å; K330-S333 PolarHBondContact O-N 3.2Å; K330-Y334 HydrophobicContact CD-CE2 3.96Å; K330-Y334 WeakPolarHBondContact CE-OH 3.27Å; K330-Y334 HydrophobicContact CG-CD2 4.23Å; K330-Y334 HydrophobicContact CG-CE2 3.56Å; K330-Y334 PolarHBondContact NZ-OH 3.22Å; K330-Y334 WeakPolarHBondContact O-CD2 3.47Å; K330-Y334 PolarHBondContact O-N 3.07Å
331R81.1Confident75.8Confident162 Ų16292.9 Ų92.961%0.61144%0.435SS*.Hα-helixtrans-62.5-39.5174-76.4-174.6-68.4156.4-2.7112.7Q327 K328 Q329 Y334 V335Q327-R331 WeakPolarHBondContact O-CG 3.33Å; Q327-R331 PolarHBondContact O-N 3.4Å; K328-R331 PolarHBondContact O-N 3Å; Q329-R331 VanDerWaalsContact C-N 3.3Å; Q329-R331 PolarHBondContact O-N 3.14Å; R331-Y334 PolarHBondContact O-N 3.01Å; R331-V335 PolarHBondContact O-N 2.88Å; R331-V335 VanDerWaalsContact O-N 3.13Å
332Y76Confident73.6Confident129 Ų12996 Ų9651%0.50646%0.459SS..Hα-helixtrans-67.2-37.3175.3-71-62.3000113K328 Q329 Y334 V335 N336K328-Y332 HydrophobicContact CD-CE2 4.05Å; K328-Y332 VanDerWaalsContact CE-OH 3.31Å; K328-Y332 WeakPolarHBondContact CE-OH 3.45Å; K328-Y332 HydrophobicContact CG-CD2 4.17Å; K328-Y332 HydrophobicContact CG-CE2 3.59Å; K328-Y332 WeakPolarHBondContact O-CD2 3.39Å; K328-Y332 PolarHBondContact O-N 3.48Å; K328-Y332 VanDerWaalsContact O-N 3.12Å; Q329-Y332 PolarHBondContact O-N 3.04Å; Q329-Y332 VanDerWaalsContact O-N 3.08Å; Y332-Y334 VanDerWaalsContact C-N 3.3Å; Y332-Y334 PolarHBondContact O-N 3.23Å; Y332-V335 HydrophobicContact CD1-CG2 4.29Å; Y332-V335 WeakPolarHBondContact O-CG2 3.35Å; Y332-V335 PolarHBondContact O-N 3.31Å; Y332-N336 PolarHBondContact O-N 3.11Å; Y332-N336 VanDerWaalsContact O-N 3.15Å; Y332-N336 PolarHBondContact O-ND2 3.23Å
333S71.4Confident71.8Confident73 Ų73103.4 Ų103.451%0.5150%0.504SS..Hα-helixtrans-61.2-39.9174.8-57.60000111.9Q329 K330 A337Q329-S333 PolarHBondContact O-N 3.45Å; Q329-S333 PolarHBondContact O-OG 2.93Å; K330-S333 PolarHBondContact O-N 3.2Å; S333-A337 PolarHBondContact O-N 3.29Å; S333-A337 VanDerWaalsContact O-N 3.14Å
334Y62.8Low69.9Low113 Ų113107 Ų10744%0.44353%0.529SS..Hα-helixtrans-69-46176.8-68.3-59.2000112.9K330 R331 Y332 N336 A337 W338K330-Y334 HydrophobicContact CD-CE2 3.96Å; K330-Y334 WeakPolarHBondContact CE-OH 3.27Å; K330-Y334 HydrophobicContact CG-CD2 4.23Å; K330-Y334 HydrophobicContact CG-CE2 3.56Å; K330-Y334 PolarHBondContact NZ-OH 3.22Å; K330-Y334 WeakPolarHBondContact O-CD2 3.47Å; K330-Y334 PolarHBondContact O-N 3.07Å; R331-Y334 PolarHBondContact O-N 3.01Å; Y332-Y334 VanDerWaalsContact C-N 3.3Å; Y332-Y334 PolarHBondContact O-N 3.23Å; Y334-N336 PolarHBondContact O-N 3.14Å; Y334-A337 PolarHBondContact O-N 2.95Å; Y334-A337 VanDerWaalsContact O-N 3.07Å; Y334-W338 PolarHBondContact O-N 3.42Å
335V64.9Low68.2Low74 Ų74107.3 Ų107.345%0.44854%0.544SS..Hα-helixtrans-62.5-32.8179.7-61.80000112.3R331 Y332 W338 L339R331-V335 PolarHBondContact O-N 2.88Å; R331-V335 VanDerWaalsContact O-N 3.13Å; Y332-V335 HydrophobicContact CD1-CG2 4.29Å; Y332-V335 WeakPolarHBondContact O-CG2 3.35Å; Y332-V335 PolarHBondContact O-N 3.31Å; V335-W338 PolarHBondContact O-N 3.36Å; V335-L339 WeakPolarHBondContact O-CG 3.47Å; V335-L339 PolarHBondContact O-N 3.47Å; V335-L339 VanDerWaalsContact O-N 3.16Å
336N61.7Low66.4Low92 Ų92115.5 Ų115.549%0.49258%0.579SS.*Hα-helixtrans-70.6-37.2173.7-71.1-29.4000112.1Y332 Y334 W338 L339 Y340Y332-N336 PolarHBondContact O-N 3.11Å; Y332-N336 VanDerWaalsContact O-N 3.15Å; Y332-N336 PolarHBondContact O-ND2 3.23Å; Y334-N336 PolarHBondContact O-N 3.14Å; N336-W338 VanDerWaalsContact C-N 3.34Å; N336-L339 PolarHBondContact O-N 3Å; N336-Y340 PolarHBondContact O-N 2.96Å
337A58.4Low64.2Low52 Ų52120 Ų12043%0.4360%0.604SS.*Hα-helixtrans-67-34.7174.300000112.5S333 Y334 L339 T341S333-A337 PolarHBondContact O-N 3.29Å; S333-A337 VanDerWaalsContact O-N 3.14Å; Y334-A337 PolarHBondContact O-N 2.95Å; Y334-A337 VanDerWaalsContact O-N 3.07Å; A337-L339 VanDerWaalsContact C-N 3.34Å; A337-T341 WeakPolarHBondContact O-CG2 3.29Å; A337-T341 PolarHBondContact O-N 2.98Å; A337-T341 PolarHBondContact O-OG1 3.13Å
338W54.8Low62.6Low199 Ų199122 Ų12275%0.75462%0.623SS**Hα-helixtrans-73.5-21.1175.4-78106.2000113.7Y334 V335 N336Y334-W338 PolarHBondContact O-N 3.42Å; V335-W338 PolarHBondContact O-N 3.36Å; N336-W338 VanDerWaalsContact C-N 3.34Å
339L57.5Low60.7Low137 Ų137126.8 Ų126.872%0.71768%0.677SS**Hα-helixtrans-91.5-16.4176.6-71.2172.1000113.8V335 N336 A337V335-L339 WeakPolarHBondContact O-CG 3.47Å; V335-L339 PolarHBondContact O-N 3.47Å; V335-L339 VanDerWaalsContact O-N 3.16Å; N336-L339 PolarHBondContact O-N 3Å; A337-L339 VanDerWaalsContact C-N 3.34Å
340Y53Low59.5Low198 Ų198128.2 Ų128.278%0.77669%0.688SS**SBendtrans-118.413.4-177.7-82-84.8000114.2N336 P342N336-Y340 PolarHBondContact O-N 2.96Å; Y340-P342 WeakPolarHBondContact O-CD 3.44Å
341T54.5Low58.2Low88 Ų88130.2 Ų130.254%0.5470%0.704SS.*  trans-79.7109.716921.60000108.5A337 V343A337-T341 WeakPolarHBondContact O-CG2 3.29Å; A337-T341 PolarHBondContact O-N 2.98Å; A337-T341 PolarHBondContact O-OG1 3.13Å; T341-V343 PolarHBondContact O-N 3.07Å
342P47.8Very low57Low95 Ų95128.4 Ų128.462%0.61771%0.709SS**  trans-64.5129.7176.426.8-32.3000109Y340 S344Y340-P342 WeakPolarHBondContact O-CD 3.44Å; P342-S344 PolarHBondContact O-N 3.17Å
343V57.5Low55.9Low159 Ų159128.4 Ų128.496%0.96472%0.721SS**SBendtrans-72.258.3171.3-171.40000108.8T341T341-V343 PolarHBondContact O-N 3.07Å
344S52.3Low54.9Low96 Ų96131.9 Ų131.967%0.67173%0.734SS**  trans-135.716-176.468.70000113.2P342P342-S344 PolarHBondContact O-N 3.17Å
345A56.3Low54.4Low92 Ų92133.1 Ų133.176%0.7675%0.753SS**SBendtrans-108.215.8-178.300000114.2
346F54.2Low53.6Low209 Ų209137.4 Ų137.492%0.91778%0.775SS**SBendtrans-125.614.4-178.2-106.5-79.2000116
347E45.3Very low53Low182 Ų182140.8 Ų140.885%0.8580%0.797SS**  trans-141.991.6179.3-141.3163.4162.700109.2
348T50.7Low52.5Low148 Ų148148.3 Ų148.391%0.90883%0.827SS**  trans170.6126.8147.3-67.20000109.2
349A46.7Very low52.3Low176 Ų176143.6 Ų143.6100%1.45583%0.834SS**  trans89.20176.500000117

Retrieved 349 of 349 residues in 71 ms (Link to these results)