APOA1_PANTR Loading...

Apolipoprotein A-I

Participates in the reverse transport of cholesterol from tissues to the liver for excretion by promoting cholesterol efflux from tissues and by acting as a cofactor for the lecithin cholesterol acyltransferase (LCAT). As part of the SPAP complex, activates spermatozoa motility (By similarity).

AlphaFold DB , UniProt , Accession P0DJG0, Species PANTR (Pan troglodytes, Chimpanzee), Gene APOA1, Length 267 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
1M49.2Very low54.5Low159 Ų15998.9 Ų98.978%0.78358%0.575SS**  0-22.50-63.9-123.7-101.900114.6L66M1-L66 HydrophobicContact CE-CD1 3.51Å
2K41.2Very low54.8Low127 Ų127104.1 Ų104.155%0.55259%0.586SS**Hα-helixtrans-75.7-23.7173.8-64.4-175.9179.8-177.70114.5
3A53.4Low54.7Low74 Ų74106.5 Ų106.561%0.61260%0.595SS**Hα-helixtrans-74-26.2177.800000113.9T7A3-T7 WeakPolarHBondContact O-CB 3.5Å; A3-T7 WeakPolarHBondContact O-CG2 3.36Å; A3-T7 PolarHBondContact O-N 3.4Å; A3-T7 VanDerWaalsContact O-N 3.14Å; A3-T7 PolarHBondContact O-OG1 3Å
4A56.2Low55Low59 Ų59105 Ų10549%0.48859%0.59SS.*Hα-helixtrans-77.2-32.7-176.600000113T7 L8A4-T7 WeakPolarHBondContact CA-OG1 3.19Å; A4-T7 PolarHBondContact O-OG1 3.42Å; A4-L8 PolarHBondContact O-N 2.94Å
5V54.9Low54.3Low110 Ų110101.6 Ų101.667%0.66759%0.588SS**Hα-helixtrans-79.3-34.8178.3-178.50000111.1L8 A9V5-L8 PolarHBondContact O-N 2.88Å; V5-A9 PolarHBondContact O-N 3.28Å; V5-A9 VanDerWaalsContact O-N 3.15Å
6L54.1Low54.1Low119 Ų119100.8 Ų100.862%0.62359%0.59SS**Hα-helixtrans-70.5-34.1175-84163.3000112.7V10L6-V10 VanDerWaalsContact O-CG2 3.28Å; L6-V10 WeakPolarHBondContact O-CG2 3.38Å; L6-V10 PolarHBondContact O-N 3.06Å; L6-V10 VanDerWaalsContact O-N 3.12Å
7T60.1Low53.7Low82 Ų82103.9 Ų103.950%0.50360%0.597SS.*Hα-helixtrans-69.9-34.2174.341.60000112.4A3 A4 L11A3-T7 WeakPolarHBondContact O-CB 3.5Å; A3-T7 WeakPolarHBondContact O-CG2 3.36Å; A3-T7 PolarHBondContact O-N 3.4Å; A3-T7 VanDerWaalsContact O-N 3.14Å; A3-T7 PolarHBondContact O-OG1 3Å; A4-T7 WeakPolarHBondContact CA-OG1 3.19Å; A4-T7 PolarHBondContact O-OG1 3.42Å; T7-L11 WeakPolarHBondContact O-CB 3.41Å; T7-L11 PolarHBondContact O-N 3.45Å
8L54Low53.4Low108 Ų108101.9 Ų101.957%0.56560%0.596SS**Hα-helixtrans-70.4-36.2176.1-126.6136.7000112.6A4 V5 F12A4-L8 PolarHBondContact O-N 2.94Å; V5-L8 PolarHBondContact O-N 2.88Å; L8-F12 HydrophobicContact CD2-CD2 4.3Å; L8-F12 HydrophobicContact CD2-CE2 4.09Å; L8-F12 WeakPolarHBondContact O-CD2 3.2Å; L8-F12 PolarHBondContact O-N 2.98Å
9A59.1Low53Low49 Ų49109.4 Ų109.441%0.40561%0.613SS.*Hα-helixtrans-70.3-37.9174.700000112.6V5 F12 L13V5-A9 PolarHBondContact O-N 3.28Å; V5-A9 VanDerWaalsContact O-N 3.15Å; A9-F12 PolarHBondContact O-N 3.42Å; A9-L13 PolarHBondContact O-N 3.13Å
10V59.7Low52.9Low86 Ų86113.2 Ų113.252%0.52163%0.625SS.*Hα-helixtrans-69.8-33.9175.5174.40000111.5L6 L13 T14L6-V10 VanDerWaalsContact O-CG2 3.28Å; L6-V10 WeakPolarHBondContact O-CG2 3.38Å; L6-V10 PolarHBondContact O-N 3.06Å; L6-V10 VanDerWaalsContact O-N 3.12Å; V10-L13 PolarHBondContact O-N 2.87Å; V10-T14 HydrophobicContact CG1-CG2 4.1Å; V10-T14 WeakPolarHBondContact O-CB 3.43Å; V10-T14 WeakPolarHBondContact O-CG2 3.4Å; V10-T14 PolarHBondContact O-N 2.69Å; V10-T14 PolarHBondContact O-OG1 3.23Å
11L58.1Low52.6Low115 Ų115116.3 Ų116.360%0.60263%0.633SS**Hα-helixtrans-65.8-34.9175-103.8153.5000113.3T7 G15T7-L11 WeakPolarHBondContact O-CB 3.41Å; T7-L11 PolarHBondContact O-N 3.45Å; L11-G15 PolarHBondContact O-N 2.92Å
12F57.7Low52.5Low161 Ų161119.8 Ų119.871%0.70664%0.637SS**Hα-helixtrans-75.2-31.6175.6-93.9-90000113.3L8 A9L8-F12 HydrophobicContact CD2-CD2 4.3Å; L8-F12 HydrophobicContact CD2-CE2 4.09Å; L8-F12 WeakPolarHBondContact O-CD2 3.2Å; L8-F12 PolarHBondContact O-N 2.98Å; A9-F12 PolarHBondContact O-N 3.42Å
13L53.9Low52.7Low135 Ų135122.9 Ų122.971%0.70765%0.654SS**Hα-helixtrans-82.2-27.4177.2-89.4140.4000113.5A9 V10A9-L13 PolarHBondContact O-N 3.13Å; V10-L13 PolarHBondContact O-N 2.87Å
14T57.8Low52.1Low86 Ų86127.3 Ų127.353%0.52866%0.662SS.*Hα-helixtrans-89.9-20.8175.154.10000113.2V10V10-T14 HydrophobicContact CG1-CG2 4.1Å; V10-T14 WeakPolarHBondContact O-CB 3.43Å; V10-T14 WeakPolarHBondContact O-CG2 3.4Å; V10-T14 PolarHBondContact O-N 2.69Å; V10-T14 PolarHBondContact O-OG1 3.23Å
15G44.7Very low51.4Low54 Ų54131.6 Ų131.656%0.55768%0.676SS**THydrogen-bonded Turntrans-73.1-19.517600000115.3L11L11-G15 PolarHBondContact O-N 2.92Å
16S51.8Low51.3Low89 Ų89135.2 Ų135.262%0.62269%0.686SS**THydrogen-bonded Turntrans-89.4-12-179.877.80000114.5
17Q46.8Very low51.4Low153 Ų153134.8 Ų134.872%0.71569%0.69SS**SBendtrans-101.4-8-179.7-68.2-73.2-4.600113.8R19Q17-R19 PolarHBondContact O-N 3.49Å
18A47.9Very low50.9Low69 Ų69137.1 Ų137.157%0.5771%0.707SS**THydrogen-bonded Turntrans-82.6-4.3-174.500000115.2
19R47.5Very low50.9Low243 Ų243138.4 Ų138.492%0.91771%0.71SS**THydrogen-bonded Turntrans-88.4-4.9-174.5-151.8172-174162.72114.6Q17Q17-R19 PolarHBondContact O-N 3.49Å
20H50.9Low50.9Low186 Ų186138.8 Ų138.886%0.86171%0.71SS**SBendtrans-108.1-0.9-172.2-134.4-68.9000115.3
21F46.6Very low50.8Low179 Ų179139.7 Ų139.779%0.78572%0.717SS**SBendtrans-114.9-6-169.2-157-98.2000116.4
22W45.6Very low50.8Low232 Ų232142.3 Ų142.388%0.87972%0.719SS**  trans-11045.6-174.1-87.481.9000114.3
23Q46.4Very low51.4Low191 Ų191139.7 Ų139.789%0.89371%0.713SS**  trans-89.787.8159.6-85.4-179.4-1100109
24Q39.8Very low51.7Low167 Ų167140 Ų14078%0.7871%0.705SS**SBendtrans-165.9114.3154.5-111.2162.9-4.400110
25D42.5Very low52.3Low149 Ų149139.6 Ų139.680%0.79770%0.701SS**  trans49.590.9151.9-67-58.2000119
26E52.2Low53.6Low187 Ų187142.7 Ų142.787%0.87470%0.7SS**  trans-173.8144.2138.3-103.6172.4170.100111.1
27P55.6Low54.6Low109 Ų109143.8 Ų143.871%0.70870%0.699SS**  trans-66.5147.8-167.725.5-32.2000113.1Q29P27-Q29 PolarHBondContact O-N 3.44Å
28P50.2Low55.6Low131 Ų131142.2 Ų142.285%0.85169%0.694SS**  trans-73.7101.4-159.329-34.1000112.2S30P28-S30 PolarHBondContact O-N 3.01Å
29Q53.8Low56.8Low135 Ų135141.2 Ų141.263%0.63169%0.686SS**  trans-68.6121.4156.9-75.1-174.3-33.800109.2P27 P31 R34P27-Q29 PolarHBondContact O-N 3.44Å; Q29-P31 VanDerWaalsContact O-N 3.1Å; Q29-R34 VanDerWaalsContact OE1-NH2 3.14Å
30S58.9Low57.9Low58 Ų58133.6 Ų133.641%0.40667%0.667SS.*  trans20.281.1136.71760000116.5P28 W32 D33 R34P28-S30 PolarHBondContact O-N 3.01Å; S30-W32 PolarHBondContact O-N 3.02Å; S30-D33 PolarHBondContact O-N 3.39Å; S30-R34 PolarHBondContact O-N 3.03Å
31P58.2Low58.9Low104 Ų104128.9 Ų128.968%0.67565%0.651SS**Hα-helixtrans-56.2-17.8177.821.1-32.3000112.4Q29 V35Q29-P31 VanDerWaalsContact O-N 3.1Å; P31-V35 WeakPolarHBondContact O-CG2 3.4Å
32W59.1Low59.6Low170 Ų170128.7 Ų128.764%0.64465%0.646SS**Hα-helixtrans-82.4-32.2176-143-138.6000114.9S30 V35 K36S30-W32 PolarHBondContact O-N 3.02Å; W32-V35 HydrophobicContact CE3-CB 4.39Å; W32-V35 HydrophobicContact CZ3-CG1 4.23Å; W32-K36 WeakPolarHBondContact O-CB 3.39Å; W32-K36 WeakPolarHBondContact O-CG 3.47Å; W32-K36 PolarHBondContact O-N 3.41Å
33D69.5Low60.6Low106 Ų106122 Ų12257%0.56763%0.631SS**Hα-helixtrans-71.1-40.3178-76.5-73.2000111.2S30 V35 K36 D37S30-D33 PolarHBondContact O-N 3.39Å; D33-V35 VanDerWaalsContact C-N 3.35Å; D33-V35 PolarHBondContact O-N 2.91Å; D33-K36 PolarHBondContact O-N 2.66Å; D33-D37 PolarHBondContact O-N 3.06Å
34R60.9Low61.7Low143 Ų143117.2 Ų117.254%0.5461%0.612SS.*Hα-helixtrans-68.5-33.9178.9-149.1177.1-73.4176.7-6.9112.5Q29 S30 L38Q29-R34 VanDerWaalsContact OE1-NH2 3.14Å; S30-R34 PolarHBondContact O-N 3.03Å; R34-L38 WeakPolarHBondContact O-CB 3.27Å; R34-L38 WeakPolarHBondContact O-CG 3.45Å; R34-L38 PolarHBondContact O-N 3.24Å; R34-L38 VanDerWaalsContact O-N 3.13Å
35V69.9Low63Low76 Ų76113.4 Ų113.446%0.46160%0.599SS.*Hα-helixtrans-71-39.5173.9171.30000111.3P31 W32 D33 A39P31-V35 WeakPolarHBondContact O-CG2 3.4Å; W32-V35 HydrophobicContact CE3-CB 4.39Å; W32-V35 HydrophobicContact CZ3-CG1 4.23Å; D33-V35 VanDerWaalsContact C-N 3.35Å; D33-V35 PolarHBondContact O-N 2.91Å; V35-A39 WeakPolarHBondContact O-CB 3.4Å; V35-A39 PolarHBondContact O-N 3.26Å
36K71.8Confident63.9Low120 Ų120111.9 Ų111.952%0.52259%0.59SS.*Hα-helixtrans-64.1-43.3175.7-80.3179.7178.2-179.70112W32 D33 A39 T40W32-K36 WeakPolarHBondContact O-CB 3.39Å; W32-K36 WeakPolarHBondContact O-CG 3.47Å; W32-K36 PolarHBondContact O-N 3.41Å; D33-K36 PolarHBondContact O-N 2.66Å; K36-A39 PolarHBondContact O-N 2.68Å; K36-T40 WeakPolarHBondContact O-CB 3.14Å; K36-T40 PolarHBondContact O-N 3.49Å; K36-T40 PolarHBondContact O-OG1 3Å
37D72Confident64.4Low112 Ų112110.4 Ų110.460%0.59958%0.581SS**Hα-helixtrans-64.6-46.1179.7-148.2-94.5000110.9D33 A39 T40 V41D33-D37 PolarHBondContact O-N 3.06Å; D37-A39 PolarHBondContact O-N 2.93Å; D37-T40 PolarHBondContact O-N 2.86Å; D37-V41 WeakPolarHBondContact O-CG2 3.49Å; D37-V41 PolarHBondContact O-N 3.45Å
38L69Low64.8Low119 Ų119110.5 Ų110.562%0.62358%0.576SS**Hα-helixtrans-61.7-42.6174.5-79.2167.9000113R34 T40 Y42R34-L38 WeakPolarHBondContact O-CB 3.27Å; R34-L38 WeakPolarHBondContact O-CG 3.45Å; R34-L38 PolarHBondContact O-N 3.24Å; R34-L38 VanDerWaalsContact O-N 3.13Å; L38-T40 VanDerWaalsContact C-N 3.32Å; L38-T40 PolarHBondContact O-N 3.26Å; L38-Y42 WeakPolarHBondContact O-CB 3.39Å; L38-Y42 PolarHBondContact O-N 3.4Å
39A73.1Confident65.3Low49 Ų49106.7 Ų106.741%0.40555%0.552SS.*Hα-helixtrans-64.2-39.6177.200000111.4V35 K36 D37 Y42 V43V35-A39 WeakPolarHBondContact O-CB 3.4Å; V35-A39 PolarHBondContact O-N 3.26Å; K36-A39 PolarHBondContact O-N 2.68Å; D37-A39 PolarHBondContact O-N 2.93Å; A39-Y42 PolarHBondContact O-N 3.44Å; A39-V43 VanDerWaalsContact O-CB 3.31Å; A39-V43 WeakPolarHBondContact O-CB 3.4Å; A39-V43 WeakPolarHBondContact O-CG2 3.39Å; A39-V43 PolarHBondContact O-N 3.28Å
40T69.4Low65.5Low83 Ų83101.8 Ų101.851%0.50954%0.538SS..Hα-helixtrans-68.1-45.7-179.2-50.50000110.8K36 D37 L38 Y42 V43 D44K36-T40 WeakPolarHBondContact O-CB 3.14Å; K36-T40 PolarHBondContact O-N 3.49Å; K36-T40 PolarHBondContact O-OG1 3Å; D37-T40 PolarHBondContact O-N 2.86Å; L38-T40 VanDerWaalsContact C-N 3.32Å; L38-T40 PolarHBondContact O-N 3.26Å; T40-Y42 VanDerWaalsContact C-N 3.33Å; T40-Y42 PolarHBondContact O-N 3.46Å; T40-V43 PolarHBondContact O-N 3.43Å; T40-D44 PolarHBondContact O-N 3.34Å
41V72.5Confident65.5Low86 Ų86108.7 Ų108.752%0.52156%0.555SS.*Hα-helixtrans-62-41.1176.41750000111.4D37 V45D37-V41 WeakPolarHBondContact O-CG2 3.49Å; D37-V41 PolarHBondContact O-N 3.45Å; V41-V45 WeakPolarHBondContact O-CB 3.31Å; V41-V45 VanDerWaalsContact O-CG2 3.27Å; V41-V45 WeakPolarHBondContact O-CG2 3.25Å; V41-V45 PolarHBondContact O-N 2.92Å
42Y61.7Low65.7Low175 Ų175109.8 Ų109.869%0.68656%0.555SS**Hα-helixtrans-68.5-36.9178.4-140.4-91.5000112.2L38 A39 T40 L46L38-Y42 WeakPolarHBondContact O-CB 3.39Å; L38-Y42 PolarHBondContact O-N 3.4Å; A39-Y42 PolarHBondContact O-N 3.44Å; T40-Y42 VanDerWaalsContact C-N 3.33Å; T40-Y42 PolarHBondContact O-N 3.46Å; Y42-L46 WeakPolarHBondContact O-CB 3.21Å; Y42-L46 PolarHBondContact O-N 3.36Å
43V67.1Low65.7Low92 Ų92109.3 Ų109.356%0.55856%0.555SS**Hα-helixtrans-70.1-39.9177.5168.80000111.5A39 T40 L46 K47A39-V43 VanDerWaalsContact O-CB 3.31Å; A39-V43 WeakPolarHBondContact O-CB 3.4Å; A39-V43 WeakPolarHBondContact O-CG2 3.39Å; A39-V43 PolarHBondContact O-N 3.28Å; T40-V43 PolarHBondContact O-N 3.43Å; V43-L46 PolarHBondContact O-N 3.36Å; V43-K47 VanDerWaalsContact O-CB 3.25Å; V43-K47 WeakPolarHBondContact O-CB 3.22Å; V43-K47 PolarHBondContact O-N 2.91Å
44D69.3Low65.1Low91 Ų91108.3 Ų108.349%0.48755%0.552SS.*Hα-helixtrans-65.9-46.6176.3-109.9-89.5000111.5T40 L46 K47 D48T40-D44 PolarHBondContact O-N 3.34Å; D44-L46 VanDerWaalsContact C-N 3.3Å; D44-L46 PolarHBondContact O-N 2.83Å; D44-K47 PolarHBondContact O-N 3.08Å; D44-K47 VanDerWaalsContact O-N 3.16Å; D44-D48 PolarHBondContact O-N 3.01Å
45V65.4Low65.1Low86 Ų86105.2 Ų105.252%0.52155%0.552SS.*Hα-helixtrans-61.6-38.8176.4172.60000111.3V41 S49V41-V45 WeakPolarHBondContact O-CB 3.31Å; V41-V45 VanDerWaalsContact O-CG2 3.27Å; V41-V45 WeakPolarHBondContact O-CG2 3.25Å; V41-V45 PolarHBondContact O-N 2.92Å; V45-S49 WeakPolarHBondContact O-CB 3.09Å; V45-S49 PolarHBondContact O-N 2.79Å; V45-S49 PolarHBondContact O-OG 2.65Å
46L62.7Low64.5Low117 Ų117108.6 Ų108.661%0.61356%0.563SS**Hα-helixtrans-71.7-32.3178.1-16174.8000112.4Y42 V43 D44 G50Y42-L46 WeakPolarHBondContact O-CB 3.21Å; Y42-L46 PolarHBondContact O-N 3.36Å; V43-L46 PolarHBondContact O-N 3.36Å; D44-L46 VanDerWaalsContact C-N 3.3Å; D44-L46 PolarHBondContact O-N 2.83Å; L46-G50 WeakPolarHBondContact O-CA 3.16Å; L46-G50 PolarHBondContact O-N 2.83Å
47K62.9Low63.7Low156 Ų156108.3 Ų108.368%0.67856%0.562SS**Hα-helixtrans-73-41.8179.4-171.7177.4178.7-176.30112.1V43 D44V43-K47 VanDerWaalsContact O-CB 3.25Å; V43-K47 WeakPolarHBondContact O-CB 3.22Å; V43-K47 PolarHBondContact O-N 2.91Å; D44-K47 PolarHBondContact O-N 3.08Å; D44-K47 VanDerWaalsContact O-N 3.16Å
48D63.5Low62.8Low112 Ų112111.1 Ų111.160%0.59957%0.572SS**Hα-helixtrans-74.9-41.6175.4-83.5-26.1000111.8D44 G50 R51 D52D44-D48 PolarHBondContact O-N 3.01Å; D48-G50 VanDerWaalsContact C-N 3.32Å; D48-G50 PolarHBondContact O-N 3.31Å; D48-R51 PolarHBondContact O-N 2.68Å; D48-D52 PolarHBondContact O-N 2.94Å
49S61.2Low62.2Low51 Ų51109 Ų10936%0.35758%0.579SS.*Hα-helixtrans-65.5-36.6175.7-570000111.7V45 R51 Y53V45-S49 WeakPolarHBondContact O-CB 3.09Å; V45-S49 PolarHBondContact O-N 2.79Å; V45-S49 PolarHBondContact O-OG 2.65Å; S49-R51 VanDerWaalsContact C-N 3.31Å; S49-R51 PolarHBondContact O-N 3.01Å; S49-Y53 WeakPolarHBondContact O-CB 3.28Å; S49-Y53 VanDerWaalsContact O-CD2 3.27Å; S49-Y53 WeakPolarHBondContact O-CD2 3.28Å; S49-Y53 PolarHBondContact O-N 2.77Å
50G57.4Low61.3Low32 Ų32109.4 Ų109.433%0.3358%0.578SS.*Hα-helixtrans-63.6-33.9-18000000113.5L46 D48 V54L46-G50 WeakPolarHBondContact O-CA 3.16Å; L46-G50 PolarHBondContact O-N 2.83Å; D48-G50 VanDerWaalsContact C-N 3.32Å; D48-G50 PolarHBondContact O-N 3.31Å; G50-V54 VanDerWaalsContact O-CB 3.25Å; G50-V54 WeakPolarHBondContact O-CB 3.49Å; G50-V54 WeakPolarHBondContact O-CG2 3.39Å; G50-V54 PolarHBondContact O-N 3.4Å
51R58.8Low60.5Low202 Ų202108.3 Ų108.376%0.76258%0.578SS**Hα-helixtrans-78.5-38.1-176.8-159.1174.7-172.2166.51.4112.7D48 S49 S55D48-R51 PolarHBondContact O-N 2.68Å; S49-R51 VanDerWaalsContact C-N 3.31Å; S49-R51 PolarHBondContact O-N 3.01Å; R51-S55 PolarHBondContact O-N 3.19Å; R51-S55 PolarHBondContact O-OG 3.49Å
52D63.5Low59.4Low127 Ų127106.4 Ų106.468%0.67956%0.564SS**Hα-helixtrans-71.3-41.6174.5-109.7-32000111.6D48 S55 Q56D48-D52 PolarHBondContact O-N 2.94Å; D52-S55 PolarHBondContact O-N 3.4Å; D52-Q56 PolarHBondContact O-N 2.99Å; D52-Q56 VanDerWaalsContact O-N 3.16Å
53Y58.3Low59Low161 Ų161101.6 Ų101.663%0.63157%0.568SS**Hα-helixtrans-66.5-40.8176.7-89.9-84.8000112.4S49 S55 Q56 F57S49-Y53 WeakPolarHBondContact O-CB 3.28Å; S49-Y53 VanDerWaalsContact O-CD2 3.27Å; S49-Y53 WeakPolarHBondContact O-CD2 3.28Å; S49-Y53 PolarHBondContact O-N 2.77Å; Y53-S55 PolarHBondContact O-N 3.45Å; Y53-Q56 PolarHBondContact O-N 2.91Å; Y53-F57 VanDerWaalsContact O-CB 3.28Å; Y53-F57 WeakPolarHBondContact O-CB 3.33Å; Y53-F57 PolarHBondContact O-N 2.75Å
54V57Low58.5Low84 Ų84105.5 Ų105.551%0.50958%0.577SS.*Hα-helixtrans-61.6-42.7177.3158.90000111.7G50 Q56 F57 E58G50-V54 VanDerWaalsContact O-CB 3.25Å; G50-V54 WeakPolarHBondContact O-CB 3.49Å; G50-V54 WeakPolarHBondContact O-CG2 3.39Å; G50-V54 PolarHBondContact O-N 3.4Å; V54-Q56 VanDerWaalsContact C-N 3.29Å; V54-Q56 PolarHBondContact O-N 3.44Å; V54-F57 PolarHBondContact O-N 2.62Å; V54-E58 PolarHBondContact O-N 3.36Å
55S60.7Low57.6Low79 Ų79105.8 Ų105.855%0.55258%0.576SS**Hα-helixtrans-64.8-34.6178.5-50.50000112.2R51 D52 Y53R51-S55 PolarHBondContact O-N 3.19Å; R51-S55 PolarHBondContact O-OG 3.49Å; D52-S55 PolarHBondContact O-N 3.4Å; Y53-S55 PolarHBondContact O-N 3.45Å
56Q57.5Low57.2Low146 Ų146104.5 Ų104.568%0.68257%0.566SS**Hα-helixtrans-81.6-23.2177.3-150176.255.400112.8D52 Y53 V54 S60D52-Q56 PolarHBondContact O-N 2.99Å; D52-Q56 VanDerWaalsContact O-N 3.16Å; Y53-Q56 PolarHBondContact O-N 2.91Å; V54-Q56 VanDerWaalsContact C-N 3.29Å; V54-Q56 PolarHBondContact O-N 3.44Å; Q56-S60 WeakPolarHBondContact O-CB 3.23Å; Q56-S60 PolarHBondContact O-N 3.34Å
57F54.1Low56.4Low115 Ų115105.8 Ų105.850%0.50457%0.573SS.*Hα-helixtrans-83.1-31.2177.7-138.7-88.9000112.6Y53 V54 G59 S60 L62Y53-F57 VanDerWaalsContact O-CB 3.28Å; Y53-F57 WeakPolarHBondContact O-CB 3.33Å; Y53-F57 PolarHBondContact O-N 2.75Å; V54-F57 PolarHBondContact O-N 2.62Å; F57-G59 VanDerWaalsContact C-N 3.27Å; F57-G59 PolarHBondContact O-N 2.92Å; F57-S60 PolarHBondContact O-N 3.08Å; F57-L62 HydrophobicContact CD1-CD1 4.02Å; F57-L62 HydrophobicContact CD2-CD1 3.52Å; F57-L62 HydrophobicContact CE1-CB 4.21Å; F57-L62 HydrophobicContact CE1-CD1 3.82Å; F57-L62 HydrophobicContact CE2-CD1 3.32Å; F57-L62 HydrophobicContact CG-CD1 3.9Å; F57-L62 HydrophobicContact CZ-CB 4.31Å; F57-L62 HydrophobicContact CZ-CD1 3.48Å; F57-L62 VanDerWaalsContact CZ-CD1 3.48Å; F57-L62 HydrophobicContact CZ-CG 4.36Å
58E53.8Low55.8Low171 Ų171104.4 Ų104.480%0.79957%0.573SS**Hα-helixtrans-69.4-22.9175.5-76.9-172.3158.200113.1V54V54-E58 PolarHBondContact O-N 3.36Å
59G56.5Low55.5Low75 Ų75104.4 Ų104.477%0.77357%0.567SS**SBendtrans-96.8-12.7174.200000115.2F57F57-G59 VanDerWaalsContact C-N 3.27Å; F57-G59 PolarHBondContact O-N 2.92Å
60S53.5Low55.2Low56 Ų56105.6 Ų105.639%0.39257%0.569SS.*SBendtrans-103.2123.5-170.8-172.30000111.2Q56 F57 L62Q56-S60 WeakPolarHBondContact O-CB 3.23Å; Q56-S60 PolarHBondContact O-N 3.34Å; F57-S60 PolarHBondContact O-N 3.08Å; S60-L62 PolarHBondContact O-N 3.3Å
61A52.8Low55Low60 Ų60110.8 Ų110.850%0.49659%0.589SS.*  trans-64.543.9-17800000114.9G63 K64 Q65A61-G63 PolarHBondContact O-N 2.85Å; A61-K64 PolarHBondContact O-N 3.29Å; A61-Q65 PolarHBondContact O-N 2.78Å
62L50.4Low55.1Low46 Ų46106.9 Ų106.924%0.24158%0.583CS.*Hα-helixtrans-62.5-30.1-179.8-85.8153.2000112.4F57 S60 K64 L66F57-L62 HydrophobicContact CD1-CD1 4.02Å; F57-L62 HydrophobicContact CD2-CD1 3.52Å; F57-L62 HydrophobicContact CE1-CB 4.21Å; F57-L62 HydrophobicContact CE1-CD1 3.82Å; F57-L62 HydrophobicContact CE2-CD1 3.32Å; F57-L62 HydrophobicContact CG-CD1 3.9Å; F57-L62 HydrophobicContact CZ-CB 4.31Å; F57-L62 HydrophobicContact CZ-CD1 3.48Å; F57-L62 VanDerWaalsContact CZ-CD1 3.48Å; F57-L62 HydrophobicContact CZ-CG 4.36Å; S60-L62 PolarHBondContact O-N 3.3Å; L62-K64 VanDerWaalsContact C-N 3.33Å; L62-K64 PolarHBondContact O-N 3.47Å; L62-L66 HydrophobicContact CD2-CD1 4.42Å; L62-L66 WeakPolarHBondContact O-CB 3.21Å; L62-L66 VanDerWaalsContact O-CD1 3.24Å; L62-L66 WeakPolarHBondContact O-CD1 3.47Å; L62-L66 VanDerWaalsContact O-CG 3.25Å; L62-L66 WeakPolarHBondContact O-CG 3.24Å; L62-L66 PolarHBondContact O-N 3.24Å
63G53Low54.9Low74 Ų74104.9 Ų104.976%0.76357%0.572SS**Hα-helixtrans-67.8-25.4171.700000114.9A61A61-G63 PolarHBondContact O-N 2.85Å
64K55.3Low54.9Low174 Ų174105.4 Ų105.476%0.75757%0.573SS**Hα-helixtrans-97.4-26.8179.3-73.1-175.7177.6179.30113.3A61 L62A61-K64 PolarHBondContact O-N 3.29Å; L62-K64 VanDerWaalsContact C-N 3.33Å; L62-K64 PolarHBondContact O-N 3.47Å
65Q52.2Low55.2Low98 Ų98107.4 Ų107.446%0.45858%0.581SS.*Hα-helixtrans-87.1-22.9-178.7-114.5-178.9-19.100114.3A61 K69A61-Q65 PolarHBondContact O-N 2.78Å; Q65-K69 HydrophobicContact CG-CD 4.44Å
66L55.5Low55.4Low59 Ų59106 Ų10631%0.30957%0.571SS.*Hα-helixtrans-72.3-32.8-179.4-79.9165000112.8M1 L62 L68 L70M1-L66 HydrophobicContact CE-CD1 3.51Å; L62-L66 HydrophobicContact CD2-CD1 4.42Å; L62-L66 WeakPolarHBondContact O-CB 3.21Å; L62-L66 VanDerWaalsContact O-CD1 3.24Å; L62-L66 WeakPolarHBondContact O-CD1 3.47Å; L62-L66 VanDerWaalsContact O-CG 3.25Å; L62-L66 WeakPolarHBondContact O-CG 3.24Å; L62-L66 PolarHBondContact O-N 3.24Å; L66-L68 PolarHBondContact O-N 3.43Å; L66-L70 HydrophobicContact CD2-CD1 4.48Å; L66-L70 WeakPolarHBondContact O-CD1 3.12Å
67N46.2Very low55.6Low144 Ų144103.2 Ų103.277%0.7756%0.564SS**Hα-helixtrans-82.5-8.3-172.9-127.426.9000115.2
68L51.2Low56.1Low126 Ų126101.1 Ų101.166%0.6656%0.561SS**Hα-helixtrans-111.4-38-180-73.6159.6000112.4L66 L70L66-L68 PolarHBondContact O-N 3.43Å; L68-L70 VanDerWaalsContact C-N 3.31Å; L68-L70 PolarHBondContact O-N 2.78Å
69K56.7Low56.7Low112 Ų11295.6 Ų95.649%0.48754%0.541SS..Hα-helixtrans-78.2-9.5-178.4-68.7-173.8171-179.60114.9Q65 N73Q65-K69 HydrophobicContact CG-CD 4.44Å; K69-N73 VanDerWaalsContact O-CB 3.23Å; K69-N73 WeakPolarHBondContact O-CB 3.43Å; K69-N73 VanDerWaalsContact O-CG 3.25Å; K69-N73 PolarHBondContact O-N 3.33Å; K69-N73 PolarHBondContact O-ND2 3.47Å; K69-N73 VanDerWaalsContact O-ND2 3.1Å
70L55.5Low56.9Low76 Ų7695.7 Ų95.740%0.39853%0.527SS..Hα-helixtrans-81.7-28.2179.9-98159.6000112.7L66 L68L66-L70 HydrophobicContact CD2-CD1 4.48Å; L66-L70 WeakPolarHBondContact O-CD1 3.12Å; L68-L70 VanDerWaalsContact C-N 3.31Å; L68-L70 PolarHBondContact O-N 2.78Å
71L52.8Low57.6Low142 Ų14299.2 Ų99.274%0.74354%0.535SS*.Hα-helixtrans-82.8-46172.2-102.778.4000111.6N73 W74L71-N73 PolarHBondContact O-N 3.37Å; L71-W74 PolarHBondContact O-N 3.47Å; L71-W74 VanDerWaalsContact O-N 3.16Å
72D60.8Low58.1Low120 Ų12099.2 Ų99.264%0.64253%0.531SS*.Hα-helixtrans-62.6-28179.1-85.1-45.4000113.6W74D72-W74 VanDerWaalsContact C-N 3.3Å; D72-W74 PolarHBondContact O-N 2.78Å
73N59.9Low58.9Low84 Ų84103.9 Ų103.945%0.44955%0.55SS..Hα-helixtrans-81.2-2.6179.3-82-22.7000114.3K69 L71 S76 V77K69-N73 VanDerWaalsContact O-CB 3.23Å; K69-N73 WeakPolarHBondContact O-CB 3.43Å; K69-N73 VanDerWaalsContact O-CG 3.25Å; K69-N73 PolarHBondContact O-N 3.33Å; K69-N73 PolarHBondContact O-ND2 3.47Å; K69-N73 VanDerWaalsContact O-ND2 3.1Å; L71-N73 PolarHBondContact O-N 3.37Å; N73-S76 PolarHBondContact O-OG 2.83Å; N73-S76 VanDerWaalsContact O-OG 3.12Å; N73-V77 VanDerWaalsContact O-CG2 3.26Å; N73-V77 WeakPolarHBondContact O-CG2 3.4Å; N73-V77 PolarHBondContact O-N 2.85Å
74W57.1Low59.6Low172 Ų172105.1 Ų105.165%0.65254%0.538SS*.Hα-helixtrans-76.6-36175.2-112.1108.6000112L71 D72 T78L71-W74 PolarHBondContact O-N 3.47Å; L71-W74 VanDerWaalsContact O-N 3.16Å; D72-W74 VanDerWaalsContact C-N 3.3Å; D72-W74 PolarHBondContact O-N 2.78Å; W74-T78 PolarHBondContact O-N 3.21Å; W74-T78 VanDerWaalsContact O-N 3.13Å; W74-T78 PolarHBondContact O-OG1 3.4Å
75D62.9Low60Low127 Ų127105.7 Ų105.768%0.67954%0.536SS*.Hα-helixtrans-67.8-35.2173.4-82.8-73000112.5S79D75-S79 WeakPolarHBondContact O-CB 3.37Å; D75-S79 PolarHBondContact O-N 2.99Å; D75-S79 PolarHBondContact O-OG 3.02Å
76S65.5Low60.6Low49 Ų49108.8 Ų108.834%0.34355%0.55SS.*Hα-helixtrans-71.2-35.2177.572.60000112.9N73 S79 T80N73-S76 PolarHBondContact O-OG 2.83Å; N73-S76 VanDerWaalsContact O-OG 3.12Å; S76-S79 WeakPolarHBondContact CA-OG 3.18Å; S76-S79 PolarHBondContact O-OG 2.79Å; S76-T80 WeakPolarHBondContact O-CB 3.45Å; S76-T80 PolarHBondContact O-N 3.46Å; S76-T80 PolarHBondContact O-OG1 3.32Å
77V62.8Low61Low87 Ų87114.3 Ų114.353%0.52758%0.575SS.*Hα-helixtrans-69.2-42.6174.8172.40000110.9N73 T80 F81N73-V77 VanDerWaalsContact O-CG2 3.26Å; N73-V77 WeakPolarHBondContact O-CG2 3.4Å; N73-V77 PolarHBondContact O-N 2.85Å; V77-T80 PolarHBondContact O-N 3.12Å; V77-F81 WeakPolarHBondContact O-CB 3.17Å; V77-F81 PolarHBondContact O-N 3.05Å
78T63.4Low61.6Low72 Ų72110.7 Ų110.744%0.44256%0.555SS.*Hα-helixtrans-64.1-44.9178.6-50.70000110.8W74 T80 F81 S82W74-T78 PolarHBondContact O-N 3.21Å; W74-T78 VanDerWaalsContact O-N 3.13Å; W74-T78 PolarHBondContact O-OG1 3.4Å; T78-T80 PolarHBondContact O-N 2.8Å; T78-F81 WeakPolarHBondContact O-CB 3.25Å; T78-F81 PolarHBondContact O-N 3.45Å; T78-S82 PolarHBondContact O-N 3.12Å; T78-S82 PolarHBondContact O-OG 3.31Å
79S66.1Low62.1Low54 Ų54106.8 Ų106.838%0.37855%0.545SS..Hα-helixtrans-67.6-32.2177.557.80000114.1D75 S76 S82 K83D75-S79 WeakPolarHBondContact O-CB 3.37Å; D75-S79 PolarHBondContact O-N 2.99Å; D75-S79 PolarHBondContact O-OG 3.02Å; S76-S79 WeakPolarHBondContact CA-OG 3.18Å; S76-S79 PolarHBondContact O-OG 2.79Å; S79-S82 PolarHBondContact O-N 3.49Å; S79-K83 WeakPolarHBondContact O-CG 3.24Å; S79-K83 PolarHBondContact O-N 2.91Å; S79-K83 VanDerWaalsContact O-N 3.1Å
80T62.1Low62.5Low78 Ų78106.5 Ų106.548%0.47956%0.555SS.*Hα-helixtrans-69.9-37.6174.3-530000111S76 V77 T78 K83 L84S76-T80 WeakPolarHBondContact O-CB 3.45Å; S76-T80 PolarHBondContact O-N 3.46Å; S76-T80 PolarHBondContact O-OG1 3.32Å; V77-T80 PolarHBondContact O-N 3.12Å; T78-T80 PolarHBondContact O-N 2.8Å; T80-K83 PolarHBondContact O-N 3.16Å; T80-L84 HydrophobicContact CG2-CD1 4.14Å; T80-L84 WeakPolarHBondContact O-CD1 3.43Å; T80-L84 PolarHBondContact O-N 3.15Å
81F66.7Low62.6Low130 Ų130108.2 Ų108.257%0.5757%0.568SS**Hα-helixtrans-64.1-39.8173-166.1-96.8000111.8V77 T78 L84 R85V77-F81 WeakPolarHBondContact O-CB 3.17Å; V77-F81 PolarHBondContact O-N 3.05Å; T78-F81 WeakPolarHBondContact O-CB 3.25Å; T78-F81 PolarHBondContact O-N 3.45Å; F81-L84 PolarHBondContact O-N 2.85Å; F81-R85 WeakPolarHBondContact O-CB 3.45Å; F81-R85 PolarHBondContact O-N 3.36Å
82S63.9Low63Low59 Ų59102.2 Ų102.241%0.41354%0.537SS..Hα-helixtrans-62-43.5174.5-45.10000112.8T78 S79 R85 E86T78-S82 PolarHBondContact O-N 3.12Å; T78-S82 PolarHBondContact O-OG 3.31Å; S79-S82 PolarHBondContact O-N 3.49Å; S82-R85 WeakPolarHBondContact O-CB 3.45Å; S82-R85 PolarHBondContact O-N 3.04Å; S82-E86 PolarHBondContact O-N 3.38Å
83K68.1Low63.1Low145 Ų145103.5 Ų103.563%0.6354%0.54SS*.Hα-helixtrans-68.3-37.6179.1-75.5179.4178.8178.50112.8S79 T80 R85 E86 Q87S79-K83 WeakPolarHBondContact O-CG 3.24Å; S79-K83 PolarHBondContact O-N 2.91Å; S79-K83 VanDerWaalsContact O-N 3.1Å; T80-K83 PolarHBondContact O-N 3.16Å; K83-R85 VanDerWaalsContact C-N 3.33Å; K83-E86 PolarHBondContact O-N 3.49Å; K83-Q87 PolarHBondContact O-N 3.04Å
84L66.3Low63.5Low100 Ų100107.1 Ų107.152%0.52455%0.554SS.*Hα-helixtrans-62.8-42.5171.3-102.4103000111T80 F81 E86 Q87 L88T80-L84 HydrophobicContact CG2-CD1 4.14Å; T80-L84 WeakPolarHBondContact O-CD1 3.43Å; T80-L84 PolarHBondContact O-N 3.15Å; F81-L84 PolarHBondContact O-N 2.85Å; L84-E86 PolarHBondContact O-N 3.41Å; L84-Q87 PolarHBondContact O-N 2.86Å; L84-L88 HydrophobicContact CD2-CD1 4.42Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.23Å; L84-L88 PolarHBondContact O-N 2.73Å
85R63.9Low64.3Low186 Ų186105 Ų10570%0.70255%0.549SS*.Hα-helixtrans-61.7-39.8178.1-176.3175.5178.8151.12.1112.8F81 S82 K83F81-R85 WeakPolarHBondContact O-CB 3.45Å; F81-R85 PolarHBondContact O-N 3.36Å; S82-R85 WeakPolarHBondContact O-CB 3.45Å; S82-R85 PolarHBondContact O-N 3.04Å; K83-R85 VanDerWaalsContact C-N 3.33Å
86E64.9Low64.5Low162 Ų162105.3 Ų105.376%0.75754%0.541SS*.Hα-helixtrans-68.9-38.1176.5-83.5-179.9152.700113.1S82 K83 L84 L88S82-E86 PolarHBondContact O-N 3.38Å; K83-E86 PolarHBondContact O-N 3.49Å; L84-E86 PolarHBondContact O-N 3.41Å; E86-L88 VanDerWaalsContact C-N 3.26Å; E86-L88 PolarHBondContact O-N 3.14Å
87Q63.7Low64.9Low176 Ų176107.3 Ų107.382%0.82255%0.548SS*.Hα-helixtrans-74-15.4-179.3-76-167.6-25.900114.2K83 L84K83-Q87 PolarHBondContact O-N 3.04Å; L84-Q87 PolarHBondContact O-N 2.86Å
88L59.1Low65.6Low67 Ų67108.1 Ų108.135%0.35155%0.549SS..THydrogen-bonded Turntrans-1005.3-175.9-68.2162000113.9L84 E86 V91 T92L84-L88 HydrophobicContact CD2-CD1 4.42Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.23Å; L84-L88 PolarHBondContact O-N 2.73Å; E86-L88 VanDerWaalsContact C-N 3.26Å; E86-L88 PolarHBondContact O-N 3.14Å; L88-V91 PolarHBondContact O-N 3.25Å; L88-V91 VanDerWaalsContact O-N 3.08Å; L88-T92 HydrophobicContact CB-CG2 3.28Å; L88-T92 VanDerWaalsContact CB-OG1 3.23Å; L88-T92 WeakPolarHBondContact CB-OG1 3.47Å; L88-T92 HydrophobicContact CD1-CG2 3.61Å; L88-T92 HydrophobicContact CD2-CG2 3.99Å; L88-T92 HydrophobicContact CG-CG2 3.8Å; L88-T92 PolarHBondContact O-N 3Å; L88-T92 PolarHBondContact O-OG1 3.34Å
89G63.2Low66.3Low45 Ų45107.6 Ų107.646%0.46454%0.543SS..THydrogen-bonded Turntrans-32.3-50.3-165.700000119.4
90P63.5Low66.7Low105 Ų105110.9 Ų110.968%0.68255%0.553SS**THydrogen-bonded Turntrans-101.2-28.2177.430.8-26000114.5T92P90-T92 VanDerWaalsContact C-N 3.34Å
91V58Low67.5Low113 Ų113113.4 Ų113.469%0.68556%0.557SS**Hα-helixtrans-80.6-17.9-176.6-179.50000112L88L88-V91 PolarHBondContact O-N 3.25Å; L88-V91 VanDerWaalsContact O-N 3.08Å
92T60.6Low67.9Low15 Ų15114 Ų1149%0.09256%0.562CS.*Hα-helixtrans-87.4-19.7176.537.30000115.6L88 P90 F95 W96L88-T92 HydrophobicContact CB-CG2 3.28Å; L88-T92 VanDerWaalsContact CB-OG1 3.23Å; L88-T92 WeakPolarHBondContact CB-OG1 3.47Å; L88-T92 HydrophobicContact CD1-CG2 3.61Å; L88-T92 HydrophobicContact CD2-CG2 3.99Å; L88-T92 HydrophobicContact CG-CG2 3.8Å; L88-T92 PolarHBondContact O-N 3Å; L88-T92 PolarHBondContact O-OG1 3.34Å; P90-T92 VanDerWaalsContact C-N 3.34Å; T92-F95 PolarHBondContact O-N 3.46Å; T92-W96 VanDerWaalsContact CB-CD1 3.46Å; T92-W96 VanDerWaalsContact O-CB 3.32Å; T92-W96 WeakPolarHBondContact O-CB 3.26Å; T92-W96 PolarHBondContact O-N 3.02Å
93Q64.2Low68.4Low148 Ų148114.5 Ų114.569%0.69256%0.562SS**Hα-helixtrans-64-49.6-178.6-94.1179.9-17.100111.4F95 W96 D97Q93-F95 VanDerWaalsContact C-N 3.31Å; Q93-F95 PolarHBondContact O-N 3.47Å; Q93-W96 PolarHBondContact O-N 3.48Å; Q93-D97 WeakPolarHBondContact O-CB 3.29Å; Q93-D97 PolarHBondContact O-N 3.18Å
94E68.6Low68.9Low159 Ų159113.2 Ų113.274%0.74356%0.558SS**Hα-helixtrans-65.3-35.2175.5-67.1-174.3137.700112.4N98E94-N98 WeakPolarHBondContact O-CB 3.07Å; E94-N98 PolarHBondContact O-N 2.7Å
95F74.1Confident69.6Low128 Ų128110 Ų11056%0.56155%0.55SS**Hα-helixtrans-67-45.6176.4-171.2-101.5000111.8T92 Q93 N98 L99T92-F95 PolarHBondContact O-N 3.46Å; Q93-F95 VanDerWaalsContact C-N 3.31Å; Q93-F95 PolarHBondContact O-N 3.47Å; F95-N98 PolarHBondContact O-N 3.06Å; F95-L99 HydrophobicContact CD1-CD1 4.03Å; F95-L99 HydrophobicContact CE1-CD1 3.42Å; F95-L99 VanDerWaalsContact CE1-CD1 3.42Å; F95-L99 HydrophobicContact CZ-CD1 3.92Å; F95-L99 WeakPolarHBondContact O-CB 3.38Å; F95-L99 PolarHBondContact O-N 3.42Å
96W66.1Low70.3Confident133 Ų133106 Ų10650%0.50454%0.542SS..Hα-helixtrans-66.9-39.3176.2-74120.6000111.7T92 Q93 N98 L99 E100T92-W96 VanDerWaalsContact CB-CD1 3.46Å; T92-W96 VanDerWaalsContact O-CB 3.32Å; T92-W96 WeakPolarHBondContact O-CB 3.26Å; T92-W96 PolarHBondContact O-N 3.02Å; Q93-W96 PolarHBondContact O-N 3.48Å; W96-N98 VanDerWaalsContact C-N 3.34Å; W96-N98 PolarHBondContact O-N 2.91Å; W96-L99 PolarHBondContact O-N 2.84Å; W96-E100 WeakPolarHBondContact O-CB 3.43Å; W96-E100 PolarHBondContact O-N 3.47Å
97D74.7Confident70.8Confident91 Ų91107.5 Ų107.549%0.48754%0.541SS..Hα-helixtrans-64.4-39.8176.9-124.833.1000111.5Q93 K101Q93-D97 WeakPolarHBondContact O-CB 3.29Å; Q93-D97 PolarHBondContact O-N 3.18Å; D97-K101 WeakPolarHBondContact O-CB 3.45Å; D97-K101 WeakPolarHBondContact O-CG 3.43Å; D97-K101 PolarHBondContact O-N 3.22Å
98N76.9Confident71.8Confident105 Ų105105.4 Ų105.456%0.56153%0.531SS*.Hα-helixtrans-70.2-41.6173.5-92.21.6000112.3E94 F95 W96 K101 E102E94-N98 WeakPolarHBondContact O-CB 3.07Å; E94-N98 PolarHBondContact O-N 2.7Å; F95-N98 PolarHBondContact O-N 3.06Å; W96-N98 VanDerWaalsContact C-N 3.34Å; W96-N98 PolarHBondContact O-N 2.91Å; N98-K101 PolarHBondContact O-N 3.36Å; N98-E102 WeakPolarHBondContact O-CB 3.35Å; N98-E102 WeakPolarHBondContact O-CG 3.27Å; N98-E102 PolarHBondContact O-N 2.91Å
99L77Confident72.9Confident60 Ų60108.5 Ų108.531%0.31454%0.544SS..Hα-helixtrans-70.4-34.4-178.7-150.3169.1000111.2F95 W96 T103F95-L99 HydrophobicContact CD1-CD1 4.03Å; F95-L99 HydrophobicContact CE1-CD1 3.42Å; F95-L99 VanDerWaalsContact CE1-CD1 3.42Å; F95-L99 HydrophobicContact CZ-CD1 3.92Å; F95-L99 WeakPolarHBondContact O-CB 3.38Å; F95-L99 PolarHBondContact O-N 3.42Å; W96-L99 PolarHBondContact O-N 2.84Å; L99-T103 VanDerWaalsContact CD2-OG1 3.28Å; L99-T103 WeakPolarHBondContact CD2-OG1 3.13Å; L99-T103 WeakPolarHBondContact O-CB 3.37Å; L99-T103 PolarHBondContact O-N 2.97Å; L99-T103 PolarHBondContact O-OG1 2.96Å
100E75.8Confident73.5Confident123 Ų123111.8 Ų111.858%0.57555%0.548SS*.Hα-helixtrans-67-44.9173.6-171.3160.9-163.200110.6W96 T103 E104W96-E100 WeakPolarHBondContact O-CB 3.43Å; W96-E100 PolarHBondContact O-N 3.47Å; E100-T103 PolarHBondContact O-N 2.97Å; E100-E104 WeakPolarHBondContact O-CB 3.33Å; E100-E104 WeakPolarHBondContact O-CG 3.2Å; E100-E104 PolarHBondContact O-N 2.87Å
101K77.8Confident74.3Confident132 Ų132109.9 Ų109.957%0.57454%0.537SS*.Hα-helixtrans-63.1-44.1173.5-74.6175.9-171165.50113D97 N98 G105D97-K101 WeakPolarHBondContact O-CB 3.45Å; D97-K101 WeakPolarHBondContact O-CG 3.43Å; D97-K101 PolarHBondContact O-N 3.22Å; N98-K101 PolarHBondContact O-N 3.36Å; K101-G105 PolarHBondContact O-N 2.83Å; K101-G105 VanDerWaalsContact O-N 3.08Å
102E76.7Confident75.6Confident143 Ų143111.2 Ų111.267%0.66853%0.534SS*.Hα-helixtrans-65.3-41.7175.8-80.7-170.9161.100111.2N98 G105 L106N98-E102 WeakPolarHBondContact O-CB 3.35Å; N98-E102 WeakPolarHBondContact O-CG 3.27Å; N98-E102 PolarHBondContact O-N 2.91Å; E102-G105 PolarHBondContact O-N 3.35Å; E102-L106 WeakPolarHBondContact O-CB 3.32Å; E102-L106 PolarHBondContact O-N 2.97Å
103T74.4Confident76.6Confident69 Ų69115.4 Ų115.442%0.42356%0.556SS.*Hα-helixtrans-67.4-38.5178.4-59.10000111.5L99 E100 L106 R107L99-T103 VanDerWaalsContact CD2-OG1 3.28Å; L99-T103 WeakPolarHBondContact CD2-OG1 3.13Å; L99-T103 WeakPolarHBondContact O-CB 3.37Å; L99-T103 PolarHBondContact O-N 2.97Å; L99-T103 PolarHBondContact O-OG1 2.96Å; E100-T103 PolarHBondContact O-N 2.97Å; T103-L106 PolarHBondContact O-N 3.02Å; T103-R107 WeakPolarHBondContact O-CB 3.43Å; T103-R107 PolarHBondContact O-N 2.76Å
104E77.2Confident77.4Confident117 Ų117113.9 Ų113.955%0.54755%0.552SS.*Hα-helixtrans-63.1-45.3174.2-79.7-167.6151.800111.6E100 R107 Q108E100-E104 WeakPolarHBondContact O-CB 3.33Å; E100-E104 WeakPolarHBondContact O-CG 3.2Å; E100-E104 PolarHBondContact O-N 2.87Å; E104-R107 PolarHBondContact O-N 3.3Å; E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 3.28Å
105G80.8Confident78.2Confident34 Ų34112.7 Ų112.735%0.35155%0.546SS..Hα-helixtrans-59.8-48.7174.600000112.3K101 E102 R107 Q108 E109K101-G105 PolarHBondContact O-N 2.83Å; K101-G105 VanDerWaalsContact O-N 3.08Å; E102-G105 PolarHBondContact O-N 3.35Å; G105-R107 PolarHBondContact O-N 3.45Å; G105-Q108 PolarHBondContact O-N 2.83Å; G105-E109 PolarHBondContact O-N 3.16Å
106L79.6Confident78.7Confident102 Ų102111.3 Ų111.353%0.53454%0.542SS..Hα-helixtrans-68.9-33.6-178.2-150.7146.3000111.8E102 T103 E109 M110E102-L106 WeakPolarHBondContact O-CB 3.32Å; E102-L106 PolarHBondContact O-N 2.97Å; T103-L106 PolarHBondContact O-N 3.02Å; L106-E109 PolarHBondContact O-N 3.39Å; L106-M110 HydrophobicContact CD2-CG 3.98Å; L106-M110 HydrophobicContact CD2-SD 3.87Å; L106-M110 VanDerWaalsContact O-CB 3.29Å; L106-M110 WeakPolarHBondContact O-CB 3.26Å; L106-M110 VanDerWaalsContact O-CG 3.26Å; L106-M110 WeakPolarHBondContact O-CG 3.4Å; L106-M110 PolarHBondContact O-N 3.48Å
107R75.7Confident79.6Confident192 Ų192108.9 Ų108.973%0.72554%0.541SS*.Hα-helixtrans-69.4-37.9174.3-167.9177.9-167.11673.7111.7T103 E104 G105 S111T103-R107 WeakPolarHBondContact O-CB 3.43Å; T103-R107 PolarHBondContact O-N 2.76Å; E104-R107 PolarHBondContact O-N 3.3Å; G105-R107 PolarHBondContact O-N 3.45Å; R107-S111 WeakPolarHBondContact O-CB 3.21Å; R107-S111 PolarHBondContact O-N 3.46Å
108Q83.1Confident79.9Confident132 Ų132111.2 Ų111.262%0.61755%0.547SS*.Hα-helixtrans-67.7-43.3173.2-73.9-176.710.700111.7E104 G105 S111 K112E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 3.28Å; G105-Q108 PolarHBondContact O-N 2.83Å; Q108-S111 PolarHBondContact O-N 2.87Å; Q108-K112 WeakPolarHBondContact O-CG 3.46Å; Q108-K112 PolarHBondContact O-N 3.37Å
109E82.2Confident80.4Confident133 Ų133109.3 Ų109.362%0.62155%0.546SS*.Hα-helixtrans-62.5-47.4173.5-79.7-166.5144.300111.7G105 L106 S111 K112 D113G105-E109 PolarHBondContact O-N 3.16Å; L106-E109 PolarHBondContact O-N 3.39Å; E109-S111 VanDerWaalsContact C-N 3.29Å; E109-S111 PolarHBondContact O-N 3.01Å; E109-K112 PolarHBondContact O-N 2.68Å; E109-K112 VanDerWaalsContact O-N 3.12Å; E109-D113 WeakPolarHBondContact O-CB 3.48Å; E109-D113 PolarHBondContact O-N 3.39Å
110M76.8Confident80.8Confident113 Ų113112.4 Ų112.456%0.55756%0.557SS**Hα-helixtrans-60.3-37.5176.7-78.3-169.2105.300112.6L106 L114L106-M110 HydrophobicContact CD2-CG 3.98Å; L106-M110 HydrophobicContact CD2-SD 3.87Å; L106-M110 VanDerWaalsContact O-CB 3.29Å; L106-M110 WeakPolarHBondContact O-CB 3.26Å; L106-M110 VanDerWaalsContact O-CG 3.26Å; L106-M110 WeakPolarHBondContact O-CG 3.4Å; L106-M110 PolarHBondContact O-N 3.48Å; M110-L114 VanDerWaalsContact O-CB 3.23Å; M110-L114 WeakPolarHBondContact O-CB 3.48Å; M110-L114 WeakPolarHBondContact O-CG 3.5Å; M110-L114 PolarHBondContact O-N 3.46Å
111S80Confident81.3Confident65 Ų65109.6 Ų109.646%0.45555%0.548SS..Hα-helixtrans-66.4-41.7176.2-161.90000111.1R107 Q108 E109 L114 E115R107-S111 WeakPolarHBondContact O-CB 3.21Å; R107-S111 PolarHBondContact O-N 3.46Å; Q108-S111 PolarHBondContact O-N 2.87Å; E109-S111 VanDerWaalsContact C-N 3.29Å; E109-S111 PolarHBondContact O-N 3.01Å; S111-L114 PolarHBondContact O-N 3.05Å; S111-E115 WeakPolarHBondContact O-CG 3.15Å; S111-E115 PolarHBondContact O-N 3.42Å
112K85.2Confident81.5Confident142 Ų142108.2 Ų108.262%0.61754%0.544SS*.Hα-helixtrans-65.1-45.4174.9-76178.2177.1175.40112Q108 E109 L114 E115 E116Q108-K112 WeakPolarHBondContact O-CG 3.46Å; Q108-K112 PolarHBondContact O-N 3.37Å; E109-K112 PolarHBondContact O-N 2.68Å; E109-K112 VanDerWaalsContact O-N 3.12Å; K112-L114 VanDerWaalsContact C-N 3.33Å; K112-L114 PolarHBondContact O-N 3.1Å; K112-E115 PolarHBondContact O-N 3.28Å; K112-E116 WeakPolarHBondContact O-CB 3.22Å; K112-E116 PolarHBondContact O-N 3.49Å
113D82.8Confident82Confident102 Ų102105 Ų10555%0.54554%0.535SS..Hα-helixtrans-62.5-40.7176.7-92.311.1000111.2E109 E116 V117E109-D113 WeakPolarHBondContact O-CB 3.48Å; E109-D113 PolarHBondContact O-N 3.39Å; D113-E116 PolarHBondContact O-N 2.84Å; D113-V117 VanDerWaalsContact O-CB 3.25Å; D113-V117 WeakPolarHBondContact O-CB 3.27Å; D113-V117 WeakPolarHBondContact O-CG2 3.41Å; D113-V117 PolarHBondContact O-N 2.83Å
114L79.7Confident82.6Confident117 Ų117110 Ų11061%0.61355%0.547SS*.Hα-helixtrans-64.5-41.1174.4-89.4160.2000111.9M110 S111 K112 K118M110-L114 VanDerWaalsContact O-CB 3.23Å; M110-L114 WeakPolarHBondContact O-CB 3.48Å; M110-L114 WeakPolarHBondContact O-CG 3.5Å; M110-L114 PolarHBondContact O-N 3.46Å; S111-L114 PolarHBondContact O-N 3.05Å; K112-L114 VanDerWaalsContact C-N 3.33Å; K112-L114 PolarHBondContact O-N 3.1Å; L114-K118 WeakPolarHBondContact O-CB 3.41Å; L114-K118 PolarHBondContact O-N 3.46Å
115E85.1Confident82.8Confident133 Ų133109.6 Ų109.662%0.62155%0.549SS*.Hα-helixtrans-66-40.5174.8-75.8-172.2110.500111.8S111 K112 K118 A119S111-E115 WeakPolarHBondContact O-CG 3.15Å; S111-E115 PolarHBondContact O-N 3.42Å; K112-E115 PolarHBondContact O-N 3.28Å; E115-K118 PolarHBondContact O-N 3Å; E115-A119 VanDerWaalsContact O-CB 3.27Å; E115-A119 WeakPolarHBondContact O-CB 3.19Å; E115-A119 PolarHBondContact O-N 3.03Å
116E85Confident83.2Confident100 Ų100112 Ų11247%0.46755%0.553SS.*Hα-helixtrans-69.3-43.2177.8-164.3-176.115100111.9K112 D113 A119 K120K112-E116 WeakPolarHBondContact O-CB 3.22Å; K112-E116 PolarHBondContact O-N 3.49Å; D113-E116 PolarHBondContact O-N 2.84Å; E116-A119 PolarHBondContact O-N 3.36Å; E116-K120 HydrophobicContact CG-CD 4.47Å; E116-K120 WeakPolarHBondContact O-CB 3.25Å; E116-K120 WeakPolarHBondContact O-CG 3.44Å; E116-K120 PolarHBondContact O-N 3.03Å; E116-K120 WeakPolarHBondContact OE1-CE 3.4Å; E116-K120 IonicContact OE1-NZ 2.68Å; E116-K120 PolarHBondContact OE1-NZ 2.84Å
117V84.9Confident83.6Confident82 Ų82110.6 Ų110.650%0.49755%0.546SS..Hα-helixtrans-63.4-44.2173.7169.90000109.9D113 A119 K120 V121D113-V117 VanDerWaalsContact O-CB 3.25Å; D113-V117 WeakPolarHBondContact O-CB 3.27Å; D113-V117 WeakPolarHBondContact O-CG2 3.41Å; D113-V117 PolarHBondContact O-N 2.83Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-A119 PolarHBondContact O-N 3.37Å; V117-K120 PolarHBondContact O-N 3.15Å; V117-V121 HydrophobicContact CG1-CG2 3.93Å; V117-V121 VanDerWaalsContact O-CB 3.24Å; V117-V121 WeakPolarHBondContact O-CB 3.09Å; V117-V121 WeakPolarHBondContact O-CG2 3.5Å; V117-V121 PolarHBondContact O-N 2.99Å
118K81Confident84.3Confident139 Ų139107.8 Ų107.860%0.60454%0.539SS*.Hα-helixtrans-60.4-45.6175.5-174.5178.2-179.7-177.70110.8L114 E115 K120 V121 Q122L114-K118 WeakPolarHBondContact O-CB 3.41Å; L114-K118 PolarHBondContact O-N 3.46Å; E115-K118 PolarHBondContact O-N 3Å; K118-K120 VanDerWaalsContact C-N 3.33Å; K118-K120 PolarHBondContact O-N 3.49Å; K118-V121 PolarHBondContact O-N 3.4Å; K118-Q122 VanDerWaalsContact O-CB 3.22Å; K118-Q122 WeakPolarHBondContact O-CB 3.44Å; K118-Q122 PolarHBondContact O-N 3.43Å
119A86.8Confident84.4Confident66 Ų66107.1 Ų107.155%0.54554%0.536SS..Hα-helixtrans-62.5-37.5176.800000112.6E115 E116 V117 P123E115-A119 VanDerWaalsContact O-CB 3.27Å; E115-A119 WeakPolarHBondContact O-CB 3.19Å; E115-A119 PolarHBondContact O-N 3.03Å; E116-A119 PolarHBondContact O-N 3.36Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-A119 PolarHBondContact O-N 3.37Å; A119-P123 WeakPolarHBondContact O-CD 3.42Å
120K86.9Confident84.8Confident125 Ų125107.1 Ų107.154%0.54353%0.534SS..Hα-helixtrans-72.8-37175.3-80.2173.9171.8161.10112.9E116 V117 K118 P123 Y124E116-K120 HydrophobicContact CG-CD 4.47Å; E116-K120 WeakPolarHBondContact O-CB 3.25Å; E116-K120 WeakPolarHBondContact O-CG 3.44Å; E116-K120 PolarHBondContact O-N 3.03Å; E116-K120 WeakPolarHBondContact OE1-CE 3.4Å; E116-K120 IonicContact OE1-NZ 2.68Å; E116-K120 PolarHBondContact OE1-NZ 2.84Å; V117-K120 PolarHBondContact O-N 3.15Å; K118-K120 VanDerWaalsContact C-N 3.33Å; K118-K120 PolarHBondContact O-N 3.49Å; K120-P123 WeakPolarHBondContact O-CD 3.47Å; K120-P123 WeakPolarHBondContact O-CG 3.28Å; K120-Y124 WeakPolarHBondContact O-CD2 3.45Å; K120-Y124 WeakPolarHBondContact O-CE2 3.38Å
121V85Confident85.4Confident63 Ų63107 Ų10738%0.38253%0.531SS..Hα-helixtrans-82-33.4-175.6170.50000112.2V117 K118 Y124 L125V117-V121 HydrophobicContact CG1-CG2 3.93Å; V117-V121 VanDerWaalsContact O-CB 3.24Å; V117-V121 WeakPolarHBondContact O-CB 3.09Å; V117-V121 WeakPolarHBondContact O-CG2 3.5Å; V117-V121 PolarHBondContact O-N 2.99Å; K118-V121 PolarHBondContact O-N 3.4Å; V121-Y124 WeakPolarHBondContact O-CA 3.37Å; V121-Y124 WeakPolarHBondContact O-CB 3.48Å; V121-Y124 PolarHBondContact O-N 3.44Å; V121-L125 HydrophobicContact CG1-CD1 3.78Å; V121-L125 HydrophobicContact CG1-CG 3.88Å; V121-L125 PolarHBondContact O-N 3.33Å
122Q81.9Confident85.8Confident104 Ų104110.5 Ų110.549%0.48653%0.534SS..Hα-helixtrans-50.7-48.6-179.2-166153.5-20.200113.8K118 Y124 L125 D126K118-Q122 VanDerWaalsContact O-CB 3.22Å; K118-Q122 WeakPolarHBondContact O-CB 3.44Å; K118-Q122 PolarHBondContact O-N 3.43Å; Q122-Y124 VanDerWaalsContact C-N 3.32Å; Q122-Y124 PolarHBondContact O-N 3.1Å; Q122-L125 PolarHBondContact O-N 3.12Å; Q122-D126 PolarHBondContact O-N 3.21Å
123P88.4Confident86Confident74 Ų74108.8 Ų108.848%0.48153%0.528SS..Hα-helixtrans-65.5-30.1175.925.7-35.2000113.8A119 K120 D127A119-P123 WeakPolarHBondContact O-CD 3.42Å; K120-P123 WeakPolarHBondContact O-CD 3.47Å; K120-P123 WeakPolarHBondContact O-CG 3.28Å; P123-D127 WeakPolarHBondContact O-CB 3.25Å; P123-D127 PolarHBondContact O-N 3.13Å
124Y86.2Confident86.4Confident174 Ų174109.8 Ų109.868%0.68253%0.53SS*.Hα-helixtrans-72.5-36.4174.4-70-74.2000112.1K120 V121 Q122 D127 F128K120-Y124 WeakPolarHBondContact O-CD2 3.45Å; K120-Y124 WeakPolarHBondContact O-CE2 3.38Å; V121-Y124 WeakPolarHBondContact O-CA 3.37Å; V121-Y124 WeakPolarHBondContact O-CB 3.48Å; V121-Y124 PolarHBondContact O-N 3.44Å; Q122-Y124 VanDerWaalsContact C-N 3.32Å; Q122-Y124 PolarHBondContact O-N 3.1Å; Y124-D127 PolarHBondContact O-N 3.03Å; Y124-F128 WeakPolarHBondContact O-CB 3.32Å; Y124-F128 PolarHBondContact O-N 2.88Å
125L82.3Confident86.9Confident110 Ų110110.3 Ų110.358%0.57653%0.529SS*.Hα-helixtrans-64.8-42.1172.8-77.7171.9000111V121 Q122 F128 Q129V121-L125 HydrophobicContact CG1-CD1 3.78Å; V121-L125 HydrophobicContact CG1-CG 3.88Å; V121-L125 PolarHBondContact O-N 3.33Å; Q122-L125 PolarHBondContact O-N 3.12Å; L125-F128 PolarHBondContact O-N 3.18Å; L125-Q129 VanDerWaalsContact O-CB 3.28Å; L125-Q129 WeakPolarHBondContact O-CB 3.2Å; L125-Q129 PolarHBondContact O-N 3.38Å
126D87.8Confident87Confident83 Ų83109.1 Ų109.144%0.44453%0.525SS..Hα-helixtrans-63.2-43.4175.1-74.4-50.4000111.9Q122 Q129 K130Q122-D126 PolarHBondContact O-N 3.21Å; D126-Q129 PolarHBondContact O-N 2.83Å; D126-K130 VanDerWaalsContact O-CG 3.32Å; D126-K130 WeakPolarHBondContact O-CG 3.26Å; D126-K130 PolarHBondContact O-N 2.87Å
127D89.9Confident87.3Confident73 Ų73110 Ų11039%0.3953%0.529SS..Hα-helixtrans-65.1-42.6175.7-170.3-105.1000111.9P123 Y124 K130 K131P123-D127 WeakPolarHBondContact O-CB 3.25Å; P123-D127 PolarHBondContact O-N 3.13Å; Y124-D127 PolarHBondContact O-N 3.03Å; D127-K130 PolarHBondContact O-N 2.93Å; D127-K131 WeakPolarHBondContact O-CB 3.41Å; D127-K131 WeakPolarHBondContact O-CG 3.42Å; D127-K131 PolarHBondContact O-N 2.99Å; D127-K131 VanDerWaalsContact OD1-CE 3.26Å; D127-K131 WeakPolarHBondContact OD1-CE 3.48Å; D127-K131 IonicContact OD1-NZ 2.7Å; D127-K131 PolarHBondContact OD1-NZ 3.46Å
128F88.8Confident87.5Confident133 Ų133110.8 Ų110.858%0.58353%0.53SS*.Hα-helixtrans-64.2-43.5176.7-173.1-92.7000111.6Y124 L125 K130 K131 W132Y124-F128 WeakPolarHBondContact O-CB 3.32Å; Y124-F128 PolarHBondContact O-N 2.88Å; L125-F128 PolarHBondContact O-N 3.18Å; F128-K130 VanDerWaalsContact C-N 3.33Å; F128-K130 PolarHBondContact O-N 3.49Å; F128-K131 PolarHBondContact O-N 2.84Å; F128-W132 HydrophobicContact CZ-CE3 4.44Å; F128-W132 VanDerWaalsContact O-CB 3.25Å; F128-W132 WeakPolarHBondContact O-CB 3.28Å; F128-W132 PolarHBondContact O-N 3.44Å
129Q85.5Confident87.8Confident118 Ų118112 Ų11255%0.55153%0.531SS*.Hα-helixtrans-64.4-38.5177.9-169.1178.3-55.300111.5L125 D126 Q133L125-Q129 VanDerWaalsContact O-CB 3.28Å; L125-Q129 WeakPolarHBondContact O-CB 3.2Å; L125-Q129 PolarHBondContact O-N 3.38Å; D126-Q129 PolarHBondContact O-N 2.83Å; Q129-Q133 WeakPolarHBondContact O-CG 3.23Å; Q129-Q133 PolarHBondContact O-N 3.07Å
130K90.4Very high87.8Confident134 Ų134117.7 Ų117.758%0.58354%0.539SS*.Hα-helixtrans-63.8-50.5173.1-75.3175.6-177.2178.40111.9D126 D127 F128 W132 Q133 E134D126-K130 VanDerWaalsContact O-CG 3.32Å; D126-K130 WeakPolarHBondContact O-CG 3.26Å; D126-K130 PolarHBondContact O-N 2.87Å; D127-K130 PolarHBondContact O-N 2.93Å; F128-K130 VanDerWaalsContact C-N 3.33Å; F128-K130 PolarHBondContact O-N 3.49Å; K130-W132 VanDerWaalsContact C-N 3.29Å; K130-W132 PolarHBondContact O-N 2.82Å; K130-Q133 PolarHBondContact O-N 3.3Å; K130-Q133 VanDerWaalsContact O-N 3.15Å; K130-E134 PolarHBondContact O-N 3.41Å
131K90.8Very high87.9Confident109 Ų109117.8 Ų117.847%0.47454%0.541SS..Hα-helixtrans-59.3-40.4176.9-78.3174.8175.7155.60112.4D127 F128 E134 E135D127-K131 WeakPolarHBondContact O-CB 3.41Å; D127-K131 WeakPolarHBondContact O-CG 3.42Å; D127-K131 PolarHBondContact O-N 2.99Å; D127-K131 VanDerWaalsContact OD1-CE 3.26Å; D127-K131 WeakPolarHBondContact OD1-CE 3.48Å; D127-K131 IonicContact OD1-NZ 2.7Å; D127-K131 PolarHBondContact OD1-NZ 3.46Å; F128-K131 PolarHBondContact O-N 2.84Å; K131-E134 PolarHBondContact O-N 2.95Å; K131-E135 WeakPolarHBondContact O-CB 3.48Å; K131-E135 PolarHBondContact O-N 2.89Å
132W88.2Confident88Confident140 Ų140121.7 Ų121.753%0.5355%0.553SS.*Hα-helixtrans-64.1-40.6176.6-177.7-92.3000112.2F128 K130 M136F128-W132 HydrophobicContact CZ-CE3 4.44Å; F128-W132 VanDerWaalsContact O-CB 3.25Å; F128-W132 WeakPolarHBondContact O-CB 3.28Å; F128-W132 PolarHBondContact O-N 3.44Å; K130-W132 VanDerWaalsContact C-N 3.29Å; K130-W132 PolarHBondContact O-N 2.82Å; W132-M136 HydrophobicContact CZ2-CG 4.48Å; W132-M136 VanDerWaalsContact O-CB 3.29Å; W132-M136 WeakPolarHBondContact O-CB 3.42Å; W132-M136 WeakPolarHBondContact O-CG 3.41Å; W132-M136 PolarHBondContact O-N 2.87Å
133Q89.5Confident88.3Confident106 Ų106119.7 Ų119.750%0.49555%0.548SS..Hα-helixtrans-63.8-46174.1-76.7179.4-8.400111.3Q129 K130 E135 M136 E137Q129-Q133 WeakPolarHBondContact O-CG 3.23Å; Q129-Q133 PolarHBondContact O-N 3.07Å; K130-Q133 PolarHBondContact O-N 3.3Å; K130-Q133 VanDerWaalsContact O-N 3.15Å; Q133-E135 PolarHBondContact O-N 3.37Å; Q133-M136 PolarHBondContact O-N 3.47Å; Q133-E137 WeakPolarHBondContact O-CG 3.24Å; Q133-E137 PolarHBondContact O-N 3.27Å
134E91.4Very high88Confident123 Ų123122.7 Ų122.758%0.57556%0.556SS**Hα-helixtrans-60.5-44.9176.1-72.3177.4-177.600112.2K130 K131 E137 L138K130-E134 PolarHBondContact O-N 3.41Å; K131-E134 PolarHBondContact O-N 2.95Å; E134-E137 PolarHBondContact O-N 2.95Å; E134-L138 WeakPolarHBondContact O-CB 3.43Å; E134-L138 WeakPolarHBondContact O-CG 3.29Å; E134-L138 PolarHBondContact O-N 2.9Å
135E89.7Confident88.1Confident128 Ų128117.3 Ų117.360%0.59854%0.542SS*.Hα-helixtrans-64.6-40.4176.1-78.9-162.9113.400112.1K131 Q133 L138 Y139K131-E135 WeakPolarHBondContact O-CB 3.48Å; K131-E135 PolarHBondContact O-N 2.89Å; Q133-E135 PolarHBondContact O-N 3.37Å; E135-L138 PolarHBondContact O-N 3.3Å; E135-Y139 VanDerWaalsContact O-CB 3.29Å; E135-Y139 WeakPolarHBondContact O-CB 3.33Å; E135-Y139 PolarHBondContact O-N 3.29Å
136M87.4Confident88.2Confident108 Ų108116.8 Ų116.853%0.53254%0.539SS..Hα-helixtrans-66.8-37.4176.2-81.8-72.7-94.400112.2W132 Q133 Y139 R140W132-M136 HydrophobicContact CZ2-CG 4.48Å; W132-M136 VanDerWaalsContact O-CB 3.29Å; W132-M136 WeakPolarHBondContact O-CB 3.42Å; W132-M136 WeakPolarHBondContact O-CG 3.41Å; W132-M136 PolarHBondContact O-N 2.87Å; Q133-M136 PolarHBondContact O-N 3.47Å; M136-Y139 PolarHBondContact O-N 2.71Å; M136-R140 VanDerWaalsContact O-CB 3.24Å; M136-R140 WeakPolarHBondContact O-CB 3.25Å; M136-R140 PolarHBondContact O-N 3.35Å
137E90.3Very high88Confident119 Ų119121.7 Ų121.756%0.55655%0.551SS**Hα-helixtrans-65.5-44.9173.7-76.1-17591.400111.4Q133 E134 Y139 R140 Q141Q133-E137 WeakPolarHBondContact O-CG 3.24Å; Q133-E137 PolarHBondContact O-N 3.27Å; E134-E137 PolarHBondContact O-N 2.95Å; E137-Y139 VanDerWaalsContact C-N 3.33Å; E137-Y139 PolarHBondContact O-N 3.01Å; E137-R140 PolarHBondContact O-N 3.38Å; E137-Q141 WeakPolarHBondContact O-CB 3.38Å; E137-Q141 WeakPolarHBondContact O-CG 3.35Å; E137-Q141 PolarHBondContact O-N 3.34Å
138L89.4Confident87.9Confident98 Ų98120.5 Ų120.551%0.51355%0.552SS.*Hα-helixtrans-61-41.9173.7-76.4164.4000112E134 E135 Q141 K142E134-L138 WeakPolarHBondContact O-CB 3.43Å; E134-L138 WeakPolarHBondContact O-CG 3.29Å; E134-L138 PolarHBondContact O-N 2.9Å; E135-L138 PolarHBondContact O-N 3.3Å; L138-Q141 PolarHBondContact O-N 3.44Å; L138-K142 WeakPolarHBondContact O-CG 3.41Å; L138-K142 PolarHBondContact O-N 3.16Å
139Y87.9Confident87.9Confident163 Ų163120.1 Ų120.164%0.63955%0.552SS**Hα-helixtrans-66.1-42.9177.5-159.4-93.2000110.9E135 M136 E137 Q141 K142 V143E135-Y139 VanDerWaalsContact O-CB 3.29Å; E135-Y139 WeakPolarHBondContact O-CB 3.33Å; E135-Y139 PolarHBondContact O-N 3.29Å; M136-Y139 PolarHBondContact O-N 2.71Å; E137-Y139 VanDerWaalsContact C-N 3.33Å; E137-Y139 PolarHBondContact O-N 3.01Å; Y139-Q141 PolarHBondContact O-N 3.03Å; Y139-K142 PolarHBondContact O-N 3.44Å; Y139-V143 HydrophobicContact CD1-CG2 3.62Å; Y139-V143 HydrophobicContact CE1-CG2 3.45Å; Y139-V143 VanDerWaalsContact CE1-CG2 3.45Å; Y139-V143 HydrophobicContact CG-CG2 4.45Å; Y139-V143 WeakPolarHBondContact O-CB 3.29Å; Y139-V143 VanDerWaalsContact O-CG2 3.24Å; Y139-V143 WeakPolarHBondContact O-CG2 3.24Å; Y139-V143 PolarHBondContact O-N 3.42Å
140R86.6Confident88.1Confident186 Ų186120.5 Ų120.570%0.70256%0.557SS**Hα-helixtrans-62-43.5176.1-168.1177.3-167.7168.43.3111.8M136 E137 K142 V143 E144M136-R140 VanDerWaalsContact O-CB 3.24Å; M136-R140 WeakPolarHBondContact O-CB 3.25Å; M136-R140 PolarHBondContact O-N 3.35Å; E137-R140 PolarHBondContact O-N 3.38Å; R140-K142 VanDerWaalsContact C-N 3.28Å; R140-K142 PolarHBondContact O-N 3.24Å; R140-V143 PolarHBondContact O-N 2.79Å; R140-E144 PolarHBondContact O-N 3.05Å
141Q88.3Confident88Confident127 Ų127118.8 Ų118.859%0.59355%0.551SS**Hα-helixtrans-62.2-32.7175-75.5178.719.900112.9E137 L138 Y139 P145E137-Q141 WeakPolarHBondContact O-CB 3.38Å; E137-Q141 WeakPolarHBondContact O-CG 3.35Å; E137-Q141 PolarHBondContact O-N 3.34Å; L138-Q141 PolarHBondContact O-N 3.44Å; Y139-Q141 PolarHBondContact O-N 3.03Å; Q141-P145 WeakPolarHBondContact O-CD 3.35Å; Q141-P145 WeakPolarHBondContact O-CG 2.94Å
142K86.7Confident88Confident146 Ų146120 Ų12064%0.63556%0.558SS**Hα-helixtrans-77.8-34.8174.2-73.2179.6179.9179.30112.8L138 Y139 R140 P145 L146L138-K142 WeakPolarHBondContact O-CG 3.41Å; L138-K142 PolarHBondContact O-N 3.16Å; Y139-K142 PolarHBondContact O-N 3.44Å; R140-K142 VanDerWaalsContact C-N 3.28Å; R140-K142 PolarHBondContact O-N 3.24Å; K142-P145 WeakPolarHBondContact O-CD 3.45Å; K142-P145 WeakPolarHBondContact O-CG 3.48Å; K142-L146 WeakPolarHBondContact O-CD1 3.19Å
143V88.3Confident88.1Confident62 Ų62114.7 Ų114.738%0.37655%0.547SS..Hα-helixtrans-81.5-34-175.5171.80000112.7Y139 R140 L146 R147Y139-V143 HydrophobicContact CD1-CG2 3.62Å; Y139-V143 HydrophobicContact CE1-CG2 3.45Å; Y139-V143 VanDerWaalsContact CE1-CG2 3.45Å; Y139-V143 HydrophobicContact CG-CG2 4.45Å; Y139-V143 WeakPolarHBondContact O-CB 3.29Å; Y139-V143 VanDerWaalsContact O-CG2 3.24Å; Y139-V143 WeakPolarHBondContact O-CG2 3.24Å; Y139-V143 PolarHBondContact O-N 3.42Å; R140-V143 PolarHBondContact O-N 2.79Å; V143-L146 PolarHBondContact O-N 2.93Å; V143-R147 WeakPolarHBondContact O-CB 3.48Å; V143-R147 PolarHBondContact O-N 2.9Å
144E83.2Confident88.1Confident137 Ų137112.1 Ų112.164%0.6454%0.544SS*.Hα-helixtrans-52.9-53.7175.9-105.5-165.1116.600113.8R140 R147 A148R140-E144 PolarHBondContact O-N 3.05Å; E144-R147 PolarHBondContact O-N 3.22Å; E144-A148 PolarHBondContact O-N 2.73Å; E144-A148 VanDerWaalsContact O-N 3.11Å
145P87.7Confident88Confident60 Ų60114 Ų11439%0.3955%0.546SS..Hα-helixtrans-66.9-40.317925.2-33000111.6Q141 K142 R147 A148 E149Q141-P145 WeakPolarHBondContact O-CD 3.35Å; Q141-P145 WeakPolarHBondContact O-CG 2.94Å; K142-P145 WeakPolarHBondContact O-CD 3.45Å; K142-P145 WeakPolarHBondContact O-CG 3.48Å; P145-R147 PolarHBondContact O-N 3.24Å; P145-A148 CarbonylContact O-C 3.59Å; P145-A148 WeakPolarHBondContact O-CB 3.46Å; P145-A148 PolarHBondContact O-N 3.3Å; P145-E149 WeakPolarHBondContact O-CB 3.24Å; P145-E149 WeakPolarHBondContact O-CG 3.48Å; P145-E149 PolarHBondContact O-N 2.92Å
146L83.8Confident88.1Confident99 Ų99114.2 Ų114.252%0.51855%0.547SS..Hα-helixtrans-58.1-37.9176.1-103.470000112.2K142 V143 L150K142-L146 WeakPolarHBondContact O-CD1 3.19Å; V143-L146 PolarHBondContact O-N 2.93Å; L146-L150 VanDerWaalsContact O-CB 3.28Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.36Å
147R83.6Confident88.2Confident187 Ų187114.9 Ų114.971%0.70655%0.547SS*.Hα-helixtrans-68.6-40.8176.3-166.8-177.2-162.4176.95.9111.6V143 E144 P145 Q151V143-R147 WeakPolarHBondContact O-CB 3.48Å; V143-R147 PolarHBondContact O-N 2.9Å; E144-R147 PolarHBondContact O-N 3.22Å; P145-R147 PolarHBondContact O-N 3.24Å; R147-Q151 VanDerWaalsContact O-CB 3.28Å; R147-Q151 WeakPolarHBondContact O-CB 3.28Å; R147-Q151 PolarHBondContact O-N 3.44Å
148A88.2Confident88.2Confident48 Ų48114.9 Ų114.940%0.39755%0.55SS..Hα-helixtrans-64.1-48.1175.700000111.2E144 P145 L150 Q151 E152E144-A148 PolarHBondContact O-N 2.73Å; E144-A148 VanDerWaalsContact O-N 3.11Å; P145-A148 CarbonylContact O-C 3.59Å; P145-A148 WeakPolarHBondContact O-CB 3.46Å; P145-A148 PolarHBondContact O-N 3.3Å; A148-L150 PolarHBondContact O-N 2.82Å; A148-Q151 PolarHBondContact O-N 2.85Å; A148-Q151 VanDerWaalsContact O-N 3.15Å; A148-E152 WeakPolarHBondContact O-CG 3.45Å; A148-E152 PolarHBondContact O-N 3.15Å
149E89.4Confident88.2Confident124 Ų124115.5 Ų115.558%0.57955%0.55SS**Hα-helixtrans-60.5-42.8176.8-72.3-178.793.800111.9P145 E152 G153P145-E149 WeakPolarHBondContact O-CB 3.24Å; P145-E149 WeakPolarHBondContact O-CG 3.48Å; P145-E149 PolarHBondContact O-N 2.92Å; E149-E152 PolarHBondContact O-N 2.87Å; E149-G153 PolarHBondContact O-N 2.97Å
150L89.4Confident88.2Confident126 Ų126110.9 Ų110.966%0.6653%0.534SS*.Hα-helixtrans-64.8-39.5175-77171.5000112.1L146 A148 A154L146-L150 VanDerWaalsContact O-CB 3.28Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.36Å; A148-L150 PolarHBondContact O-N 2.82Å; L150-A154 WeakPolarHBondContact O-CB 3.49Å; L150-A154 PolarHBondContact O-N 2.78Å
151Q88.8Confident88.4Confident99 Ų99106.5 Ų106.546%0.46352%0.524SS..Hα-helixtrans-69.4-40.3178.8-176.5174.7-18.700111.8R147 A148 R155R147-Q151 VanDerWaalsContact O-CB 3.28Å; R147-Q151 WeakPolarHBondContact O-CB 3.28Å; R147-Q151 PolarHBondContact O-N 3.44Å; A148-Q151 PolarHBondContact O-N 2.85Å; A148-Q151 VanDerWaalsContact O-N 3.15Å; Q151-R155 WeakPolarHBondContact O-CB 3.37Å; Q151-R155 WeakPolarHBondContact O-CG 3.15Å; Q151-R155 PolarHBondContact O-N 3.46Å
152E90Very high88.2Confident133 Ų133106.8 Ų106.862%0.62153%0.526SS*.Hα-helixtrans-67.1-47.3174.2-72.7-174.8162.600111.3A148 E149 A154 R155 Q156A148-E152 WeakPolarHBondContact O-CG 3.45Å; A148-E152 PolarHBondContact O-N 3.15Å; E149-E152 PolarHBondContact O-N 2.87Å; E152-A154 VanDerWaalsContact C-N 3.33Å; E152-A154 PolarHBondContact O-N 2.92Å; E152-R155 PolarHBondContact O-N 3.49Å; E152-Q156 WeakPolarHBondContact O-CB 3.28Å; E152-Q156 PolarHBondContact O-N 3.15Å
153G90.2Very high88.2Confident29 Ų29105.7 Ų105.730%0.29952%0.523SS..Hα-helixtrans-60.3-40.3175.800000112.8E149 Q156 K157E149-G153 PolarHBondContact O-N 2.97Å; G153-Q156 PolarHBondContact O-N 2.9Å; G153-K157 WeakPolarHBondContact O-CB 3.44Å; G153-K157 VanDerWaalsContact O-CG 3.29Å; G153-K157 WeakPolarHBondContact O-CG 3.45Å; G153-K157 PolarHBondContact O-N 3.11Å
154A90.4Very high88.1Confident52 Ų52110 Ų11043%0.4354%0.536SS..Hα-helixtrans-66.4-40.8175.400000112.4L150 E152 K157 L158L150-A154 WeakPolarHBondContact O-CB 3.49Å; L150-A154 PolarHBondContact O-N 2.78Å; E152-A154 VanDerWaalsContact C-N 3.33Å; E152-A154 PolarHBondContact O-N 2.92Å; A154-K157 PolarHBondContact O-N 3.2Å; A154-L158 WeakPolarHBondContact O-CB 3.47Å; A154-L158 WeakPolarHBondContact O-CG 3.29Å; A154-L158 PolarHBondContact O-N 3.4Å
155R89.7Confident88.2Confident163 Ų163108.1 Ų108.162%0.61553%0.53SS*.Hα-helixtrans-64.5-43.6174.9-80.8179.4175.2160.8-1.7111.9Q151 E152 L158 H159Q151-R155 WeakPolarHBondContact O-CB 3.37Å; Q151-R155 WeakPolarHBondContact O-CG 3.15Å; Q151-R155 PolarHBondContact O-N 3.46Å; E152-R155 PolarHBondContact O-N 3.49Å; R155-L158 PolarHBondContact O-N 3.34Å; R155-H159 PolarHBondContact O-N 2.79Å
156Q91.7Very high87.9Confident132 Ų132109 Ų10962%0.61754%0.538SS*.Hα-helixtrans-62.5-46.2177.2-168.8178.615.800110.9E152 G153 L158 H159 E160E152-Q156 WeakPolarHBondContact O-CB 3.28Å; E152-Q156 PolarHBondContact O-N 3.15Å; G153-Q156 PolarHBondContact O-N 2.9Å; Q156-L158 PolarHBondContact O-N 3.44Å; Q156-H159 WeakPolarHBondContact O-CB 3.47Å; Q156-H159 PolarHBondContact O-N 2.89Å; Q156-H159 VanDerWaalsContact O-N 3.15Å; Q156-E160 WeakPolarHBondContact O-CG 3.48Å; Q156-E160 PolarHBondContact O-N 3.47Å
157K89.5Confident88.1Confident122 Ų122107.6 Ų107.653%0.5354%0.535SS..Hα-helixtrans-62.8-39.3176.5-75.1-73.7163.6-1380112.9G153 A154 H159 E160 L161G153-K157 WeakPolarHBondContact O-CB 3.44Å; G153-K157 VanDerWaalsContact O-CG 3.29Å; G153-K157 WeakPolarHBondContact O-CG 3.45Å; G153-K157 PolarHBondContact O-N 3.11Å; A154-K157 PolarHBondContact O-N 3.2Å; K157-H159 VanDerWaalsContact C-N 3.33Å; K157-E160 WeakPolarHBondContact CD-OE2 3.31Å; K157-E160 WeakPolarHBondContact CE-OE2 3.43Å; K157-E160 IonicContact NZ-OE1 3.52Å; K157-E160 IonicContact NZ-OE2 3.61Å; K157-E160 PolarHBondContact NZ-OE2 3.03Å; K157-E160 PolarHBondContact O-N 3.4Å; K157-L161 WeakPolarHBondContact O-CB 3.27Å; K157-L161 VanDerWaalsContact O-CD1 3.27Å; K157-L161 WeakPolarHBondContact O-CD1 3.5Å; K157-L161 PolarHBondContact O-N 3.49Å
158L89.5Confident88Confident119 Ų119103.1 Ų103.162%0.62352%0.524SS*.Hα-helixtrans-64-39.5174-80.6169.8000111.7A154 R155 Q156 L161 Q162A154-L158 WeakPolarHBondContact O-CB 3.47Å; A154-L158 WeakPolarHBondContact O-CG 3.29Å; A154-L158 PolarHBondContact O-N 3.4Å; R155-L158 PolarHBondContact O-N 3.34Å; Q156-L158 PolarHBondContact O-N 3.44Å; L158-L161 PolarHBondContact O-N 3.36Å; L158-Q162 WeakPolarHBondContact O-CB 3.33Å; L158-Q162 PolarHBondContact O-N 3.49Å
159H88.8Confident87.9Confident112 Ų112102.8 Ų102.852%0.51953%0.525SS..Hα-helixtrans-65.5-47.5176.2-157.870.8000111.5R155 Q156 K157 L161 Q162 E163R155-H159 PolarHBondContact O-N 2.79Å; Q156-H159 WeakPolarHBondContact O-CB 3.47Å; Q156-H159 PolarHBondContact O-N 2.89Å; Q156-H159 VanDerWaalsContact O-N 3.15Å; K157-H159 VanDerWaalsContact C-N 3.33Å; H159-L161 VanDerWaalsContact C-N 3.29Å; H159-L161 PolarHBondContact O-N 2.91Å; H159-Q162 PolarHBondContact O-N 2.94Å; H159-Q162 VanDerWaalsContact O-N 3.13Å; H159-E163 IonicContact CD2-OE2 3.83Å; H159-E163 PolarHBondContact O-N 3.05Å
160E89.1Confident87.7Confident65 Ų65103 Ų10330%0.30453%0.527SS..Hα-helixtrans-58.9-39.9174.6-70.6-178.791.800112Q156 K157 K164Q156-E160 WeakPolarHBondContact O-CG 3.48Å; Q156-E160 PolarHBondContact O-N 3.47Å; K157-E160 WeakPolarHBondContact CD-OE2 3.31Å; K157-E160 WeakPolarHBondContact CE-OE2 3.43Å; K157-E160 IonicContact NZ-OE1 3.52Å; K157-E160 IonicContact NZ-OE2 3.61Å; K157-E160 PolarHBondContact NZ-OE2 3.03Å; K157-E160 PolarHBondContact O-N 3.4Å; E160-K164 WeakPolarHBondContact O-CB 3.41Å; E160-K164 VanDerWaalsContact O-CG 3.31Å; E160-K164 WeakPolarHBondContact O-CG 3.44Å; E160-K164 PolarHBondContact O-N 2.9Å
161L89.4Confident87.6Confident95 Ų95102 Ų10250%0.49752%0.518SS..Hα-helixtrans-66.4-43.6175-10483.2000111.4K157 L158 H159 E163 K164 L165K157-L161 WeakPolarHBondContact O-CB 3.27Å; K157-L161 VanDerWaalsContact O-CD1 3.27Å; K157-L161 WeakPolarHBondContact O-CD1 3.5Å; K157-L161 PolarHBondContact O-N 3.49Å; L158-L161 PolarHBondContact O-N 3.36Å; H159-L161 VanDerWaalsContact C-N 3.29Å; H159-L161 PolarHBondContact O-N 2.91Å; L161-E163 VanDerWaalsContact C-N 3.35Å; L161-K164 PolarHBondContact O-N 2.97Å; L161-L165 VanDerWaalsContact O-CB 3.22Å; L161-L165 WeakPolarHBondContact O-CB 3.42Å; L161-L165 WeakPolarHBondContact O-CG 3.36Å; L161-L165 PolarHBondContact O-N 3.08Å
162Q84.4Confident87.6Confident133 Ų133102.7 Ų102.762%0.62152%0.523SS*.Hα-helixtrans-62.1-44.1178.4-176.1179-1.800111L158 H159 K164 L165 S166L158-Q162 WeakPolarHBondContact O-CB 3.33Å; L158-Q162 PolarHBondContact O-N 3.49Å; H159-Q162 PolarHBondContact O-N 2.94Å; H159-Q162 VanDerWaalsContact O-N 3.13Å; Q162-K164 VanDerWaalsContact C-N 3.33Å; Q162-K164 PolarHBondContact O-N 3.44Å; Q162-L165 PolarHBondContact O-N 3.41Å; Q162-S166 PolarHBondContact O-N 3.1Å
163E86.4Confident87.5Confident123 Ų123103.7 Ų103.758%0.57552%0.521SS*.Hα-helixtrans-62.2-38.5175.1-75.3-172.197.800112.2H159 L161 P167H159-E163 IonicContact CD2-OE2 3.83Å; H159-E163 PolarHBondContact O-N 3.05Å; L161-E163 VanDerWaalsContact C-N 3.35Å; E163-P167 WeakPolarHBondContact O-CD 3.5Å
164K86.2Confident87.5Confident152 Ų152107 Ų10766%0.66153%0.532SS*.Hα-helixtrans-75.6-30.8176-73.6-179.9-178.5179.60113.6E160 L161 Q162 P167E160-K164 WeakPolarHBondContact O-CB 3.41Å; E160-K164 VanDerWaalsContact O-CG 3.31Å; E160-K164 WeakPolarHBondContact O-CG 3.44Å; E160-K164 PolarHBondContact O-N 2.9Å; L161-K164 PolarHBondContact O-N 2.97Å; Q162-K164 VanDerWaalsContact C-N 3.33Å; Q162-K164 PolarHBondContact O-N 3.44Å; K164-P167 WeakPolarHBondContact O-CD 3.46Å; K164-P167 WeakPolarHBondContact O-CG 3.46Å
165L85.4Confident87.4Confident97 Ų97110.8 Ų110.851%0.50854%0.535SS..Hα-helixtrans-80.1-29.7-178.9-76.6169.4000112.5L161 Q162 L168 G169L161-L165 VanDerWaalsContact O-CB 3.22Å; L161-L165 WeakPolarHBondContact O-CB 3.42Å; L161-L165 WeakPolarHBondContact O-CG 3.36Å; L161-L165 PolarHBondContact O-N 3.08Å; Q162-L165 PolarHBondContact O-N 3.41Å; L165-L168 HydrophobicContact CD2-CD2 4.33Å; L165-L168 PolarHBondContact O-N 3.4Å; L165-G169 PolarHBondContact O-N 3.44Å
166S82.3Confident87.4Confident79 Ų79105.6 Ų105.655%0.55253%0.527SS*.Hα-helixtrans-57.8-51.3178.8-152.60000113.3Q162 L168 G169 E170Q162-S166 PolarHBondContact O-N 3.1Å; S166-L168 VanDerWaalsContact C-N 3.34Å; S166-L168 PolarHBondContact O-N 2.99Å; S166-G169 PolarHBondContact O-N 3.44Å; S166-E170 PolarHBondContact O-N 3.35Å; S166-E170 VanDerWaalsContact O-N 3.11Å
167P86.8Confident87.3Confident69 Ų69105.6 Ų105.645%0.44852%0.521SS..Hα-helixtrans-69.2-33.2176.827.6-34.6000112E163 K164 G169 E170 E171E163-P167 WeakPolarHBondContact O-CD 3.5Å; K164-P167 WeakPolarHBondContact O-CD 3.46Å; K164-P167 WeakPolarHBondContact O-CG 3.46Å; P167-G169 VanDerWaalsContact C-N 3.28Å; P167-G169 PolarHBondContact O-N 3.32Å; P167-E170 PolarHBondContact O-N 2.9Å; P167-E171 WeakPolarHBondContact O-CB 3.49Å; P167-E171 PolarHBondContact O-N 3.37Å
168L82.8Confident87.3Confident93 Ų93102.6 Ų102.649%0.48752%0.519SS..Hα-helixtrans-64.7-36.3176.5-158.176.2000111.4L165 S166 M172L165-L168 HydrophobicContact CD2-CD2 4.33Å; L165-L168 PolarHBondContact O-N 3.4Å; S166-L168 VanDerWaalsContact C-N 3.34Å; S166-L168 PolarHBondContact O-N 2.99Å; L168-M172 VanDerWaalsContact O-CB 3.29Å; L168-M172 WeakPolarHBondContact O-CB 2.95Å; L168-M172 WeakPolarHBondContact O-CG 3.46Å; L168-M172 PolarHBondContact O-N 2.94Å
169G85.3Confident87.3Confident41 Ų41102.6 Ų102.642%0.42352%0.516SS..Hα-helixtrans-67.9-40174.200000112.7L165 S166 P167 R173L165-G169 PolarHBondContact O-N 3.44Å; S166-G169 PolarHBondContact O-N 3.44Å; P167-G169 VanDerWaalsContact C-N 3.28Å; P167-G169 PolarHBondContact O-N 3.32Å; G169-R173 VanDerWaalsContact O-CB 3.24Å; G169-R173 WeakPolarHBondContact O-CB 3.17Å; G169-R173 PolarHBondContact O-N 2.98Å
170E86.2Confident87.3Confident130 Ų130101.9 Ų101.961%0.60752%0.519SS*.Hα-helixtrans-64.4-48.3172.6-71.1-169.215100111.4S166 P167 M172 R173 D174S166-E170 PolarHBondContact O-N 3.35Å; S166-E170 VanDerWaalsContact O-N 3.11Å; P167-E170 PolarHBondContact O-N 2.9Å; E170-M172 VanDerWaalsContact C-N 3.31Å; E170-M172 PolarHBondContact O-N 3.29Å; E170-R173 WeakPolarHBondContact O-CB 3.22Å; E170-R173 PolarHBondContact O-N 3.31Å; E170-D174 PolarHBondContact O-N 3.5Å
171E87.6Confident87.3Confident103 Ų103103.1 Ų103.148%0.48153%0.528SS..Hα-helixtrans-61.4-39.9178.3-163.3-175.1126.600111.8P167 R175P167-E171 WeakPolarHBondContact O-CB 3.49Å; P167-E171 PolarHBondContact O-N 3.37Å; E171-R175 VanDerWaalsContact O-CB 3.23Å; E171-R175 WeakPolarHBondContact O-CB 3.33Å; E171-R175 PolarHBondContact O-N 2.85Å; E171-R175 IonicContact OE1-CZ 3.7Å; E171-R175 IonicContact OE1-NH1 2.78Å; E171-R175 IonicContact OE1-NH2 2.73Å; E171-R175 PolarHBondContact OE1-NH2 3.13Å
172M88.1Confident87.2Confident115 Ų115100.9 Ų100.957%0.56752%0.523SS*.Hα-helixtrans-64.5-41.1173.1-79-69.7-154.800112.1L168 E170 R175 A176L168-M172 VanDerWaalsContact O-CB 3.29Å; L168-M172 WeakPolarHBondContact O-CB 2.95Å; L168-M172 WeakPolarHBondContact O-CG 3.46Å; L168-M172 PolarHBondContact O-N 2.94Å; E170-M172 VanDerWaalsContact C-N 3.31Å; E170-M172 PolarHBondContact O-N 3.29Å; M172-R175 PolarHBondContact O-N 2.75Å; M172-A176 WeakPolarHBondContact O-CB 3.29Å; M172-A176 PolarHBondContact O-N 3.05Å
173R87.1Confident87.3Confident154 Ų15499.4 Ų99.458%0.58152%0.519SS*.Hα-helixtrans-67.5-40.8178.9-176.8179.2174.9-175.4-1111.5G169 E170 A176 R177G169-R173 VanDerWaalsContact O-CB 3.24Å; G169-R173 WeakPolarHBondContact O-CB 3.17Å; G169-R173 PolarHBondContact O-N 2.98Å; E170-R173 WeakPolarHBondContact O-CB 3.22Å; E170-R173 PolarHBondContact O-N 3.31Å; R173-A176 PolarHBondContact O-N 2.79Å; R173-R177 PolarHBondContact O-N 3.46Å
174D90Very high87.2Confident97 Ų97102.5 Ų102.552%0.51953%0.525SS..Hα-helixtrans-68.2-42.6174.9-81.5-47.3000111.5E170 A176 R177 A178E170-D174 PolarHBondContact O-N 3.5Å; D174-A176 VanDerWaalsContact C-N 3.32Å; D174-A176 PolarHBondContact O-N 3.26Å; D174-R177 PolarHBondContact O-N 2.87Å; D174-A178 WeakPolarHBondContact O-CB 3.35Å; D174-A178 PolarHBondContact O-N 3.13Å
175R88.8Confident87.1Confident132 Ų13299.8 Ų99.850%0.49852%0.522SS..Hα-helixtrans-62.7-39.3174.5-167.8175.4-72.3145.85.7111.8E171 M172 A178 H179E171-R175 VanDerWaalsContact O-CB 3.23Å; E171-R175 WeakPolarHBondContact O-CB 3.33Å; E171-R175 PolarHBondContact O-N 2.85Å; E171-R175 IonicContact OE1-CZ 3.7Å; E171-R175 IonicContact OE1-NH1 2.78Å; E171-R175 IonicContact OE1-NH2 2.73Å; E171-R175 PolarHBondContact OE1-NH2 3.13Å; M172-R175 PolarHBondContact O-N 2.75Å; R175-A178 PolarHBondContact O-N 2.93Å; R175-H179 WeakPolarHBondContact O-CB 3.19Å; R175-H179 PolarHBondContact O-N 2.82Å; R175-H179 PolarHBondContact O-ND1 3.49Å; R175-H179 VanDerWaalsContact O-ND1 3.1Å
176A90.5Very high87Confident54 Ų54101.9 Ų101.945%0.44653%0.528SS..Hα-helixtrans-65.9-44.2175.300000112.1M172 R173 D174 H179 V180M172-A176 WeakPolarHBondContact O-CB 3.29Å; M172-A176 PolarHBondContact O-N 3.05Å; R173-A176 PolarHBondContact O-N 2.79Å; D174-A176 VanDerWaalsContact C-N 3.32Å; D174-A176 PolarHBondContact O-N 3.26Å; A176-H179 PolarHBondContact O-N 3Å; A176-V180 VanDerWaalsContact O-CG2 3.29Å; A176-V180 WeakPolarHBondContact O-CG2 3.42Å; A176-V180 PolarHBondContact O-N 3.03Å
177R88.3Confident86.9Confident133 Ų133102.4 Ų102.450%0.50252%0.524SS..Hα-helixtrans-59.7-47.9173.1-85.8180174.8161-6.2111.5R173 D174 H179 V180 D181R173-R177 PolarHBondContact O-N 3.46Å; D174-R177 PolarHBondContact O-N 2.87Å; R177-H179 VanDerWaalsContact C-N 3.29Å; R177-H179 PolarHBondContact O-N 2.7Å; R177-V180 PolarHBondContact O-N 3.46Å; R177-V180 VanDerWaalsContact O-N 3.11Å; R177-D181 PolarHBondContact O-N 2.86Å
178A89.7Confident86.6Confident58 Ų58101.3 Ų101.348%0.47952%0.521SS..Hα-helixtrans-59-40.4177.400000112D174 R175 A182D174-A178 WeakPolarHBondContact O-CB 3.35Å; D174-A178 PolarHBondContact O-N 3.13Å; R175-A178 PolarHBondContact O-N 2.93Å; A178-A182 VanDerWaalsContact O-CB 3.26Å; A178-A182 WeakPolarHBondContact O-CB 3.37Å; A178-A182 PolarHBondContact O-N 2.78Å
179H89.1Confident86.3Confident119 Ų119100.8 Ų100.855%0.55152%0.524SS*.Hα-helixtrans-66.6-41174.7-83.246.6000112.3R175 A176 R177 A182 L183R175-H179 WeakPolarHBondContact O-CB 3.19Å; R175-H179 PolarHBondContact O-N 2.82Å; R175-H179 PolarHBondContact O-ND1 3.49Å; R175-H179 VanDerWaalsContact O-ND1 3.1Å; A176-H179 PolarHBondContact O-N 3Å; R177-H179 VanDerWaalsContact C-N 3.29Å; R177-H179 PolarHBondContact O-N 2.7Å; H179-A182 PolarHBondContact O-N 3.09Å; H179-L183 WeakPolarHBondContact O-CB 3.37Å; H179-L183 WeakPolarHBondContact O-CD1 3.47Å; H179-L183 PolarHBondContact O-N 2.86Å
180V90.2Very high86Confident97 Ų97105.8 Ų105.859%0.58853%0.531SS*.Hα-helixtrans-66.1-41.6177.2170.40000111.2A176 R177 L183 R184A176-V180 VanDerWaalsContact O-CG2 3.29Å; A176-V180 WeakPolarHBondContact O-CG2 3.42Å; A176-V180 PolarHBondContact O-N 3.03Å; R177-V180 PolarHBondContact O-N 3.46Å; R177-V180 VanDerWaalsContact O-N 3.11Å; V180-L183 PolarHBondContact O-N 3.27Å; V180-R184 WeakPolarHBondContact O-CB 3.24Å; V180-R184 PolarHBondContact O-N 3.33Å
181D88.1Confident85.6Confident92 Ų92101.9 Ų101.949%0.49252%0.518SS..Hα-helixtrans-67.6-40.6176.1-90.4-63.7000112.1R177 R184 T185R177-D181 PolarHBondContact O-N 2.86Å; D181-R184 PolarHBondContact O-N 3.31Å; D181-T185 WeakPolarHBondContact O-CB 3.45Å; D181-T185 PolarHBondContact O-N 2.99Å; D181-T185 PolarHBondContact O-OG1 3.47Å
182A87.3Confident85.3Confident47 Ų47101.5 Ų101.539%0.38852%0.519SS..Hα-helixtrans-63.1-46173.600000111.5A178 H179 T185 H186A178-A182 VanDerWaalsContact O-CB 3.26Å; A178-A182 WeakPolarHBondContact O-CB 3.37Å; A178-A182 PolarHBondContact O-N 2.78Å; H179-A182 PolarHBondContact O-N 3.09Å; A182-T185 PolarHBondContact O-N 3.42Å; A182-H186 WeakPolarHBondContact O-CB 3.21Å; A182-H186 PolarHBondContact O-N 2.93Å
183L87.3Confident85.1Confident103 Ų103100.5 Ų100.554%0.53951%0.513SS..Hα-helixtrans-60.3-47.1173.2-99.383000110.7H179 V180 T185 H186 L187H179-L183 WeakPolarHBondContact O-CB 3.37Å; H179-L183 WeakPolarHBondContact O-CD1 3.47Å; H179-L183 PolarHBondContact O-N 2.86Å; V180-L183 PolarHBondContact O-N 3.27Å; L183-T185 VanDerWaalsContact C-N 3.28Å; L183-T185 PolarHBondContact O-N 2.88Å; L183-H186 PolarHBondContact O-N 3.05Å; L183-L187 HydrophobicContact CB-CD1 4.19Å; L183-L187 HydrophobicContact CD2-CD1 4.48Å; L183-L187 HydrophobicContact CG-CD1 4.21Å; L183-L187 VanDerWaalsContact O-CB 3.23Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 WeakPolarHBondContact O-CD1 3.23Å; L183-L187 PolarHBondContact O-N 3.42Å
184R84.6Confident85Confident187 Ų18797.7 Ų97.771%0.70651%0.509SS*.Hα-helixtrans-60-39.9179.9-177176.5179.6150.80.1111.7V180 D181 A188V180-R184 WeakPolarHBondContact O-CB 3.24Å; V180-R184 PolarHBondContact O-N 3.33Å; D181-R184 PolarHBondContact O-N 3.31Å; R184-A188 WeakPolarHBondContact O-CB 3.5Å; R184-A188 PolarHBondContact O-N 3.11Å
185T84.2Confident84.7Confident96 Ų96101.3 Ų101.359%0.58952%0.515SS*.Hα-helixtrans-67.7-44.5177.8-56.10000111.2D181 A182 L183D181-T185 WeakPolarHBondContact O-CB 3.45Å; D181-T185 PolarHBondContact O-N 2.99Å; D181-T185 PolarHBondContact O-OG1 3.47Å; A182-T185 PolarHBondContact O-N 3.42Å; L183-T185 VanDerWaalsContact C-N 3.28Å; L183-T185 PolarHBondContact O-N 2.88Å
186H82.1Confident84.6Confident140 Ų140101.7 Ų101.765%0.64852%0.523SS*.Hα-helixtrans-70.4-34176.9-72.5-175.9000112.9A182 L183 P189 Y190A182-H186 WeakPolarHBondContact O-CB 3.21Å; A182-H186 PolarHBondContact O-N 2.93Å; L183-H186 PolarHBondContact O-N 3.05Å; H186-P189 WeakPolarHBondContact O-CD 3.28Å; H186-Y190 WeakPolarHBondContact O-CD2 3.17Å
187L81.8Confident84.4Confident90 Ų90107.3 Ų107.347%0.47153%0.532SS..Hα-helixtrans-85-14.6179.3-84.780.5000113L183 Y190 S191L183-L187 HydrophobicContact CB-CD1 4.19Å; L183-L187 HydrophobicContact CD2-CD1 4.48Å; L183-L187 HydrophobicContact CG-CD1 4.21Å; L183-L187 VanDerWaalsContact O-CB 3.23Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 WeakPolarHBondContact O-CD1 3.23Å; L183-L187 PolarHBondContact O-N 3.42Å; L187-Y190 CarbonylContact O-C 3.5Å; L187-Y190 PolarHBondContact O-N 2.84Å; L187-Y190 VanDerWaalsContact O-N 3.15Å; L187-S191 WeakPolarHBondContact O-CB 3.37Å; L187-S191 PolarHBondContact O-N 2.91Å
188A78.7Confident84.5Confident47 Ų47106.5 Ų106.539%0.38854%0.537SS..Hα-helixtrans-50.5-53.4177.300000112.6R184 Y190 S191R184-A188 WeakPolarHBondContact O-CB 3.5Å; R184-A188 PolarHBondContact O-N 3.11Å; A188-Y190 PolarHBondContact O-N 3.47Å; A188-S191 PolarHBondContact O-N 3.35Å; A188-S191 PolarHBondContact O-OG 2.85Å
189P78.3Confident84.5Confident82 Ų82106.2 Ų106.253%0.53254%0.535SS..Hα-helixtrans-66.2-37.1177.325.3-34.2000112.8H186 S191 D192 E193H186-P189 WeakPolarHBondContact O-CD 3.28Å; P189-S191 VanDerWaalsContact C-N 3.27Å; P189-S191 PolarHBondContact O-N 2.83Å; P189-D192 PolarHBondContact O-N 3.1Å; P189-E193 PolarHBondContact O-N 3.02Å
190Y78.2Confident84.5Confident146 Ų146103.2 Ų103.257%0.57353%0.531SS*.Hα-helixtrans-69-25.2176.5-74.8-74000113H186 L187 A188 E193 L194H186-Y190 WeakPolarHBondContact O-CD2 3.17Å; L187-Y190 CarbonylContact O-C 3.5Å; L187-Y190 PolarHBondContact O-N 2.84Å; L187-Y190 VanDerWaalsContact O-N 3.15Å; A188-Y190 PolarHBondContact O-N 3.47Å; Y190-E193 PolarHBondContact O-N 3.18Å; Y190-L194 WeakPolarHBondContact O-CB 3.46Å; Y190-L194 WeakPolarHBondContact O-CD1 3.18Å; Y190-L194 VanDerWaalsContact O-CG 3.28Å; Y190-L194 WeakPolarHBondContact O-CG 3.49Å; Y190-L194 PolarHBondContact O-N 3.43Å
191S77.3Confident84.3Confident47 Ų47108.2 Ų108.233%0.32954%0.539SS..Hα-helixtrans-69.8-35.7-179.6780000111.7L187 A188 P189 R195L187-S191 WeakPolarHBondContact O-CB 3.37Å; L187-S191 PolarHBondContact O-N 2.91Å; A188-S191 PolarHBondContact O-N 3.35Å; A188-S191 PolarHBondContact O-OG 2.85Å; P189-S191 VanDerWaalsContact C-N 3.27Å; P189-S191 PolarHBondContact O-N 2.83Å; S191-R195 WeakPolarHBondContact O-CB 3.4Å; S191-R195 WeakPolarHBondContact O-CG 3.43Å; S191-R195 PolarHBondContact O-N 2.94Å
192D81.4Confident84.4Confident96 Ų96109.7 Ų109.751%0.51355%0.546SS..Hα-helixtrans-71.3-43.5173-81.4-52.2000111.1P189 L194 R195 Q196P189-D192 PolarHBondContact O-N 3.1Å; D192-L194 VanDerWaalsContact C-N 3.35Å; D192-L194 PolarHBondContact O-N 3.34Å; D192-R195 PolarHBondContact O-N 3.4Å; D192-Q196 WeakPolarHBondContact O-CG 3.3Å; D192-Q196 PolarHBondContact O-N 2.9Å
193E83.4Confident84.4Confident94 Ų94113.9 Ų113.944%0.43956%0.558SS.*Hα-helixtrans-60.4-42.5172.2-81.2-165.4130.900112.4P189 Y190 Q196 R197P189-E193 PolarHBondContact O-N 3.02Å; Y190-E193 PolarHBondContact O-N 3.18Å; E193-Q196 PolarHBondContact O-N 3.47Å; E193-R197 WeakPolarHBondContact O-CB 3.41Å; E193-R197 WeakPolarHBondContact O-CG 3.49Å; E193-R197 PolarHBondContact O-N 3.03Å
194L85Confident84.3Confident95 Ų95110.8 Ų110.850%0.49755%0.547SS..Hα-helixtrans-64.4-43.9176.9-84.2161.4000110.9Y190 D192 R197 L198Y190-L194 WeakPolarHBondContact O-CB 3.46Å; Y190-L194 WeakPolarHBondContact O-CD1 3.18Å; Y190-L194 VanDerWaalsContact O-CG 3.28Å; Y190-L194 WeakPolarHBondContact O-CG 3.49Å; Y190-L194 PolarHBondContact O-N 3.43Å; D192-L194 VanDerWaalsContact C-N 3.35Å; D192-L194 PolarHBondContact O-N 3.34Å; L194-R197 PolarHBondContact O-N 3.06Å; L194-L198 VanDerWaalsContact O-CB 3.26Å; L194-L198 WeakPolarHBondContact O-CB 3.39Å; L194-L198 WeakPolarHBondContact O-CD1 3.29Å; L194-L198 VanDerWaalsContact O-CG 3.27Å; L194-L198 WeakPolarHBondContact O-CG 3.26Å; L194-L198 PolarHBondContact O-N 3.3Å
195R84.3Confident84.4Confident173 Ų173107.6 Ų107.665%0.65354%0.544SS*.Hα-helixtrans-60.3-44.9175.2-87.4179.3172.8153-1.8111.8S191 D192 L198 A199S191-R195 WeakPolarHBondContact O-CB 3.4Å; S191-R195 WeakPolarHBondContact O-CG 3.43Å; S191-R195 PolarHBondContact O-N 2.94Å; D192-R195 PolarHBondContact O-N 3.4Å; R195-L198 PolarHBondContact O-N 3.43Å; R195-A199 WeakPolarHBondContact O-CB 3.4Å; R195-A199 PolarHBondContact O-N 3.23Å
196Q87.1Confident84.3Confident140 Ų140111.1 Ų111.165%0.65455%0.551SS**Hα-helixtrans-64.1-44.5176.9-73.6-178.6-2.100111.6D192 E193 L198 A199 A200D192-Q196 WeakPolarHBondContact O-CG 3.3Å; D192-Q196 PolarHBondContact O-N 2.9Å; E193-Q196 PolarHBondContact O-N 3.47Å; Q196-L198 VanDerWaalsContact C-N 3.34Å; Q196-L198 PolarHBondContact O-N 2.92Å; Q196-A199 PolarHBondContact O-N 2.92Å; Q196-A200 WeakPolarHBondContact O-CB 3.36Å; Q196-A200 PolarHBondContact O-N 3.45Å
197R86.4Confident84.4Confident171 Ų171111.7 Ų111.765%0.64555%0.554SS**Hα-helixtrans-63-38.8175.3-78-177.8179.1172.14.8112.5E193 L194 R201E193-R197 WeakPolarHBondContact O-CB 3.41Å; E193-R197 WeakPolarHBondContact O-CG 3.49Å; E193-R197 PolarHBondContact O-N 3.03Å; L194-R197 PolarHBondContact O-N 3.06Å; R197-R201 VanDerWaalsContact O-CB 3.28Å; R197-R201 WeakPolarHBondContact O-CB 3.49Å; R197-R201 WeakPolarHBondContact O-CG 3.4Å; R197-R201 PolarHBondContact O-N 2.87Å
198L89.2Confident84.3Confident116 Ų116111.9 Ų111.961%0.60756%0.555SS**Hα-helixtrans-65.8-45.1176.1-81.3157.9000111.1L194 R195 Q196 R201 L202L194-L198 VanDerWaalsContact O-CB 3.26Å; L194-L198 WeakPolarHBondContact O-CB 3.39Å; L194-L198 WeakPolarHBondContact O-CD1 3.29Å; L194-L198 VanDerWaalsContact O-CG 3.27Å; L194-L198 WeakPolarHBondContact O-CG 3.26Å; L194-L198 PolarHBondContact O-N 3.3Å; R195-L198 PolarHBondContact O-N 3.43Å; Q196-L198 VanDerWaalsContact C-N 3.34Å; Q196-L198 PolarHBondContact O-N 2.92Å; L198-R201 PolarHBondContact O-N 3.47Å; L198-L202 VanDerWaalsContact O-CB 3.31Å; L198-L202 WeakPolarHBondContact O-CB 3.37Å; L198-L202 PolarHBondContact O-N 3.31Å
199A89.8Confident84.3Confident53 Ų53110.7 Ų110.744%0.43855%0.548SS..Hα-helixtrans-59.8-49.6175.400000111.2R195 Q196 R201 L202 E203R195-A199 WeakPolarHBondContact O-CB 3.4Å; R195-A199 PolarHBondContact O-N 3.23Å; Q196-A199 PolarHBondContact O-N 2.92Å; A199-R201 VanDerWaalsContact C-N 3.34Å; A199-R201 PolarHBondContact O-N 3.34Å; A199-L202 PolarHBondContact O-N 3.48Å; A199-L202 VanDerWaalsContact O-N 3.11Å; A199-E203 PolarHBondContact O-N 2.92Å
200A89.3Confident84.3Confident55 Ų55108.9 Ų108.946%0.45554%0.544SS..Hα-helixtrans-61.4-39.7177.600000112.5Q196 L202 A204Q196-A200 WeakPolarHBondContact O-CB 3.36Å; Q196-A200 PolarHBondContact O-N 3.45Å; A200-L202 VanDerWaalsContact C-N 3.34Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.04Å; A200-A204 PolarHBondContact O-N 2.96Å
201R87.1Confident84.3Confident202 Ų202104.6 Ų104.676%0.76254%0.539SS*.Hα-helixtrans-65.4-37.1174.8-80.4-84.6-176.5151.60112.1R197 L198 A199 L205R197-R201 VanDerWaalsContact O-CB 3.28Å; R197-R201 WeakPolarHBondContact O-CB 3.49Å; R197-R201 WeakPolarHBondContact O-CG 3.4Å; R197-R201 PolarHBondContact O-N 2.87Å; L198-R201 PolarHBondContact O-N 3.47Å; A199-R201 VanDerWaalsContact C-N 3.34Å; A199-R201 PolarHBondContact O-N 3.34Å; R201-L205 WeakPolarHBondContact O-CB 3.04Å; R201-L205 PolarHBondContact O-N 3.36Å
202L88.7Confident84.1Confident123 Ų123110 Ų11064%0.64455%0.552SS**Hα-helixtrans-74.7-38.1-178.6-154.7148.9000111.1L198 A199 A200 L205 K206L198-L202 VanDerWaalsContact O-CB 3.31Å; L198-L202 WeakPolarHBondContact O-CB 3.37Å; L198-L202 PolarHBondContact O-N 3.31Å; A199-L202 PolarHBondContact O-N 3.48Å; A199-L202 VanDerWaalsContact O-N 3.11Å; A200-L202 VanDerWaalsContact C-N 3.34Å; L202-L205 PolarHBondContact O-N 2.85Å; L202-K206 WeakPolarHBondContact O-CB 3.37Å; L202-K206 PolarHBondContact O-N 2.82Å
203E88.4Confident83.9Confident136 Ų136111.2 Ų111.264%0.63656%0.558SS**Hα-helixtrans-62.9-50169.1-78.1-173.5111.600111.5A199 L205 K206 E207A199-E203 PolarHBondContact O-N 2.92Å; E203-L205 VanDerWaalsContact C-N 3.25Å; E203-L205 PolarHBondContact O-N 3.47Å; E203-K206 WeakPolarHBondContact O-CB 3.23Å; E203-K206 PolarHBondContact O-N 3.11Å; E203-E207 PolarHBondContact O-N 2.89Å
204A86Confident83.8Confident38 Ų38109.9 Ų109.931%0.31456%0.563SS.*Hα-helixtrans-60.3-35.9176.300000112A200 N208A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.04Å; A200-A204 PolarHBondContact O-N 2.96Å; A204-N208 WeakPolarHBondContact O-CB 3.19Å; A204-N208 PolarHBondContact O-N 2.89Å; A204-N208 PolarHBondContact O-ND2 3.35Å
205L85.3Confident83.5Confident120 Ų120110.8 Ų110.863%0.62856%0.564SS**Hα-helixtrans-71.3-33.9175.4-174.166.7000111.8R201 L202 E203 G209R201-L205 WeakPolarHBondContact O-CB 3.04Å; R201-L205 PolarHBondContact O-N 3.36Å; L202-L205 PolarHBondContact O-N 2.85Å; E203-L205 VanDerWaalsContact C-N 3.25Å; E203-L205 PolarHBondContact O-N 3.47Å; L205-G209 WeakPolarHBondContact O-CA 3.4Å; L205-G209 PolarHBondContact O-N 3.3Å
206K82.9Confident83.4Confident169 Ų169110.7 Ų110.774%0.73557%0.565SS**Hα-helixtrans-68.7-44.4176.4-174.7178.5175.2-175.10111.3L202 E203 G210L202-K206 WeakPolarHBondContact O-CB 3.37Å; L202-K206 PolarHBondContact O-N 2.82Å; E203-K206 WeakPolarHBondContact O-CB 3.23Å; E203-K206 PolarHBondContact O-N 3.11Å; K206-G210 PolarHBondContact O-N 3.5Å
207E83.2Confident82.8Confident153 Ų153111 Ų11172%0.71557%0.566SS**Hα-helixtrans-65.7-52174.6-76.2-172.9140.400111.8E203 G209 G210 A211E203-E207 PolarHBondContact O-N 2.89Å; E207-G209 VanDerWaalsContact C-N 3.28Å; E207-G209 PolarHBondContact O-N 3.13Å; E207-G210 PolarHBondContact O-N 3.41Å; E207-A211 PolarHBondContact O-N 3.1Å; E207-A211 VanDerWaalsContact O-N 3.07Å
208N80.6Confident82.7Confident93 Ų93105.7 Ų105.750%0.49756%0.559SS.*Hα-helixtrans-66.6-32.2179.2-71.7-48000112.2A204 R212A204-N208 WeakPolarHBondContact O-CB 3.19Å; A204-N208 PolarHBondContact O-N 2.89Å; A204-N208 PolarHBondContact O-ND2 3.35Å; N208-R212 VanDerWaalsContact O-CB 3.23Å; N208-R212 WeakPolarHBondContact O-CB 3.28Å; N208-R212 VanDerWaalsContact O-CG 3.28Å; N208-R212 WeakPolarHBondContact O-CG 3.4Å; N208-R212 PolarHBondContact O-N 2.86Å
209G78.9Confident82.3Confident23 Ų23106 Ų10624%0.23756%0.556CS.*Hα-helixtrans-66.4-43.4176.500000111.5L205 E207 L213L205-G209 WeakPolarHBondContact O-CA 3.4Å; L205-G209 PolarHBondContact O-N 3.3Å; E207-G209 VanDerWaalsContact C-N 3.28Å; E207-G209 PolarHBondContact O-N 3.13Å; G209-L213 VanDerWaalsContact O-CB 3.27Å; G209-L213 WeakPolarHBondContact O-CB 3.46Å; G209-L213 WeakPolarHBondContact O-CD1 3.45Å; G209-L213 VanDerWaalsContact O-CG 3.25Å; G209-L213 WeakPolarHBondContact O-CG 3.34Å; G209-L213 PolarHBondContact O-N 2.87Å
210G78.3Confident82Confident43 Ų43106 Ų10644%0.44356%0.556SS.*Hα-helixtrans-61.8-46.8173.600000112.6K206 E207 L213 A214K206-G210 PolarHBondContact O-N 3.5Å; E207-G210 PolarHBondContact O-N 3.41Å; G210-L213 PolarHBondContact O-N 2.73Å; G210-A214 PolarHBondContact O-N 2.77Å
211A77.2Confident81.7Confident57 Ų57107.3 Ų107.347%0.47156%0.558SS.*Hα-helixtrans-64-45.9177.400000112.2E207 L213 A214 E215E207-A211 PolarHBondContact O-N 3.1Å; E207-A211 VanDerWaalsContact O-N 3.07Å; A211-L213 PolarHBondContact O-N 2.77Å; A211-A214 PolarHBondContact O-N 3.47Å; A211-E215 PolarHBondContact O-N 2.99Å
212R74.5Confident81.6Confident161 Ų161104 Ų10461%0.60855%0.552SS**Hα-helixtrans-64.3-38.7177.2-78-179.9177.4-179.9-0.1112.2N208 A214 E215 Y216N208-R212 VanDerWaalsContact O-CB 3.23Å; N208-R212 WeakPolarHBondContact O-CB 3.28Å; N208-R212 VanDerWaalsContact O-CG 3.28Å; N208-R212 WeakPolarHBondContact O-CG 3.4Å; N208-R212 PolarHBondContact O-N 2.86Å; R212-A214 VanDerWaalsContact C-N 3.3Å; R212-A214 PolarHBondContact O-N 3.33Å; R212-E215 PolarHBondContact O-N 3.25Å; R212-Y216 HydrophobicContact CB-CD2 4.43Å; R212-Y216 WeakPolarHBondContact O-CB 3.21Å; R212-Y216 WeakPolarHBondContact O-CD2 3.48Å; R212-Y216 PolarHBondContact O-N 3.34Å
213L76.9Confident81.2Confident121 Ų121104.1 Ų104.163%0.63455%0.549SS*.Hα-helixtrans-60.6-41176-83.8161.8000111.5G209 G210 A211 Y216 H217G209-L213 VanDerWaalsContact O-CB 3.27Å; G209-L213 WeakPolarHBondContact O-CB 3.46Å; G209-L213 WeakPolarHBondContact O-CD1 3.45Å; G209-L213 VanDerWaalsContact O-CG 3.25Å; G209-L213 WeakPolarHBondContact O-CG 3.34Å; G209-L213 PolarHBondContact O-N 2.87Å; G210-L213 PolarHBondContact O-N 2.73Å; A211-L213 PolarHBondContact O-N 2.77Å; L213-Y216 PolarHBondContact O-N 3.27Å; L213-H217 PolarHBondContact O-N 3.45Å
214A79.8Confident80.7Confident66 Ų66103.6 Ų103.655%0.54555%0.549SS..Hα-helixtrans-64.5-43.5174.700000112G210 A211 R212 H217 A218G210-A214 PolarHBondContact O-N 2.77Å; A211-A214 PolarHBondContact O-N 3.47Å; R212-A214 VanDerWaalsContact C-N 3.3Å; R212-A214 PolarHBondContact O-N 3.33Å; A214-H217 PolarHBondContact O-N 3.15Å; A214-A218 PolarHBondContact O-N 2.73Å
215E80.4Confident80.3Confident113 Ų113105 Ų10553%0.52856%0.556SS.*Hα-helixtrans-64.8-39175.5-71.5-167.311100113A211 R212 H217 A218 K219A211-E215 PolarHBondContact O-N 2.99Å; R212-E215 PolarHBondContact O-N 3.25Å; E215-H217 VanDerWaalsContact C-N 3.34Å; E215-A218 PolarHBondContact O-N 3.47Å; E215-K219 WeakPolarHBondContact O-CB 3.35Å; E215-K219 WeakPolarHBondContact O-CG 3.33Å; E215-K219 PolarHBondContact O-N 2.85Å
216Y80.8Confident80.1Confident171 Ų171102 Ų10267%0.67154%0.544SS*.Hα-helixtrans-63.8-40175.6-91.3-73.3000111.4R212 L213 A220R212-Y216 HydrophobicContact CB-CD2 4.43Å; R212-Y216 WeakPolarHBondContact O-CB 3.21Å; R212-Y216 WeakPolarHBondContact O-CD2 3.48Å; R212-Y216 PolarHBondContact O-N 3.34Å; L213-Y216 PolarHBondContact O-N 3.27Å; Y216-A220 WeakPolarHBondContact O-CB 3.2Å; Y216-A220 PolarHBondContact O-N 3.2Å
217H76.2Confident79.8Confident146 Ų146100 Ų10068%0.67654%0.54SS*.Hα-helixtrans-65.1-42.9175.5-121.3-98.2000111.9L213 A214 E215 T221L213-H217 PolarHBondContact O-N 3.45Å; A214-H217 PolarHBondContact O-N 3.15Å; E215-H217 VanDerWaalsContact C-N 3.34Å; H217-T221 PolarHBondContact O-N 2.72Å; H217-T221 VanDerWaalsContact O-N 3.12Å; H217-T221 PolarHBondContact O-OG1 3.39Å
218A84.3Confident79.5Confident61 Ų6196.4 Ų96.450%0.50453%0.532SS..Hα-helixtrans-62.7-50.8176.500000111.4A214 E215 A220 T221 E222A214-A218 PolarHBondContact O-N 2.73Å; E215-A218 PolarHBondContact O-N 3.47Å; A218-A220 PolarHBondContact O-N 3.04Å; A218-T221 PolarHBondContact O-N 3.22Å; A218-E222 PolarHBondContact O-N 2.87Å; A218-E222 VanDerWaalsContact O-N 3.08Å
219K80.5Confident79.4Confident121 Ų12199.1 Ų99.153%0.52654%0.541SS..Hα-helixtrans-63.9-39.3178.3-76.6-178.3178.61740113E215 T221 E222 H223E215-K219 WeakPolarHBondContact O-CB 3.35Å; E215-K219 WeakPolarHBondContact O-CG 3.33Å; E215-K219 PolarHBondContact O-N 2.85Å; K219-T221 VanDerWaalsContact C-N 3.3Å; K219-T221 PolarHBondContact O-N 3.35Å; K219-E222 PolarHBondContact O-N 3.35Å; K219-H223 WeakPolarHBondContact O-CB 3.38Å; K219-H223 PolarHBondContact O-CD2 3.42Å; K219-H223 PolarHBondContact O-N 2.81Å
220A82.5Confident79.2Confident53 Ų53105.4 Ų105.444%0.43856%0.562SS.*Hα-helixtrans-62.4-40.2177.300000111.5Y216 A218 H223 L224Y216-A220 WeakPolarHBondContact O-CB 3.2Å; Y216-A220 PolarHBondContact O-N 3.2Å; A218-A220 PolarHBondContact O-N 3.04Å; A220-H223 PolarHBondContact O-N 3.45Å; A220-L224 WeakPolarHBondContact O-CB 3.4Å; A220-L224 PolarHBondContact O-N 2.9Å
221T83.1Confident78.8Confident83 Ų83105.6 Ų105.651%0.50956%0.56SS.*Hα-helixtrans-66.1-45177.8-49.80000111H217 A218 K219 H223 L224 S225H217-T221 PolarHBondContact O-N 2.72Å; H217-T221 VanDerWaalsContact O-N 3.12Å; H217-T221 PolarHBondContact O-OG1 3.39Å; A218-T221 PolarHBondContact O-N 3.22Å; K219-T221 VanDerWaalsContact C-N 3.3Å; K219-T221 PolarHBondContact O-N 3.35Å; T221-H223 PolarHBondContact O-N 3.36Å; T221-L224 PolarHBondContact O-N 3.14Å; T221-S225 PolarHBondContact O-N 3.45Å; T221-S225 PolarHBondContact O-OG 3.48Å
222E85.3Confident78.6Confident134 Ų134110.8 Ų110.863%0.62657%0.572SS**Hα-helixtrans-63.2-41.9176.7-161.1-173.112900112.2A218 K219 S225 T226A218-E222 PolarHBondContact O-N 2.87Å; A218-E222 VanDerWaalsContact O-N 3.08Å; K219-E222 PolarHBondContact O-N 3.35Å; E222-S225 PolarHBondContact O-N 2.78Å; E222-T226 WeakPolarHBondContact O-CG2 3.2Å; E222-T226 PolarHBondContact O-N 3.44Å; E222-T226 PolarHBondContact O-OG1 2.89Å
223H79.5Confident78.8Confident125 Ų125106.3 Ų106.358%0.57956%0.564SS**Hα-helixtrans-65.8-37.5175.6-80.9-56.6000112.7K219 A220 T221 T226 L227K219-H223 WeakPolarHBondContact O-CB 3.38Å; K219-H223 PolarHBondContact O-CD2 3.42Å; K219-H223 PolarHBondContact O-N 2.81Å; A220-H223 PolarHBondContact O-N 3.45Å; T221-H223 PolarHBondContact O-N 3.36Å; H223-T226 WeakPolarHBondContact CA-OG1 3.41Å; H223-T226 PolarHBondContact O-OG1 3.35Å; H223-L227 VanDerWaalsContact O-CB 3.31Å; H223-L227 WeakPolarHBondContact O-CB 3.35Å; H223-L227 PolarHBondContact O-N 2.88Å
224L78.8Confident78.7Confident125 Ų125103.2 Ų103.265%0.65456%0.555SS**Hα-helixtrans-66.5-42176.5-113.2153.6000112.1A220 T221 L227 S228A220-L224 WeakPolarHBondContact O-CB 3.4Å; A220-L224 PolarHBondContact O-N 2.9Å; T221-L224 PolarHBondContact O-N 3.14Å; L224-L227 PolarHBondContact O-N 2.86Å; L224-S228 PolarHBondContact O-N 3.49Å
225S77.9Confident78.3Confident66 Ų66106.4 Ų106.446%0.46256%0.563SS.*Hα-helixtrans-61.7-50.4176.2-62.10000111.2T221 E222 L227 S228 E229T221-S225 PolarHBondContact O-N 3.45Å; T221-S225 PolarHBondContact O-OG 3.48Å; E222-S225 PolarHBondContact O-N 2.78Å; S225-L227 VanDerWaalsContact C-N 3.32Å; S225-L227 PolarHBondContact O-N 3.15Å; S225-S228 PolarHBondContact O-N 3.11Å; S225-S228 PolarHBondContact O-OG 2.91Å; S225-E229 PolarHBondContact O-N 3.33Å
226T80.4Confident78Confident58 Ų58107.6 Ų107.636%0.35657%0.568SS.*Hα-helixtrans-64.5-33.9178.4520000112.9E222 H223 K230E222-T226 WeakPolarHBondContact O-CG2 3.2Å; E222-T226 PolarHBondContact O-N 3.44Å; E222-T226 PolarHBondContact O-OG1 2.89Å; H223-T226 WeakPolarHBondContact CA-OG1 3.41Å; H223-T226 PolarHBondContact O-OG1 3.35Å; T226-K230 WeakPolarHBondContact O-CB 3.27Å; T226-K230 WeakPolarHBondContact O-CG 3.26Å; T226-K230 PolarHBondContact O-N 3.36Å
227L77.2Confident77.8Confident127 Ų127105 Ų10567%0.66557%0.566SS**Hα-helixtrans-67-43.2173.7-138.584.4000111.5H223 L224 S225 E229 K230 A231H223-L227 VanDerWaalsContact O-CB 3.31Å; H223-L227 WeakPolarHBondContact O-CB 3.35Å; H223-L227 PolarHBondContact O-N 2.88Å; L224-L227 PolarHBondContact O-N 2.86Å; S225-L227 VanDerWaalsContact C-N 3.32Å; S225-L227 PolarHBondContact O-N 3.15Å; L227-E229 VanDerWaalsContact C-N 3.3Å; L227-E229 PolarHBondContact O-N 3.28Å; L227-K230 PolarHBondContact O-N 2.9Å; L227-A231 WeakPolarHBondContact O-CA 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.18Å; L227-A231 PolarHBondContact O-N 3.3Å
228S75.9Confident78Confident77 Ų77103.6 Ų103.654%0.53856%0.562SS.*Hα-helixtrans-65.3-36.3179.484.20000112.3L224 S225 A231L224-S228 PolarHBondContact O-N 3.49Å; S225-S228 PolarHBondContact O-N 3.11Å; S225-S228 PolarHBondContact O-OG 2.91Å; S228-A231 PolarHBondContact O-N 3.35Å
229E79.3Confident77.6Confident150 Ų150110.3 Ų110.370%0.70158%0.575SS**Hα-helixtrans-72.1-38.3-179.9-155.2179.7139.100111.2S225 L227 P233S225-E229 PolarHBondContact O-N 3.33Å; L227-E229 VanDerWaalsContact C-N 3.3Å; L227-E229 PolarHBondContact O-N 3.28Å; E229-P233 WeakPolarHBondContact O-CD 3.34Å
230K75.2Confident77.4Confident156 Ų156111.4 Ų111.468%0.67858%0.582SS**Hα-helixtrans-78.4-26.4174-71.7-178.3177.8-178.60113.7T226 L227 P233 A234T226-K230 WeakPolarHBondContact O-CB 3.27Å; T226-K230 WeakPolarHBondContact O-CG 3.26Å; T226-K230 PolarHBondContact O-N 3.36Å; L227-K230 PolarHBondContact O-N 2.9Å; K230-P233 WeakPolarHBondContact O-CD 3.35Å; K230-P233 WeakPolarHBondContact O-CG 3.41Å; K230-A234 WeakPolarHBondContact O-CB 3.47Å; K230-A234 PolarHBondContact O-N 2.91Å; K230-A234 VanDerWaalsContact O-N 3.11Å
231A70.4Confident77.2Confident47 Ų47110.9 Ų110.939%0.38858%0.581SS.*Hα-helixtrans-70.3-35.2-176.700000112.7L227 S228 L235L227-A231 WeakPolarHBondContact O-CA 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.18Å; L227-A231 PolarHBondContact O-N 3.3Å; S228-A231 PolarHBondContact O-N 3.35Å; A231-L235 WeakPolarHBondContact O-CB 3.47Å; A231-L235 PolarHBondContact O-N 2.9Å
232K72Confident77Confident166 Ų166111 Ų11172%0.72258%0.578SS**Hα-helixtrans-58.9-56.9176-93.4-176.8174.9179.90113.3L235 E236K232-L235 PolarHBondContact O-N 3.11Å; K232-E236 PolarHBondContact O-N 2.84Å
233P78.4Confident76.6Confident67 Ų67110.5 Ų110.544%0.43558%0.579SS.*Hα-helixtrans-67.7-36.4178.525.2-32.4000111.6E229 K230 L235 E236 D237E229-P233 WeakPolarHBondContact O-CD 3.34Å; K230-P233 WeakPolarHBondContact O-CD 3.35Å; K230-P233 WeakPolarHBondContact O-CG 3.41Å; P233-L235 VanDerWaalsContact C-N 3.3Å; P233-L235 PolarHBondContact O-N 2.92Å; P233-E236 PolarHBondContact O-N 2.87Å; P233-E236 VanDerWaalsContact O-N 3.15Å; P233-D237 WeakPolarHBondContact O-CB 3.39Å; P233-D237 PolarHBondContact O-N 3.38Å
234A74.4Confident76.6Confident55 Ų55108.1 Ų108.146%0.45558%0.575SS.*Hα-helixtrans-63.9-32.8176.700000113K230 L238K230-A234 WeakPolarHBondContact O-CB 3.47Å; K230-A234 PolarHBondContact O-N 2.91Å; K230-A234 VanDerWaalsContact O-N 3.11Å; A234-L238 WeakPolarHBondContact O-CB 3.31Å; A234-L238 PolarHBondContact O-N 3.35Å
235L72.2Confident76.7Confident134 Ų134106.1 Ų106.170%0.70257%0.568SS**Hα-helixtrans-69.7-36.1174.3-137.488.8000111.7A231 K232 P233 R239A231-L235 WeakPolarHBondContact O-CB 3.47Å; A231-L235 PolarHBondContact O-N 2.9Å; K232-L235 PolarHBondContact O-N 3.11Å; P233-L235 VanDerWaalsContact C-N 3.3Å; P233-L235 PolarHBondContact O-N 2.92Å; L235-R239 WeakPolarHBondContact O-CB 3.39Å; L235-R239 PolarHBondContact O-N 2.83Å
236E73.3Confident76.7Confident138 Ų138108.6 Ų108.665%0.64558%0.575SS**Hα-helixtrans-69.3-43.6174.8-78.6-176.3112.400111.8K232 P233 L238 R239 Q240K232-E236 PolarHBondContact O-N 2.84Å; P233-E236 PolarHBondContact O-N 2.87Å; P233-E236 VanDerWaalsContact O-N 3.15Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.88Å; E236-R239 WeakPolarHBondContact O-CB 3.39Å; E236-R239 PolarHBondContact O-N 2.93Å; E236-Q240 PolarHBondContact O-N 3.38Å
237D77.5Confident76.6Confident117 Ų117112.8 Ų112.863%0.62659%0.591SS**Hα-helixtrans-60-44175.1-128.3-77.8000110.9P233 R239 Q240 G241P233-D237 WeakPolarHBondContact O-CB 3.39Å; P233-D237 PolarHBondContact O-N 3.38Å; D237-R239 VanDerWaalsContact C-N 3.33Å; D237-R239 PolarHBondContact O-N 3.28Å; D237-Q240 PolarHBondContact O-N 3.41Å; D237-G241 PolarHBondContact O-N 2.92Å
238L79.8Confident76.8Confident115 Ų115109.9 Ų109.960%0.60258%0.581SS**Hα-helixtrans-68.1-33.6178.3-157.5146.5000111.7A234 E236 L242A234-L238 WeakPolarHBondContact O-CB 3.31Å; A234-L238 PolarHBondContact O-N 3.35Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.88Å; L238-L242 HydrophobicContact CD2-CD1 3.57Å; L238-L242 HydrophobicContact CD2-CG 4.39Å; L238-L242 WeakPolarHBondContact O-CB 3.33Å; L238-L242 WeakPolarHBondContact O-CG 3.15Å; L238-L242 PolarHBondContact O-N 2.85Å; L238-L242 VanDerWaalsContact O-N 3.1Å
239R75.5Confident77.3Confident202 Ų202113 Ų11376%0.76259%0.585SS**Hα-helixtrans-67.8-43.5171.7-117.7-169.4176.8-163.6-0.1112.2L235 E236 D237 L242 L243L235-R239 WeakPolarHBondContact O-CB 3.39Å; L235-R239 PolarHBondContact O-N 2.83Å; E236-R239 WeakPolarHBondContact O-CB 3.39Å; E236-R239 PolarHBondContact O-N 2.93Å; D237-R239 VanDerWaalsContact C-N 3.33Å; D237-R239 PolarHBondContact O-N 3.28Å; R239-L242 PolarHBondContact O-N 3.25Å; R239-L243 PolarHBondContact O-N 2.72Å
240Q76.7Confident77.4Confident145 Ų145112.7 Ų112.768%0.67858%0.581SS**Hα-helixtrans-66.3-39.4177.9-86.3-175.2-9.400111.9E236 D237 P244E236-Q240 PolarHBondContact O-N 3.38Å; D237-Q240 PolarHBondContact O-N 3.41Å; Q240-P244 WeakPolarHBondContact O-CD 3.2Å
241G79.4Confident77.7Confident41 Ų41110.1 Ų110.142%0.42358%0.579SS.*Hα-helixtrans-69.4-29.7176.100000113.8D237 P244 V245D237-G241 PolarHBondContact O-N 2.92Å; G241-P244 WeakPolarHBondContact O-CD 3.2Å; G241-P244 WeakPolarHBondContact O-CG 3.26Å; G241-V245 WeakPolarHBondContact O-CG2 3.2Å
242L78.8Confident78.2Confident86 Ų86111.5 Ų111.545%0.4559%0.585SS.*Hα-helixtrans-76.4-32179.4-88.5168.6000114L238 R239 V245 L246L238-L242 HydrophobicContact CD2-CD1 3.57Å; L238-L242 HydrophobicContact CD2-CG 4.39Å; L238-L242 WeakPolarHBondContact O-CB 3.33Å; L238-L242 WeakPolarHBondContact O-CG 3.15Å; L238-L242 PolarHBondContact O-N 2.85Å; L238-L242 VanDerWaalsContact O-N 3.1Å; R239-L242 PolarHBondContact O-N 3.25Å; L242-V245 PolarHBondContact O-N 3.45Å; L242-L246 WeakPolarHBondContact O-CB 3.47Å; L242-L246 PolarHBondContact O-N 3.46Å
243L77Confident79Confident124 Ų124109.3 Ų109.365%0.64958%0.576SS**Hα-helixtrans-55-51.7179.7-75.4173.5000113.8R239 V245 L246 E247R239-L243 PolarHBondContact O-N 2.72Å; L243-V245 PolarHBondContact O-N 3.44Å; L243-L246 PolarHBondContact O-N 2.88Å; L243-E247 PolarHBondContact O-N 3.5Å; L243-E247 VanDerWaalsContact O-N 3.13Å
244P79.2Confident79.2Confident75 Ų75111.3 Ų111.349%0.48758%0.582SS.*Hα-helixtrans-70.7-31.5179.227.2-34000112.5Q240 G241 L246 E247 S248Q240-P244 WeakPolarHBondContact O-CD 3.2Å; G241-P244 WeakPolarHBondContact O-CD 3.2Å; G241-P244 WeakPolarHBondContact O-CG 3.26Å; P244-L246 VanDerWaalsContact C-N 3.35Å; P244-E247 PolarHBondContact O-N 2.82Å; P244-S248 WeakPolarHBondContact O-CB 3.49Å; P244-S248 PolarHBondContact O-N 3.48Å; P244-S248 PolarHBondContact O-OG 3.39Å
245V79.7Confident79.6Confident82 Ų82111.6 Ų111.650%0.49758%0.581SS.*Hα-helixtrans-64.9-42.1175.1175.70000110.2G241 L242 L243 S248 F249G241-V245 WeakPolarHBondContact O-CG2 3.2Å; L242-V245 PolarHBondContact O-N 3.45Å; L243-V245 PolarHBondContact O-N 3.44Å; V245-S248 WeakPolarHBondContact CA-OG 3.28Å; V245-S248 PolarHBondContact O-N 3.36Å; V245-S248 PolarHBondContact O-OG 2.88Å; V245-F249 VanDerWaalsContact O-CB 3.28Å; V245-F249 WeakPolarHBondContact O-CB 3.23Å; V245-F249 PolarHBondContact O-N 2.85Å
246L77.6Confident80.1Confident118 Ų118107.5 Ų107.562%0.61857%0.567SS**Hα-helixtrans-67.5-37.4179.1-134.8133.9000112.1L242 L243 P244 K250L242-L246 WeakPolarHBondContact O-CB 3.47Å; L242-L246 PolarHBondContact O-N 3.46Å; L243-L246 PolarHBondContact O-N 2.88Å; P244-L246 VanDerWaalsContact C-N 3.35Å; L246-K250 WeakPolarHBondContact O-CB 3.13Å; L246-K250 PolarHBondContact O-N 3.02Å
247E80Confident80.5Confident147 Ų147105 Ų10569%0.68756%0.558SS**Hα-helixtrans-66.2-47.9173-75.7-168.5151.200112L243 P244 F249 K250 V251L243-E247 PolarHBondContact O-N 3.5Å; L243-E247 VanDerWaalsContact O-N 3.13Å; P244-E247 PolarHBondContact O-N 2.82Å; E247-F249 VanDerWaalsContact C-N 3.27Å; E247-F249 PolarHBondContact O-N 2.95Å; E247-K250 PolarHBondContact O-N 3.44Å; E247-V251 WeakPolarHBondContact O-CG2 3.37Å; E247-V251 PolarHBondContact O-N 2.96Å
248S81.1Confident80.7Confident66 Ų66105.9 Ų105.946%0.46256%0.558SS.*Hα-helixtrans-61.6-36.3177.969.60000112.4P244 V245 S252P244-S248 WeakPolarHBondContact O-CB 3.49Å; P244-S248 PolarHBondContact O-N 3.48Å; P244-S248 PolarHBondContact O-OG 3.39Å; V245-S248 WeakPolarHBondContact CA-OG 3.28Å; V245-S248 PolarHBondContact O-N 3.36Å; V245-S248 PolarHBondContact O-OG 2.88Å; S248-S252 WeakPolarHBondContact O-CB 3.37Å; S248-S252 PolarHBondContact O-N 3.05Å; S248-S252 PolarHBondContact O-OG 3.4Å; S248-S252 VanDerWaalsContact O-OG 3.13Å
249F85.5Confident80.8Confident141 Ų141105.7 Ų105.762%0.61855%0.554SS**Hα-helixtrans-67.9-42.6176.1-159.1-90.2000111.3V245 E247 V251 S252 F253V245-F249 VanDerWaalsContact O-CB 3.28Å; V245-F249 WeakPolarHBondContact O-CB 3.23Å; V245-F249 PolarHBondContact O-N 2.85Å; E247-F249 VanDerWaalsContact C-N 3.27Å; E247-F249 PolarHBondContact O-N 2.95Å; F249-V251 PolarHBondContact O-N 3.3Å; F249-S252 PolarHBondContact O-N 2.91Å; F249-F253 HydrophobicContact CE1-CD2 4.2Å; F249-F253 WeakPolarHBondContact O-CB 3.41Å; F249-F253 PolarHBondContact O-N 3.04Å
250K81.2Confident80.9Confident144 Ų144104.3 Ų104.363%0.62655%0.55SS*.Hα-helixtrans-63.8-40.8178.6-150175.5-172.6-176.80111.8L246 E247 L254L246-K250 WeakPolarHBondContact O-CB 3.13Å; L246-K250 PolarHBondContact O-N 3.02Å; E247-K250 PolarHBondContact O-N 3.44Å; K250-L254 WeakPolarHBondContact O-CB 3.44Å; K250-L254 VanDerWaalsContact O-CG 3.3Å; K250-L254 WeakPolarHBondContact O-CG 3.36Å; K250-L254 PolarHBondContact O-N 3.19Å
251V82.9Confident81Confident102 Ų102101.2 Ų101.262%0.61854%0.541SS*.Hα-helixtrans-68-45.6176.8175.10000111.6E247 F249 F253 S255E247-V251 WeakPolarHBondContact O-CG2 3.37Å; E247-V251 PolarHBondContact O-N 2.96Å; F249-V251 PolarHBondContact O-N 3.3Å; V251-F253 VanDerWaalsContact C-N 3.32Å; V251-F253 PolarHBondContact O-N 3.03Å; V251-S255 PolarHBondContact O-N 2.96Å; V251-S255 VanDerWaalsContact O-N 3.09Å; V251-S255 PolarHBondContact O-OG 2.77Å
252S80.9Confident80.9Confident76 Ų76106.4 Ų106.453%0.53155%0.552SS.*Hα-helixtrans-64.6-37.1177.1-67.30000112.3S248 F249 S255 A256S248-S252 WeakPolarHBondContact O-CB 3.37Å; S248-S252 PolarHBondContact O-N 3.05Å; S248-S252 PolarHBondContact O-OG 3.4Å; S248-S252 VanDerWaalsContact O-OG 3.13Å; F249-S252 PolarHBondContact O-N 2.91Å; S252-S255 WeakPolarHBondContact CA-OG 3.31Å; S252-S255 PolarHBondContact O-OG 3.39Å; S252-A256 WeakPolarHBondContact O-CB 3.37Å; S252-A256 PolarHBondContact O-N 3.42Å
253F87.1Confident80.7Confident121 Ų121108.9 Ų108.953%0.53156%0.559SS.*Hα-helixtrans-71.4-41.3-179.7-161.4-95.6000112.2F249 V251 L257F249-F253 HydrophobicContact CE1-CD2 4.2Å; F249-F253 WeakPolarHBondContact O-CB 3.41Å; F249-F253 PolarHBondContact O-N 3.04Å; V251-F253 VanDerWaalsContact C-N 3.32Å; V251-F253 PolarHBondContact O-N 3.03Å; F253-L257 HydrophobicContact CD1-CD1 3.84Å; F253-L257 HydrophobicContact CE1-CD1 3.52Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CZ-CD1 4.43Å; F253-L257 WeakPolarHBondContact O-CB 3.43Å; F253-L257 PolarHBondContact O-N 2.94Å
254L83.4Confident80.3Confident108 Ų108109.3 Ų109.357%0.56556%0.561SS**Hα-helixtrans-65.6-43.1176.2-74.2173.2000112.1K250 L257 E258K250-L254 WeakPolarHBondContact O-CB 3.44Å; K250-L254 VanDerWaalsContact O-CG 3.3Å; K250-L254 WeakPolarHBondContact O-CG 3.36Å; K250-L254 PolarHBondContact O-N 3.19Å; L254-L257 PolarHBondContact O-N 2.92Å; L254-E258 PolarHBondContact O-N 3.31Å
255S82.2Confident79.7Confident61 Ų61112.7 Ų112.743%0.42758%0.575SS.*Hα-helixtrans-64.6-41.6177.547.40000112.3V251 S252 L257 E258 E259V251-S255 PolarHBondContact O-N 2.96Å; V251-S255 VanDerWaalsContact O-N 3.09Å; V251-S255 PolarHBondContact O-OG 2.77Å; S252-S255 WeakPolarHBondContact CA-OG 3.31Å; S252-S255 PolarHBondContact O-OG 3.39Å; S255-L257 PolarHBondContact O-N 3.03Å; S255-E258 PolarHBondContact O-N 3.05Å; S255-E259 WeakPolarHBondContact O-CB 3.08Å; S255-E259 PolarHBondContact O-N 2.88Å
256A83.3Confident78.8Confident48 Ų48114.6 Ų114.640%0.39759%0.587SS.*Hα-helixtrans-63.2-40.7174.300000112.5S252 E259 Y260S252-A256 WeakPolarHBondContact O-CB 3.37Å; S252-A256 PolarHBondContact O-N 3.42Å; A256-E259 PolarHBondContact O-N 3.44Å; A256-Y260 WeakPolarHBondContact O-CB 3.39Å; A256-Y260 WeakPolarHBondContact O-CD2 3.25Å; A256-Y260 PolarHBondContact O-N 3.05Å
257L82Confident77.2Confident87 Ų87120.6 Ų120.646%0.45561%0.612SS.*Hα-helixtrans-65.7-42.6176.6-105.6165.2000112.5F253 L254 S255 E259 Y260 T261F253-L257 HydrophobicContact CD1-CD1 3.84Å; F253-L257 HydrophobicContact CE1-CD1 3.52Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CZ-CD1 4.43Å; F253-L257 WeakPolarHBondContact O-CB 3.43Å; F253-L257 PolarHBondContact O-N 2.94Å; L254-L257 PolarHBondContact O-N 2.92Å; S255-L257 PolarHBondContact O-N 3.03Å; L257-E259 VanDerWaalsContact C-N 3.34Å; L257-Y260 PolarHBondContact O-N 3.02Å; L257-T261 WeakPolarHBondContact O-CB 3.07Å; L257-T261 PolarHBondContact O-N 3.34Å; L257-T261 PolarHBondContact O-OG1 3.07Å
258E81.3Confident77.1Confident135 Ų135119.3 Ų119.363%0.63161%0.608SS**Hα-helixtrans-62.8-41.1174.8-94.9-172154.800111.8L254 S255 T261 K262L254-E258 PolarHBondContact O-N 3.31Å; S255-E258 PolarHBondContact O-N 3.05Å; E258-T261 PolarHBondContact O-N 3.25Å; E258-K262 WeakPolarHBondContact O-CB 3.47Å; E258-K262 PolarHBondContact O-N 3.43Å
259E81.6Confident76.9Confident110 Ų110122.1 Ų122.151%0.51462%0.616SS.*Hα-helixtrans-66.7-40.9178.6-152.1-167.1150.800111.7S255 A256 L257 K263S255-E259 WeakPolarHBondContact O-CB 3.08Å; S255-E259 PolarHBondContact O-N 2.88Å; A256-E259 PolarHBondContact O-N 3.44Å; L257-E259 VanDerWaalsContact C-N 3.34Å; E259-K263 WeakPolarHBondContact O-CG 3.27Å; E259-K263 PolarHBondContact O-N 3.46Å; E259-K263 VanDerWaalsContact O-N 3.08Å; E259-K263 WeakPolarHBondContact OE1-CE 3.45Å; E259-K263 IonicContact OE1-NZ 2.75Å; E259-K263 PolarHBondContact OE1-NZ 3.18Å
260Y77.2Confident76.4Confident174 Ų174121 Ų12168%0.68262%0.616SS**Hα-helixtrans-63.9-42.6173.2-100.6-89000112.3A256 L257 K263 L264A256-Y260 WeakPolarHBondContact O-CB 3.39Å; A256-Y260 WeakPolarHBondContact O-CD2 3.25Å; A256-Y260 PolarHBondContact O-N 3.05Å; L257-Y260 PolarHBondContact O-N 3.02Å; Y260-K263 PolarHBondContact O-N 3.26Å; Y260-L264 PolarHBondContact O-N 3.12Å; Y260-L264 VanDerWaalsContact O-N 3.1Å
261T80.7Confident76.1Confident80 Ų80119.6 Ų119.649%0.49162%0.615SS.*Hα-helixtrans-67.5-38.8-179.5-52.10000111.4L257 E258 L264 N265L257-T261 WeakPolarHBondContact O-CB 3.07Å; L257-T261 PolarHBondContact O-N 3.34Å; L257-T261 PolarHBondContact O-OG1 3.07Å; E258-T261 PolarHBondContact O-N 3.25Å; T261-L264 PolarHBondContact O-N 3.46Å; T261-N265 PolarHBondContact O-N 3.05Å
262K76.5Confident75.7Confident149 Ų149120.8 Ų120.865%0.64862%0.615SS**Hα-helixtrans-65.8-40.8173.9-84-177.7176.61730112.8E258 L264 N265 T266E258-K262 WeakPolarHBondContact O-CB 3.47Å; E258-K262 PolarHBondContact O-N 3.43Å; K262-L264 VanDerWaalsContact C-N 3.3Å; K262-L264 PolarHBondContact O-N 3.08Å; K262-N265 PolarHBondContact O-N 3.19Å; K262-T266 PolarHBondContact O-N 3.07Å; K262-T266 PolarHBondContact O-OG1 2.76Å
263K74.6Confident75.4Confident139 Ų139123.7 Ų123.760%0.60462%0.62SS**Hα-helixtrans-66.1-31177.6-76.1179.6-174.9162.40112.8E259 Y260E259-K263 WeakPolarHBondContact O-CG 3.27Å; E259-K263 PolarHBondContact O-N 3.46Å; E259-K263 VanDerWaalsContact O-N 3.08Å; E259-K263 WeakPolarHBondContact OE1-CE 3.45Å; E259-K263 IonicContact OE1-NZ 2.75Å; E259-K263 PolarHBondContact OE1-NZ 3.18Å; Y260-K263 PolarHBondContact O-N 3.26Å
264L67.4Low74.5Confident132 Ų132123.9 Ų123.969%0.69163%0.627SS**Hα-helixtrans-76.6-24.1177.5-98.1150.1000114.7Y260 T261 K262Y260-L264 PolarHBondContact O-N 3.12Å; Y260-L264 VanDerWaalsContact O-N 3.1Å; T261-L264 PolarHBondContact O-N 3.46Å; K262-L264 VanDerWaalsContact C-N 3.3Å; K262-L264 PolarHBondContact O-N 3.08Å
265N67.6Low73.8Confident147 Ų147125.2 Ų125.279%0.78663%0.631SS**SBendtrans-99.3-0.3-177.6-114.11.8000114.2T261 K262T261-N265 PolarHBondContact O-N 3.05Å; K262-N265 PolarHBondContact O-N 3.19Å
266T60.4Low73.1Confident121 Ų121130.5 Ų130.574%0.74265%0.649SS**  trans-1147.4-177.2-38.70000112.7K262K262-T266 PolarHBondContact O-N 3.07Å; K262-T266 PolarHBondContact O-OG1 2.76Å
267Q45Very low72.2Confident244 Ų244138 Ų138100%1.1467%0.671SS**  trans-113.90167.5-88-154.9-21.300109.9

Retrieved 267 of 267 residues in 288 ms (Link to these results)