A0A093J8S4_STRCA Loading...

Protein CWC15 A

AlphaFold DB , UniProt , Accession A0A093J8S4, Species STRCA (Struthio camelus australis), Gene n/a, Length 230 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
1M65.2Low89.9Confident244 Ų244142.7 Ų142.7100%1.20280%0.797SS**  0135.30-69.1-172.9-127.700108.1
2T79.6Confident90.3Very high131 Ų131139.8 Ų139.880%0.80480%0.804SS**  trans-85.9142.6178.851.30000110.5A4T2-A4 VanDerWaalsContact C-N 3.28Å; T2-A4 PolarHBondContact O-N 2.92Å
3T87.1Confident90.5Very high132 Ų132145.5 Ų145.581%0.8180%0.804SS**SBendtrans-88.510-176.350.20000113.5
4A90.3Very high90.7Very high83 Ų83139.6 Ų139.669%0.68679%0.793SS**  trans-73.5-35-173.100000113.3T2 R6T2-A4 VanDerWaalsContact C-N 3.28Å; T2-A4 PolarHBondContact O-N 2.92Å; A4-R6 PolarHBondContact O-N 3.18Å
5A93.8Very high90.5Very high102 Ų102133.3 Ų133.384%0.84377%0.772SS**  trans-80.4103.9172.700000109
6R93.3Very high90.2Very high212 Ų212140.3 Ų140.380%0.878%0.782SS**  trans-132.2144.5-179.652.2176.6164.1160.9-4.1111.3A4A4-R6 PolarHBondContact O-N 3.18Å
7P95.1Very high89.8Confident89 Ų89134.4 Ų134.458%0.57876%0.76SS**  trans-69.8157173.230.8-35.6000111.3F9P7-F9 HydrophobicContact CB-CZ 4.42Å; P7-F9 HydrophobicContact CG-CD2 4.46Å; P7-F9 HydrophobicContact CG-CE1 4.1Å; P7-F9 HydrophobicContact CG-CE2 3.66Å; P7-F9 HydrophobicContact CG-CZ 3.44Å; P7-F9 VanDerWaalsContact CG-CZ 3.44Å
8T95.4Very high89.3Confident132 Ų132134.7 Ų134.781%0.8175%0.751SS**  trans-88.1112.1171.152.70000109.6
9F95.4Very high88.9Confident180 Ų180131 Ų13179%0.78975%0.747SS**SBendtrans-90.2-28.3175.8-64.3-70.9000112.8P7P7-F9 HydrophobicContact CB-CZ 4.42Å; P7-F9 HydrophobicContact CG-CD2 4.46Å; P7-F9 HydrophobicContact CG-CE1 4.1Å; P7-F9 HydrophobicContact CG-CE2 3.66Å; P7-F9 HydrophobicContact CG-CZ 3.44Å; P7-F9 VanDerWaalsContact CG-CZ 3.44Å
10E96.4Very high88.8Confident152 Ų152128.6 Ų128.671%0.7173%0.729SS**SBendtrans-123127.3175.6-64.6-174.9-165.800109.6
11P96.8Very high88.3Confident113 Ų113126.7 Ų126.773%0.73474%0.738SS**PPolyproline II helixtrans-75.1156.8175.531.7-34.4000111.2R13P11-R13 PolarHBondContact O-N 3.22Å
12A95Very high88.6Confident107 Ų107120.4 Ų120.488%0.88471%0.709SS**PPolyproline II helixtrans-63.3134171.700000110.7
13R93.7Very high87.8Confident214 Ų214120.4 Ų120.481%0.80870%0.703SS**PPolyproline II helixtrans-86.6138175.9-69.2-179.7167.2101.3-2.8110.3P11P11-R13 PolarHBondContact O-N 3.22Å
14G92.4Very high86Confident63 Ų63118.7 Ų118.765%0.64970%0.697SS**SBendtrans-70.8171.6168.200000112.3
15G88Confident84.7Confident46 Ų46123.3 Ų123.347%0.47470%0.704SS.*SBendtrans106.56.2177.300000115.7E20G15-E20 VanDerWaalsContact CA-OE2 3.27Å; G15-E20 WeakPolarHBondContact CA-OE2 3.41Å; G15-E20 PolarHBondContact N-OE1 2.73Å; G15-E20 PolarHBondContact N-OE2 3.2Å
16R85.4Confident83.6Confident245 Ų245124.8 Ų124.893%0.92570%0.697SS**SBendtrans-130.41.3-178.9-62.8-168.3-179.4-164.10.9113.7E20R16-E20 PolarHBondContact N-OE2 2.91Å
17G83.6Confident83.1Confident40 Ų40117.4 Ų117.441%0.41268%0.678SS.*SBendtrans-97.2-174.9-175.400000114.6G19 E20G17-G19 PolarHBondContact O-N 3.19Å; G17-E20 PolarHBondContact N-OE2 3.02Å; G17-E20 PolarHBondContact O-N 3.42Å; G17-E20 VanDerWaalsContact O-N 3.08Å
18K81.4Confident82.7Confident139 Ų139122.8 Ų122.860%0.60469%0.692SS**THydrogen-bonded Turntrans-58.6123175.9-176.2-167.8179.1-161.50110.2E20 Q29 D34K18-E20 VanDerWaalsContact C-N 3.35Å; K18-Q29 VanDerWaalsContact CE-O 3.25Å; K18-Q29 WeakPolarHBondContact CE-O 3.34Å; K18-Q29 PolarHBondContact NZ-O 3.38Å; K18-D34 IonicContact NZ-OD2 3.9Å
19G81.9Confident82.5Confident65 Ų65123.7 Ų123.767%0.6769%0.687SS**THydrogen-bonded Turntrans84.27.3-179.500000114.4G17G17-G19 PolarHBondContact O-N 3.19Å
20E85.8Confident82.3Confident83 Ų83123.4 Ų123.439%0.38868%0.682SS.*SBendtrans-115.6137.9177.5-56.6179.8139.200110.9G15 R16 G17 K18 D22G15-E20 VanDerWaalsContact CA-OE2 3.27Å; G15-E20 WeakPolarHBondContact CA-OE2 3.41Å; G15-E20 PolarHBondContact N-OE1 2.73Å; G15-E20 PolarHBondContact N-OE2 3.2Å; R16-E20 PolarHBondContact N-OE2 2.91Å; G17-E20 PolarHBondContact N-OE2 3.02Å; G17-E20 PolarHBondContact O-N 3.42Å; G17-E20 VanDerWaalsContact O-N 3.08Å; K18-E20 VanDerWaalsContact C-N 3.35Å; E20-D22 PolarHBondContact O-N 3.42Å
21G79Confident82.2Confident88 Ų88118.7 Ų118.791%0.90767%0.666SS**SBendtrans78.7-80.3175.900000113.6
22D70.8Confident82.2Confident112 Ų112118.2 Ų118.260%0.59967%0.665SS**  trans-120.4110.6-175.2-170.911.9000110.8E20 S24E20-D22 PolarHBondContact O-N 3.42Å; D22-S24 PolarHBondContact O-N 3.31Å; D22-S24 WeakPolarHBondContact OD1-CB 3.02Å; D22-S24 PolarHBondContact OD1-N 3.42Å; D22-S24 WeakPolarHBondContact OD2-CB 3.27Å
23L62.2Low82.2Confident131 Ų131123.7 Ų123.769%0.68666%0.663SS**THydrogen-bonded Turntrans-66.2-7171.2-83.1147.5000111.8Q25 L26L23-Q25 PolarHBondContact O-N 3.36Å; L23-L26 HydrophobicContact CB-CD1 4.24Å; L23-L26 HydrophobicContact CD2-CD1 3.91Å; L23-L26 WeakPolarHBondContact O-CB 2.95Å; L23-L26 WeakPolarHBondContact O-CD1 3.48Å; L23-L26 PolarHBondContact O-N 3.33Å
24S50.4Low82.2Confident96 Ų96118.2 Ų118.267%0.67165%0.65SS**THydrogen-bonded Turntrans-79.3-10.1-170.6-165.10000116D22 L26D22-S24 PolarHBondContact O-N 3.31Å; D22-S24 WeakPolarHBondContact OD1-CB 3.02Å; D22-S24 PolarHBondContact OD1-N 3.42Å; D22-S24 WeakPolarHBondContact OD2-CB 3.27Å; S24-L26 VanDerWaalsContact C-N 3.27Å; S24-L26 PolarHBondContact O-N 3.14Å
25Q63.1Low82.4Confident181 Ų181119.5 Ų119.585%0.84664%0.641SS**SBendtrans-95.957.2162.1-66.5-172.40.200109.8L23 S27L23-Q25 PolarHBondContact O-N 3.36Å; Q25-S27 PolarHBondContact O-N 2.99Å
26L70.7Confident82.9Confident133 Ų133123 Ų12370%0.69666%0.656SS**  trans-63.493.2-170.5-146.779000110.5L23 S24 K28L23-L26 HydrophobicContact CB-CD1 4.24Å; L23-L26 HydrophobicContact CD2-CD1 3.91Å; L23-L26 WeakPolarHBondContact O-CB 2.95Å; L23-L26 WeakPolarHBondContact O-CD1 3.48Å; L23-L26 PolarHBondContact O-N 3.33Å; S24-L26 VanDerWaalsContact C-N 3.27Å; S24-L26 PolarHBondContact O-N 3.14Å; L26-K28 PolarHBondContact O-N 3.36Å
27S82.1Confident83.4Confident57 Ų57115.5 Ų115.540%0.39964%0.641SS.*  trans-63133.8177.4177.90000110Q25 Q29Q25-S27 PolarHBondContact O-N 2.99Å; S27-Q29 PolarHBondContact O-N 3.48Å; S27-Q29 WeakPolarHBondContact OG-CB 3.44Å; S27-Q29 PolarHBondContact OG-N 3.41Å
28K88.1Confident84.1Confident202 Ų202122.1 Ų122.188%0.87866%0.66SS**SBendtrans-75.5-4.8173.8-63.5-176179.9-179.30113L26L26-K28 PolarHBondContact O-N 3.36Å
29Q89.6Confident84.9Confident150 Ų150121.5 Ų121.570%0.70167%0.669SS**  trans-77.6128.2179.6-61.5173.6-17.500109.7K18 S27K18-Q29 VanDerWaalsContact CE-O 3.25Å; K18-Q29 WeakPolarHBondContact CE-O 3.34Å; K18-Q29 PolarHBondContact NZ-O 3.38Å; S27-Q29 PolarHBondContact O-N 3.48Å; S27-Q29 WeakPolarHBondContact OG-CB 3.44Å; S27-Q29 PolarHBondContact OG-N 3.41Å
30Y91.4Very high85.6Confident175 Ų175126.9 Ų126.969%0.68667%0.673SS**  trans-132.8148.5171.160.7-89.7000109.7L35Y30-L35 HydrophobicContact CD2-CD1 3.66Å; Y30-L35 HydrophobicContact CE2-CD1 3.63Å
31S93.8Very high86.2Confident53 Ų53128.8 Ų128.837%0.37169%0.685SS.*  trans-82.3158.5175.3-172.50000110.7R33 D34 L35S31-R33 PolarHBondContact O-N 3.35Å; S31-R33 VanDerWaalsContact O-N 3.13Å; S31-R33 PolarHBondContact OG-N 3.2Å; S31-D34 WeakPolarHBondContact CB-OD2 3.41Å; S31-D34 PolarHBondContact N-OD2 3.21Å; S31-D34 WeakPolarHBondContact O-CB 3.08Å; S31-D34 PolarHBondContact O-N 3.15Å; S31-L35 VanDerWaalsContact O-CD1 3.32Å; S31-L35 WeakPolarHBondContact O-CD1 3.47Å
32S96.9Very high87.1Confident102 Ų102134.1 Ų134.171%0.71368%0.683SS**G310 helixtrans-57.4-24.3168.256.60000112.8
33R96.4Very high88.3Confident222 Ų222136.9 Ų136.984%0.83869%0.687SS**G310 helixtrans-80.9-16176.7-62.1165.274.2104-3.6113.6S31 L35S31-R33 PolarHBondContact O-N 3.35Å; S31-R33 VanDerWaalsContact O-N 3.13Å; S31-R33 PolarHBondContact OG-N 3.2Å; R33-L35 VanDerWaalsContact C-N 3.32Å
34D94.2Very high90Very high99 Ų99138.6 Ų138.653%0.52968%0.684SS.*G310 helixtrans-88.4-3.2178.1-58-27.5000111.7K18 S31K18-D34 IonicContact NZ-OD2 3.9Å; S31-D34 WeakPolarHBondContact CB-OD2 3.41Å; S31-D34 PolarHBondContact N-OD2 3.21Å; S31-D34 WeakPolarHBondContact O-CB 3.08Å; S31-D34 PolarHBondContact O-N 3.15Å
35L95.6Very high92.1Very high90 Ų90139.6 Ų139.647%0.47168%0.678SS.*SBendtrans-64.7150.3175.2-87.866.1000110.4Y30 S31 R33 S37Y30-L35 HydrophobicContact CD2-CD1 3.66Å; Y30-L35 HydrophobicContact CE2-CD1 3.63Å; S31-L35 VanDerWaalsContact O-CD1 3.32Å; S31-L35 WeakPolarHBondContact O-CD1 3.47Å; R33-L35 VanDerWaalsContact C-N 3.32Å; L35-S37 PolarHBondContact O-N 3.47Å
36P97.8Very high93.5Very high121 Ų121133.6 Ų133.679%0.78666%0.659SS**SBendtrans-53.7113.9179.4-27.435.6000112.6T39P36-T39 HydrophobicContact CB-CG2 4.07Å
37S97.5Very high94.6Very high86 Ų86133.4 Ų133.460%0.60166%0.664SS**  trans-144.2145.5174.8-176.50000109.3L35 T39L35-S37 PolarHBondContact O-N 3.47Å; S37-T39 VanDerWaalsContact C-N 3.32Å; S37-T39 PolarHBondContact O-N 2.81Å
38H97.2Very high95.2Very high179 Ų179135.7 Ų135.783%0.82967%0.668SS**  trans50.147.5-175.7-62.4-74.3000114K40H38-K40 PolarHBondContact O-N 3.08Å; H38-K40 VanDerWaalsContact O-N 3.07Å
39T97.6Very high95.5Very high126 Ų126129.9 Ų129.977%0.77365%0.647SS**  trans-70.1-1.8-178.657.30000114.7P36 S37P36-T39 HydrophobicContact CB-CG2 4.07Å; S37-T39 VanDerWaalsContact C-N 3.32Å; S37-T39 PolarHBondContact O-N 2.81Å
40K97.8Very high95.8Very high178 Ų178123.4 Ų123.477%0.77462%0.619SS**SBendtrans-126.7116.4179.4-173.9-179.7-66.7-1790110.2H38H38-K40 PolarHBondContact O-N 3.08Å; H38-K40 VanDerWaalsContact O-N 3.07Å
41I97.7Very high95.9Very high124 Ų124119.5 Ų119.564%0.63662%0.615SS**  trans-73.2136.1174-61.3175.8000109.1
42K97.8Very high95.9Very high199 Ų199122.9 Ų122.987%0.86563%0.625SS**  trans-90.2133.3174-64.6-179.7179.1-179.70109.3
43Y96.9Very high95.7Very high171 Ų171121.7 Ų121.767%0.67161%0.608SS**  trans-104.2143.9173.7-62.9-83.4000110.2Q45Y43-Q45 PolarHBondContact O-N 3.29Å; Y43-Q45 PolarHBondContact O-NE2 3.41Å
44R96.8Very high95.6Very high167 Ų167113.6 Ų113.663%0.6358%0.583SS**  trans-62.1125.8172.5-66.7179.5-178.8-83.8-0.7108.9Q48 D49R44-Q48 HydrophobicContact CB-CB 4.39Å; R44-Q48 WeakPolarHBondContact CD-O 3.19Å; R44-Q48 PolarHBondContact NH1-O 3.5Å; R44-Q48 VanDerWaalsContact NH1-O 3.08Å; R44-D49 WeakPolarHBondContact CD-O 3.29Å
45Q95.8Very high95.6Very high117 Ų117118.5 Ų118.555%0.54759%0.594SS.*  trans-80.6168171.4-55.8-54.1-63.100109.5Y43 T47 Q48Y43-Q45 PolarHBondContact O-N 3.29Å; Y43-Q45 PolarHBondContact O-NE2 3.41Å; Q45-T47 VanDerWaalsContact C-N 3.3Å; Q45-T47 PolarHBondContact O-N 2.79Å; Q45-Q48 PolarHBondContact O-N 3.47Å
46A92.8Very high95.5Very high54 Ų54120.7 Ų120.745%0.44661%0.606SS.*G310 helixtrans-41.2-56.4179.700000112Q48 E53A46-Q48 PolarHBondContact O-N 3.11Å; A46-E53 WeakPolarHBondContact CA-OE1 3.32Å; A46-E53 VanDerWaalsContact CB-OE1 3.32Å; A46-E53 WeakPolarHBondContact CB-OE1 3.41Å
47T93.8Very high95.3Very high130 Ų130118.2 Ų118.280%0.79858%0.581SS**G310 helixtrans-72.64.2-177.961.70000116.6Q45Q45-T47 VanDerWaalsContact C-N 3.3Å; Q45-T47 PolarHBondContact O-N 2.79Å
48Q94.5Very high95.2Very high105 Ų105118.3 Ų118.349%0.49158%0.575SS.*G310 helixtrans-119.330.3-174.7-61.8-176.5-19.800112.9R44 Q45 A46R44-Q48 HydrophobicContact CB-CB 4.39Å; R44-Q48 WeakPolarHBondContact CD-O 3.19Å; R44-Q48 PolarHBondContact NH1-O 3.5Å; R44-Q48 VanDerWaalsContact NH1-O 3.08Å; Q45-Q48 PolarHBondContact O-N 3.47Å; A46-Q48 PolarHBondContact O-N 3.11Å
49D94.1Very high95.2Very high80 Ų80114.6 Ų114.643%0.42856%0.556SS.*THydrogen-bonded Turntrans63.657-170.9-63.1-57000112.3R44 V54 R57R44-D49 WeakPolarHBondContact CD-O 3.29Å; D49-V54 HydrophobicContact CB-CG2 3.76Å; D49-R57 IonicContact OD1-CZ 2.75Å; D49-R57 IonicContact OD1-NH1 2.66Å; D49-R57 PolarHBondContact OD1-NH1 3.43Å; D49-R57 IonicContact OD1-NH2 3.87Å; D49-R57 PolarHBondContact OD1-NH2 2.99Å
50A95.6Very high95.2Very high13 Ų13118.1 Ų118.111%0.10756%0.556CS.*  trans-58.5143.9164.400000110E52 E53 V54A50-E52 PolarHBondContact O-N 3.15Å; A50-E52 VanDerWaalsContact O-N 3.15Å; A50-E53 PolarHBondContact O-N 3.17Å; A50-V54 WeakPolarHBondContact O-CG2 3.26Å; A50-V54 PolarHBondContact O-N 3.36Å; A50-V54 VanDerWaalsContact O-N 3.15Å
51P94.7Very high95.2Very high93 Ų93117.5 Ų117.560%0.60455%0.549SS*.Hα-helixtrans-59.7-32.1-173.423.9-34.5000113.1V54 R55P51-V54 PolarHBondContact O-N 3.47Å; P51-R55 WeakPolarHBondContact O-CB 3.33Å; P51-R55 PolarHBondContact O-N 3.29Å
52E92.6Very high95.1Very high125 Ų125115.7 Ų115.758%0.58454%0.537SS*.Hα-helixtrans-65.1-37.4177.2-59-55150.200112.6A50 N56A50-E52 PolarHBondContact O-N 3.15Å; A50-E52 VanDerWaalsContact O-N 3.15Å; E52-N56 PolarHBondContact O-ND2 3.03Å
53E92.4Very high95.1Very high77 Ų77110.7 Ų110.736%0.3652%0.519SS..Hα-helixtrans-74.2-41.7177.6-63.6-171-17600111.6A46 A50 R55 N56 R57A46-E53 WeakPolarHBondContact CA-OE1 3.32Å; A46-E53 VanDerWaalsContact CB-OE1 3.32Å; A46-E53 WeakPolarHBondContact CB-OE1 3.41Å; A50-E53 PolarHBondContact O-N 3.17Å; E53-R55 VanDerWaalsContact C-N 3.27Å; E53-R55 PolarHBondContact O-N 3.22Å; E53-N56 PolarHBondContact O-N 2.69Å; E53-R57 PolarHBondContact O-N 3.33Å; E53-R57 IonicContact OE2-NH2 3.66Å
54V94.8Very high95.1Very high51 Ų51108.8 Ų108.831%0.30952%0.517SS..Hα-helixtrans-61.2-38.8177.9171.20000110.7D49 A50 P51 N56 R57 F59D49-V54 HydrophobicContact CB-CG2 3.76Å; A50-V54 WeakPolarHBondContact O-CG2 3.26Å; A50-V54 PolarHBondContact O-N 3.36Å; A50-V54 VanDerWaalsContact O-N 3.15Å; P51-V54 PolarHBondContact O-N 3.47Å; V54-N56 VanDerWaalsContact C-N 3.29Å; V54-N56 PolarHBondContact O-N 2.92Å; V54-R57 PolarHBondContact O-N 3.16Å; V54-F59 HydrophobicContact CB-CZ 4.42Å; V54-F59 HydrophobicContact CG1-CE2 4.13Å; V54-F59 HydrophobicContact CG1-CZ 3.77Å; V54-F59 WeakPolarHBondContact O-CE2 3.25Å
55R94.4Very high95.1Very high202 Ų202105.3 Ų105.376%0.76251%0.508SS*.Hα-helixtrans-62.5-34.6-178.6-173.9175.4-176.3162.92.1113.3P51 E53P51-R55 WeakPolarHBondContact O-CB 3.33Å; P51-R55 PolarHBondContact O-N 3.29Å; E53-R55 VanDerWaalsContact C-N 3.27Å; E53-R55 PolarHBondContact O-N 3.22Å
56N92.3Very high95.2Very high137 Ų137108.8 Ų108.873%0.73352%0.516SS*.THydrogen-bonded Turntrans-94.5-1.5-175.8-62.6-33.1000113E52 E53 V54E52-N56 PolarHBondContact O-ND2 3.03Å; E53-N56 PolarHBondContact O-N 2.69Å; V54-N56 VanDerWaalsContact C-N 3.29Å; V54-N56 PolarHBondContact O-N 2.92Å
57R94Very high95.4Very high69 Ų69112.1 Ų112.126%0.2652%0.522SS..  trans-88133.4-173.9-161.8174.8-56.1139.3-4.3111.6D49 E53 V54 F59 E62D49-R57 IonicContact OD1-CZ 2.75Å; D49-R57 IonicContact OD1-NH1 2.66Å; D49-R57 PolarHBondContact OD1-NH1 3.43Å; D49-R57 IonicContact OD1-NH2 3.87Å; D49-R57 PolarHBondContact OD1-NH2 2.99Å; E53-R57 PolarHBondContact O-N 3.33Å; E53-R57 IonicContact OE2-NH2 3.66Å; V54-R57 PolarHBondContact O-N 3.16Å; R57-F59 HydrophobicContact CB-CE1 4.27Å; R57-F59 HydrophobicContact CB-CE2 4.19Å; R57-F59 HydrophobicContact CB-CZ 3.91Å; R57-F59 HydrophobicContact CG-CD1 4.47Å; R57-F59 HydrophobicContact CG-CE1 4.18Å; R57-F59 HydrophobicContact CG-CZ 4.33Å; R57-F59 PolarHBondContact O-N 3.07Å; R57-E62 VanDerWaalsContact CD-OE2 3.29Å; R57-E62 WeakPolarHBondContact CD-OE2 3.38Å
58D96Very high95.5Very high87 Ų87113.9 Ų113.947%0.46551%0.514SS..  trans-87.994.7169.5179.910.1000110.7R60 R61 E62D58-R60 VanDerWaalsContact C-N 3.31Å; D58-R60 PolarHBondContact O-N 3.49Å; D58-R60 PolarHBondContact OD1-N 2.91Å; D58-R60 VanDerWaalsContact OD1-N 3.14Å; D58-R61 WeakPolarHBondContact OD2-CB 3.46Å; D58-E62 PolarHBondContact O-N 3.04Å
59F97.3Very high95.6Very high101 Ų101113 Ų11344%0.44352%0.516SS..Hα-helixtrans-67.9-26.8-179.2-65.9-70.7000113.9V54 R57 L63V54-F59 HydrophobicContact CB-CZ 4.42Å; V54-F59 HydrophobicContact CG1-CE2 4.13Å; V54-F59 HydrophobicContact CG1-CZ 3.77Å; V54-F59 WeakPolarHBondContact O-CE2 3.25Å; R57-F59 HydrophobicContact CB-CE1 4.27Å; R57-F59 HydrophobicContact CB-CE2 4.19Å; R57-F59 HydrophobicContact CB-CZ 3.91Å; R57-F59 HydrophobicContact CG-CD1 4.47Å; R57-F59 HydrophobicContact CG-CE1 4.18Å; R57-F59 HydrophobicContact CG-CZ 4.33Å; R57-F59 PolarHBondContact O-N 3.07Å; F59-L63 WeakPolarHBondContact O-CB 3.35Å; F59-L63 PolarHBondContact O-N 3.43Å
60R96.9Very high95.7Very high200 Ų200111.9 Ų111.976%0.75552%0.517SS*.Hα-helixtrans-66.7-49.3-176.6177.4178-86.7107.2-5.4109.8D58 L63 E64D58-R60 VanDerWaalsContact C-N 3.31Å; D58-R60 PolarHBondContact O-N 3.49Å; D58-R60 PolarHBondContact OD1-N 2.91Å; D58-R60 VanDerWaalsContact OD1-N 3.14Å; R60-L63 PolarHBondContact O-N 3.46Å; R60-E64 PolarHBondContact O-N 3.43Å; R60-E64 VanDerWaalsContact O-N 3.11Å
61R97.3Very high95.6Very high166 Ų166113.6 Ų113.663%0.62653%0.532SS*.Hα-helixtrans-63.7-46.1179.6-175.4-18066.398.93112.4D58 E64 E65D58-R61 WeakPolarHBondContact OD2-CB 3.46Å; R61-E64 PolarHBondContact O-N 2.95Å; R61-E65 PolarHBondContact O-N 2.99Å
62E96.4Very high95.5Very high85 Ų85118.9 Ų118.940%0.39754%0.54SS..Hα-helixtrans-64.5-40.9-180-173.8-175162.800112R57 D58 E65 R66R57-E62 VanDerWaalsContact CD-OE2 3.29Å; R57-E62 WeakPolarHBondContact CD-OE2 3.38Å; D58-E62 PolarHBondContact O-N 3.04Å; E62-E65 PolarHBondContact O-N 2.91Å; E62-R66 WeakPolarHBondContact O-CB 3.41Å; E62-R66 PolarHBondContact O-N 3.45Å
63L97.7Very high95.6Very high94 Ų94117.3 Ų117.349%0.49253%0.533SS..Hα-helixtrans-62-47.9177.9-174.2161.1000110.6F59 R60 E65 R66 E67F59-L63 WeakPolarHBondContact O-CB 3.35Å; F59-L63 PolarHBondContact O-N 3.43Å; R60-L63 PolarHBondContact O-N 3.46Å; L63-E65 PolarHBondContact O-N 3.19Å; L63-R66 PolarHBondContact O-N 2.82Å; L63-E67 HydrophobicContact CD2-CG 3.86Å; L63-E67 VanDerWaalsContact CD2-OE1 3.26Å; L63-E67 WeakPolarHBondContact CD2-OE1 3.31Å; L63-E67 WeakPolarHBondContact O-CB 3.43Å; L63-E67 WeakPolarHBondContact O-CG 3.46Å; L63-E67 PolarHBondContact O-N 3.2Å
64E97.3Very high95.6Very high131 Ų131121.3 Ų121.361%0.61255%0.549SS*.Hα-helixtrans-64.1-39.7179.6-175.6160.6-160.500112.3R60 R61 R66 E67 R68R60-E64 PolarHBondContact O-N 3.43Å; R60-E64 VanDerWaalsContact O-N 3.11Å; R61-E64 PolarHBondContact O-N 2.95Å; E64-R66 PolarHBondContact O-N 3.34Å; E64-E67 PolarHBondContact O-N 2.78Å; E64-R68 WeakPolarHBondContact O-CB 3.49Å; E64-R68 PolarHBondContact O-N 3.08Å
65E97.1Very high95.3Very high95 Ų95124.6 Ų124.644%0.44456%0.564SS.*Hα-helixtrans-61.1-44.9173.2176.9167.2-151.600111.8R61 E62 L63 R68 V69R61-E65 PolarHBondContact O-N 2.99Å; E62-E65 PolarHBondContact O-N 2.91Å; L63-E65 PolarHBondContact O-N 3.19Å; E65-R68 WeakPolarHBondContact O-CB 3.36Å; E65-R68 PolarHBondContact O-N 3.47Å; E65-R68 IonicContact OE1-NH2 3.34Å; E65-V69 WeakPolarHBondContact O-CG2 3.43Å; E65-V69 PolarHBondContact O-N 3.29Å
66R97.6Very high95.1Very high189 Ų189124.5 Ų124.571%0.71356%0.564SS**Hα-helixtrans-68.7-37-179.8-168.7170.8171.3117.4-0.8112E62 L63 E64 V69 A70E62-R66 WeakPolarHBondContact O-CB 3.41Å; E62-R66 PolarHBondContact O-N 3.45Å; L63-R66 PolarHBondContact O-N 2.82Å; E64-R66 PolarHBondContact O-N 3.34Å; R66-V69 PolarHBondContact O-N 2.97Å; R66-A70 WeakPolarHBondContact O-CB 3.32Å; R66-A70 PolarHBondContact O-N 3.33Å
67E96.3Very high94.5Very high124 Ų124123.8 Ų123.858%0.57956%0.56SS**Hα-helixtrans-62.7-43.5171.7-77.5-173.9165.300111.6L63 E64 V69 A70 A71L63-E67 HydrophobicContact CD2-CG 3.86Å; L63-E67 VanDerWaalsContact CD2-OE1 3.26Å; L63-E67 WeakPolarHBondContact CD2-OE1 3.31Å; L63-E67 WeakPolarHBondContact O-CB 3.43Å; L63-E67 WeakPolarHBondContact O-CG 3.46Å; L63-E67 PolarHBondContact O-N 3.2Å; E64-E67 PolarHBondContact O-N 2.78Å; E67-V69 VanDerWaalsContact C-N 3.35Å; E67-V69 PolarHBondContact O-N 3.41Å; E67-A70 PolarHBondContact O-N 3.46Å; E67-A71 VanDerWaalsContact O-CB 3.31Å; E67-A71 WeakPolarHBondContact O-CB 3.39Å; E67-A71 PolarHBondContact O-N 3.48Å
68R96.3Very high93.6Very high168 Ų168129.7 Ų129.763%0.63458%0.583SS**Hα-helixtrans-60-43.9175.1-177.7-179.464.5179.5-2.1111.9E64 E65 A71 R72E64-R68 WeakPolarHBondContact O-CB 3.49Å; E64-R68 PolarHBondContact O-N 3.08Å; E65-R68 WeakPolarHBondContact O-CB 3.36Å; E65-R68 PolarHBondContact O-N 3.47Å; E65-R68 IonicContact OE1-NH2 3.34Å; R68-A71 PolarHBondContact O-N 3.13Å; R68-R72 WeakPolarHBondContact O-CB 3.42Å; R68-R72 PolarHBondContact O-N 3.3Å
69V96.1Very high91.8Very high86 Ų86130.5 Ų130.552%0.52159%0.593SS.*Hα-helixtrans-65.4-45.3176.7173.10000111.1E65 R66 E67 A71 R72 E73E65-V69 WeakPolarHBondContact O-CG2 3.43Å; E65-V69 PolarHBondContact O-N 3.29Å; R66-V69 PolarHBondContact O-N 2.97Å; E67-V69 VanDerWaalsContact C-N 3.35Å; E67-V69 PolarHBondContact O-N 3.41Å; V69-A71 VanDerWaalsContact C-N 3.33Å; V69-A71 PolarHBondContact O-N 3.33Å; V69-R72 PolarHBondContact O-N 2.83Å; V69-E73 WeakPolarHBondContact O-CB 3.46Å; V69-E73 PolarHBondContact O-N 3.11Å
70A96.1Very high89.9Confident56 Ų56132.7 Ų132.746%0.46362%0.615SS.*Hα-helixtrans-62.3-39.6177.700000112.1R66 E67 E73 K74R66-A70 WeakPolarHBondContact O-CB 3.32Å; R66-A70 PolarHBondContact O-N 3.33Å; E67-A70 PolarHBondContact O-N 3.46Å; A70-E73 PolarHBondContact O-N 2.9Å; A70-K74 WeakPolarHBondContact O-CB 3.43Å; A70-K74 PolarHBondContact O-N 2.98Å
71A94.1Very high87.7Confident50 Ų50131.6 Ų131.641%0.41361%0.611SS.*Hα-helixtrans-64.7-41.2174.600000112E67 R68 V69 N75E67-A71 VanDerWaalsContact O-CB 3.31Å; E67-A71 WeakPolarHBondContact O-CB 3.39Å; E67-A71 PolarHBondContact O-N 3.48Å; R68-A71 PolarHBondContact O-N 3.13Å; V69-A71 VanDerWaalsContact C-N 3.33Å; V69-A71 PolarHBondContact O-N 3.33Å; A71-N75 WeakPolarHBondContact O-CB 3.45Å; A71-N75 PolarHBondContact O-N 3.01Å; A71-N75 PolarHBondContact O-ND2 3.39Å
72R93.4Very high85.2Confident203 Ų203131.6 Ų131.677%0.76662%0.617SS**Hα-helixtrans-64.7-42.5175.7-176.4178.7177.6-175.80.6112R68 V69 N75 R76R68-R72 WeakPolarHBondContact O-CB 3.42Å; R68-R72 PolarHBondContact O-N 3.3Å; V69-R72 PolarHBondContact O-N 2.83Å; R72-N75 PolarHBondContact O-N 3.31Å; R72-R76 PolarHBondContact O-N 2.99Å
73E93.9Very high82.9Confident93 Ų93136.3 Ų136.344%0.43564%0.639SS.*Hα-helixtrans-63.6-48.4178.3-166.7-81.1146.800110.7V69 A70 N75 R76 D77V69-E73 WeakPolarHBondContact O-CB 3.46Å; V69-E73 PolarHBondContact O-N 3.11Å; A70-E73 PolarHBondContact O-N 2.9Å; E73-N75 VanDerWaalsContact C-N 3.27Å; E73-N75 PolarHBondContact O-N 2.9Å; E73-R76 PolarHBondContact O-N 2.96Å; E73-R76 VanDerWaalsContact O-N 3.07Å; E73-D77 PolarHBondContact O-N 3.45Å
74K92.9Very high80.2Confident161 Ų161137.4 Ų137.470%0.765%0.65SS**Hα-helixtrans-56.8-36.7173-176.4179.9177.9-176.60113.4A70A70-K74 WeakPolarHBondContact O-CB 3.43Å; A70-K74 PolarHBondContact O-N 2.98Å
75N88.9Confident77.9Confident119 Ų119136.8 Ų136.864%0.63666%0.655SS**Hα-helixtrans-73.5-35.4176.7-82.5-29.3000112.6A71 R72 E73A71-N75 WeakPolarHBondContact O-CB 3.45Å; A71-N75 PolarHBondContact O-N 3.01Å; A71-N75 PolarHBondContact O-ND2 3.39Å; R72-N75 PolarHBondContact O-N 3.31Å; E73-N75 VanDerWaalsContact C-N 3.27Å; E73-N75 PolarHBondContact O-N 2.9Å
76R88.6Confident75.3Confident200 Ų200137 Ų13776%0.75567%0.668SS**Hα-helixtrans-69.4-38177.1-174.9-177.466.8-167.1-2112.1R72 E73 R78R72-R76 PolarHBondContact O-N 2.99Å; E73-R76 PolarHBondContact O-N 2.96Å; E73-R76 VanDerWaalsContact O-N 3.07Å; R76-R78 PolarHBondContact O-N 3.45Å
77D80.6Confident72.8Confident123 Ų123133.4 Ų133.466%0.65867%0.671SS**SBendtrans-80.4-3.6-176.8-158.745.2000113.4E73 P79E73-D77 PolarHBondContact O-N 3.45Å; D77-P79 WeakPolarHBondContact O-CD 3.46Å
78R75.8Confident70.2Confident192 Ų192132 Ų13273%0.72568%0.675SS**SBendtrans-89.1101.6173.2-166.7175.6-177.2-169.5-2.1109.2R76 T80R76-R78 PolarHBondContact O-N 3.45Å; R78-T80 PolarHBondContact O-N 3.28Å
79P57.1Low68.1Low105 Ų105129.8 Ų129.868%0.68268%0.68SS**  trans-59.8135.4169.325.7-33.3000108.5D77 R81D77-P79 WeakPolarHBondContact O-CD 3.46Å; P79-R81 PolarHBondContact O-N 3.08Å
80T56.9Low65.6Low147 Ų147130.9 Ų130.990%0.90269%0.691SS**  trans-55.682.5176-43.50000109.9R78 E82R78-T80 PolarHBondContact O-N 3.28Å; T80-E82 PolarHBondContact O-N 3.23Å
81R51.5Low63.3Low177 Ų177137.5 Ų137.567%0.66871%0.71SS**  trans-87104.4171.7-163.9169.7175.2-174.5-7.6106.2P79 D203P79-R81 PolarHBondContact O-N 3.08Å; R81-D203 IonicContact CZ-OD2 3.46Å; R81-D203 IonicContact NH1-OD2 3.3Å; R81-D203 PolarHBondContact NH1-OD2 2.86Å; R81-D203 IonicContact NH2-OD2 2.72Å; R81-D203 PolarHBondContact NH2-OD2 3.34Å
82E44.2Very low61.2Low165 Ų165144.2 Ų144.277%0.77173%0.729SS**  trans-3.6132.1174.4-65.1-174.5156.300117.4T80 T84T80-E82 PolarHBondContact O-N 3.23Å; E82-T84 PolarHBondContact O-N 3.44Å
83H48.1Very low58.9Low185 Ų185140.6 Ų140.686%0.85673%0.732SS**  trans-29.1102.1154.3-117.4-73.8000111.4
84T40.5Very low56.5Low117 Ų117147.9 Ų147.972%0.71876%0.756SS**  trans-111.299.815449.10000105.5E82 S86E82-T84 PolarHBondContact O-N 3.44Å; T84-S86 PolarHBondContact O-N 3.21Å
85T48.8Very low54.6Low118 Ų118147.4 Ų147.472%0.72476%0.76SS**  trans-48105.9164.1410000108.3
86S44.5Very low52.9Low100 Ų100148.4 Ų148.470%0.69977%0.765SS**  trans-124.264.6165.442.20000108.1T84 S88T84-S86 PolarHBondContact O-N 3.21Å; S86-S88 VanDerWaalsContact C-N 3.28Å; S86-S88 PolarHBondContact O-N 3.47Å; S86-S88 VanDerWaalsContact O-N 3.1Å
87S44.6Very low50.9Low112 Ų112148.3 Ų148.378%0.78377%0.774SS**  trans-60.894.4146.341.70000108.3
88S40.6Very low49.3Very low95 Ų95150.3 Ų150.366%0.66478%0.782SS**  trans-154.695.7149.342.30000109.3S86 S90S86-S88 VanDerWaalsContact C-N 3.28Å; S86-S88 PolarHBondContact O-N 3.47Å; S86-S88 VanDerWaalsContact O-N 3.1Å; S88-S90 PolarHBondContact O-N 3.36Å
89V51.9Low47.7Very low122 Ų122146.8 Ų146.874%0.73979%0.785SS**  trans-23.7114.4150.3173.10000111.7K91V89-K91 HydrophobicContact CG1-CD 4.37Å; V89-K91 HydrophobicContact CG1-CG 4.07Å
90S45.2Very low47.2Very low109 Ų109146.6 Ų146.676%0.76279%0.792SS**  trans-134.783.5155.6-70.20000107.1S88 K92S88-S90 PolarHBondContact O-N 3.36Å; S90-K92 PolarHBondContact O-N 3.2Å; S90-K92 VanDerWaalsContact O-N 3.11Å
91K47.3Very low47.1Very low195 Ų195143.6 Ų143.685%0.84878%0.782SS**  trans-49110.1166.4-72168.8174.4174.20108.5V89V89-K91 HydrophobicContact CG1-CD 4.37Å; V89-K91 HydrophobicContact CG1-CG 4.07Å
92K49.3Very low46.8Very low190 Ų190142.7 Ų142.783%0.82679%0.79SS**  trans-89.2129.9154.3-74-179.3169.6-176.10106.7S90 R94S90-K92 PolarHBondContact O-N 3.2Å; S90-K92 VanDerWaalsContact O-N 3.11Å; K92-R94 PolarHBondContact O-N 2.99Å; K92-R94 VanDerWaalsContact O-N 3.16Å
93P46.3Very low46.9Very low127 Ų127143.4 Ų143.483%0.82580%0.798SS**  trans-67117.618028-31.1000108.4L95P93-L95 PolarHBondContact O-N 3.01Å
94R43.7Very low46.6Very low247 Ų247141.9 Ų141.993%0.93280%0.797SS**  trans-73.6104.4160.5-89.2-177.1161.3100.9-4.7106.1K92K92-R94 PolarHBondContact O-N 2.99Å; K92-R94 VanDerWaalsContact O-N 3.16Å
95L51.6Low46.7Very low150 Ų150140 Ų14079%0.78579%0.793SS**  trans-76.8135.3163.7-172.762.8000107.5P93P93-L95 PolarHBondContact O-N 3.01Å
96D52.8Low46.7Very low140 Ų140142.2 Ų142.275%0.74980%0.801SS**  trans79.279.6170.3-57.4-24.2000118.7
97Q46.8Very low46.8Very low199 Ų199145.1 Ų145.193%0.9381%0.808SS**  trans-138.2123.6139.9-117.1170.124.800109.8
98I48.4Very low47Very low164 Ų164144.4 Ų144.484%0.84180%0.801SS**  trans-66.3138.6-174.1-61.5159.9000109.7A100I98-A100 PolarHBondContact O-N 3.44Å
99P41.8Very low47.4Very low119 Ų119148.4 Ų148.477%0.77381%0.814SS**  trans-79.3120.3-170.430.9-32.1000111.3A101P99-A101 PolarHBondContact O-N 3.49Å
100A46.2Very low46.8Very low100 Ų100148.6 Ų148.683%0.82682%0.816SS**  trans-75.4100.9157.900000107.4I98 N102I98-A100 PolarHBondContact O-N 3.44Å; A100-N102 PolarHBondContact O-N 2.96Å
101A55.2Low46.8Very low85 Ų85150.8 Ų150.870%0.70282%0.819SS**  trans-51.7115.5161.900000109P99P99-A101 PolarHBondContact O-N 3.49Å
102N45.3Very low46.6Very low158 Ų158150.4 Ų150.485%0.84582%0.82SS**  trans-171.970.1149.1-81.5-29.8000106.6A100A100-N102 PolarHBondContact O-N 2.96Å
103L45Very low46.3Very low179 Ų179148.2 Ų148.294%0.93782%0.817SS**  trans-81.1113.4152.1-93.980.5000106
104D42.7Very low46.1Very low153 Ų153147.9 Ų147.982%0.81881%0.809SS**  trans-137.191.6167.7-163.930.5000104.1
105A43.1Very low46Very low78 Ų78144 Ų14465%0.64580%0.801SS**  73.4111.28400000112.4
106D48.9Very low45.8Very low165 Ų165144.1 Ų144.188%0.88280%0.803SS**  trans55.5106.9162.2-62.5-20.7000119.7
107D45.8Very low45.3Very low161 Ų161146.4 Ų146.486%0.86181%0.808SS**  trans-137.4119.3146.2-158.928.7000109.5
108P48.7Very low45.4Very low97 Ų97144.1 Ų144.163%0.6380%0.803SS**  trans-81.7144.1-165.432.2-33.4000113T110P108-T110 PolarHBondContact O-N 3.44Å
109L50Low45.2Very low179 Ų179145.1 Ų145.194%0.93781%0.809SS**  trans-63.8113.6156.8-91.4152.2000109
110T38.3Very low45.4Very low126 Ų126148.2 Ų148.277%0.77381%0.813SS**  trans-120.510715943.50000109P108P108-T110 PolarHBondContact O-N 3.44Å
111D46.5Very low45.5Very low155 Ų155152.3 Ų152.383%0.82982%0.815SS**  trans-57.1169.8142.5-110-24.9000109.8
112E41.4Very low44.9Very low186 Ų186153.8 Ų153.887%0.86982%0.82SS**  trans10394.6179.6-58.8177.9-168.900111.8
113D43.6Very low45.2Very low145 Ų145153 Ų15378%0.77582%0.816SS**  67.6135.574.6-129.77.3000113.5
114D42.2Very low45.3Very low120 Ų120149.7 Ų149.764%0.64280%0.799SS**  trans80.9122.7156.5-66.6-35.8000123.2
115E41.1Very low45.9Very low166 Ų166149.2 Ų149.278%0.77680%0.797SS**  trans83.6107.2131.5-67.7174.8-175.300120.5
116D47.1Very low46.5Very low152 Ų152151.5 Ų151.581%0.81380%0.798SS**  28.6124.1126.4-63.8-32.1000119.8
117E42.3Very low47Very low187 Ų187148.3 Ų148.387%0.87479%0.785SS**  -178.5114.1123.9-98.9174.8-164.400112
118D49.5Very low47.9Very low152 Ų152143.9 Ų143.981%0.81377%0.77SS**  trans30.3117141.2-59.9-23.6000122
119L43.8Very low48.6Very low185 Ų185142.5 Ų142.597%0.96977%0.767SS**  trans-135.5124.2144-81.3174.7000111
120E46.7Very low49Very low184 Ų184139.1 Ų139.186%0.8675%0.75SS**  trans-64.2137.7-172.9-65.3175.9158.900115.1
121E48.1Very low50.4Low185 Ų185138.5 Ų138.586%0.86474%0.741SS**  trans46.996.8131.4-155.5160.7-15700119.1
122S42.6Very low51.6Low116 Ų116133.9 Ų133.981%0.81172%0.724SS**  trans-121.1108.3148.4-175.50000108.6D124S122-D124 PolarHBondContact O-N 2.89Å
123D51.8Low52.9Low141 Ų141131 Ų13175%0.75471%0.711SS**  trans-52.2107.1172.3-174.431.6000111.2
124D46.6Very low53.9Low110 Ų110128.2 Ų128.259%0.58870%0.696SS**  trans-148.2107.8163.5-144.113.4000109.3S122 D126 T127S122-D124 PolarHBondContact O-N 2.89Å; D124-D126 PolarHBondContact O-N 3.1Å; D124-T127 PolarHBondContact O-N 3.31Å; D124-T127 PolarHBondContact O-OG1 2.88Å
125D56.2Low55.4Low144 Ų144129.2 Ų129.277%0.7770%0.696SS**THydrogen-bonded Turntrans-57.9-7.1-172-107.6-25.1000114.7
126D56.1Low56.9Low126 Ų126128.5 Ų128.567%0.67469%0.691SS**THydrogen-bonded Turntrans-87.8-14.2-177-76.6-27.4000114.3D124D124-D126 PolarHBondContact O-N 3.1Å
127T58.7Low57.9Low98 Ų98124.8 Ų124.860%0.60167%0.67SS**Hα-helixtrans-82.2-34.1-175.655.70000113.7D124 L130 L131D124-T127 PolarHBondContact O-N 3.31Å; D124-T127 PolarHBondContact O-OG1 2.88Å; T127-L130 PolarHBondContact O-N 3.39Å; T127-L131 PolarHBondContact O-N 2.95Å
128A63.7Low59.4Low67 Ų67123.7 Ų123.755%0.55466%0.662SS**Hα-helixtrans-71.7-33.7-178.500000113L130 A132A128-L130 VanDerWaalsContact C-N 3.32Å; A128-L130 PolarHBondContact O-N 3.41Å; A128-A132 PolarHBondContact O-N 2.87Å
129A65.1Low60.8Low68 Ų68123.8 Ų123.856%0.56266%0.656SS**Hα-helixtrans-65.6-35.9177.200000112.2E133A129-E133 PolarHBondContact O-N 2.95Å
130L58.5Low62.4Low109 Ų109121.2 Ų121.257%0.57164%0.638SS**Hα-helixtrans-78.2-32.5-173.7-150.8147.8000112.6T127 A128 L134T127-L130 PolarHBondContact O-N 3.39Å; A128-L130 VanDerWaalsContact C-N 3.32Å; A128-L130 PolarHBondContact O-N 3.41Å; L130-L134 HydrophobicContact CD2-CD1 4.28Å; L130-L134 PolarHBondContact O-N 3.26Å; L130-L134 VanDerWaalsContact O-N 3.08Å
131L66.4Low63.6Low112 Ų112120.1 Ų120.159%0.58663%0.627SS**Hα-helixtrans-70.6-38.5173.3-72.7173.1000112.4T127 E133 L134 E135T127-L131 PolarHBondContact O-N 2.95Å; L131-E133 VanDerWaalsContact C-N 3.31Å; L131-E133 PolarHBondContact O-N 2.92Å; L131-L134 PolarHBondContact O-N 3.1Å; L131-E135 WeakPolarHBondContact O-CG 3.31Å; L131-E135 PolarHBondContact O-N 3.07Å
132A72.3Confident64.9Low59 Ų59114 Ų11449%0.48861%0.607SS.*Hα-helixtrans-65.9-33.5174.900000112.4A128 K136A128-A132 PolarHBondContact O-N 2.87Å; A132-K136 WeakPolarHBondContact O-CB 3.45Å; A132-K136 PolarHBondContact O-N 2.91Å; A132-K136 VanDerWaalsContact O-N 3.1Å
133E68.4Low66.5Low125 Ų125115.1 Ų115.158%0.58460%0.6SS**Hα-helixtrans-71.2-38.6173.8-167.9169.9-175.500111.9A129 L131 K136 I137A129-E133 PolarHBondContact O-N 2.95Å; L131-E133 VanDerWaalsContact C-N 3.31Å; L131-E133 PolarHBondContact O-N 2.92Å; E133-K136 PolarHBondContact O-N 3.41Å; E133-I137 HydrophobicContact CG-CD1 4.27Å; E133-I137 VanDerWaalsContact O-CG1 3.31Å; E133-I137 WeakPolarHBondContact O-CG1 3.32Å; E133-I137 PolarHBondContact O-N 3Å
134L65.1Low67.6Low87 Ų87114.4 Ų114.446%0.45559%0.592SS.*Hα-helixtrans-64.9-39.2173.8-88.7172.5000113.2L130 L131 K136 I137 K138L130-L134 HydrophobicContact CD2-CD1 4.28Å; L130-L134 PolarHBondContact O-N 3.26Å; L130-L134 VanDerWaalsContact O-N 3.08Å; L131-L134 PolarHBondContact O-N 3.1Å; L134-K136 VanDerWaalsContact C-N 3.34Å; L134-I137 PolarHBondContact O-N 3.39Å; L134-K138 WeakPolarHBondContact O-CB 3.25Å; L134-K138 PolarHBondContact O-N 2.97Å
135E72.8Confident69.1Low140 Ų140115.4 Ų115.465%0.65459%0.593SS**Hα-helixtrans-66.3-37.8174.8-75.1-176.2172.200111.9L131 K138 K139L131-E135 WeakPolarHBondContact O-CG 3.31Å; L131-E135 PolarHBondContact O-N 3.07Å; E135-K138 PolarHBondContact O-N 3.29Å; E135-K139 VanDerWaalsContact O-CB 3.27Å; E135-K139 WeakPolarHBondContact O-CB 3.27Å; E135-K139 PolarHBondContact O-N 2.99Å
136K74Confident70.2Confident152 Ų152110.7 Ų110.766%0.66157%0.574SS**Hα-helixtrans-64.3-43174-166177178.9-176.10111.6A132 E133 L134 K139 E140A132-K136 WeakPolarHBondContact O-CB 3.45Å; A132-K136 PolarHBondContact O-N 2.91Å; A132-K136 VanDerWaalsContact O-N 3.1Å; E133-K136 PolarHBondContact O-N 3.41Å; L134-K136 VanDerWaalsContact C-N 3.34Å; K136-K139 PolarHBondContact O-N 2.69Å; K136-E140 VanDerWaalsContact O-CB 3.31Å; K136-E140 WeakPolarHBondContact O-CB 3.45Å; K136-E140 PolarHBondContact O-N 2.85Å
137I68.4Low71.3Confident74 Ų74113 Ų11338%0.37957%0.573SS.*Hα-helixtrans-66.2-40.4175.9-68.4167.5000111.5E133 L134 R141E133-I137 HydrophobicContact CG-CD1 4.27Å; E133-I137 VanDerWaalsContact O-CG1 3.31Å; E133-I137 WeakPolarHBondContact O-CG1 3.32Å; E133-I137 PolarHBondContact O-N 3Å; L134-I137 PolarHBondContact O-N 3.39Å; I137-R141 VanDerWaalsContact O-CB 3.25Å; I137-R141 WeakPolarHBondContact O-CB 3.31Å; I137-R141 PolarHBondContact O-N 3.36Å
138K73.3Confident72.3Confident163 Ų163114.6 Ų114.671%0.70957%0.572SS**Hα-helixtrans-64.6-42.1175.3-89.9-178.2175.5174.70111.8L134 E135 A142L134-K138 WeakPolarHBondContact O-CB 3.25Å; L134-K138 PolarHBondContact O-N 2.97Å; E135-K138 PolarHBondContact O-N 3.29Å; K138-A142 VanDerWaalsContact O-CB 3.25Å; K138-A142 WeakPolarHBondContact O-CB 3.25Å; K138-A142 PolarHBondContact O-N 2.91Å
139K79.1Confident73Confident155 Ų155117.9 Ų117.967%0.67458%0.576SS**Hα-helixtrans-67.7-42.8179-169.6175.6-179178.80111.8E135 K136 A142 E143E135-K139 VanDerWaalsContact O-CB 3.27Å; E135-K139 WeakPolarHBondContact O-CB 3.27Å; E135-K139 PolarHBondContact O-N 2.99Å; K136-K139 PolarHBondContact O-N 2.69Å; K139-A142 PolarHBondContact O-N 3.15Å; K139-E143 WeakPolarHBondContact O-CB 3.25Å; K139-E143 PolarHBondContact O-N 3.11Å
140E76Confident73.5Confident130 Ų130121.5 Ų121.561%0.60758%0.581SS**Hα-helixtrans-62.7-44.4175.5-175.4176.9-17700111.6K136 E143 E144K136-E140 VanDerWaalsContact O-CB 3.31Å; K136-E140 WeakPolarHBondContact O-CB 3.45Å; K136-E140 PolarHBondContact O-N 2.85Å; E140-E143 PolarHBondContact O-N 3.28Å; E140-E144 PolarHBondContact O-N 3.1Å
141R73.3Confident74.5Confident162 Ų162122.4 Ų122.461%0.61158%0.583SS**Hα-helixtrans-70.2-32.9178.9-166.3-178.2-87.2166.2-6.8112.6I137 Q145I137-R141 VanDerWaalsContact O-CB 3.25Å; I137-R141 WeakPolarHBondContact O-CB 3.31Å; I137-R141 PolarHBondContact O-N 3.36Å; R141-Q145 WeakPolarHBondContact O-CB 3.48Å; R141-Q145 PolarHBondContact O-N 3.27Å
142A74.7Confident75Confident56 Ų56121.8 Ų121.846%0.46358%0.577SS.*Hα-helixtrans-69.3-38.2173.900000112K138 K139 Q145 A146K138-A142 VanDerWaalsContact O-CB 3.25Å; K138-A142 WeakPolarHBondContact O-CB 3.25Å; K138-A142 PolarHBondContact O-N 2.91Å; K139-A142 PolarHBondContact O-N 3.15Å; A142-Q145 PolarHBondContact O-N 3.49Å; A142-A146 WeakPolarHBondContact O-CB 3.28Å; A142-A146 PolarHBondContact O-N 2.94Å
143E76.9Confident75.4Confident139 Ų139125.1 Ų125.165%0.6558%0.58SS**Hα-helixtrans-69.8-38.7176.7-169.1170.1-172.400111.8K139 E140 A146 R147K139-E143 WeakPolarHBondContact O-CB 3.25Å; K139-E143 PolarHBondContact O-N 3.11Å; E140-E143 PolarHBondContact O-N 3.28Å; E143-A146 PolarHBondContact O-N 3.34Å; E143-R147 WeakPolarHBondContact O-CB 3.14Å; E143-R147 PolarHBondContact O-N 2.91Å
144E74.4Confident76Confident126 Ų126121.7 Ų121.759%0.58957%0.573SS**Hα-helixtrans-65.9-41.5173.5-167.9-178.5-166.500112.2E140 R147 K148E140-E144 PolarHBondContact O-N 3.1Å; E144-R147 PolarHBondContact O-N 3.44Å; E144-K148 WeakPolarHBondContact O-CB 3.33Å; E144-K148 PolarHBondContact O-N 3.01Å
145Q77.2Confident76.6Confident132 Ų132123.6 Ų123.662%0.61758%0.58SS**Hα-helixtrans-63.5-44.3173.9-84.8-178.3-25.100112R141 A142 R147 K148 E149R141-Q145 WeakPolarHBondContact O-CB 3.48Å; R141-Q145 PolarHBondContact O-N 3.27Å; A142-Q145 PolarHBondContact O-N 3.49Å; Q145-R147 VanDerWaalsContact C-N 3.34Å; Q145-R147 PolarHBondContact O-N 3.49Å; Q145-K148 PolarHBondContact O-N 2.96Å; Q145-E149 WeakPolarHBondContact O-CB 3.43Å; Q145-E149 PolarHBondContact O-N 3.35Å
146A78.9Confident76.8Confident45 Ų45123.1 Ų123.137%0.37258%0.577SS.*Hα-helixtrans-63.1-39.6177.400000112A142 E143 E149 Q150A142-A146 WeakPolarHBondContact O-CB 3.28Å; A142-A146 PolarHBondContact O-N 2.94Å; E143-A146 PolarHBondContact O-N 3.34Å; A146-E149 PolarHBondContact O-N 2.99Å; A146-Q150 WeakPolarHBondContact O-CG 3.11Å; A146-Q150 PolarHBondContact O-N 3.39Å
147R80.9Confident76.8Confident173 Ų173121.6 Ų121.665%0.65357%0.573SS**Hα-helixtrans-64.3-41.8175.4-160.1-175.686.8-165.23111.6E143 E144 Q145 Q150 E151E143-R147 WeakPolarHBondContact O-CB 3.14Å; E143-R147 PolarHBondContact O-N 2.91Å; E144-R147 PolarHBondContact O-N 3.44Å; Q145-R147 VanDerWaalsContact C-N 3.34Å; Q145-R147 PolarHBondContact O-N 3.49Å; R147-Q150 PolarHBondContact O-N 2.75Å; R147-E151 PolarHBondContact O-N 3.07Å; R147-E151 VanDerWaalsContact O-N 3.1Å
148K78.6Confident77.3Confident132 Ų132126.7 Ų126.757%0.57459%0.587SS**Hα-helixtrans-70-33178.9-165.6176.8-178.2175.40112.6E144 Q145 Q152E144-K148 WeakPolarHBondContact O-CB 3.33Å; E144-K148 PolarHBondContact O-N 3.01Å; Q145-K148 PolarHBondContact O-N 2.96Å; K148-Q152 WeakPolarHBondContact O-CG 3.35Å; K148-Q152 PolarHBondContact O-N 2.97Å
149E78.7Confident77.4Confident137 Ų137123.7 Ų123.764%0.6458%0.578SS**Hα-helixtrans-72.3-37.8175.4-167.7177177.500111.7Q145 A146 Q152 K153Q145-E149 WeakPolarHBondContact O-CB 3.43Å; Q145-E149 PolarHBondContact O-N 3.35Å; A146-E149 PolarHBondContact O-N 2.99Å; E149-Q152 PolarHBondContact O-N 3.22Å; E149-K153 VanDerWaalsContact O-CB 3.32Å; E149-K153 WeakPolarHBondContact O-CB 3.14Å; E149-K153 PolarHBondContact O-N 3Å
150Q76.3Confident77.3Confident143 Ų143124.9 Ų124.967%0.66858%0.578SS**Hα-helixtrans-63.3-40.6172.2-74.6179.810.200112.3A146 R147 K153 A154A146-Q150 WeakPolarHBondContact O-CG 3.11Å; A146-Q150 PolarHBondContact O-N 3.39Å; R147-Q150 PolarHBondContact O-N 2.75Å; Q150-K153 PolarHBondContact O-N 3.17Å; Q150-A154 WeakPolarHBondContact O-CB 3.21Å; Q150-A154 PolarHBondContact O-N 3.25Å
151E78.8Confident76.8Confident128 Ų128124.7 Ų124.760%0.59858%0.579SS**Hα-helixtrans-66.3-44.7177.2-168.9171.9-167.400111.7R147 K153 A154 E155R147-E151 PolarHBondContact O-N 3.07Å; R147-E151 VanDerWaalsContact O-N 3.1Å; E151-K153 PolarHBondContact O-N 2.87Å; E151-A154 PolarHBondContact O-N 2.91Å; E151-E155 PolarHBondContact O-N 3.01Å
152Q77.4Confident76.7Confident99 Ų99123 Ų12346%0.46358%0.578SS.*Hα-helixtrans-62.5-42.2175.2-76.7178.860.700112.1K148 E149 A154 E155 E156K148-Q152 WeakPolarHBondContact O-CG 3.35Å; K148-Q152 PolarHBondContact O-N 2.97Å; E149-Q152 PolarHBondContact O-N 3.22Å; Q152-A154 VanDerWaalsContact C-N 3.33Å; Q152-A154 PolarHBondContact O-N 3.17Å; Q152-E155 PolarHBondContact O-N 3.37Å; Q152-E156 WeakPolarHBondContact O-CB 3.29Å; Q152-E156 WeakPolarHBondContact O-CG 3.39Å; Q152-E156 PolarHBondContact O-N 2.69Å
153K80.6Confident76.5Confident130 Ų130125.7 Ų125.757%0.56559%0.585SS**Hα-helixtrans-64.7-37.6177.8-168.6175.9-178.4178.50112.2E149 Q150 E151 E157E149-K153 VanDerWaalsContact O-CB 3.32Å; E149-K153 WeakPolarHBondContact O-CB 3.14Å; E149-K153 PolarHBondContact O-N 3Å; Q150-K153 PolarHBondContact O-N 3.17Å; E151-K153 PolarHBondContact O-N 2.87Å; K153-E157 WeakPolarHBondContact O-CB 3.46Å; K153-E157 WeakPolarHBondContact O-CG 3.39Å; K153-E157 PolarHBondContact O-N 3.42Å
154A81.4Confident76Confident53 Ų53125 Ų12544%0.43858%0.584SS.*Hα-helixtrans-68-36.9174.800000112.2Q150 E151 Q152 E157 R158Q150-A154 WeakPolarHBondContact O-CB 3.21Å; Q150-A154 PolarHBondContact O-N 3.25Å; E151-A154 PolarHBondContact O-N 2.91Å; Q152-A154 VanDerWaalsContact C-N 3.33Å; Q152-A154 PolarHBondContact O-N 3.17Å; A154-E157 PolarHBondContact O-N 2.86Å; A154-R158 PolarHBondContact O-N 3.27Å
155E77Confident75.4Confident126 Ų126125.8 Ų125.859%0.58959%0.591SS**Hα-helixtrans-69.8-40.8175.8-165162-148.300111.6E151 Q152 R158 I159E151-E155 PolarHBondContact O-N 3.01Å; Q152-E155 PolarHBondContact O-N 3.37Å; E155-R158 PolarHBondContact O-N 3.45Å; E155-I159 HydrophobicContact CG-CD1 4.3Å; E155-I159 VanDerWaalsContact O-CG1 3.29Å; E155-I159 WeakPolarHBondContact O-CG1 3.41Å; E155-I159 PolarHBondContact O-N 3.43Å
156E76.4Confident74.6Confident130 Ų130123.3 Ų123.361%0.60759%0.589SS**Hα-helixtrans-62.8-40.7172.1-74.8-178.517900112.3Q152 I159 R160Q152-E156 WeakPolarHBondContact O-CB 3.29Å; Q152-E156 WeakPolarHBondContact O-CG 3.39Å; Q152-E156 PolarHBondContact O-N 2.69Å; E156-I159 PolarHBondContact O-N 3Å; E156-R160 VanDerWaalsContact O-CB 3.23Å; E156-R160 WeakPolarHBondContact O-CB 3.36Å; E156-R160 PolarHBondContact O-N 2.91Å
157E74.8Confident73.7Confident120 Ų120123.6 Ų123.656%0.56160%0.597SS**Hα-helixtrans-66.3-37173.7-79.2-176.5-178.900112.2K153 A154 R160 M161K153-E157 WeakPolarHBondContact O-CB 3.46Å; K153-E157 WeakPolarHBondContact O-CG 3.39Å; K153-E157 PolarHBondContact O-N 3.42Å; A154-E157 PolarHBondContact O-N 2.86Å; E157-R160 PolarHBondContact O-N 3.28Å; E157-M161 WeakPolarHBondContact O-CB 3.32Å; E157-M161 PolarHBondContact O-N 3Å
158R78.6Confident72.7Confident181 Ų181118.6 Ų118.668%0.68358%0.583SS**Hα-helixtrans-64.4-46172.6-86.2-156.571.1161.31.2112.2A154 E155 R160 M161 E162A154-R158 PolarHBondContact O-N 3.27Å; E155-R158 PolarHBondContact O-N 3.45Å; R158-R160 VanDerWaalsContact C-N 3.3Å; R158-R160 PolarHBondContact O-N 3.42Å; R158-M161 PolarHBondContact O-N 3.19Å; R158-E162 WeakPolarHBondContact O-CB 3.04Å; R158-E162 PolarHBondContact O-N 2.94Å
159I75.9Confident72.1Confident101 Ų101117.1 Ų117.152%0.51859%0.586SS.*Hα-helixtrans-63.4-41.1176.9-67.2164.9000109.7E155 E156 M161 E162 N163E155-I159 HydrophobicContact CG-CD1 4.3Å; E155-I159 VanDerWaalsContact O-CG1 3.29Å; E155-I159 WeakPolarHBondContact O-CG1 3.41Å; E155-I159 PolarHBondContact O-N 3.43Å; E156-I159 PolarHBondContact O-N 3Å; I159-M161 PolarHBondContact O-N 3.04Å; I159-E162 PolarHBondContact O-N 3.24Å; I159-N163 VanDerWaalsContact O-CB 3.28Å; I159-N163 WeakPolarHBondContact O-CB 3.44Å; I159-N163 PolarHBondContact O-N 3.01Å
160R75.8Confident71.1Confident179 Ų179117.5 Ų117.568%0.67559%0.592SS**Hα-helixtrans-62.5-42175.9-171.8177.2-177.5-173.51.1111.6E156 E157 R158 N163 I164E156-R160 VanDerWaalsContact O-CB 3.23Å; E156-R160 WeakPolarHBondContact O-CB 3.36Å; E156-R160 PolarHBondContact O-N 2.91Å; E157-R160 PolarHBondContact O-N 3.28Å; R158-R160 VanDerWaalsContact C-N 3.3Å; R158-R160 PolarHBondContact O-N 3.42Å; R160-N163 PolarHBondContact O-N 2.66Å; R160-I164 HydrophobicContact CG-CD1 4.15Å; R160-I164 WeakPolarHBondContact O-CB 3.42Å; R160-I164 VanDerWaalsContact O-CG1 3.23Å; R160-I164 WeakPolarHBondContact O-CG1 3.37Å; R160-I164 PolarHBondContact O-N 2.72Å
161M66.9Low70.1Confident126 Ų126116.4 Ų116.462%0.62159%0.59SS**Hα-helixtrans-68.3-40.9176.6-165.7178.372.700111.8E157 R158 I159 N163 I164 L165E157-M161 WeakPolarHBondContact O-CB 3.32Å; E157-M161 PolarHBondContact O-N 3Å; R158-M161 PolarHBondContact O-N 3.19Å; I159-M161 PolarHBondContact O-N 3.04Å; M161-N163 VanDerWaalsContact C-N 3.35Å; M161-N163 PolarHBondContact O-N 3.39Å; M161-I164 PolarHBondContact O-N 3.3Å; M161-L165 WeakPolarHBondContact O-CB 3.38Å; M161-L165 PolarHBondContact O-N 3.29Å
162E70.9Confident69Low126 Ų126117.4 Ų117.459%0.58960%0.6SS**Hα-helixtrans-63.8-38.9175.3-175.9175.7-17900111.9R158 I159 L165 S166R158-E162 WeakPolarHBondContact O-CB 3.04Å; R158-E162 PolarHBondContact O-N 2.94Å; I159-E162 PolarHBondContact O-N 3.24Å; E162-L165 PolarHBondContact O-N 2.58Å; E162-S166 VanDerWaalsContact O-CB 3.26Å; E162-S166 WeakPolarHBondContact O-CB 3.25Å; E162-S166 PolarHBondContact O-N 3.18Å; E162-S166 PolarHBondContact O-OG 3.3Å
163N70.8Confident67.8Low114 Ų114119.2 Ų119.261%0.6161%0.612SS**Hα-helixtrans-73.2-31177.9-148.823.9000112I159 R160 M161 G167I159-N163 VanDerWaalsContact O-CB 3.28Å; I159-N163 WeakPolarHBondContact O-CB 3.44Å; I159-N163 PolarHBondContact O-N 3.01Å; R160-N163 PolarHBondContact O-N 2.66Å; M161-N163 VanDerWaalsContact C-N 3.35Å; M161-N163 PolarHBondContact O-N 3.39Å; N163-G167 VanDerWaalsContact O-CA 3.26Å; N163-G167 WeakPolarHBondContact O-CA 3.45Å; N163-G167 PolarHBondContact O-N 3.19Å
164I65.8Low66.4Low123 Ų123119.5 Ų119.563%0.63162%0.624SS**Hα-helixtrans-70.6-37.2170.3-70.2167.5000111R160 M161R160-I164 HydrophobicContact CG-CD1 4.15Å; R160-I164 WeakPolarHBondContact O-CB 3.42Å; R160-I164 VanDerWaalsContact O-CG1 3.23Å; R160-I164 WeakPolarHBondContact O-CG1 3.37Å; R160-I164 PolarHBondContact O-N 2.72Å; M161-I164 PolarHBondContact O-N 3.3Å
165L61.8Low64.6Low143 Ų143119.9 Ų119.975%0.74963%0.634SS**Hα-helixtrans-75.6-37.4-180-146.185.9000112.6M161 E162M161-L165 WeakPolarHBondContact O-CB 3.38Å; M161-L165 PolarHBondContact O-N 3.29Å; E162-L165 PolarHBondContact O-N 2.58Å
166S60.8Low63.2Low80 Ų80120.1 Ų120.156%0.55965%0.646SS**Hα-helixtrans-92.2-15.3-179.4650000114E162 N168E162-S166 VanDerWaalsContact O-CB 3.26Å; E162-S166 WeakPolarHBondContact O-CB 3.25Å; E162-S166 PolarHBondContact O-N 3.18Å; E162-S166 PolarHBondContact O-OG 3.3Å; S166-N168 PolarHBondContact O-N 2.92Å
167G59.6Low61.6Low52 Ų52118.2 Ų118.254%0.53665%0.652SS.*SBendtrans-771.1178.200000115.1N163 P169N163-G167 VanDerWaalsContact O-CA 3.26Å; N163-G167 WeakPolarHBondContact O-CA 3.45Å; N163-G167 PolarHBondContact O-N 3.19Å; G167-P169 WeakPolarHBondContact O-CD 3.48Å
168N60.8Low60.3Low68 Ų68119.4 Ų119.436%0.36466%0.658SS.*  trans-100.397177.1-167.5-12.6000111.6S166 L170 L171S166-N168 PolarHBondContact O-N 2.92Å; N168-L170 PolarHBondContact O-N 3.48Å; N168-L170 VanDerWaalsContact O-N 3.1Å; N168-L170 WeakPolarHBondContact OD1-CB 3.33Å; N168-L170 PolarHBondContact OD1-N 3.49Å; N168-L170 VanDerWaalsContact OD1-N 3.16Å; N168-L171 HydrophobicContact CB-CD1 4.39Å; N168-L171 PolarHBondContact O-N 3.47Å
169P64.4Low59Low100 Ų100116.4 Ų116.465%0.64966%0.662SS**THydrogen-bonded Turntrans-70.1-3.1-178.529.9-36.8000114.4G167 L173G167-P169 WeakPolarHBondContact O-CD 3.48Å; P169-L173 WeakPolarHBondContact O-CD1 3.25Å
170L58.3Low57.7Low146 Ų146118.3 Ų118.376%0.76467%0.669SS**THydrogen-bonded Turntrans-86.1-15.4177.8-74.3154.5000113.8N168N168-L170 PolarHBondContact O-N 3.48Å; N168-L170 VanDerWaalsContact O-N 3.1Å; N168-L170 WeakPolarHBondContact OD1-CB 3.33Å; N168-L170 PolarHBondContact OD1-N 3.49Å; N168-L170 VanDerWaalsContact OD1-N 3.16Å
171L55.2Low56.6Low120 Ų120113.8 Ų113.863%0.62867%0.67SS**THydrogen-bonded Turntrans-90.5-7.4-177.9-80.3164.8000114.6N168N168-L171 HydrophobicContact CB-CD1 4.39Å; N168-L171 PolarHBondContact O-N 3.47Å
172N55.6Low55.8Low148 Ų148114.6 Ų114.679%0.79168%0.677SS**THydrogen-bonded Turntrans-97.515.9-179.6-76.7-3000114.5
173L53Low54.8Low138 Ų138118.2 Ų118.272%0.72369%0.691SS**  trans-105.60.5-177.5-88.886.5000115.7P169P169-L173 WeakPolarHBondContact O-CD1 3.25Å
174T49.8Very low54.4Low135 Ų135121.2 Ų121.283%0.82870%0.698SS**  trans-110.955.5-173.852.70000114
175G44Very low54.1Low61 Ų61120.5 Ų120.563%0.62970%0.699SS**SBendtrans-128.1134.5164.300000110.4
176P47.7Very low54.2Low131 Ų131123.4 Ų123.485%0.85171%0.706SS**  trans-79138.8-163.531.4-33.3000112.8
177A44.3Very low54.6Low90 Ų90126.9 Ų126.974%0.74471%0.707SS**  trans54.9106.4154.300000118.1
178Q46.3Very low55.2Low145 Ų145133.1 Ų133.168%0.67871%0.714SS**  -179.1133.6118.2-91.7-68.8-37.700109Q180Q178-Q180 HydrophobicContact CB-CG 4.48Å; Q178-Q180 PolarHBondContact O-N 3.06Å
179P51.6Low56Low118 Ų118140.5 Ų140.577%0.76674%0.737SS**  trans-76.580.9169.933.6-31.3000108.3A181P179-A181 VanDerWaalsContact C-N 3.27Å; P179-A181 PolarHBondContact O-N 3.1Å
180Q48.8Very low56.4Low142 Ų142138.7 Ų138.766%0.66472%0.722SS**  trans-72.294.6164-65-62.3-40.300106.7Q178 N182Q178-Q180 HydrophobicContact CB-CG 4.48Å; Q178-Q180 PolarHBondContact O-N 3.06Å; Q180-N182 PolarHBondContact O-N 3.46Å
181A52Low57.4Low84 Ų84134.9 Ų134.969%0.69470%0.702SS**  trans-50.8100157.800000106.6P179 F183P179-A181 VanDerWaalsContact C-N 3.27Å; P179-A181 PolarHBondContact O-N 3.1Å; A181-F183 VanDerWaalsContact C-N 3.29Å; A181-F183 PolarHBondContact O-N 2.88Å
182N49.7Very low58.6Low143 Ų143135.7 Ų135.777%0.76571%0.708SS**  trans-57.797171.2-80.4-50.6000107Q180 K184Q180-N182 PolarHBondContact O-N 3.46Å; N182-K184 PolarHBondContact O-N 3.39Å
183F50.3Low60.1Low201 Ų201132 Ų13288%0.88269%0.69SS**  trans-71.234169.2-128.3-88000110.9A181 V185A181-F183 VanDerWaalsContact C-N 3.29Å; A181-F183 PolarHBondContact O-N 2.88Å; F183-V185 PolarHBondContact O-N 3.29Å
184K62.3Low61.8Low177 Ų177131.6 Ų131.677%0.7769%0.693SS**  trans-82100.2169.5-152.5158.7-172.2177.20104.2N182 K186N182-K184 PolarHBondContact O-N 3.39Å; K184-K186 VanDerWaalsContact C-N 3.31Å; K184-K186 WeakPolarHBondContact O-CA 3.32Å; K184-K186 PolarHBondContact O-N 3.3Å
185V60.4Low63.5Low108 Ų108132.6 Ų132.666%0.65569%0.686SS**  trans-44.198.5174.7174.60000108F183 R187F183-V185 PolarHBondContact O-N 3.29Å; V185-R187 WeakPolarHBondContact CG1-O 3.32Å; V185-R187 PolarHBondContact O-N 3.12Å
186K63.3Low65.5Low205 Ų205134.3 Ų134.389%0.89168%0.676SS**SBendtrans-76.4-20.6-168.4-152.8163.1-175.8167.70111K184K184-K186 VanDerWaalsContact C-N 3.31Å; K184-K186 WeakPolarHBondContact O-CA 3.32Å; K184-K186 PolarHBondContact O-N 3.3Å
187R69.5Low67.2Low152 Ų152133.6 Ų133.657%0.57467%0.665SS**SBendtrans-139.7124.3172.8-70.7177.340.693.1-13.1108.2V185 D191V185-R187 WeakPolarHBondContact CG1-O 3.32Å; V185-R187 PolarHBondContact O-N 3.12Å; R187-D191 HydrophobicContact CB-CB 4.2Å; R187-D191 VanDerWaalsContact CG-OD2 3.25Å; R187-D191 WeakPolarHBondContact CG-OD2 3.45Å; R187-D191 IonicContact CZ-OD2 3.35Å; R187-D191 IonicContact NE-OD2 3.7Å; R187-D191 IonicContact NH1-OD2 2.67Å; R187-D191 PolarHBondContact NH1-OD2 3.23Å
188R71.3Confident69.1Low184 Ų184134.4 Ų134.469%0.69466%0.664SS**  trans-70.5155.3176.3-53.6178.673.3101.5-0.3108.2D190 D191R188-D190 PolarHBondContact O-N 3.5Å; R188-D190 VanDerWaalsContact O-N 3.16Å; R188-D191 WeakPolarHBondContact O-CB 3.39Å; R188-D191 PolarHBondContact O-N 2.92Å
189W78.1Confident70.9Confident222 Ų222130.7 Ų130.784%0.84166%0.659SS**G310 helixtrans-56.8-30175.165.6-85000112.3D191W189-D191 VanDerWaalsContact C-N 3.28Å; W189-D191 PolarHBondContact O-N 2.84Å
190D74.2Confident72.6Confident62 Ų62133.2 Ų133.233%0.33266%0.658SS.*G310 helixtrans-77.70.2173.4-67.3-53.4000114.9R188 D192 V193 K196R188-D190 PolarHBondContact O-N 3.5Å; R188-D190 VanDerWaalsContact O-N 3.16Å; D190-D192 VanDerWaalsContact C-N 3.33Å; D190-V193 WeakPolarHBondContact O-CG2 3.47Å; D190-K196 PolarHBondContact O-NZ 3.03Å
191D77.6Confident74.2Confident66 Ų66130.2 Ų130.235%0.35366%0.664SS.*G310 helixtrans-73.4-28.1-174.3-161.527.4000112R187 R188 W189 V193 K196R187-D191 HydrophobicContact CB-CB 4.2Å; R187-D191 VanDerWaalsContact CG-OD2 3.25Å; R187-D191 WeakPolarHBondContact CG-OD2 3.45Å; R187-D191 IonicContact CZ-OD2 3.35Å; R187-D191 IonicContact NE-OD2 3.7Å; R187-D191 IonicContact NH1-OD2 2.67Å; R187-D191 PolarHBondContact NH1-OD2 3.23Å; R188-D191 WeakPolarHBondContact O-CB 3.39Å; R188-D191 PolarHBondContact O-N 2.92Å; W189-D191 VanDerWaalsContact C-N 3.28Å; W189-D191 PolarHBondContact O-N 2.84Å; D191-V193 PolarHBondContact O-N 2.98Å; D191-K196 PolarHBondContact O-NZ 3.3Å
192D82.2Confident75.7Confident138 Ų138131.2 Ų131.274%0.73866%0.657SS**SBendtrans-95.758176.4-159.416.6000112.2D190D190-D192 VanDerWaalsContact C-N 3.33Å
193V86.5Confident77Confident69 Ų69126.8 Ų126.842%0.41863%0.633SS.*  trans-119.4129.4175.7179.20000108.1D190 D191 F195 K196D190-V193 WeakPolarHBondContact O-CG2 3.47Å; D191-V193 PolarHBondContact O-N 2.98Å; V193-F195 WeakPolarHBondContact CG1-O 3.42Å; V193-F195 PolarHBondContact O-N 2.94Å; V193-K196 WeakPolarHBondContact O-CE 3.35Å
194V87.3Confident78Confident130 Ų130123.9 Ų123.979%0.78862%0.622SS**SBendtrans-65.2-20.5-173.6-65.70000114.3
195F86.3Confident78.3Confident156 Ų156118.3 Ų118.368%0.68460%0.603SS**  trans-122.1129.2176.7-60.8-65.3000111V193V193-F195 WeakPolarHBondContact CG1-O 3.42Å; V193-F195 PolarHBondContact O-N 2.94Å
196K86.4Confident78.7Confident98 Ų98119.2 Ų119.243%0.42660%0.599SS.*  trans-120.4139.5177.2-55.9-62.2-172.6179.50109.6D190 D191 V193 C198D190-K196 PolarHBondContact O-NZ 3.03Å; D191-K196 PolarHBondContact O-NZ 3.3Å; V193-K196 WeakPolarHBondContact O-CE 3.35Å; K196-C198 VanDerWaalsContact C-N 3.29Å; K196-C198 PolarHBondContact O-N 3.44Å; K196-C198 VanDerWaalsContact O-N 3.11Å
197N84.1Confident78.9Confident116 Ų116114.9 Ų114.962%0.6258%0.58SS**  trans57.230.3163.2-62.970.2000116.1A199 K200N197-A199 PolarHBondContact O-N 3.01Å; N197-K200 HydrophobicContact CB-CB 3.97Å; N197-K200 HydrophobicContact CB-CD 4.33Å; N197-K200 WeakPolarHBondContact O-CB 3.37Å; N197-K200 PolarHBondContact O-N 3.48Å
198C83.9Confident79.2Confident106 Ų106112.5 Ų112.572%0.71658%0.578SS**THydrogen-bonded Turntrans-56.5-27.8-176.2-58.30000114.9K196K196-C198 VanDerWaalsContact C-N 3.29Å; K196-C198 PolarHBondContact O-N 3.44Å; K196-C198 VanDerWaalsContact O-N 3.11Å
199A83.2Confident79.8Confident68 Ų68111.6 Ų111.656%0.56258%0.579SS**THydrogen-bonded Turntrans-108.614.5179.400000113.9N197 G201 I202N197-A199 PolarHBondContact O-N 3.01Å; A199-G201 PolarHBondContact O-N 3.06Å; A199-G201 VanDerWaalsContact O-N 3.12Å; A199-I202 HydrophobicContact CB-CD1 3.85Å; A199-I202 HydrophobicContact CB-CG1 4.45Å; A199-I202 PolarHBondContact O-N 2.87Å
200K86.5Confident80.4Confident171 Ų171109.3 Ų109.374%0.74357%0.571SS**THydrogen-bonded Turntrans-66.3115.9-178.6-171.7-176.7-174.6179.70109.9N197N197-K200 HydrophobicContact CB-CB 3.97Å; N197-K200 HydrophobicContact CB-CD 4.33Å; N197-K200 WeakPolarHBondContact O-CB 3.37Å; N197-K200 PolarHBondContact O-N 3.48Å
201G83.2Confident81.3Confident78 Ų78115 Ų11580%0.80459%0.593SS**THydrogen-bonded Turntrans87.310.2177.400000115.5A199 D203A199-G201 PolarHBondContact O-N 3.06Å; A199-G201 VanDerWaalsContact O-N 3.12Å; G201-D203 PolarHBondContact O-N 3.27Å
202I82.7Confident82.1Confident106 Ų106114.5 Ų114.554%0.54459%0.592SS.*  trans-72.2109.6171.1-60.5-179.6000108.8A199 E204A199-I202 HydrophobicContact CB-CD1 3.85Å; A199-I202 HydrophobicContact CB-CG1 4.45Å; A199-I202 PolarHBondContact O-N 2.87Å; I202-E204 HydrophobicContact CG2-CG 4.15Å
203D77.1Confident82.8Confident50 Ų50115.3 Ų115.327%0.26760%0.596SS.*  trans-100.499.6173.4-173.6-0.7000109.9R81 G201 T205R81-D203 IonicContact CZ-OD2 3.46Å; R81-D203 IonicContact NH1-OD2 3.3Å; R81-D203 PolarHBondContact NH1-OD2 2.86Å; R81-D203 IonicContact NH2-OD2 2.72Å; R81-D203 PolarHBondContact NH2-OD2 3.34Å; G201-D203 PolarHBondContact O-N 3.27Å; D203-T205 VanDerWaalsContact CG-OG1 3.23Å; D203-T205 PolarHBondContact O-N 3.49Å; D203-T205 WeakPolarHBondContact OD1-CB 3.45Å; D203-T205 WeakPolarHBondContact OD1-CG2 3.44Å; D203-T205 PolarHBondContact OD1-N 3.42Å; D203-T205 PolarHBondContact OD1-OG1 2.84Å; D203-T205 PolarHBondContact OD2-OG1 3.43Å
204E72.4Confident83.2Confident139 Ų139114 Ų11465%0.6559%0.587SS**G310 helixtrans-68.4-18.6-177.9-60.6-167.7154.200113I202 K206 K207I202-E204 HydrophobicContact CG2-CG 4.15Å; E204-K206 PolarHBondContact O-N 2.88Å; E204-K207 PolarHBondContact O-N 2.84Å; E204-K207 VanDerWaalsContact O-N 3.17Å
205T67.9Low83.6Confident60 Ų60113.5 Ų113.537%0.36858%0.584SS.*G310 helixtrans-64.2-15.8-175.667.50000113.9D203 K209D203-T205 VanDerWaalsContact CG-OG1 3.23Å; D203-T205 PolarHBondContact O-N 3.49Å; D203-T205 WeakPolarHBondContact OD1-CB 3.45Å; D203-T205 WeakPolarHBondContact OD1-CG2 3.44Å; D203-T205 PolarHBondContact OD1-N 3.42Å; D203-T205 PolarHBondContact OD1-OG1 2.84Å; D203-T205 PolarHBondContact OD2-OG1 3.43Å; T205-K209 WeakPolarHBondContact O-CG 3.23Å
206K68.8Low84.1Confident128 Ų128111.3 Ų111.356%0.55758%0.579SS**G310 helixtrans-81.7-23.4-179.7-65.9-178.8-177.1176.50113.6E204E204-K206 PolarHBondContact O-N 2.88Å
207K68.1Low84.4Confident114 Ų114114.5 Ų114.550%0.49659%0.588SS.*THydrogen-bonded Turntrans-73.6-43.2179.3-66.3178.4-176.3171.40110.4E204 K209 R210E204-K207 PolarHBondContact O-N 2.84Å; E204-K207 VanDerWaalsContact O-N 3.17Å; K207-K209 VanDerWaalsContact C-N 3.27Å; K207-K209 PolarHBondContact O-N 3.24Å; K207-R210 PolarHBondContact O-N 3.33Å
208D76Confident84.9Confident101 Ų101110.1 Ų110.154%0.5457%0.567SS.*THydrogen-bonded Turntrans-70.6-19.2-176.5-68.6-14.5000114.5K223D208-K223 VanDerWaalsContact CG-NZ 3.32Å; D208-K223 WeakPolarHBondContact OD1-CE 3.36Å; D208-K223 IonicContact OD1-NZ 3.39Å; D208-K223 PolarHBondContact OD1-NZ 3.11Å; D208-K223 IonicContact OD2-NZ 2.69Å; D208-K223 PolarHBondContact OD2-NZ 2.73Å
209K84.4Confident85.3Confident165 Ų165107.3 Ų107.372%0.71754%0.543SS*.THydrogen-bonded Turntrans-85.8-10.4178.9-67.2177.5-175-176.50113.7T205 K207T205-K209 WeakPolarHBondContact O-CG 3.23Å; K207-K209 VanDerWaalsContact C-N 3.27Å; K207-K209 PolarHBondContact O-N 3.24Å
210R90.1Very high85.9Confident175 Ų175111.7 Ų111.766%0.6655%0.55SS*.  trans-86.9117.3-178.2-69.9171.4178.4172.9-1.7109.5K207K207-R210 PolarHBondContact O-N 3.33Å
211F93.1Very high86.4Confident182 Ų182105.4 Ų105.480%0.79852%0.523SS*.  trans-85.4128.9166.5-178.1-100.3000109.8N213F211-N213 HydrophobicContact CE1-CB 4.14Å
212V94.7Very high86.9Confident54 Ų54106.5 Ų106.533%0.32751%0.505SS..  trans-120.5120.8175.8-173.90000107.9D214V212-D214 HydrophobicContact CG1-CB 3.74Å; V212-D214 PolarHBondContact O-N 3Å
213N96Very high87.4Confident155 Ų155106.1 Ų106.183%0.82950%0.5SS*.SBendtrans-79.261.3174.1-169.518.2000110.7F211F211-N213 HydrophobicContact CE1-CB 4.14Å
214D96.1Very high88.4Confident42 Ų42107.9 Ų107.923%0.22551%0.505CS..  trans-149.9123.4178.7-177.3-32000108.1V212 L216 R217 S218V212-D214 HydrophobicContact CG1-CB 3.74Å; V212-D214 PolarHBondContact O-N 3Å; D214-L216 VanDerWaalsContact C-N 3.28Å; D214-L216 PolarHBondContact O-N 3.5Å; D214-L216 PolarHBondContact OD1-N 3.49Å; D214-R217 HydrophobicContact CB-CB 4.12Å; D214-R217 PolarHBondContact OD1-N 3.28Å; D214-R217 VanDerWaalsContact OD1-N 3.11Å; D214-R217 WeakPolarHBondContact OD2-CB 3.39Å; D214-R217 VanDerWaalsContact OD2-CD 3.25Å; D214-R217 WeakPolarHBondContact OD2-CD 3.49Å; D214-R217 VanDerWaalsContact OD2-CG 3.28Å; D214-R217 WeakPolarHBondContact OD2-CG 3.29Å; D214-R217 IonicContact OD2-CZ 3.51Å; D214-R217 IonicContact OD2-NE 3.87Å; D214-R217 IonicContact OD2-NH1 2.78Å; D214-R217 PolarHBondContact OD2-NH1 2.59Å; D214-S218 WeakPolarHBondContact O-CB 3.23Å; D214-S218 PolarHBondContact O-N 3.31Å; D214-S218 VanDerWaalsContact O-N 3.1Å
215T95.6Very high89.6Confident119 Ų119104.3 Ų104.373%0.7349%0.49SS*.THydrogen-bonded Turntrans-71.5-19.4-17554.20000113.9H221T215-H221 WeakPolarHBondContact O-CB 3.4Å; T215-H221 PolarHBondContact O-ND1 2.88Å; T215-H221 VanDerWaalsContact O-ND1 3.15Å
216L94.9Very high90.9Very high110 Ų110109 Ų10958%0.57651%0.507SS*.THydrogen-bonded Turntrans-103.4-31.9-178.7-60.4-179.3000112.3D214 H221D214-L216 VanDerWaalsContact C-N 3.28Å; D214-L216 PolarHBondContact O-N 3.5Å; D214-L216 PolarHBondContact OD1-N 3.49Å; L216-H221 PolarHBondContact O-CD2 3.21Å
217R93.9Very high92.3Very high166 Ų166110.3 Ų110.363%0.62651%0.513SS*.THydrogen-bonded Turntrans-97.4-9.2-176.5-60.2-174.9-178.286.6-0.9114.2D214 K222D214-R217 HydrophobicContact CB-CB 4.12Å; D214-R217 PolarHBondContact OD1-N 3.28Å; D214-R217 VanDerWaalsContact OD1-N 3.11Å; D214-R217 WeakPolarHBondContact OD2-CB 3.39Å; D214-R217 VanDerWaalsContact OD2-CD 3.25Å; D214-R217 WeakPolarHBondContact OD2-CD 3.49Å; D214-R217 VanDerWaalsContact OD2-CG 3.28Å; D214-R217 WeakPolarHBondContact OD2-CG 3.29Å; D214-R217 IonicContact OD2-CZ 3.51Å; D214-R217 IonicContact OD2-NE 3.87Å; D214-R217 IonicContact OD2-NH1 2.78Å; D214-R217 PolarHBondContact OD2-NH1 2.59Å; R217-K222 WeakPolarHBondContact O-CE 3.39Å; R217-K222 PolarHBondContact O-NZ 2.81Å
218S95.1Very high93.7Very high24 Ų24111.9 Ų111.917%0.16852%0.517CS..SBendtrans-57.3142.3171.8176.10000111.1D214 F220 H221 K222D214-S218 WeakPolarHBondContact O-CB 3.23Å; D214-S218 PolarHBondContact O-N 3.31Å; D214-S218 VanDerWaalsContact O-N 3.1Å; S218-F220 PolarHBondContact O-N 2.81Å; S218-F220 PolarHBondContact OG-N 3.33Å; S218-H221 PolarHBondContact O-N 2.67Å; S218-K222 PolarHBondContact O-N 3.16Å; S218-K222 VanDerWaalsContact O-N 3.07Å
219E92.6Very high94.5Very high47 Ų47112.4 Ų112.422%0.2252%0.518CS..Hα-helixtrans-57.2-29.3173.9-62.9-59.5126.700111.4K222 K223E219-K222 IonicContact OE1-NZ 3.66Å; E219-K222 PolarHBondContact OE1-NZ 3.1Å; E219-K223 WeakPolarHBondContact O-CB 3.5Å; E219-K223 VanDerWaalsContact O-CG 3.29Å; E219-K223 WeakPolarHBondContact O-CG 3.26Å; E219-K223 PolarHBondContact O-N 2.89Å
220F95.1Very high94.5Very high159 Ų159117.8 Ų117.870%0.69754%0.542SS*.Hα-helixtrans-58.2-49.1171.9174.9-97.6000111.8S218 F224S218-F220 PolarHBondContact O-N 2.81Å; S218-F220 PolarHBondContact OG-N 3.33Å; F220-F224 WeakPolarHBondContact O-CB 3.28Å; F220-F224 PolarHBondContact O-N 2.69Å
221H95.7Very high94.7Very high40 Ų40114.9 Ų114.919%0.18554%0.536CS..Hα-helixtrans-71.3-38.3-177.7-171.585.7000112.2T215 L216 S218 F224 M225T215-H221 WeakPolarHBondContact O-CB 3.4Å; T215-H221 PolarHBondContact O-ND1 2.88Å; T215-H221 VanDerWaalsContact O-ND1 3.15Å; L216-H221 PolarHBondContact O-CD2 3.21Å; S218-H221 PolarHBondContact O-N 2.67Å; H221-F224 WeakPolarHBondContact O-CB 3.37Å; H221-F224 PolarHBondContact O-N 2.87Å; H221-M225 WeakPolarHBondContact CE1-CE 3.13Å; H221-M225 VanDerWaalsContact NE2-CE 3.35Å; H221-M225 WeakPolarHBondContact NE2-CE 3.42Å; H221-M225 WeakPolarHBondContact O-CG 3.25Å; H221-M225 PolarHBondContact O-N 3.4Å
222K94.3Very high94.8Very high100 Ų100111.4 Ų111.444%0.43552%0.522SS..Hα-helixtrans-58.9-50.2174.3-65.8177.7-170.5163.40111.3R217 S218 E219 F224 M225 E226R217-K222 WeakPolarHBondContact O-CE 3.39Å; R217-K222 PolarHBondContact O-NZ 2.81Å; S218-K222 PolarHBondContact O-N 3.16Å; S218-K222 VanDerWaalsContact O-N 3.07Å; E219-K222 IonicContact OE1-NZ 3.66Å; E219-K222 PolarHBondContact OE1-NZ 3.1Å; K222-F224 VanDerWaalsContact C-N 3.3Å; K222-F224 PolarHBondContact O-N 3.42Å; K222-M225 PolarHBondContact O-N 3.16Å; K222-E226 WeakPolarHBondContact O-CB 3.15Å; K222-E226 PolarHBondContact O-N 2.79Å
223K94.6Very high94.8Very high99 Ų99114.6 Ų114.643%0.4353%0.533SS..Hα-helixtrans-62.8-37176.3-71.1-178.7-175.8-174.60112.1D208 E219 K227D208-K223 VanDerWaalsContact CG-NZ 3.32Å; D208-K223 WeakPolarHBondContact OD1-CE 3.36Å; D208-K223 IonicContact OD1-NZ 3.39Å; D208-K223 PolarHBondContact OD1-NZ 3.11Å; D208-K223 IonicContact OD2-NZ 2.69Å; D208-K223 PolarHBondContact OD2-NZ 2.73Å; E219-K223 WeakPolarHBondContact O-CB 3.5Å; E219-K223 VanDerWaalsContact O-CG 3.29Å; E219-K223 WeakPolarHBondContact O-CG 3.26Å; E219-K223 PolarHBondContact O-N 2.89Å; K223-K227 VanDerWaalsContact O-CB 3.25Å; K223-K227 WeakPolarHBondContact O-CB 3.14Å; K223-K227 PolarHBondContact O-N 3.4Å
224F96.9Very high94.7Very high86 Ų86112.2 Ų112.238%0.37752%0.515SS..Hα-helixtrans-62.2-50.2174.8178.8-90.6000111.1F220 H221 K222 K227 Y228F220-F224 WeakPolarHBondContact O-CB 3.28Å; F220-F224 PolarHBondContact O-N 2.69Å; H221-F224 WeakPolarHBondContact O-CB 3.37Å; H221-F224 PolarHBondContact O-N 2.87Å; K222-F224 VanDerWaalsContact C-N 3.3Å; K222-F224 PolarHBondContact O-N 3.42Å; F224-K227 PolarHBondContact O-N 2.83Å; F224-Y228 HydrophobicContact CD1-CD2 4.35Å; F224-Y228 AromaticContact CD2-CD2 3.51Å; F224-Y228 HydrophobicContact CD2-CD2 3.51Å; F224-Y228 AromaticContact CD2-CE2 3.57Å; F224-Y228 HydrophobicContact CD2-CE2 3.57Å; F224-Y228 HydrophobicContact CE1-CD2 4.26Å; F224-Y228 AromaticContact CE2-CD2 3.41Å; F224-Y228 HydrophobicContact CE2-CD2 3.41Å; F224-Y228 VanDerWaalsContact CE2-CD2 3.41Å; F224-Y228 AromaticContact CE2-CE2 3.47Å; F224-Y228 HydrophobicContact CE2-CE2 3.47Å; F224-Y228 VanDerWaalsContact CE2-CE2 3.47Å; F224-Y228 HydrophobicContact CE2-CG 4.32Å; F224-Y228 AromaticContact CG-CD2 3.99Å; F224-Y228 HydrophobicContact CG-CD2 3.99Å; F224-Y228 HydrophobicContact CG-CE2 4.43Å; F224-Y228 AromaticContact CZ-CD2 3.81Å; F224-Y228 HydrophobicContact CZ-CD2 3.81Å; F224-Y228 HydrophobicContact CZ-CE2 4.28Å; F224-Y228 HydrophobicContact CZ-CG 4.35Å; F224-Y228 VanDerWaalsContact O-CD2 3.25Å; F224-Y228 WeakPolarHBondContact O-CD2 3.26Å; F224-Y228 PolarHBondContact O-N 3.25Å
225M97.3Very high94.6Very high65 Ų65116.6 Ų116.632%0.3253%0.534SS..Hα-helixtrans-66.1-42-179.6-68.5-58.8170.900112.2H221 K222 K227 Y228 I229H221-M225 WeakPolarHBondContact CE1-CE 3.13Å; H221-M225 VanDerWaalsContact NE2-CE 3.35Å; H221-M225 WeakPolarHBondContact NE2-CE 3.42Å; H221-M225 WeakPolarHBondContact O-CG 3.25Å; H221-M225 PolarHBondContact O-N 3.4Å; K222-M225 PolarHBondContact O-N 3.16Å; M225-K227 PolarHBondContact O-N 2.81Å; M225-Y228 PolarHBondContact O-N 2.96Å; M225-I229 WeakPolarHBondContact O-CA 3.46Å; M225-I229 WeakPolarHBondContact O-CB 3.47Å; M225-I229 PolarHBondContact O-N 2.94Å; M225-I229 HydrophobicContact SD-CD1 3.45Å; M225-I229 WeakPolarHBondContact SD-CD1 3.08Å; M225-I229 HydrophobicContact SD-CG1 4.21Å
226E96.4Very high94.6Very high158 Ų158116.4 Ų116.474%0.73852%0.52SS*.Hα-helixtrans-58.3-34.9173.2-176.9179.9-175.100112.5K222K222-E226 WeakPolarHBondContact O-CB 3.15Å; K222-E226 PolarHBondContact O-N 2.79Å
227K97.2Very high94.5Very high156 Ų156116.9 Ų116.968%0.67852%0.517SS*.Hα-helixtrans-77.9-40.3-179.6-176.6176.4179.9-175.40113.3K223 F224 M225K223-K227 VanDerWaalsContact O-CB 3.25Å; K223-K227 WeakPolarHBondContact O-CB 3.14Å; K223-K227 PolarHBondContact O-N 3.4Å; F224-K227 PolarHBondContact O-N 2.83Å; M225-K227 PolarHBondContact O-N 2.81Å
228Y97.4Very high94.6Very high146 Ų146113.1 Ų113.157%0.57351%0.508SS*.Hα-helixtrans-103.5-9.7-169.6-69.5-76.6000114F224 M225F224-Y228 HydrophobicContact CD1-CD2 4.35Å; F224-Y228 AromaticContact CD2-CD2 3.51Å; F224-Y228 HydrophobicContact CD2-CD2 3.51Å; F224-Y228 AromaticContact CD2-CE2 3.57Å; F224-Y228 HydrophobicContact CD2-CE2 3.57Å; F224-Y228 HydrophobicContact CE1-CD2 4.26Å; F224-Y228 AromaticContact CE2-CD2 3.41Å; F224-Y228 HydrophobicContact CE2-CD2 3.41Å; F224-Y228 VanDerWaalsContact CE2-CD2 3.41Å; F224-Y228 AromaticContact CE2-CE2 3.47Å; F224-Y228 HydrophobicContact CE2-CE2 3.47Å; F224-Y228 VanDerWaalsContact CE2-CE2 3.47Å; F224-Y228 HydrophobicContact CE2-CG 4.32Å; F224-Y228 AromaticContact CG-CD2 3.99Å; F224-Y228 HydrophobicContact CG-CD2 3.99Å; F224-Y228 HydrophobicContact CG-CE2 4.43Å; F224-Y228 AromaticContact CZ-CD2 3.81Å; F224-Y228 HydrophobicContact CZ-CD2 3.81Å; F224-Y228 HydrophobicContact CZ-CE2 4.28Å; F224-Y228 HydrophobicContact CZ-CG 4.35Å; F224-Y228 VanDerWaalsContact O-CD2 3.25Å; F224-Y228 WeakPolarHBondContact O-CD2 3.26Å; F224-Y228 PolarHBondContact O-N 3.25Å; M225-Y228 PolarHBondContact O-N 2.96Å
229I94.1Very high94.6Very high112 Ų112120.5 Ų120.557%0.57454%0.536SS*.  trans-125.5121.8175.1-52.8-178.9000107.6M225M225-I229 WeakPolarHBondContact O-CA 3.46Å; M225-I229 WeakPolarHBondContact O-CB 3.47Å; M225-I229 PolarHBondContact O-N 2.94Å; M225-I229 HydrophobicContact SD-CD1 3.45Å; M225-I229 WeakPolarHBondContact SD-CD1 3.08Å; M225-I229 HydrophobicContact SD-CG1 4.21Å
230K83.1Confident94.7Very high278 Ų278127.2 Ų127.2100%1.20957%0.565SS**  trans-105.30-177.7-171.5173.7-176.3177.10111.5

Retrieved 230 of 230 residues in 32.1 ms (Link to these results)