A0A3Q0KTT4_SCHMA Loading...

Putative spindle assembly checkpoint component MAD1 (Mitotic arrest deficient protein 1) AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KTT4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 930 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.7Very low35.8Very low247 Ų247172.4 Ų172.4100%1.21786%0.855SS**  084.70-89.4179.3155.800108.8
2M32.9Very low35.6Very low188 Ų188168.3 Ų168.393%0.92685%0.846SS**PPolyproline II helixtrans-83.1123.7167.6-78.9171.1169.500107.6
3K32.7Very low35.1Very low213 Ų213162.5 Ų162.593%0.92683%0.831SS**PPolyproline II helixtrans-95.5121.5166.2-89.4-175.9174.71800108.3
4F34.1Very low35Very low161 Ų161166.1 Ų166.171%0.70684%0.838SS**PPolyproline II helixtrans-55.8141166-83.2-100.8000111.6F6F4-F6 HydrophobicContact CB-CD2 4.48Å; F4-F6 AromaticContact CD1-CD2 3.84Å; F4-F6 HydrophobicContact CD1-CD2 3.84Å; F4-F6 AromaticContact CD1-CE2 3.47Å; F4-F6 HydrophobicContact CD1-CE2 3.47Å; F4-F6 VanDerWaalsContact CD1-CE2 3.47Å; F4-F6 HydrophobicContact CD1-CZ 4.49Å; F4-F6 AromaticContact CE1-CE2 3.86Å; F4-F6 HydrophobicContact CE1-CE2 3.86Å; F4-F6 HydrophobicContact CG-CE2 4.44Å
5N39.2Very low34.6Very low174 Ų174165 Ų16593%0.9384%0.835SS**  trans-133.4120.1151.1-95-20.4000107.8
6F34.6Very low34.3Very low161 Ų161159.9 Ų159.971%0.70683%0.826SS**  trans-94.1170.1179.3-96.6-97.9000111.1F4F4-F6 HydrophobicContact CB-CD2 4.48Å; F4-F6 AromaticContact CD1-CD2 3.84Å; F4-F6 HydrophobicContact CD1-CD2 3.84Å; F4-F6 AromaticContact CD1-CE2 3.47Å; F4-F6 HydrophobicContact CD1-CE2 3.47Å; F4-F6 VanDerWaalsContact CD1-CE2 3.47Å; F4-F6 HydrophobicContact CD1-CZ 4.49Å; F4-F6 AromaticContact CE1-CE2 3.86Å; F4-F6 HydrophobicContact CE1-CE2 3.86Å; F4-F6 HydrophobicContact CG-CE2 4.44Å
7Y31.2Very low34.2Very low213 Ų213162.1 Ų162.184%0.83583%0.828SS**  trans9990.5154.7-84.3-87.1000119.5
8D38.4Very low33.8Very low143 Ų143159.9 Ų159.977%0.76582%0.818SS**  -60.4155129.3-149.812.2000108.8
9P47.8Very low33.6Very low108 Ų108160.5 Ų160.570%0.70182%0.817SS**  cis-146.914124.638.6-15.9000117.1
10S30.8Very low33.5Very low103 Ų103161.7 Ų161.772%0.7282%0.819SS**  trans-151.778167.1660000112.4
11L35.5Very low33.3Very low185 Ų185159.3 Ų159.397%0.96981%0.813SS**  trans-133.497.5155.9-85178.9000110.5
12V33.3Very low33.2Very low124 Ų124154.5 Ų154.575%0.75279%0.792SS**  trans-64.5139.5179.9166.60000111.8
13S29Very low33.1Very low92 Ų92151.5 Ų151.564%0.64378%0.78SS**  trans-15.5130.9155.946.60000118.1
14K33.7Very low32.9Very low214 Ų214148.2 Ų148.293%0.9377%0.772SS**  trans-119.894.8146.2-90.7-177.6176.3175.20108.8
15N29.2Very low32.7Very low149 Ų149149.4 Ų149.480%0.79778%0.779SS**  trans-78.9146.8163.2-87.9-20.1000110.3
16A30.5Very low32.7Very low84 Ų84145.3 Ų145.369%0.69476%0.762SS**  trans53.2126.8134.900000121.3
17K31.4Very low32.5Very low197 Ų197143.4 Ų143.486%0.85776%0.763SS**  trans-153.8101.9136.2-94.3-177.9-178.9-175.60106
18D28.3Very low32.6Very low122 Ų122139.8 Ų139.865%0.65276%0.759SS**  69.798.683-65.4-17.2000110.7
19E29.4Very low32.2Very low171 Ų171137 Ų13780%0.79976%0.755SS**  81.7115.398.9-81.2-171.716700113
20Q31.5Very low31.5Very low184 Ų184142.2 Ų142.286%0.8677%0.767SS**  trans-159.788.4134.6-111.4170.823.100110.6
21T29.5Very low31.5Very low113 Ų113143.1 Ų143.169%0.69377%0.772SS**  trans-65.1129.5150.946.30000109.6
22N33.9Very low31.6Very low145 Ų145139.5 Ų139.578%0.77576%0.759SS**  trans-135.491.7158.3-100.4-23000110.8
23N30.7Very low31.7Very low126 Ų126141.1 Ų141.167%0.67476%0.762SS**  trans11.6117.2134.4-61.3-41.5000116.9
24L28.4Very low32.1Very low144 Ų144144.5 Ų144.575%0.75477%0.772SS**  57.7102.486.5-81.7151.4000114.2
25H29.6Very low32.7Very low185 Ų185141.1 Ų141.186%0.85676%0.764SS**  trans-157.3115.1131.6-123.6-62000112
26P40.3Very low33.7Very low89 Ų89136.1 Ų136.158%0.57875%0.748SS**  trans-91-169.6164.236.2-27.2000110.2
27V30.8Very low35Very low120 Ų120139.3 Ų139.373%0.72775%0.753SS**  trans100.1122171.7-177.10000111.3
28D32.6Very low36.6Very low138 Ų138135.3 Ų135.374%0.73874%0.741SS**  cis-157.8135.815.4-96.8-29.9000106.6
29A29.9Very low38.2Very low83 Ų83132.3 Ų132.369%0.68673%0.733SS**  60.194.565.400000115
30K34.1Very low40.1Very low219 Ų219129 Ų12995%0.95273%0.725SS**  trans-177.686.1134-97.5164.6-167.7179.40110.2
31C29.2Very low42.2Very low122 Ų122125.9 Ų125.982%0.82471%0.711SS**  trans-97.6142.1165.7-134.10000108.7
32P37.9Very low44.5Very low108 Ų108125.7 Ų125.770%0.70170%0.704SS**  trans-78136.3-17726.8-21.8000111.9
33I36Very low46.6Very low158 Ų158123.6 Ų123.681%0.8169%0.692SS**SBendtrans24.8105.8149.2-51.7177.4000115.8
34L36.5Very low48.9Very low163 Ų163121.3 Ų121.385%0.85368%0.677SS**SBendtrans80.725.4156.4-66.6164.5000120.1
35N47.9Very low51.4Low144 Ų144121.7 Ų121.777%0.7767%0.672SS**  trans-130.218.7158.1-93.8-22.6000113.7D37 L38N35-D37 PolarHBondContact O-N 2.87Å; N35-L38 PolarHBondContact O-N 3.19Å
36G48.7Very low53.9Low44 Ų44119.1 Ų119.145%0.45466%0.661SS.*Hα-helixtrans-60.5-26.4-175.100000115.1L38 T40G36-L38 VanDerWaalsContact C-N 3.29Å; G36-L38 PolarHBondContact O-N 3.4Å; G36-T40 PolarHBondContact O-N 3.12Å; G36-T40 PolarHBondContact O-OG1 3.2Å
37D58Low55.9Low151 Ų151123.2 Ų123.281%0.80767%0.665SS**Hα-helixtrans-65.6-31.1-176.2-67.7-19.8000112.8N35 M41N35-D37 PolarHBondContact O-N 2.87Å; D37-M41 WeakPolarHBondContact O-CB 3.29Å; D37-M41 PolarHBondContact O-N 3.35Å
38L64.8Low58.4Low113 Ų113124.4 Ų124.459%0.59266%0.656SS**Hα-helixtrans-79-40-175.3-160.674.7000113N35 G36 M41 M42N35-L38 PolarHBondContact O-N 3.19Å; G36-L38 VanDerWaalsContact C-N 3.29Å; G36-L38 PolarHBondContact O-N 3.4Å; L38-M41 HydrophobicContact CD1-CE 3.7Å; L38-M41 PolarHBondContact O-N 3.08Å; L38-M42 PolarHBondContact O-N 3.48Å
39A63.2Low60.9Low59 Ų59123.2 Ų123.249%0.48865%0.646SS.*Hα-helixtrans-72.3-39.9-177.800000112.1M41 M42 I43A39-M41 VanDerWaalsContact C-N 3.32Å; A39-M42 PolarHBondContact O-N 3.48Å; A39-I43 PolarHBondContact O-N 3.29Å
40T68.8Low63.6Low102 Ų102122.3 Ų122.363%0.62664%0.638SS**Hα-helixtrans-65.6-38173.5-43.40000110.9G36 M42 E44G36-T40 PolarHBondContact O-N 3.12Å; G36-T40 PolarHBondContact O-OG1 3.2Å; T40-M42 VanDerWaalsContact C-N 3.34Å; T40-M42 PolarHBondContact O-N 2.94Å; T40-E44 WeakPolarHBondContact O-CB 3.44Å; T40-E44 PolarHBondContact O-N 3.37Å
41M74.7Confident66Low118 Ų118114.3 Ų114.358%0.58161%0.613SS**Hα-helixtrans-65.8-33.6175.3-169.5-17473.300112.7D37 L38 A39 K45D37-M41 WeakPolarHBondContact O-CB 3.29Å; D37-M41 PolarHBondContact O-N 3.35Å; L38-M41 HydrophobicContact CD1-CE 3.7Å; L38-M41 PolarHBondContact O-N 3.08Å; A39-M41 VanDerWaalsContact C-N 3.32Å; M41-K45 VanDerWaalsContact O-CB 3.26Å; M41-K45 WeakPolarHBondContact O-CB 3.42Å; M41-K45 PolarHBondContact O-N 3.43Å
42M77.5Confident68.8Low108 Ų108113.9 Ų113.953%0.53260%0.599SS.*Hα-helixtrans-69.1-48.7175.5-84.4-17254.600113.3L38 A39 T40 E44 K45 E46L38-M42 PolarHBondContact O-N 3.48Å; A39-M42 PolarHBondContact O-N 3.48Å; T40-M42 VanDerWaalsContact C-N 3.34Å; T40-M42 PolarHBondContact O-N 2.94Å; M42-E44 VanDerWaalsContact C-N 3.27Å; M42-E44 PolarHBondContact O-N 2.96Å; M42-K45 WeakPolarHBondContact O-CB 3.44Å; M42-K45 PolarHBondContact O-N 3.44Å; M42-K45 VanDerWaalsContact O-N 3.11Å; M42-E46 PolarHBondContact O-N 3.16Å
43I78.8Confident71.2Confident101 Ų101113.2 Ų113.252%0.51859%0.589SS.*Hα-helixtrans-62.1-40.2177.9-65.4172000110.4A39 K45 E46 R47A39-I43 PolarHBondContact O-N 3.29Å; I43-K45 VanDerWaalsContact C-N 3.34Å; I43-E46 PolarHBondContact O-N 3.45Å; I43-R47 PolarHBondContact O-N 3.34Å
44E78.5Confident73.7Confident78 Ų78110.3 Ų110.336%0.36458%0.575SS.*Hα-helixtrans-64.5-38.2175.2-17961.2-165.400111.7T40 M42 R47 R48T40-E44 WeakPolarHBondContact O-CB 3.44Å; T40-E44 PolarHBondContact O-N 3.37Å; M42-E44 VanDerWaalsContact C-N 3.27Å; M42-E44 PolarHBondContact O-N 2.96Å; E44-R47 PolarHBondContact O-N 2.92Å; E44-R48 VanDerWaalsContact CG-NH2 3.29Å; E44-R48 WeakPolarHBondContact O-CB 3.46Å; E44-R48 WeakPolarHBondContact O-CG 3.43Å; E44-R48 PolarHBondContact O-N 2.87Å; E44-R48 IonicContact OE1-CZ 3.82Å; E44-R48 IonicContact OE1-NE 3.56Å; E44-R48 PolarHBondContact OE1-NE 3.35Å; E44-R48 IonicContact OE1-NH2 2.98Å; E44-R48 PolarHBondContact OE1-NH2 2.92Å
45K81.9Confident76.2Confident152 Ų152106 Ų10666%0.66156%0.558SS**Hα-helixtrans-64.7-41.7174.2-172.1-178.8179.6-175.80112M41 M42 I43 R48 H49M41-K45 VanDerWaalsContact O-CB 3.26Å; M41-K45 WeakPolarHBondContact O-CB 3.42Å; M41-K45 PolarHBondContact O-N 3.43Å; M42-K45 WeakPolarHBondContact O-CB 3.44Å; M42-K45 PolarHBondContact O-N 3.44Å; M42-K45 VanDerWaalsContact O-N 3.11Å; I43-K45 VanDerWaalsContact C-N 3.34Å; K45-R48 PolarHBondContact O-N 2.98Å; K45-H49 WeakPolarHBondContact O-CB 3.31Å; K45-H49 PolarHBondContact O-N 2.92Å
46E82.5Confident78.3Confident131 Ų131104.7 Ų104.761%0.61255%0.547SS*.Hα-helixtrans-66.2-41.7175.7-74.1178.6174.900111.9M42 I43 H49 A50M42-E46 PolarHBondContact O-N 3.16Å; I43-E46 PolarHBondContact O-N 3.45Å; E46-H49 PolarHBondContact O-N 3.26Å; E46-A50 WeakPolarHBondContact O-CB 3.36Å; E46-A50 PolarHBondContact O-N 2.95Å
47R82.1Confident80.2Confident175 Ų175108 Ų10866%0.6655%0.552SS**Hα-helixtrans-61.9-43.3173.6-102.2-170.2170.2125.90.2112.4I43 E44 H49 A50 A51I43-R47 PolarHBondContact O-N 3.34Å; E44-R47 PolarHBondContact O-N 2.92Å; R47-H49 VanDerWaalsContact C-N 3.34Å; R47-A50 PolarHBondContact O-N 3.48Å; R47-A51 VanDerWaalsContact O-CB 3.3Å; R47-A51 WeakPolarHBondContact O-CB 3.39Å; R47-A51 PolarHBondContact O-N 2.68Å
48R82.7Confident81.9Confident145 Ų145105.2 Ų105.255%0.54754%0.537SS..Hα-helixtrans-62.1-44.2174.1-76.7-179.5-161158.25.6111.1E44 K45 A50 A51 E52E44-R48 VanDerWaalsContact CG-NH2 3.29Å; E44-R48 WeakPolarHBondContact O-CB 3.46Å; E44-R48 WeakPolarHBondContact O-CG 3.43Å; E44-R48 PolarHBondContact O-N 2.87Å; E44-R48 IonicContact OE1-CZ 3.82Å; E44-R48 IonicContact OE1-NE 3.56Å; E44-R48 PolarHBondContact OE1-NE 3.35Å; E44-R48 IonicContact OE1-NH2 2.98Å; E44-R48 PolarHBondContact OE1-NH2 2.92Å; K45-R48 PolarHBondContact O-N 2.98Å; R48-A50 PolarHBondContact O-N 3.24Å; R48-A51 CarbonylContact O-C 3.56Å; R48-A51 PolarHBondContact O-N 3.01Å; R48-E52 WeakPolarHBondContact O-CB 3.41Å; R48-E52 VanDerWaalsContact O-CG 3.23Å; R48-E52 WeakPolarHBondContact O-CG 3.4Å; R48-E52 PolarHBondContact O-N 3.49Å
49H84.8Confident83.2Confident114 Ų114105.2 Ų105.253%0.52854%0.537SS..Hα-helixtrans-65.6-40.2179.7-162.943.3000112.4K45 E46 R47 E52 L53K45-H49 WeakPolarHBondContact O-CB 3.31Å; K45-H49 PolarHBondContact O-N 2.92Å; E46-H49 PolarHBondContact O-N 3.26Å; R47-H49 VanDerWaalsContact C-N 3.34Å; H49-E52 IonicContact ND1-OE2 2.79Å; H49-E52 PolarHBondContact O-N 3.19Å; H49-L53 WeakPolarHBondContact O-CB 3.5Å; H49-L53 PolarHBondContact O-N 2.9Å
50A86.2Confident84.6Confident63 Ų63108.1 Ų108.152%0.52154%0.541SS..Hα-helixtrans-65.4-39173.100000112.2E46 R47 R48 N54E46-A50 WeakPolarHBondContact O-CB 3.36Å; E46-A50 PolarHBondContact O-N 2.95Å; R47-A50 PolarHBondContact O-N 3.48Å; R48-A50 PolarHBondContact O-N 3.24Å; A50-N54 VanDerWaalsContact O-CB 3.27Å; A50-N54 WeakPolarHBondContact O-CB 3.39Å; A50-N54 PolarHBondContact O-N 3.17Å
51A85.6Confident85.7Confident52 Ų52109.2 Ų109.243%0.4354%0.539SS..Hα-helixtrans-66.8-41.8174.900000111.9R47 R48 N54 C55R47-A51 VanDerWaalsContact O-CB 3.3Å; R47-A51 WeakPolarHBondContact O-CB 3.39Å; R47-A51 PolarHBondContact O-N 2.68Å; R48-A51 CarbonylContact O-C 3.56Å; R48-A51 PolarHBondContact O-N 3.01Å; A51-N54 PolarHBondContact O-N 3.32Å; A51-C55 WeakPolarHBondContact O-CB 3.39Å; A51-C55 PolarHBondContact O-N 3.43Å; A51-C55 PolarHBondContact O-SG 2.82Å
52E87.7Confident86.6Confident112 Ų112109.1 Ų109.152%0.52354%0.54SS..Hα-helixtrans-60.6-48.7173.7-76.4165.7-175.700110.5R48 H49 N54 C55 E56R48-E52 WeakPolarHBondContact O-CB 3.41Å; R48-E52 VanDerWaalsContact O-CG 3.23Å; R48-E52 WeakPolarHBondContact O-CG 3.4Å; R48-E52 PolarHBondContact O-N 3.49Å; H49-E52 IonicContact ND1-OE2 2.79Å; H49-E52 PolarHBondContact O-N 3.19Å; E52-N54 VanDerWaalsContact C-N 3.31Å; E52-N54 PolarHBondContact O-N 2.83Å; E52-C55 CarbonylContact O-C 3.58Å; E52-C55 WeakPolarHBondContact O-CB 3.39Å; E52-C55 PolarHBondContact O-N 3.32Å; E52-C55 VanDerWaalsContact O-N 3.16Å; E52-E56 WeakPolarHBondContact O-CB 3.43Å; E52-E56 PolarHBondContact O-N 3.28Å
53L88.6Confident87.4Confident94 Ų94110 Ų11049%0.49254%0.543SS..Hα-helixtrans-62.4-39.4178.3-155.8108.3000111.6H49 E56 M57H49-L53 WeakPolarHBondContact O-CB 3.5Å; H49-L53 PolarHBondContact O-N 2.9Å; L53-E56 PolarHBondContact O-N 2.88Å; L53-M57 WeakPolarHBondContact O-CG 3.41Å; L53-M57 PolarHBondContact O-N 3.19Å
54N88.4Confident88Confident97 Ų97108.4 Ų108.452%0.51954%0.54SS..Hα-helixtrans-69.7-37.7176-156.619.4000111.6A50 A51 E52 E56 L58A50-N54 VanDerWaalsContact O-CB 3.27Å; A50-N54 WeakPolarHBondContact O-CB 3.39Å; A50-N54 PolarHBondContact O-N 3.17Å; A51-N54 PolarHBondContact O-N 3.32Å; E52-N54 VanDerWaalsContact C-N 3.31Å; E52-N54 PolarHBondContact O-N 2.83Å; N54-E56 VanDerWaalsContact C-N 3.32Å; N54-L58 WeakPolarHBondContact O-CB 3.45Å; N54-L58 VanDerWaalsContact O-CG 3.3Å; N54-L58 WeakPolarHBondContact O-CG 3.48Å; N54-L58 PolarHBondContact O-N 3.26Å
55C89.1Confident88.8Confident74 Ų74112.7 Ų112.750%0.555%0.553SS.*Hα-helixtrans-64.2-38.7171.4-69.70000111.4A51 E52 L58 L59A51-C55 WeakPolarHBondContact O-CB 3.39Å; A51-C55 PolarHBondContact O-N 3.43Å; A51-C55 PolarHBondContact O-SG 2.82Å; E52-C55 CarbonylContact O-C 3.58Å; E52-C55 WeakPolarHBondContact O-CB 3.39Å; E52-C55 PolarHBondContact O-N 3.32Å; E52-C55 VanDerWaalsContact O-N 3.16Å; C55-L58 PolarHBondContact O-N 3.01Å; C55-L59 WeakPolarHBondContact O-CB 3.15Å; C55-L59 WeakPolarHBondContact O-CG 3.35Å; C55-L59 PolarHBondContact O-N 3.5Å
56E91Very high89.5Confident116 Ų116112 Ų11254%0.54255%0.552SS.*Hα-helixtrans-69.9-40.4178.7-166.6159.9-161.100111.6E52 L53 N54 L59 Q60E52-E56 WeakPolarHBondContact O-CB 3.43Å; E52-E56 PolarHBondContact O-N 3.28Å; L53-E56 PolarHBondContact O-N 2.88Å; N54-E56 VanDerWaalsContact C-N 3.32Å; E56-L59 WeakPolarHBondContact O-CB 3.36Å; E56-L59 PolarHBondContact O-N 3.24Å; E56-Q60 WeakPolarHBondContact O-CG 3.39Å; E56-Q60 PolarHBondContact O-N 3.42Å
57M90.2Very high90Very high112 Ų112109.5 Ų109.555%0.55255%0.546SS*.Hα-helixtrans-61.5-44.1169.7-75.3-175.96300112L53 L59 Q60 E61L53-M57 WeakPolarHBondContact O-CG 3.41Å; L53-M57 PolarHBondContact O-N 3.19Å; M57-L59 VanDerWaalsContact C-N 3.34Å; M57-L59 PolarHBondContact O-N 3.21Å; M57-Q60 PolarHBondContact O-N 3.42Å; M57-E61 WeakPolarHBondContact O-CB 3.34Å; M57-E61 PolarHBondContact O-N 3.41Å
58L92.8Very high90.6Very high94 Ų94108.4 Ų108.449%0.49254%0.543SS..Hα-helixtrans-64.2-38175.4-76.3169.6000112N54 C55 E61 L62N54-L58 WeakPolarHBondContact O-CB 3.45Å; N54-L58 VanDerWaalsContact O-CG 3.3Å; N54-L58 WeakPolarHBondContact O-CG 3.48Å; N54-L58 PolarHBondContact O-N 3.26Å; C55-L58 PolarHBondContact O-N 3.01Å; L58-E61 PolarHBondContact O-N 3.09Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 VanDerWaalsContact O-CG 3.23Å; L58-L62 WeakPolarHBondContact O-CG 3.21Å; L58-L62 PolarHBondContact O-N 2.77Å
59L93Very high91.2Very high113 Ų113106.2 Ų106.259%0.59254%0.541SS*.Hα-helixtrans-63.1-46.7174-89.1157.1000111.3C55 E56 M57 E61 L62 E63C55-L59 WeakPolarHBondContact O-CB 3.15Å; C55-L59 WeakPolarHBondContact O-CG 3.35Å; C55-L59 PolarHBondContact O-N 3.5Å; E56-L59 WeakPolarHBondContact O-CB 3.36Å; E56-L59 PolarHBondContact O-N 3.24Å; M57-L59 VanDerWaalsContact C-N 3.34Å; M57-L59 PolarHBondContact O-N 3.21Å; L59-E61 VanDerWaalsContact C-N 3.32Å; L59-E61 PolarHBondContact O-N 3.03Å; L59-L62 PolarHBondContact O-N 3.4Å; L59-E63 WeakPolarHBondContact O-CB 3.49Å; L59-E63 PolarHBondContact O-N 3.29Å
60Q92.3Very high91.8Very high120 Ų120104.5 Ų104.556%0.56153%0.534SS*.Hα-helixtrans-62.2-39.9175.4-74.5178.2-0.400111.9E56 M57 E63 S64E56-Q60 WeakPolarHBondContact O-CG 3.39Å; E56-Q60 PolarHBondContact O-N 3.42Å; M57-Q60 PolarHBondContact O-N 3.42Å; Q60-E63 PolarHBondContact O-N 3.11Å; Q60-S64 WeakPolarHBondContact O-CB 3.26Å; Q60-S64 PolarHBondContact O-N 3.14Å; Q60-S64 PolarHBondContact O-OG 3.02Å
61E91.9Very high92.2Very high125 Ų125106.8 Ų106.858%0.58454%0.537SS*.Hα-helixtrans-66.8-40.8176.2-170.8154.1-16700111.5M57 L58 L59 S64 R65M57-E61 WeakPolarHBondContact O-CB 3.34Å; M57-E61 PolarHBondContact O-N 3.41Å; L58-E61 PolarHBondContact O-N 3.09Å; L59-E61 VanDerWaalsContact C-N 3.32Å; L59-E61 PolarHBondContact O-N 3.03Å; E61-S64 PolarHBondContact O-N 3.41Å; E61-S64 PolarHBondContact O-OG 2.97Å; E61-R65 VanDerWaalsContact O-CB 3.31Å; E61-R65 WeakPolarHBondContact O-CB 3.35Å; E61-R65 PolarHBondContact O-N 3.45Å
62L93.3Very high92.7Very high115 Ų115107.7 Ų107.760%0.60253%0.534SS*.Hα-helixtrans-61.7-44.5172.2-74.8171.7000112.1L58 L59 R65 E66L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 VanDerWaalsContact O-CG 3.23Å; L58-L62 WeakPolarHBondContact O-CG 3.21Å; L58-L62 PolarHBondContact O-N 2.77Å; L59-L62 PolarHBondContact O-N 3.4Å; L62-R65 PolarHBondContact O-N 2.85Å; L62-E66 WeakPolarHBondContact O-CB 3.36Å; L62-E66 PolarHBondContact O-N 3.03Å
63E93.6Very high93Very high127 Ų127107.3 Ų107.359%0.59353%0.531SS*.Hα-helixtrans-65.8-40.7178.8-169.5172-15900111.4L59 Q60 R65 E66 T67L59-E63 WeakPolarHBondContact O-CB 3.49Å; L59-E63 PolarHBondContact O-N 3.29Å; Q60-E63 PolarHBondContact O-N 3.11Å; E63-R65 VanDerWaalsContact C-N 3.3Å; E63-R65 PolarHBondContact O-N 2.89Å; E63-E66 PolarHBondContact O-N 3.11Å; E63-T67 WeakPolarHBondContact O-CG2 3.42Å; E63-T67 PolarHBondContact O-N 2.93Å; E63-T67 PolarHBondContact O-OG1 2.89Å
64S92.8Very high93.4Very high67 Ų67106 Ų10647%0.46952%0.524SS..Hα-helixtrans-64.2-34.9173.478.20000112.4Q60 E61 T67 Y68Q60-S64 WeakPolarHBondContact O-CB 3.26Å; Q60-S64 PolarHBondContact O-N 3.14Å; Q60-S64 PolarHBondContact O-OG 3.02Å; E61-S64 PolarHBondContact O-N 3.41Å; E61-S64 PolarHBondContact O-OG 2.97Å; S64-T67 VanDerWaalsContact C-OG1 3.32Å; S64-T67 VanDerWaalsContact CA-OG1 3.31Å; S64-T67 WeakPolarHBondContact CA-OG1 3.42Å; S64-T67 PolarHBondContact O-OG1 3.45Å; S64-Y68 WeakPolarHBondContact O-CB 3.4Å; S64-Y68 PolarHBondContact O-N 3.05Å
65R95Very high93.8Very high168 Ų168104.3 Ų104.363%0.63452%0.52SS*.Hα-helixtrans-76.8-36.1178-163.1170.8-176.6105.6-1.5111.5E61 L62 E63 L69E61-R65 VanDerWaalsContact O-CB 3.31Å; E61-R65 WeakPolarHBondContact O-CB 3.35Å; E61-R65 PolarHBondContact O-N 3.45Å; L62-R65 PolarHBondContact O-N 2.85Å; E63-R65 VanDerWaalsContact C-N 3.3Å; E63-R65 PolarHBondContact O-N 2.89Å; R65-L69 HydrophobicContact CG-CD1 4.45Å; R65-L69 WeakPolarHBondContact O-CB 3.42Å; R65-L69 WeakPolarHBondContact O-CG 3.3Å; R65-L69 PolarHBondContact O-N 2.98Å
66E95.4Very high94.1Very high139 Ų139105.2 Ų105.265%0.6552%0.52SS*.Hα-helixtrans-63.7-47172.9-178.2171.3-165.800111.2L62 E63 L69 Q70L62-E66 WeakPolarHBondContact O-CB 3.36Å; L62-E66 PolarHBondContact O-N 3.03Å; E63-E66 PolarHBondContact O-N 3.11Å; E66-L69 PolarHBondContact O-N 3.19Å; E66-Q70 WeakPolarHBondContact O-CB 3.44Å; E66-Q70 PolarHBondContact O-N 2.86Å
67T94.2Very high94.3Very high77 Ų77104.8 Ų104.847%0.47252%0.516SS..Hα-helixtrans-61.7-44.6175.247.10000111.7E63 S64 L69 Q70 D71E63-T67 WeakPolarHBondContact O-CG2 3.42Å; E63-T67 PolarHBondContact O-N 2.93Å; E63-T67 PolarHBondContact O-OG1 2.89Å; S64-T67 VanDerWaalsContact C-OG1 3.32Å; S64-T67 VanDerWaalsContact CA-OG1 3.31Å; S64-T67 WeakPolarHBondContact CA-OG1 3.42Å; S64-T67 PolarHBondContact O-OG1 3.45Å; T67-L69 PolarHBondContact O-N 3.47Å; T67-Q70 PolarHBondContact O-N 3.02Å; T67-D71 PolarHBondContact O-N 3Å
68Y94.5Very high94.6Very high153 Ų153106.2 Ų106.260%0.652%0.519SS*.Hα-helixtrans-59.2-45173.4177.3-97.4000113S64 Q70 D71 L72S64-Y68 WeakPolarHBondContact O-CB 3.4Å; S64-Y68 PolarHBondContact O-N 3.05Å; Y68-Q70 VanDerWaalsContact C-N 3.33Å; Y68-D71 PolarHBondContact O-N 2.85Å; Y68-L72 HydrophobicContact CE1-CD2 4.48Å; Y68-L72 WeakPolarHBondContact O-CB 3.41Å; Y68-L72 PolarHBondContact O-N 3.4Å
69L95.8Very high94.7Very high98 Ų98110.2 Ų110.251%0.51353%0.528SS..Hα-helixtrans-66.7-35.4177.7-74.8172.6000111.9R65 E66 T67 L72 K73R65-L69 HydrophobicContact CG-CD1 4.45Å; R65-L69 WeakPolarHBondContact O-CB 3.42Å; R65-L69 WeakPolarHBondContact O-CG 3.3Å; R65-L69 PolarHBondContact O-N 2.98Å; E66-L69 PolarHBondContact O-N 3.19Å; T67-L69 PolarHBondContact O-N 3.47Å; L69-L72 PolarHBondContact O-N 3.3Å; L69-K73 WeakPolarHBondContact O-CB 3.34Å; L69-K73 PolarHBondContact O-N 2.92Å
70Q95.7Very high94.9Very high79 Ų79109.5 Ų109.537%0.36952%0.523SS..Hα-helixtrans-68.8-40.5176.4-173.656.843.900111.4E66 T67 Y68 K73 N74E66-Q70 WeakPolarHBondContact O-CB 3.44Å; E66-Q70 PolarHBondContact O-N 2.86Å; T67-Q70 PolarHBondContact O-N 3.02Å; Y68-Q70 VanDerWaalsContact C-N 3.33Å; Q70-K73 PolarHBondContact O-N 3.19Å; Q70-N74 PolarHBondContact NE2-OD1 3.23Å; Q70-N74 WeakPolarHBondContact O-CB 3.35Å; Q70-N74 PolarHBondContact O-N 2.93Å; Q70-N74 PolarHBondContact O-ND2 2.82Å; Q70-N74 PolarHBondContact O-OD1 3.44Å
71D95Very high95Very high110 Ų110110.2 Ų110.259%0.58853%0.526SS*.Hα-helixtrans-65.6-41.3173.3-78.6-16.6000112T67 Y68 N74 S75T67-D71 PolarHBondContact O-N 3Å; Y68-D71 PolarHBondContact O-N 2.85Å; D71-N74 PolarHBondContact O-N 3.36Å; D71-S75 VanDerWaalsContact O-CB 3.31Å; D71-S75 WeakPolarHBondContact O-CB 3.43Å; D71-S75 PolarHBondContact O-N 3.16Å
72L95.7Very high95.2Very high71 Ų71108 Ų10837%0.37252%0.521SS..Hα-helixtrans-62.3-45.2174.3-175.763000111Y68 L69 S75 L76Y68-L72 HydrophobicContact CE1-CD2 4.48Å; Y68-L72 WeakPolarHBondContact O-CB 3.41Å; Y68-L72 PolarHBondContact O-N 3.4Å; L69-L72 PolarHBondContact O-N 3.3Å; L72-S75 WeakPolarHBondContact O-CB 3.23Å; L72-S75 PolarHBondContact O-N 3.34Å; L72-L76 HydrophobicContact CG-CD1 4.23Å; L72-L76 WeakPolarHBondContact O-CB 3.25Å; L72-L76 VanDerWaalsContact O-CG 3.28Å; L72-L76 WeakPolarHBondContact O-CG 3.33Å; L72-L76 PolarHBondContact O-N 3.43Å
73K95.5Very high95.2Very high105 Ų105105.1 Ų105.146%0.45751%0.513SS..Hα-helixtrans-58.6-47.2174.6175.3-179.2171.6-172.40111.2L69 Q70 S75 L76 F77L69-K73 WeakPolarHBondContact O-CB 3.34Å; L69-K73 PolarHBondContact O-N 2.92Å; Q70-K73 PolarHBondContact O-N 3.19Å; K73-S75 VanDerWaalsContact C-N 3.35Å; K73-S75 PolarHBondContact O-N 3.47Å; K73-L76 PolarHBondContact O-N 2.89Å; K73-F77 HydrophobicContact CD-CE2 4.13Å; K73-F77 HydrophobicContact CG-CD2 3.73Å; K73-F77 HydrophobicContact CG-CE2 3.5Å; K73-F77 VanDerWaalsContact CG-CE2 3.5Å; K73-F77 WeakPolarHBondContact O-CD2 3.43Å; K73-F77 PolarHBondContact O-N 2.75Å
74N96Very high95.2Very high65 Ų65104.4 Ų104.435%0.34851%0.51SS..Hα-helixtrans-62.4-41177.4-69.8-18.8000111.9Q70 D71 F77 K78Q70-N74 PolarHBondContact NE2-OD1 3.23Å; Q70-N74 WeakPolarHBondContact O-CB 3.35Å; Q70-N74 PolarHBondContact O-N 2.93Å; Q70-N74 PolarHBondContact O-ND2 2.82Å; Q70-N74 PolarHBondContact O-OD1 3.44Å; D71-N74 PolarHBondContact O-N 3.36Å; N74-F77 PolarHBondContact O-N 2.86Å; N74-K78 WeakPolarHBondContact O-CG 3.33Å; N74-K78 PolarHBondContact O-N 2.86Å
75S96.1Very high95.3Very high62 Ų62109 Ų10943%0.43452%0.518SS..Hα-helixtrans-63.9-43.8175.3-1790000111.9D71 L72 K73 K78 R79D71-S75 VanDerWaalsContact O-CB 3.31Å; D71-S75 WeakPolarHBondContact O-CB 3.43Å; D71-S75 PolarHBondContact O-N 3.16Å; L72-S75 WeakPolarHBondContact O-CB 3.23Å; L72-S75 PolarHBondContact O-N 3.34Å; K73-S75 VanDerWaalsContact C-N 3.35Å; K73-S75 PolarHBondContact O-N 3.47Å; S75-K78 PolarHBondContact O-N 3.28Å; S75-R79 WeakPolarHBondContact O-CG 3.41Å; S75-R79 PolarHBondContact O-N 2.77Å
76L95.9Very high95.4Very high94 Ų94106.5 Ų106.549%0.49251%0.514SS..Hα-helixtrans-64.9-40.9175.7-71.4174.9000111.9L72 K73 R79 M80L72-L76 HydrophobicContact CG-CD1 4.23Å; L72-L76 WeakPolarHBondContact O-CB 3.25Å; L72-L76 VanDerWaalsContact O-CG 3.28Å; L72-L76 WeakPolarHBondContact O-CG 3.33Å; L72-L76 PolarHBondContact O-N 3.43Å; K73-L76 PolarHBondContact O-N 2.89Å; L76-R79 PolarHBondContact O-N 3.39Å; L76-M80 WeakPolarHBondContact O-CB 3.34Å; L76-M80 PolarHBondContact O-N 3.42Å
77F96.5Very high95.4Very high106 Ų106105.4 Ų105.447%0.46551%0.51SS..Hα-helixtrans-61.4-46.3174.5-85.5-60000112.5K73 N74 R79 M80 E81K73-F77 HydrophobicContact CD-CE2 4.13Å; K73-F77 HydrophobicContact CG-CD2 3.73Å; K73-F77 HydrophobicContact CG-CE2 3.5Å; K73-F77 VanDerWaalsContact CG-CE2 3.5Å; K73-F77 WeakPolarHBondContact O-CD2 3.43Å; K73-F77 PolarHBondContact O-N 2.75Å; N74-F77 PolarHBondContact O-N 2.86Å; F77-R79 VanDerWaalsContact C-N 3.3Å; F77-R79 PolarHBondContact O-N 3.21Å; F77-M80 HydrophobicContact CD1-CE 3.95Å; F77-M80 HydrophobicContact CE1-CE 3.92Å; F77-M80 WeakPolarHBondContact O-CB 3.44Å; F77-M80 PolarHBondContact O-N 3.47Å; F77-M80 VanDerWaalsContact O-N 3.13Å; F77-E81 WeakPolarHBondContact O-CB 3.43Å; F77-E81 PolarHBondContact O-N 3.1Å
78K96Very high95.5Very high143 Ų143106.2 Ų106.262%0.62251%0.511SS*.Hα-helixtrans-59.9-40.8175.9-73.3175.5-179.1178.20112N74 S75 E81 V82N74-K78 WeakPolarHBondContact O-CG 3.33Å; N74-K78 PolarHBondContact O-N 2.86Å; S75-K78 PolarHBondContact O-N 3.28Å; K78-E81 PolarHBondContact O-N 3.29Å; K78-V82 VanDerWaalsContact O-CG2 3.27Å; K78-V82 WeakPolarHBondContact O-CG2 3.39Å; K78-V82 PolarHBondContact O-N 2.86Å
79R95.3Very high95.5Very high178 Ų178104.8 Ų104.867%0.67251%0.509SS*.Hα-helixtrans-65.7-39.2175.3-74.7-17964.4-176.9-1.2112.2S75 L76 F77 A83S75-R79 WeakPolarHBondContact O-CG 3.41Å; S75-R79 PolarHBondContact O-N 2.77Å; L76-R79 PolarHBondContact O-N 3.39Å; F77-R79 VanDerWaalsContact C-N 3.3Å; F77-R79 PolarHBondContact O-N 3.21Å; R79-A83 VanDerWaalsContact O-CB 3.32Å; R79-A83 WeakPolarHBondContact O-CB 3.41Å; R79-A83 PolarHBondContact O-N 3.17Å
80M96.1Very high95.5Very high98 Ų98105.4 Ų105.448%0.48351%0.512SS..Hα-helixtrans-65.5-44.7176.4-169.1152.380.100111.1L76 F77 V82 A83 E84L76-M80 WeakPolarHBondContact O-CB 3.34Å; L76-M80 PolarHBondContact O-N 3.42Å; F77-M80 HydrophobicContact CD1-CE 3.95Å; F77-M80 HydrophobicContact CE1-CE 3.92Å; F77-M80 WeakPolarHBondContact O-CB 3.44Å; F77-M80 PolarHBondContact O-N 3.47Å; F77-M80 VanDerWaalsContact O-N 3.13Å; M80-V82 PolarHBondContact O-N 2.97Å; M80-A83 CarbonylContact O-C 3.55Å; M80-A83 PolarHBondContact O-N 3.39Å; M80-A83 VanDerWaalsContact O-N 3.16Å; M80-E84 WeakPolarHBondContact O-CB 3.27Å; M80-E84 WeakPolarHBondContact O-CG 3.37Å; M80-E84 PolarHBondContact O-N 3.15Å
81E95Very high95.5Very high135 Ų135105.3 Ų105.363%0.63151%0.513SS*.Hα-helixtrans-60.8-43.7176.1-172.1178.1-164.200111.8F77 K78 E84 Y85F77-E81 WeakPolarHBondContact O-CB 3.43Å; F77-E81 PolarHBondContact O-N 3.1Å; K78-E81 PolarHBondContact O-N 3.29Å; E81-E84 PolarHBondContact O-N 2.79Å; E81-Y85 WeakPolarHBondContact O-CB 3.35Å; E81-Y85 PolarHBondContact O-N 2.81Å
82V95Very high95.5Very high79 Ų79103.4 Ų103.448%0.47951%0.507SS..Hα-helixtrans-63.8-41.5173.8171.60000111.6K78 M80 Y85 Q86K78-V82 VanDerWaalsContact O-CG2 3.27Å; K78-V82 WeakPolarHBondContact O-CG2 3.39Å; K78-V82 PolarHBondContact O-N 2.86Å; M80-V82 PolarHBondContact O-N 2.97Å; V82-Y85 PolarHBondContact O-N 2.82Å; V82-Q86 WeakPolarHBondContact O-CB 3.38Å; V82-Q86 VanDerWaalsContact O-CG 3.29Å; V82-Q86 WeakPolarHBondContact O-CG 3.3Å; V82-Q86 PolarHBondContact O-N 3.41Å
83A93.9Very high95.5Very high53 Ų53103.6 Ų103.644%0.43851%0.508SS..Hα-helixtrans-66.6-40177.600000112R79 M80 Q86 M87R79-A83 VanDerWaalsContact O-CB 3.32Å; R79-A83 WeakPolarHBondContact O-CB 3.41Å; R79-A83 PolarHBondContact O-N 3.17Å; M80-A83 CarbonylContact O-C 3.55Å; M80-A83 PolarHBondContact O-N 3.39Å; M80-A83 VanDerWaalsContact O-N 3.16Å; A83-Q86 PolarHBondContact O-N 2.93Å; A83-M87 VanDerWaalsContact O-CB 3.31Å; A83-M87 WeakPolarHBondContact O-CB 3.37Å; A83-M87 PolarHBondContact O-N 3.35Å
84E94.8Very high95.4Very high113 Ų113106.6 Ų106.653%0.52852%0.517SS..Hα-helixtrans-63.9-43.9173.8-78.4-179.7-176.200111.3M80 E81 Q86 M87 N88M80-E84 WeakPolarHBondContact O-CB 3.27Å; M80-E84 WeakPolarHBondContact O-CG 3.37Å; M80-E84 PolarHBondContact O-N 3.15Å; E81-E84 PolarHBondContact O-N 2.79Å; E84-Q86 PolarHBondContact O-N 2.71Å; E84-M87 PolarHBondContact O-N 3.1Å; E84-N88 WeakPolarHBondContact O-CB 3.38Å; E84-N88 VanDerWaalsContact O-CG 3.27Å; E84-N88 PolarHBondContact O-N 3.39Å; E84-N88 PolarHBondContact O-ND2 3.31Å
85Y95Very high95.4Very high162 Ų162107.4 Ų107.464%0.63552%0.521SS*.Hα-helixtrans-61.1-44.6175.3179.5-100.6000112.1E81 V82 N88 K89E81-Y85 WeakPolarHBondContact O-CB 3.35Å; E81-Y85 PolarHBondContact O-N 2.81Å; V82-Y85 PolarHBondContact O-N 2.82Å; Y85-N88 PolarHBondContact O-N 3.46Å; Y85-K89 WeakPolarHBondContact O-CB 3.49Å; Y85-K89 PolarHBondContact O-N 2.94Å
86Q95.3Very high95.3Very high116 Ų116109.7 Ų109.754%0.54253%0.525SS..Hα-helixtrans-64.2-42.5176-73.7176-500112.1V82 A83 E84 K89 L90V82-Q86 WeakPolarHBondContact O-CB 3.38Å; V82-Q86 VanDerWaalsContact O-CG 3.29Å; V82-Q86 WeakPolarHBondContact O-CG 3.3Å; V82-Q86 PolarHBondContact O-N 3.41Å; A83-Q86 PolarHBondContact O-N 2.93Å; E84-Q86 PolarHBondContact O-N 2.71Å; Q86-K89 PolarHBondContact O-N 3.39Å; Q86-L90 WeakPolarHBondContact O-CG 3.4Å; Q86-L90 PolarHBondContact O-N 2.95Å
87M95.3Very high95.2Very high116 Ų116111.5 Ų111.557%0.57153%0.531SS*.Hα-helixtrans-61-47.8175.7-178.763.5110.400111A83 E84 K89 L90 I91A83-M87 VanDerWaalsContact O-CB 3.31Å; A83-M87 WeakPolarHBondContact O-CB 3.37Å; A83-M87 PolarHBondContact O-N 3.35Å; E84-M87 PolarHBondContact O-N 3.1Å; M87-K89 VanDerWaalsContact C-N 3.32Å; M87-K89 PolarHBondContact O-N 2.89Å; M87-L90 PolarHBondContact O-N 3.27Å; M87-I91 HydrophobicContact CG-CD1 3.98Å; M87-I91 VanDerWaalsContact O-CG1 3.32Å; M87-I91 WeakPolarHBondContact O-CG1 3.49Å; M87-I91 PolarHBondContact O-N 3.34Å; M87-I91 HydrophobicContact SD-CD1 4.42Å
88N96.6Very high95.1Very high94 Ų94109.7 Ų109.750%0.50353%0.529SS..Hα-helixtrans-61-41177.3-74.4-30.4000111.7E84 Y85 L90 I91 C92E84-N88 WeakPolarHBondContact O-CB 3.38Å; E84-N88 VanDerWaalsContact O-CG 3.27Å; E84-N88 PolarHBondContact O-N 3.39Å; E84-N88 PolarHBondContact O-ND2 3.31Å; Y85-N88 PolarHBondContact O-N 3.46Å; N88-L90 PolarHBondContact O-N 2.83Å; N88-I91 PolarHBondContact O-N 2.94Å; N88-C92 PolarHBondContact O-N 3.01Å; N88-C92 PolarHBondContact O-SG 3.5Å; N88-C92 VanDerWaalsContact O-SG 3.35Å
89K95.7Very high94.9Very high124 Ų124107.8 Ų107.854%0.53952%0.522SS..Hα-helixtrans-62.2-42.5174.6-174.1174.5-179.6179.10112.4Y85 Q86 M87 I91 C92 L93Y85-K89 WeakPolarHBondContact O-CB 3.49Å; Y85-K89 PolarHBondContact O-N 2.94Å; Q86-K89 PolarHBondContact O-N 3.39Å; M87-K89 VanDerWaalsContact C-N 3.32Å; M87-K89 PolarHBondContact O-N 2.89Å; K89-I91 VanDerWaalsContact C-N 3.35Å; K89-C92 PolarHBondContact O-N 3.37Å; K89-L93 HydrophobicContact CG-CD1 4.37Å; K89-L93 WeakPolarHBondContact O-CG 3.49Å; K89-L93 PolarHBondContact O-N 3.46Å
90L94.7Very high94.9Very high111 Ų111105.9 Ų105.958%0.58152%0.521SS*.Hα-helixtrans-65.7-37.2175.9-73.4171.9000112.1Q86 M87 N88 R94Q86-L90 WeakPolarHBondContact O-CG 3.4Å; Q86-L90 PolarHBondContact O-N 2.95Å; M87-L90 PolarHBondContact O-N 3.27Å; N88-L90 PolarHBondContact O-N 2.83Å; L90-R94 WeakPolarHBondContact O-CB 3.23Å; L90-R94 PolarHBondContact O-N 2.86Å
91I96.1Very high94.8Very high76 Ų76104 Ų10439%0.3952%0.521SS..Hα-helixtrans-62.9-46.2174.3-69.7166.3000110.5M87 N88 K89 R94 N95M87-I91 HydrophobicContact CG-CD1 3.98Å; M87-I91 VanDerWaalsContact O-CG1 3.32Å; M87-I91 WeakPolarHBondContact O-CG1 3.49Å; M87-I91 PolarHBondContact O-N 3.34Å; M87-I91 HydrophobicContact SD-CD1 4.42Å; N88-I91 PolarHBondContact O-N 2.94Å; K89-I91 VanDerWaalsContact C-N 3.35Å; I91-R94 PolarHBondContact O-N 3.14Å; I91-N95 WeakPolarHBondContact O-CB 3.38Å; I91-N95 PolarHBondContact O-N 2.84Å; I91-N95 PolarHBondContact O-ND2 2.83Å; I91-N95 PolarHBondContact O-OD1 2.8Å
92C94.8Very high94.7Very high70 Ų70103.4 Ų103.447%0.47352%0.518SS..Hα-helixtrans-60.1-49.2176.9-67.90000112N88 K89 R94 N95 E96N88-C92 PolarHBondContact O-N 3.01Å; N88-C92 PolarHBondContact O-SG 3.5Å; N88-C92 VanDerWaalsContact O-SG 3.35Å; K89-C92 PolarHBondContact O-N 3.37Å; C92-R94 PolarHBondContact O-N 3.18Å; C92-N95 WeakPolarHBondContact O-CB 3.38Å; C92-N95 PolarHBondContact O-N 3.29Å; C92-N95 VanDerWaalsContact O-N 3.1Å; C92-E96 WeakPolarHBondContact O-CG 3.31Å; C92-E96 PolarHBondContact O-N 3.04Å
93L95.1Very high94.7Very high75 Ų75104.8 Ų104.839%0.39352%0.518SS..Hα-helixtrans-60.4-43.6178.4-72.3171.2000112.1K89 N95 E96 E97K89-L93 HydrophobicContact CG-CD1 4.37Å; K89-L93 WeakPolarHBondContact O-CG 3.49Å; K89-L93 PolarHBondContact O-N 3.46Å; L93-N95 VanDerWaalsContact C-N 3.3Å; L93-N95 PolarHBondContact O-N 3.49Å; L93-E96 PolarHBondContact O-N 3.37Å; L93-E97 WeakPolarHBondContact O-CG 3.36Å; L93-E97 PolarHBondContact O-N 3.39Å
94R94.3Very high94.7Very high168 Ų168104.6 Ų104.663%0.63452%0.516SS*.Hα-helixtrans-60.1-42.5175-173.9-151.2169.1-166.7-3.7111L90 I91 C92 E97 T98L90-R94 WeakPolarHBondContact O-CB 3.23Å; L90-R94 PolarHBondContact O-N 2.86Å; I91-R94 PolarHBondContact O-N 3.14Å; C92-R94 PolarHBondContact O-N 3.18Å; R94-E97 PolarHBondContact O-N 2.8Å; R94-T98 HydrophobicContact CG-CG2 4.48Å; R94-T98 VanDerWaalsContact O-CG2 3.25Å; R94-T98 WeakPolarHBondContact O-CG2 3.44Å; R94-T98 PolarHBondContact O-N 3.32Å; R94-T98 PolarHBondContact O-OG1 2.94Å
95N95Very high94.7Very high83 Ų83101.6 Ų101.644%0.44451%0.508SS..Hα-helixtrans-64.4-43.9179.4-70-16.7000111.3I91 C92 L93 T98 E99I91-N95 WeakPolarHBondContact O-CB 3.38Å; I91-N95 PolarHBondContact O-N 2.84Å; I91-N95 PolarHBondContact O-ND2 2.83Å; I91-N95 PolarHBondContact O-OD1 2.8Å; C92-N95 WeakPolarHBondContact O-CB 3.38Å; C92-N95 PolarHBondContact O-N 3.29Å; C92-N95 VanDerWaalsContact O-N 3.1Å; L93-N95 VanDerWaalsContact C-N 3.3Å; L93-N95 PolarHBondContact O-N 3.49Å; N95-T98 WeakPolarHBondContact CA-OG1 3.32Å; N95-T98 PolarHBondContact O-N 3.2Å; N95-T98 PolarHBondContact O-OG1 3.44Å; N95-E99 WeakPolarHBondContact O-CB 3.31Å; N95-E99 PolarHBondContact O-N 3.4Å
96E94.3Very high94.6Very high109 Ų10999.7 Ų99.751%0.50950%0.504SS..Hα-helixtrans-58.4-50174.4-71.6169.6-172.700111.3C92 L93 T98 E99 E100C92-E96 WeakPolarHBondContact O-CG 3.31Å; C92-E96 PolarHBondContact O-N 3.04Å; L93-E96 PolarHBondContact O-N 3.37Å; E96-T98 VanDerWaalsContact C-N 3.31Å; E96-T98 PolarHBondContact O-N 2.85Å; E96-E99 PolarHBondContact O-N 2.88Å; E96-E99 VanDerWaalsContact O-N 3.14Å; E96-E100 PolarHBondContact O-N 2.91Å
97E93.8Very high94.6Very high133 Ų13399.9 Ų99.962%0.62151%0.508SS*.Hα-helixtrans-59.8-39.4176.3-73.5178.1177.600112.2L93 R94 A101L93-E97 WeakPolarHBondContact O-CG 3.36Å; L93-E97 PolarHBondContact O-N 3.39Å; R94-E97 PolarHBondContact O-N 2.8Å; E97-A101 VanDerWaalsContact O-CB 3.29Å; E97-A101 WeakPolarHBondContact O-CB 3.47Å; E97-A101 PolarHBondContact O-N 2.86Å
98T93.9Very high94.6Very high68 Ų6899.5 Ų99.542%0.41751%0.508SS..Hα-helixtrans-68.2-36176.556.20000112.6R94 N95 E96 Q102R94-T98 HydrophobicContact CG-CG2 4.48Å; R94-T98 VanDerWaalsContact O-CG2 3.25Å; R94-T98 WeakPolarHBondContact O-CG2 3.44Å; R94-T98 PolarHBondContact O-N 3.32Å; R94-T98 PolarHBondContact O-OG1 2.94Å; N95-T98 WeakPolarHBondContact CA-OG1 3.32Å; N95-T98 PolarHBondContact O-N 3.2Å; N95-T98 PolarHBondContact O-OG1 3.44Å; E96-T98 VanDerWaalsContact C-N 3.31Å; E96-T98 PolarHBondContact O-N 2.85Å; T98-Q102 WeakPolarHBondContact O-CB 3.39Å; T98-Q102 PolarHBondContact O-N 2.77Å
99E93.6Very high94.5Very high103 Ų103102.3 Ų102.348%0.48151%0.511SS..Hα-helixtrans-70.1-42177.6-163.9-171.6149.800111N95 E96 Q102 K103N95-E99 WeakPolarHBondContact O-CB 3.31Å; N95-E99 PolarHBondContact O-N 3.4Å; E96-E99 PolarHBondContact O-N 2.88Å; E96-E99 VanDerWaalsContact O-N 3.14Å; E99-Q102 PolarHBondContact O-N 2.97Å; E99-K103 WeakPolarHBondContact O-CG 3.47Å; E99-K103 PolarHBondContact O-N 2.89Å; E99-K103 WeakPolarHBondContact OE1-CE 3.43Å; E99-K103 IonicContact OE1-NZ 3.94Å; E99-K103 PolarHBondContact OE1-NZ 2.89Å
100E93.8Very high94.4Very high137 Ų13799.1 Ų99.164%0.6451%0.505SS*.Hα-helixtrans-62.1-44.7173.4-73-173174.200111.8E96 Q102 K103 A104E96-E100 PolarHBondContact O-N 2.91Å; E100-Q102 VanDerWaalsContact C-N 3.29Å; E100-Q102 PolarHBondContact O-N 3.43Å; E100-K103 PolarHBondContact O-N 2.88Å; E100-A104 WeakPolarHBondContact O-CB 3.34Å; E100-A104 PolarHBondContact O-N 2.74Å
101A93.6Very high94.5Very high59 Ų5996.1 Ų96.149%0.48849%0.493SS..Hα-helixtrans-61.7-37.417500000112E97 S105E97-A101 VanDerWaalsContact O-CB 3.29Å; E97-A101 WeakPolarHBondContact O-CB 3.47Å; E97-A101 PolarHBondContact O-N 2.86Å; A101-S105 VanDerWaalsContact O-CB 3.32Å; A101-S105 WeakPolarHBondContact O-CB 3.32Å; A101-S105 PolarHBondContact O-N 3.42Å
102Q94.1Very high94.4Very high123 Ų12396.4 Ų96.458%0.57549%0.494SS*.Hα-helixtrans-67.6-44.9176.4-173.8170.2-12.600111.8T98 E99 E100 S105 E106T98-Q102 WeakPolarHBondContact O-CB 3.39Å; T98-Q102 PolarHBondContact O-N 2.77Å; E99-Q102 PolarHBondContact O-N 2.97Å; E100-Q102 VanDerWaalsContact C-N 3.29Å; E100-Q102 PolarHBondContact O-N 3.43Å; Q102-S105 WeakPolarHBondContact O-CB 3.22Å; Q102-S105 PolarHBondContact O-N 3.15Å; Q102-E106 WeakPolarHBondContact O-CB 3.22Å; Q102-E106 PolarHBondContact O-N 3.41Å
103K94.5Very high94.4Very high107 Ų10795.8 Ų95.847%0.46549%0.494SS..Hα-helixtrans-59.7-45.5174.2-73.3170.9-175.6163.40111.4E99 E100 S105 E106 I107E99-K103 WeakPolarHBondContact O-CG 3.47Å; E99-K103 PolarHBondContact O-N 2.89Å; E99-K103 WeakPolarHBondContact OE1-CE 3.43Å; E99-K103 IonicContact OE1-NZ 3.94Å; E99-K103 PolarHBondContact OE1-NZ 2.89Å; E100-K103 PolarHBondContact O-N 2.88Å; K103-S105 PolarHBondContact O-N 3.2Å; K103-E106 PolarHBondContact O-N 2.74Å; K103-I107 WeakPolarHBondContact O-CG1 3.3Å; K103-I107 PolarHBondContact O-N 3.34Å
104A94.8Very high94.3Very high50 Ų5098.3 Ų98.341%0.41350%0.502SS..Hα-helixtrans-61.8-42.617600000112.1E100 E106 I107 L108E100-A104 WeakPolarHBondContact O-CB 3.34Å; E100-A104 PolarHBondContact O-N 2.74Å; A104-E106 VanDerWaalsContact C-N 3.33Å; A104-E106 PolarHBondContact O-N 2.78Å; A104-I107 PolarHBondContact O-N 3.42Å; A104-L108 WeakPolarHBondContact O-CG 3.22Å; A104-L108 PolarHBondContact O-N 2.89Å
105S93.5Very high94.3Very high49 Ų4995.1 Ų95.134%0.34350%0.497SS..Hα-helixtrans-62.2-37.9175-1790000112.6A101 Q102 K103 L108 R109A101-S105 VanDerWaalsContact O-CB 3.32Å; A101-S105 WeakPolarHBondContact O-CB 3.32Å; A101-S105 PolarHBondContact O-N 3.42Å; Q102-S105 WeakPolarHBondContact O-CB 3.22Å; Q102-S105 PolarHBondContact O-N 3.15Å; K103-S105 PolarHBondContact O-N 3.2Å; S105-L108 PolarHBondContact O-N 3.31Å; S105-R109 WeakPolarHBondContact O-CB 3.37Å; S105-R109 WeakPolarHBondContact O-CG 3.37Å; S105-R109 PolarHBondContact O-N 2.94Å; S105-R109 PolarHBondContact O-NE 3.27Å; S105-R109 PolarHBondContact OG-NH2 3.41Å
106E94.6Very high94.3Very high122 Ų12299.5 Ų99.557%0.5751%0.508SS*.Hα-helixtrans-69.4-41.6177.6-168.8164.4-161.200112Q102 K103 A104 L108 R109 S110Q102-E106 WeakPolarHBondContact O-CB 3.22Å; Q102-E106 PolarHBondContact O-N 3.41Å; K103-E106 PolarHBondContact O-N 2.74Å; A104-E106 VanDerWaalsContact C-N 3.33Å; A104-E106 PolarHBondContact O-N 2.78Å; E106-L108 PolarHBondContact O-N 3.4Å; E106-R109 PolarHBondContact O-N 3.18Å; E106-S110 WeakPolarHBondContact O-CB 3.35Å; E106-S110 PolarHBondContact O-N 2.9Å
107I94.9Very high94.3Very high121 Ų12199.7 Ų99.762%0.62151%0.509SS*.Hα-helixtrans-60.4-44.8172.9-67.3166.7000110.8K103 A104 S110 S111K103-I107 WeakPolarHBondContact O-CG1 3.3Å; K103-I107 PolarHBondContact O-N 3.34Å; A104-I107 PolarHBondContact O-N 3.42Å; I107-S110 PolarHBondContact O-N 2.91Å; I107-S111 PolarHBondContact O-N 2.84Å
108L94.4Very high94.4Very high108 Ų108100.5 Ų100.557%0.56551%0.506SS*.Hα-helixtrans-64.8-40.2176.7-73173.2000112.3A104 S105 E106 S110 S111 I112A104-L108 WeakPolarHBondContact O-CG 3.22Å; A104-L108 PolarHBondContact O-N 2.89Å; S105-L108 PolarHBondContact O-N 3.31Å; E106-L108 PolarHBondContact O-N 3.4Å; L108-S110 VanDerWaalsContact C-N 3.34Å; L108-S110 PolarHBondContact O-N 3.25Å; L108-S111 PolarHBondContact O-N 3.46Å; L108-S111 PolarHBondContact O-OG 2.86Å; L108-I112 WeakPolarHBondContact O-CB 3.35Å; L108-I112 VanDerWaalsContact O-CG1 3.25Å; L108-I112 WeakPolarHBondContact O-CG1 3.2Å; L108-I112 PolarHBondContact O-N 3.34Å
109R95.2Very high94.4Very high152 Ų152104.8 Ų104.857%0.57452%0.516SS*.Hα-helixtrans-62.9-41.8174.4-79.7-176.2-83.1-177.7-2.2111.6S105 E106 I112 A113S105-R109 WeakPolarHBondContact O-CB 3.37Å; S105-R109 WeakPolarHBondContact O-CG 3.37Å; S105-R109 PolarHBondContact O-N 2.94Å; S105-R109 PolarHBondContact O-NE 3.27Å; S105-R109 PolarHBondContact OG-NH2 3.41Å; E106-R109 PolarHBondContact O-N 3.18Å; R109-I112 PolarHBondContact O-N 3.39Å; R109-A113 WeakPolarHBondContact O-CB 3.26Å; R109-A113 PolarHBondContact O-N 3.46Å
110S94.1Very high94.5Very high57 Ų57103.4 Ų103.440%0.39951%0.51SS..Hα-helixtrans-63.4-42.5175.3-173.70000112.2E106 I107 L108 A113 K114E106-S110 WeakPolarHBondContact O-CB 3.35Å; E106-S110 PolarHBondContact O-N 2.9Å; I107-S110 PolarHBondContact O-N 2.91Å; L108-S110 VanDerWaalsContact C-N 3.34Å; L108-S110 PolarHBondContact O-N 3.25Å; S110-A113 PolarHBondContact O-N 2.83Å; S110-K114 WeakPolarHBondContact O-CG 3.31Å; S110-K114 PolarHBondContact O-N 3.47Å
111S95.5Very high94.5Very high49 Ų4999.7 Ų99.734%0.34350%0.497SS..Hα-helixtrans-67.3-40.6178.374.40000112.4I107 L108 K114 L115I107-S111 PolarHBondContact O-N 2.84Å; L108-S111 PolarHBondContact O-N 3.46Å; L108-S111 PolarHBondContact O-OG 2.86Å; S111-K114 PolarHBondContact O-N 3.27Å; S111-L115 WeakPolarHBondContact O-CG 3.36Å; S111-L115 PolarHBondContact O-N 3.03Å
112I94Very high94.6Very high81 Ų81101.1 Ų101.142%0.41550%0.496SS..Hα-helixtrans-63.1-43.1174.1-69.7167.3000110.8L108 R109 K114 L115 R116L108-I112 WeakPolarHBondContact O-CB 3.35Å; L108-I112 VanDerWaalsContact O-CG1 3.25Å; L108-I112 WeakPolarHBondContact O-CG1 3.2Å; L108-I112 PolarHBondContact O-N 3.34Å; R109-I112 PolarHBondContact O-N 3.39Å; I112-K114 PolarHBondContact O-N 2.9Å; I112-L115 PolarHBondContact O-N 2.86Å; I112-R116 HydrophobicContact CG2-CG 4.48Å; I112-R116 WeakPolarHBondContact O-CG 3.32Å; I112-R116 PolarHBondContact O-N 3.35Å
113A94.7Very high94.7Very high57 Ų57100 Ų10047%0.47149%0.49SS..Hα-helixtrans-60.4-45.4176.600000111.6R109 S110 L115 R116 E117R109-A113 WeakPolarHBondContact O-CB 3.26Å; R109-A113 PolarHBondContact O-N 3.46Å; S110-A113 PolarHBondContact O-N 2.83Å; A113-L115 VanDerWaalsContact C-N 3.32Å; A113-L115 PolarHBondContact O-N 3.38Å; A113-R116 PolarHBondContact O-N 3.5Å; A113-E117 PolarHBondContact O-N 3.32Å
114K94.4Very high94.6Very high129 Ų129101.4 Ų101.456%0.56150%0.496SS*.Hα-helixtrans-63-34.6175.4-70.4175.6-174.8-179.20113.2S110 S111 I112 R118S110-K114 WeakPolarHBondContact O-CG 3.31Å; S110-K114 PolarHBondContact O-N 3.47Å; S111-K114 PolarHBondContact O-N 3.27Å; I112-K114 PolarHBondContact O-N 2.9Å; K114-R118 WeakPolarHBondContact O-CG 3.38Å; K114-R118 PolarHBondContact O-N 3.47Å; K114-R118 VanDerWaalsContact O-N 3.12Å
115L94.4Very high94.6Very high101 Ų101103.8 Ų103.853%0.52950%0.499SS..Hα-helixtrans-70.8-39.9175-76.3169.6000112.1S111 I112 A113 R118 Y119S111-L115 WeakPolarHBondContact O-CG 3.36Å; S111-L115 PolarHBondContact O-N 3.03Å; I112-L115 PolarHBondContact O-N 2.86Å; A113-L115 VanDerWaalsContact C-N 3.32Å; A113-L115 PolarHBondContact O-N 3.38Å; L115-R118 PolarHBondContact O-N 3.05Å; L115-Y119 WeakPolarHBondContact O-CB 3.44Å; L115-Y119 PolarHBondContact O-N 3.4Å
116R94.6Very high94.6Very high175 Ų175106.5 Ų106.566%0.6651%0.508SS*.Hα-helixtrans-62.9-43.7174.6-73.9176.9177-178.5-0.7111.7I112 A113 Y119 I120I112-R116 HydrophobicContact CG2-CG 4.48Å; I112-R116 WeakPolarHBondContact O-CG 3.32Å; I112-R116 PolarHBondContact O-N 3.35Å; A113-R116 PolarHBondContact O-N 3.5Å; R116-Y119 PolarHBondContact O-N 2.91Å; R116-I120 VanDerWaalsContact O-CG1 3.3Å; R116-I120 WeakPolarHBondContact O-CG1 3.42Å; R116-I120 PolarHBondContact O-N 3.45Å
117E94.3Very high94.6Very high113 Ų113105.1 Ų105.153%0.52850%0.502SS..Hα-helixtrans-62.7-46.4177.3-168.859.3-154.200111.2A113 Y119 I120 V121A113-E117 PolarHBondContact O-N 3.32Å; E117-Y119 PolarHBondContact O-N 2.84Å; E117-I120 PolarHBondContact O-N 2.95Å; E117-I120 VanDerWaalsContact O-N 3.15Å; E117-V121 WeakPolarHBondContact O-CG2 3.28Å; E117-V121 PolarHBondContact O-N 3.27Å
118R94.5Very high94.5Very high150 Ų150103.1 Ų103.157%0.56650%0.499SS*.Hα-helixtrans-56.9-46.5173.6-81.7-172.9-79.5-158.60.6112.4K114 L115 I120 V121 D122K114-R118 WeakPolarHBondContact O-CG 3.38Å; K114-R118 PolarHBondContact O-N 3.47Å; K114-R118 VanDerWaalsContact O-N 3.12Å; L115-R118 PolarHBondContact O-N 3.05Å; R118-I120 VanDerWaalsContact C-N 3.31Å; R118-I120 PolarHBondContact O-N 2.74Å; R118-V121 PolarHBondContact O-N 3.18Å; R118-D122 WeakPolarHBondContact O-CB 3.37Å; R118-D122 VanDerWaalsContact O-CG 3.23Å; R118-D122 PolarHBondContact O-N 3.44Å
119Y95.1Very high94.5Very high158 Ų158103.4 Ų103.462%0.6250%0.496SS*.Hα-helixtrans-59.5-39.7176.6175-96.8000112.7L115 R116 E117 K123L115-Y119 WeakPolarHBondContact O-CB 3.44Å; L115-Y119 PolarHBondContact O-N 3.4Å; R116-Y119 PolarHBondContact O-N 2.91Å; E117-Y119 PolarHBondContact O-N 2.84Å; Y119-K123 HydrophobicContact CE1-CD 4.39Å; Y119-K123 WeakPolarHBondContact O-CB 3.41Å; Y119-K123 PolarHBondContact O-N 3.09Å
120I95.3Very high94.5Very high73 Ų73100.6 Ų100.637%0.37449%0.491SS..Hα-helixtrans-66.6-42.7177.5-69.9165.3000111R116 E117 R118 K124R116-I120 VanDerWaalsContact O-CG1 3.3Å; R116-I120 WeakPolarHBondContact O-CG1 3.42Å; R116-I120 PolarHBondContact O-N 3.45Å; E117-I120 PolarHBondContact O-N 2.95Å; E117-I120 VanDerWaalsContact O-N 3.15Å; R118-I120 VanDerWaalsContact C-N 3.31Å; R118-I120 PolarHBondContact O-N 2.74Å; I120-K124 HydrophobicContact CG2-CD 4.46Å; I120-K124 WeakPolarHBondContact O-CG 3.27Å; I120-K124 PolarHBondContact O-N 3.24Å
121V94.2Very high94.3Very high60 Ų60101 Ų10136%0.36449%0.493SS..Hα-helixtrans-63.6-51.7176.7173.90000110.4E117 R118 K123 K124 E125E117-V121 WeakPolarHBondContact O-CG2 3.28Å; E117-V121 PolarHBondContact O-N 3.27Å; R118-V121 PolarHBondContact O-N 3.18Å; V121-K123 VanDerWaalsContact C-N 3.27Å; V121-K123 PolarHBondContact O-N 3.38Å; V121-K124 PolarHBondContact O-N 3.29Å; V121-K124 VanDerWaalsContact O-N 3.09Å; V121-E125 PolarHBondContact O-N 3.48Å
122D95Very high94.2Very high88 Ų88101.5 Ų101.547%0.47150%0.496SS..Hα-helixtrans-58.3-41.1178.8-67.6-13.3000111.3R118 E125 L126R118-D122 WeakPolarHBondContact O-CB 3.37Å; R118-D122 VanDerWaalsContact O-CG 3.23Å; R118-D122 PolarHBondContact O-N 3.44Å; D122-E125 PolarHBondContact O-N 3.47Å; D122-L126 WeakPolarHBondContact O-CB 3.43Å; D122-L126 VanDerWaalsContact O-CG 3.31Å; D122-L126 WeakPolarHBondContact O-CG 3.49Å; D122-L126 PolarHBondContact O-N 3.29Å
123K95.9Very high94.1Very high100 Ų100101.8 Ų101.844%0.43550%0.498SS..Hα-helixtrans-60.6-48.1175.1179.5179.5170.2-179.10111.6Y119 V121 E125 L126 E127Y119-K123 HydrophobicContact CE1-CD 4.39Å; Y119-K123 WeakPolarHBondContact O-CB 3.41Å; Y119-K123 PolarHBondContact O-N 3.09Å; V121-K123 VanDerWaalsContact C-N 3.27Å; V121-K123 PolarHBondContact O-N 3.38Å; K123-E125 VanDerWaalsContact C-N 3.34Å; K123-E125 PolarHBondContact O-N 2.87Å; K123-L126 PolarHBondContact O-N 2.87Å; K123-E127 WeakPolarHBondContact CE-OE1 3.37Å; K123-E127 HydrophobicContact CG-CG 4.48Å; K123-E127 IonicContact NZ-OE1 2.68Å; K123-E127 WeakPolarHBondContact O-CB 3.43Å; K123-E127 VanDerWaalsContact O-CG 3.32Å; K123-E127 WeakPolarHBondContact O-CG 3.31Å; K123-E127 PolarHBondContact O-N 3.3Å
124K94.1Very high94Very high137 Ų137104.1 Ų104.160%0.59650%0.499SS*.Hα-helixtrans-62.4-40.3177.5-77.1178.9178.5177.90112I120 V121 E127 S128I120-K124 HydrophobicContact CG2-CD 4.46Å; I120-K124 WeakPolarHBondContact O-CG 3.27Å; I120-K124 PolarHBondContact O-N 3.24Å; V121-K124 PolarHBondContact O-N 3.29Å; V121-K124 VanDerWaalsContact O-N 3.09Å; K124-E127 PolarHBondContact O-N 3.49Å; K124-S128 WeakPolarHBondContact O-CB 3.39Å; K124-S128 PolarHBondContact O-N 2.99Å
125E92.9Very high93.8Very high100 Ų100103 Ų10347%0.46750%0.499SS..Hα-helixtrans-64.4-41.7176.3-73.1-171.9-175.800112.1V121 D122 K123 S128 K129V121-E125 PolarHBondContact O-N 3.48Å; D122-E125 PolarHBondContact O-N 3.47Å; K123-E125 VanDerWaalsContact C-N 3.34Å; K123-E125 PolarHBondContact O-N 2.87Å; E125-S128 PolarHBondContact O-N 3.43Å; E125-K129 WeakPolarHBondContact O-CG 3.46Å; E125-K129 PolarHBondContact O-N 2.85Å
126L94Very high93.7Very high105 Ų105102.6 Ų102.655%0.5550%0.501SS..Hα-helixtrans-66.8-43175.9-72.5171.9000111.9D122 K123 S128 K129 I130D122-L126 WeakPolarHBondContact O-CB 3.43Å; D122-L126 VanDerWaalsContact O-CG 3.31Å; D122-L126 WeakPolarHBondContact O-CG 3.49Å; D122-L126 PolarHBondContact O-N 3.29Å; K123-L126 PolarHBondContact O-N 2.87Å; L126-S128 VanDerWaalsContact C-N 3.33Å; L126-S128 PolarHBondContact O-N 3.04Å; L126-K129 PolarHBondContact O-N 3.13Å; L126-I130 VanDerWaalsContact O-CG1 3.29Å; L126-I130 WeakPolarHBondContact O-CG1 3.31Å; L126-I130 PolarHBondContact O-N 3.37Å
127E95.6Very high93.4Very high93 Ų93101.7 Ų101.744%0.43550%0.499SS..Hα-helixtrans-59.5-43.4174.2-75170.8168.900111.3K123 K124 I130 C131K123-E127 WeakPolarHBondContact CE-OE1 3.37Å; K123-E127 HydrophobicContact CG-CG 4.48Å; K123-E127 IonicContact NZ-OE1 2.68Å; K123-E127 WeakPolarHBondContact O-CB 3.43Å; K123-E127 VanDerWaalsContact O-CG 3.32Å; K123-E127 WeakPolarHBondContact O-CG 3.31Å; K123-E127 PolarHBondContact O-N 3.3Å; K124-E127 PolarHBondContact O-N 3.49Å; E127-I130 PolarHBondContact O-N 2.82Å; E127-C131 PolarHBondContact O-N 2.85Å; E127-C131 PolarHBondContact O-SG 3.25Å
128S93Very high93.3Very high79 Ų79102.2 Ų102.255%0.55250%0.501SS*.Hα-helixtrans-64-40.6175.4-179.20000112.5K124 E125 L126 C131 S132K124-S128 WeakPolarHBondContact O-CB 3.39Å; K124-S128 PolarHBondContact O-N 2.99Å; E125-S128 PolarHBondContact O-N 3.43Å; L126-S128 VanDerWaalsContact C-N 3.33Å; L126-S128 PolarHBondContact O-N 3.04Å; S128-C131 PolarHBondContact O-N 3.41Å; S128-S132 PolarHBondContact O-N 2.96Å
129K94.4Very high93.2Very high115 Ų11596.8 Ų96.850%0.549%0.492SS..Hα-helixtrans-63.8-43.8175.1-75.1170.6-174.4167.30111.2E125 L126 C131 S132 I133E125-K129 WeakPolarHBondContact O-CG 3.46Å; E125-K129 PolarHBondContact O-N 2.85Å; L126-K129 PolarHBondContact O-N 3.13Å; K129-C131 PolarHBondContact O-N 2.92Å; K129-S132 PolarHBondContact O-N 3.49Å; K129-S132 PolarHBondContact O-OG 2.93Å; K129-I133 VanDerWaalsContact O-CG1 3.3Å; K129-I133 WeakPolarHBondContact O-CG1 3.33Å; K129-I133 PolarHBondContact O-N 3.44Å
130I93.4Very high93.1Very high93 Ų9395.4 Ų95.448%0.47749%0.486SS..Hα-helixtrans-59.6-47.1176.5-70.5166.5000110.7L126 E127 S132 I133 Q134L126-I130 VanDerWaalsContact O-CG1 3.29Å; L126-I130 WeakPolarHBondContact O-CG1 3.31Å; L126-I130 PolarHBondContact O-N 3.37Å; E127-I130 PolarHBondContact O-N 2.82Å; I130-S132 PolarHBondContact O-N 2.87Å; I130-I133 PolarHBondContact O-N 3.05Å; I130-Q134 HydrophobicContact CG2-CG 4.45Å; I130-Q134 WeakPolarHBondContact O-CG 3.49Å; I130-Q134 PolarHBondContact O-N 3.05Å
131C91.8Very high92.9Very high65 Ų6596.5 Ų96.544%0.43949%0.491SS..Hα-helixtrans-59.3-47176.8-64.90000111.2E127 S128 K129 I133 Q134 D135E127-C131 PolarHBondContact O-N 2.85Å; E127-C131 PolarHBondContact O-SG 3.25Å; S128-C131 PolarHBondContact O-N 3.41Å; K129-C131 PolarHBondContact O-N 2.92Å; C131-I133 VanDerWaalsContact C-N 3.27Å; C131-I133 PolarHBondContact O-N 3.28Å; C131-Q134 WeakPolarHBondContact O-CB 3.29Å; C131-Q134 PolarHBondContact O-N 3.22Å; C131-Q134 VanDerWaalsContact O-N 3.15Å; C131-D135 VanDerWaalsContact O-CG 3.27Å; C131-D135 PolarHBondContact O-N 3.49Å
132S91.9Very high92.8Very high59 Ų5997.5 Ų97.541%0.41350%0.497SS..Hα-helixtrans-60.2-38.1178.773.60000112.8S128 K129 I130 T136S128-S132 PolarHBondContact O-N 2.96Å; K129-S132 PolarHBondContact O-N 3.49Å; K129-S132 PolarHBondContact O-OG 2.93Å; I130-S132 PolarHBondContact O-N 2.87Å; S132-T136 VanDerWaalsContact O-CG2 3.27Å; S132-T136 WeakPolarHBondContact O-CG2 3.5Å; S132-T136 PolarHBondContact O-N 3.38Å; S132-T136 VanDerWaalsContact O-N 3.1Å; S132-T136 PolarHBondContact O-OG1 3.45Å
133I91.5Very high92.6Very high88 Ų8897.8 Ų97.845%0.45150%0.496SS..Hα-helixtrans-68.3-44177.6-70.8168.2000110K129 I130 C131 T136 Y137K129-I133 VanDerWaalsContact O-CG1 3.3Å; K129-I133 WeakPolarHBondContact O-CG1 3.33Å; K129-I133 PolarHBondContact O-N 3.44Å; I130-I133 PolarHBondContact O-N 3.05Å; C131-I133 VanDerWaalsContact C-N 3.27Å; C131-I133 PolarHBondContact O-N 3.28Å; I133-T136 PolarHBondContact O-N 2.77Å; I133-T136 PolarHBondContact O-OG1 3.14Å; I133-Y137 HydrophobicContact CG2-CD2 3.54Å; I133-Y137 HydrophobicContact CG2-CE2 3.41Å; I133-Y137 VanDerWaalsContact CG2-CE2 3.41Å; I133-Y137 VanDerWaalsContact O-CD2 3.23Å; I133-Y137 WeakPolarHBondContact O-CD2 3.11Å; I133-Y137 PolarHBondContact O-N 3.27Å
134Q93.4Very high92.4Very high105 Ų10597 Ų9749%0.49150%0.496SS..Hα-helixtrans-58.3-48.7175.4-73.9173.3-33.900111.5I130 C131 T136 Y137 E138I130-Q134 HydrophobicContact CG2-CG 4.45Å; I130-Q134 WeakPolarHBondContact O-CG 3.49Å; I130-Q134 PolarHBondContact O-N 3.05Å; C131-Q134 WeakPolarHBondContact O-CB 3.29Å; C131-Q134 PolarHBondContact O-N 3.22Å; C131-Q134 VanDerWaalsContact O-N 3.15Å; Q134-T136 VanDerWaalsContact C-N 3.29Å; Q134-T136 PolarHBondContact O-N 3.35Å; Q134-Y137 PolarHBondContact O-N 3.26Å; Q134-Y137 VanDerWaalsContact O-N 3.12Å; Q134-E138 WeakPolarHBondContact O-CB 3.07Å; Q134-E138 WeakPolarHBondContact O-CG 3.42Å; Q134-E138 PolarHBondContact O-N 2.74Å
135D91.4Very high92.4Very high107 Ų10794.7 Ų94.757%0.57249%0.49SS*.Hα-helixtrans-58.1-41.3178.1-65.5-20.8000111.6C131 G139C131-D135 VanDerWaalsContact O-CG 3.27Å; C131-D135 PolarHBondContact O-N 3.49Å; D135-G139 PolarHBondContact O-N 3.41Å
136T91.3Very high92.4Very high92 Ų9294.5 Ų94.556%0.56449%0.493SS*.Hα-helixtrans-66.7-39.717760.30000113S132 I133 Q134 R140S132-T136 VanDerWaalsContact O-CG2 3.27Å; S132-T136 WeakPolarHBondContact O-CG2 3.5Å; S132-T136 PolarHBondContact O-N 3.38Å; S132-T136 VanDerWaalsContact O-N 3.1Å; S132-T136 PolarHBondContact O-OG1 3.45Å; I133-T136 PolarHBondContact O-N 2.77Å; I133-T136 PolarHBondContact O-OG1 3.14Å; Q134-T136 VanDerWaalsContact C-N 3.29Å; Q134-T136 PolarHBondContact O-N 3.35Å; T136-R140 WeakPolarHBondContact O-CB 3.37Å; T136-R140 PolarHBondContact O-N 3.13Å
137Y88.5Confident92.4Very high155 Ų15594.2 Ų94.261%0.60849%0.491SS*.Hα-helixtrans-72.3-37177.6-79.7-62.8000111.8I133 Q134 R140 I141I133-Y137 HydrophobicContact CG2-CD2 3.54Å; I133-Y137 HydrophobicContact CG2-CE2 3.41Å; I133-Y137 VanDerWaalsContact CG2-CE2 3.41Å; I133-Y137 VanDerWaalsContact O-CD2 3.23Å; I133-Y137 WeakPolarHBondContact O-CD2 3.11Å; I133-Y137 PolarHBondContact O-N 3.27Å; Q134-Y137 PolarHBondContact O-N 3.26Å; Q134-Y137 VanDerWaalsContact O-N 3.12Å; Y137-R140 PolarHBondContact O-N 3.42Å; Y137-I141 WeakPolarHBondContact O-CB 3.37Å; Y137-I141 WeakPolarHBondContact O-CD1 3.49Å; Y137-I141 WeakPolarHBondContact O-CG1 3.43Å; Y137-I141 PolarHBondContact O-N 3.4Å
138E93Very high92.2Very high124 Ų12494.2 Ų94.258%0.57949%0.493SS*.Hα-helixtrans-62.6-45.4171.7-74.9-175.8-176.900111.2Q134 R140 I141 T142Q134-E138 WeakPolarHBondContact O-CB 3.07Å; Q134-E138 WeakPolarHBondContact O-CG 3.42Å; Q134-E138 PolarHBondContact O-N 2.74Å; E138-R140 VanDerWaalsContact C-N 3.34Å; E138-R140 PolarHBondContact O-N 3.32Å; E138-I141 PolarHBondContact O-N 3.19Å; E138-T142 WeakPolarHBondContact O-CG2 3.36Å; E138-T142 PolarHBondContact O-N 3.11Å; E138-T142 PolarHBondContact O-OG1 2.89Å
139G91.8Very high92.1Very high36 Ų3698.9 Ų98.937%0.37150%0.499SS..Hα-helixtrans-54.6-47.7170.800000112.1D135 I141 T142 E143D135-G139 PolarHBondContact O-N 3.41Å; G139-I141 PolarHBondContact O-N 3Å; G139-T142 PolarHBondContact O-N 3.15Å; G139-T142 PolarHBondContact O-OG1 3.32Å; G139-E143 PolarHBondContact O-N 3.49Å
140R92.8Very high92Very high129 Ų12998.2 Ų98.249%0.48750%0.497SS..Hα-helixtrans-65.7-38.5178.1-172.755.9173.2178.6-1.7113.2T136 Y137 E138 E143 L144T136-R140 WeakPolarHBondContact O-CB 3.37Å; T136-R140 PolarHBondContact O-N 3.13Å; Y137-R140 PolarHBondContact O-N 3.42Å; E138-R140 VanDerWaalsContact C-N 3.34Å; E138-R140 PolarHBondContact O-N 3.32Å; R140-E143 IonicContact CZ-OE2 3.96Å; R140-E143 IonicContact NH1-OE1 3.68Å; R140-E143 IonicContact NH1-OE2 3.26Å; R140-E143 PolarHBondContact NH1-OE2 3.42Å; R140-E143 PolarHBondContact O-N 2.85Å; R140-L144 HydrophobicContact CG-CD1 4.2Å; R140-L144 WeakPolarHBondContact O-CB 3.17Å; R140-L144 VanDerWaalsContact O-CG 3.29Å; R140-L144 WeakPolarHBondContact O-CG 3.46Å; R140-L144 PolarHBondContact O-N 2.99Å
141I91.3Very high91.8Very high96 Ų9697.1 Ų97.149%0.49250%0.498SS..Hα-helixtrans-64.5-43.8176.1-72.9165.4000110.3Y137 E138 G139 L144 N145Y137-I141 WeakPolarHBondContact O-CB 3.37Å; Y137-I141 WeakPolarHBondContact O-CD1 3.49Å; Y137-I141 WeakPolarHBondContact O-CG1 3.43Å; Y137-I141 PolarHBondContact O-N 3.4Å; E138-I141 PolarHBondContact O-N 3.19Å; G139-I141 PolarHBondContact O-N 3Å; I141-L144 PolarHBondContact O-N 3.22Å; I141-N145 WeakPolarHBondContact CG2-ND2 3.29Å; I141-N145 WeakPolarHBondContact O-CB 3.46Å; I141-N145 VanDerWaalsContact O-CG 3.29Å; I141-N145 PolarHBondContact O-N 3.16Å; I141-N145 PolarHBondContact O-ND2 2.78Å; I141-N145 VanDerWaalsContact O-ND2 3.14Å
142T92Very high91.8Very high81 Ų8198.2 Ų98.250%0.49750%0.497SS..Hα-helixtrans-63.9-41.117759.10000112.1E138 G139 N145 N146E138-T142 WeakPolarHBondContact O-CG2 3.36Å; E138-T142 PolarHBondContact O-N 3.11Å; E138-T142 PolarHBondContact O-OG1 2.89Å; G139-T142 PolarHBondContact O-N 3.15Å; G139-T142 PolarHBondContact O-OG1 3.32Å; T142-N145 PolarHBondContact O-N 3.21Å; T142-N146 VanDerWaalsContact O-CG 3.28Å; T142-N146 PolarHBondContact O-N 3.43Å; T142-N146 PolarHBondContact O-ND2 3.33Å
143E91.3Very high91.7Very high94 Ų94101.3 Ų101.344%0.43950%0.502SS..Hα-helixtrans-61.8-47.3174.9-167.1-173.3-172.700111.9G139 R140 N145 N146 I147G139-E143 PolarHBondContact O-N 3.49Å; R140-E143 IonicContact CZ-OE2 3.96Å; R140-E143 IonicContact NH1-OE1 3.68Å; R140-E143 IonicContact NH1-OE2 3.26Å; R140-E143 PolarHBondContact NH1-OE2 3.42Å; R140-E143 PolarHBondContact O-N 2.85Å; E143-N145 VanDerWaalsContact C-N 3.34Å; E143-N145 PolarHBondContact O-N 2.93Å; E143-N146 WeakPolarHBondContact O-CB 3.47Å; E143-N146 PolarHBondContact O-N 2.93Å; E143-I147 HydrophobicContact CG-CD1 4.38Å; E143-I147 WeakPolarHBondContact O-CG1 3.28Å; E143-I147 PolarHBondContact O-N 2.96Å
144L90.6Very high91.7Very high85 Ų85100.7 Ų100.745%0.44550%0.5SS..Hα-helixtrans-62.6-39.7176.7-73171.7000112.3R140 I141 N146 I147 L148R140-L144 HydrophobicContact CG-CD1 4.2Å; R140-L144 WeakPolarHBondContact O-CB 3.17Å; R140-L144 VanDerWaalsContact O-CG 3.29Å; R140-L144 WeakPolarHBondContact O-CG 3.46Å; R140-L144 PolarHBondContact O-N 2.99Å; I141-L144 PolarHBondContact O-N 3.22Å; L144-N146 VanDerWaalsContact C-N 3.33Å; L144-N146 PolarHBondContact O-N 2.88Å; L144-I147 PolarHBondContact O-N 3.34Å; L144-L148 WeakPolarHBondContact O-CB 3.35Å; L144-L148 PolarHBondContact O-N 2.79Å
145N94Very high91.7Very high87 Ų87101.5 Ų101.547%0.46550%0.499SS..Hα-helixtrans-64.5-37.2174.7-78.1-35.2000112.1I141 T142 E143 L148 R149I141-N145 WeakPolarHBondContact CG2-ND2 3.29Å; I141-N145 WeakPolarHBondContact O-CB 3.46Å; I141-N145 VanDerWaalsContact O-CG 3.29Å; I141-N145 PolarHBondContact O-N 3.16Å; I141-N145 PolarHBondContact O-ND2 2.78Å; I141-N145 VanDerWaalsContact O-ND2 3.14Å; T142-N145 PolarHBondContact O-N 3.21Å; E143-N145 VanDerWaalsContact C-N 3.34Å; E143-N145 PolarHBondContact O-N 2.93Å; N145-L148 PolarHBondContact O-N 2.95Å; N145-R149 VanDerWaalsContact O-CB 3.32Å; N145-R149 WeakPolarHBondContact O-CB 3.32Å; N145-R149 PolarHBondContact O-N 3.46Å
146N93.1Very high91.8Very high97 Ų97101.8 Ų101.852%0.51950%0.497SS..Hα-helixtrans-66.4-42.3174.8-72.8-26.5000111.7T142 E143 L144 R149 Q150T142-N146 VanDerWaalsContact O-CG 3.28Å; T142-N146 PolarHBondContact O-N 3.43Å; T142-N146 PolarHBondContact O-ND2 3.33Å; E143-N146 WeakPolarHBondContact O-CB 3.47Å; E143-N146 PolarHBondContact O-N 2.93Å; L144-N146 VanDerWaalsContact C-N 3.33Å; L144-N146 PolarHBondContact O-N 2.88Å; N146-R149 PolarHBondContact O-N 3.44Å; N146-Q150 WeakPolarHBondContact O-CB 3.39Å; N146-Q150 PolarHBondContact O-N 3.45Å
147I93.5Very high91.7Very high99 Ų99101.5 Ų101.551%0.50849%0.492SS..Hα-helixtrans-63-44175.3-66.1167.3000110.6E143 L144 Q150 S151E143-I147 HydrophobicContact CG-CD1 4.38Å; E143-I147 WeakPolarHBondContact O-CG1 3.28Å; E143-I147 PolarHBondContact O-N 2.96Å; L144-I147 PolarHBondContact O-N 3.34Å; I147-Q150 PolarHBondContact O-N 3.4Å; I147-S151 WeakPolarHBondContact O-CB 3.3Å; I147-S151 PolarHBondContact O-N 3.22Å
148L91.7Very high91.7Very high92 Ų9299.4 Ų99.448%0.48249%0.491SS..Hα-helixtrans-60.5-49.7176.8-177.765.5000111.2L144 N145 Q150 S151 E152L144-L148 WeakPolarHBondContact O-CB 3.35Å; L144-L148 PolarHBondContact O-N 2.79Å; N145-L148 PolarHBondContact O-N 2.95Å; L148-Q150 VanDerWaalsContact C-N 3.29Å; L148-Q150 PolarHBondContact O-N 2.84Å; L148-S151 WeakPolarHBondContact O-CA 3.42Å; L148-S151 WeakPolarHBondContact O-CB 3.41Å; L148-S151 PolarHBondContact O-N 2.93Å; L148-S151 VanDerWaalsContact O-N 3.08Å; L148-E152 WeakPolarHBondContact O-CG 3.5Å; L148-E152 PolarHBondContact O-N 2.65Å
149R92.2Very high91.5Very high178 Ų17897.6 Ų97.667%0.67248%0.484SS*.Hα-helixtrans-59.9-38.8178.6-169-177.1-79.1169.5-6.4111.9N145 N146 E152 K153N145-R149 VanDerWaalsContact O-CB 3.32Å; N145-R149 WeakPolarHBondContact O-CB 3.32Å; N145-R149 PolarHBondContact O-N 3.46Å; N146-R149 PolarHBondContact O-N 3.44Å; R149-E152 PolarHBondContact O-N 2.85Å; R149-K153 PolarHBondContact O-N 2.89Å
150Q91.5Very high91.4Very high100 Ų10098.4 Ų98.447%0.46749%0.488SS..Hα-helixtrans-67.9-39.7174.9-173.459.935.400112.2N146 I147 L148 K153 N154N146-Q150 WeakPolarHBondContact O-CB 3.39Å; N146-Q150 PolarHBondContact O-N 3.45Å; I147-Q150 PolarHBondContact O-N 3.4Å; L148-Q150 VanDerWaalsContact C-N 3.29Å; L148-Q150 PolarHBondContact O-N 2.84Å; Q150-K153 PolarHBondContact O-N 3.22Å; Q150-N154 PolarHBondContact NE2-OD1 3.44Å; Q150-N154 WeakPolarHBondContact O-CB 3.41Å; Q150-N154 PolarHBondContact O-N 3.12Å; Q150-N154 PolarHBondContact O-ND2 3.27Å
151S88.6Confident91.2Very high71 Ų7199.1 Ų99.150%0.49749%0.494SS..Hα-helixtrans-63.1-41.7174.4-174.30000111.9I147 L148 N154 R155I147-S151 WeakPolarHBondContact O-CB 3.3Å; I147-S151 PolarHBondContact O-N 3.22Å; L148-S151 WeakPolarHBondContact O-CA 3.42Å; L148-S151 WeakPolarHBondContact O-CB 3.41Å; L148-S151 PolarHBondContact O-N 2.93Å; L148-S151 VanDerWaalsContact O-N 3.08Å; S151-N154 PolarHBondContact O-N 2.77Å; S151-R155 WeakPolarHBondContact O-CB 3.17Å; S151-R155 PolarHBondContact O-N 3.26Å
152E91.6Very high91Very high88 Ų8898 Ų9841%0.41149%0.494SS..Hα-helixtrans-62.1-45.6175.1-72.3173.915600111.9L148 R149 N154 R155 E156L148-E152 WeakPolarHBondContact O-CG 3.5Å; L148-E152 PolarHBondContact O-N 2.65Å; R149-E152 PolarHBondContact O-N 2.85Å; E152-N154 VanDerWaalsContact C-N 3.33Å; E152-N154 PolarHBondContact O-N 3.41Å; E152-R155 WeakPolarHBondContact O-CB 3.22Å; E152-R155 PolarHBondContact O-N 3.27Å; E152-E156 WeakPolarHBondContact O-CG 3.48Å; E152-E156 PolarHBondContact O-N 2.91Å
153K91.2Very high90.9Very high123 Ų123100.5 Ų100.554%0.53550%0.498SS..Hα-helixtrans-60.7-41.4174.6-171.2175.5-177.81760112R149 Q150 E156 N157R149-K153 PolarHBondContact O-N 2.89Å; Q150-K153 PolarHBondContact O-N 3.22Å; K153-E156 PolarHBondContact O-N 3.49Å; K153-N157 VanDerWaalsContact O-CG 3.26Å; K153-N157 PolarHBondContact O-N 3.36Å; K153-N157 PolarHBondContact O-ND2 2.95Å
154N91.8Very high90.8Very high76 Ų7699.9 Ų99.941%0.40650%0.501SS..Hα-helixtrans-64.4-42175.6-71.1-16000111.8Q150 S151 E152 N157 L158Q150-N154 PolarHBondContact NE2-OD1 3.44Å; Q150-N154 WeakPolarHBondContact O-CB 3.41Å; Q150-N154 PolarHBondContact O-N 3.12Å; Q150-N154 PolarHBondContact O-ND2 3.27Å; S151-N154 PolarHBondContact O-N 2.77Å; E152-N154 VanDerWaalsContact C-N 3.33Å; E152-N154 PolarHBondContact O-N 3.41Å; N154-N157 PolarHBondContact O-N 2.94Å; N154-L158 WeakPolarHBondContact O-CG 3.4Å; N154-L158 PolarHBondContact O-N 3.3Å
155R92.9Very high90.5Very high122 Ų12298.4 Ų98.446%0.4650%0.497SS..Hα-helixtrans-62.1-42.5175.4-177.6-173.659.868.96.8111.7S151 E152 L158 L159S151-R155 WeakPolarHBondContact O-CB 3.17Å; S151-R155 PolarHBondContact O-N 3.26Å; E152-R155 WeakPolarHBondContact O-CB 3.22Å; E152-R155 PolarHBondContact O-N 3.27Å; R155-L158 PolarHBondContact O-N 3.38Å; R155-L159 HydrophobicContact CG-CD1 4.3Å; R155-L159 VanDerWaalsContact NH1-CD1 3.3Å; R155-L159 PolarHBondContact O-N 3.35Å
156E92.4Very high90.2Very high113 Ų11399.8 Ų99.853%0.52850%0.501SS..Hα-helixtrans-64-43175.8-75.4176.6-179.300112.3E152 K153 L158 L159 A160E152-E156 WeakPolarHBondContact O-CG 3.48Å; E152-E156 PolarHBondContact O-N 2.91Å; K153-E156 PolarHBondContact O-N 3.49Å; E156-L158 VanDerWaalsContact C-N 3.31Å; E156-L158 PolarHBondContact O-N 3.36Å; E156-L159 PolarHBondContact O-N 3.35Å; E156-A160 PolarHBondContact O-N 3.42Å
157N89.8Confident90Very high85 Ų85102 Ų10246%0.45551%0.506SS..Hα-helixtrans-60.2-40.2173.8-72.5-27.5000112.2K153 N154 A160 K161K153-N157 VanDerWaalsContact O-CG 3.26Å; K153-N157 PolarHBondContact O-N 3.36Å; K153-N157 PolarHBondContact O-ND2 2.95Å; N154-N157 PolarHBondContact O-N 2.94Å; N157-A160 PolarHBondContact O-N 3.34Å; N157-K161 WeakPolarHBondContact O-CG 3.05Å; N157-K161 PolarHBondContact O-N 2.99Å
158L87.8Confident89.8Confident112 Ų11299.4 Ų99.459%0.58650%0.496SS*.Hα-helixtrans-67.4-40.8175.4-73.7170.9000112N154 R155 E156 K161 C162N154-L158 WeakPolarHBondContact O-CG 3.4Å; N154-L158 PolarHBondContact O-N 3.3Å; R155-L158 PolarHBondContact O-N 3.38Å; E156-L158 VanDerWaalsContact C-N 3.31Å; E156-L158 PolarHBondContact O-N 3.36Å; L158-K161 PolarHBondContact O-N 2.74Å; L158-C162 PolarHBondContact O-N 3.46Å
159L89.5Confident89.6Confident86 Ų8699.6 Ų99.645%0.4550%0.496SS..Hα-helixtrans-62.5-41.3174.5-85.5162.4000112.1R155 E156 C162 K163R155-L159 HydrophobicContact CG-CD1 4.3Å; R155-L159 VanDerWaalsContact NH1-CD1 3.3Å; R155-L159 PolarHBondContact O-N 3.35Å; E156-L159 PolarHBondContact O-N 3.35Å; L159-C162 PolarHBondContact O-N 3.36Å; L159-K163 WeakPolarHBondContact O-CG 3.47Å; L159-K163 PolarHBondContact O-N 2.94Å
160A89.7Confident89.4Confident53 Ų5396.9 Ų96.944%0.43849%0.491SS..Hα-helixtrans-62-45.2174.800000111.4E156 N157 K163 T164E156-A160 PolarHBondContact O-N 3.42Å; N157-A160 PolarHBondContact O-N 3.34Å; A160-K163 PolarHBondContact O-N 3.41Å; A160-T164 PolarHBondContact O-N 3.5Å; A160-T164 PolarHBondContact O-OG1 2.96Å
161K89.1Confident89.3Confident143 Ų14397.5 Ų97.562%0.62249%0.492SS*.Hα-helixtrans-60.7-43.5174.7-73.7178-178.7-176.60112.4N157 L158 K163 T164 S165N157-K161 WeakPolarHBondContact O-CG 3.05Å; N157-K161 PolarHBondContact O-N 2.99Å; L158-K161 PolarHBondContact O-N 2.74Å; K161-K163 PolarHBondContact O-N 3Å; K161-T164 WeakPolarHBondContact CA-OG1 3.39Å; K161-T164 PolarHBondContact O-N 3.35Å; K161-T164 PolarHBondContact O-OG1 3.34Å; K161-S165 PolarHBondContact O-N 3.42Å; K161-S165 PolarHBondContact O-OG 3.49Å; K161-S165 VanDerWaalsContact O-OG 3.11Å
162C85.9Confident89.3Confident73 Ų7397.3 Ų97.349%0.49349%0.485SS..Hα-helixtrans-59.9-43.5174.6-100.70000112.4L158 L159 T164 S165 E166L158-C162 PolarHBondContact O-N 3.46Å; L159-C162 PolarHBondContact O-N 3.36Å; C162-T164 VanDerWaalsContact C-N 3.35Å; C162-T164 PolarHBondContact O-N 3.44Å; C162-S165 WeakPolarHBondContact CA-OG 3.49Å; C162-S165 PolarHBondContact O-N 3.45Å; C162-S165 PolarHBondContact O-OG 3.38Å; C162-E166 WeakPolarHBondContact O-CB 3.46Å; C162-E166 WeakPolarHBondContact O-CG 3.43Å; C162-E166 PolarHBondContact O-N 2.96Å
163K91.5Very high89.2Confident133 Ų13397.6 Ų97.658%0.57849%0.489SS*.Hα-helixtrans-62.2-42.6175.5-75.4-179.2176.9-179.30111.6L159 A160 K161 E166 F167L159-K163 WeakPolarHBondContact O-CG 3.47Å; L159-K163 PolarHBondContact O-N 2.94Å; A160-K163 PolarHBondContact O-N 3.41Å; K161-K163 PolarHBondContact O-N 3Å; K163-E166 PolarHBondContact O-N 3.29Å; K163-F167 WeakPolarHBondContact O-CD2 3.31Å; K163-F167 PolarHBondContact O-N 2.9Å
164T88.8Confident89.2Confident82 Ų8298.7 Ų98.750%0.50349%0.494SS..Hα-helixtrans-63.5-42.8176.851.20000112.1A160 K161 C162 F167 T168A160-T164 PolarHBondContact O-N 3.5Å; A160-T164 PolarHBondContact O-OG1 2.96Å; K161-T164 WeakPolarHBondContact CA-OG1 3.39Å; K161-T164 PolarHBondContact O-N 3.35Å; K161-T164 PolarHBondContact O-OG1 3.34Å; C162-T164 VanDerWaalsContact C-N 3.35Å; C162-T164 PolarHBondContact O-N 3.44Å; T164-F167 PolarHBondContact O-N 3.19Å; T164-T168 PolarHBondContact O-N 3.41Å; T164-T168 PolarHBondContact O-OG1 2.86Å
165S84.5Confident89.1Confident53 Ų5399.4 Ų99.437%0.37150%0.495SS..Hα-helixtrans-66.8-37176.951.70000112.1K161 C162 T168 I169K161-S165 PolarHBondContact O-N 3.42Å; K161-S165 PolarHBondContact O-OG 3.49Å; K161-S165 VanDerWaalsContact O-OG 3.11Å; C162-S165 WeakPolarHBondContact CA-OG 3.49Å; C162-S165 PolarHBondContact O-N 3.45Å; C162-S165 PolarHBondContact O-OG 3.38Å; S165-T168 PolarHBondContact O-N 3.39Å; S165-I169 WeakPolarHBondContact O-CB 3.45Å; S165-I169 VanDerWaalsContact O-CG1 3.29Å; S165-I169 WeakPolarHBondContact O-CG1 3.32Å; S165-I169 PolarHBondContact O-N 2.93Å
166E87.4Confident88.9Confident116 Ų11697.9 Ų97.954%0.54250%0.495SS..Hα-helixtrans-58.7-46.7171.2-80.5178.8173.600112.4C162 K163 T168 I169 Q170C162-E166 WeakPolarHBondContact O-CB 3.46Å; C162-E166 WeakPolarHBondContact O-CG 3.43Å; C162-E166 PolarHBondContact O-N 2.96Å; K163-E166 PolarHBondContact O-N 3.29Å; E166-T168 VanDerWaalsContact C-N 3.28Å; E166-T168 PolarHBondContact O-N 2.87Å; E166-I169 PolarHBondContact O-N 3.45Å; E166-Q170 WeakPolarHBondContact O-CG 3.46Å; E166-Q170 PolarHBondContact O-N 3.29Å
167F88.2Confident88.8Confident143 Ų14395.2 Ų95.263%0.62749%0.492SS*.Hα-helixtrans-60.4-39.1174.7-82.8-65.6000112.1K163 T164 Q170 K171K163-F167 WeakPolarHBondContact O-CD2 3.31Å; K163-F167 PolarHBondContact O-N 2.9Å; T164-F167 PolarHBondContact O-N 3.19Å; F167-Q170 PolarHBondContact O-N 3.42Å; F167-K171 PolarHBondContact O-N 2.9Å
168T88.9Confident88.9Confident46 Ų4695.3 Ų95.328%0.28249%0.493SS..Hα-helixtrans-66.7-44178.7-37.40000110.9T164 S165 E166 Q170 K171 L172T164-T168 PolarHBondContact O-N 3.41Å; T164-T168 PolarHBondContact O-OG1 2.86Å; S165-T168 PolarHBondContact O-N 3.39Å; E166-T168 VanDerWaalsContact C-N 3.28Å; E166-T168 PolarHBondContact O-N 2.87Å; T168-Q170 PolarHBondContact O-N 2.68Å; T168-K171 PolarHBondContact O-N 3.03Å; T168-L172 WeakPolarHBondContact O-CG 3.4Å; T168-L172 PolarHBondContact O-N 3.42Å
169I87.6Confident88.9Confident95 Ų9591.7 Ų91.749%0.48748%0.482SS..Hα-helixtrans-61.4-42.4174.7-70.7166.2000110.8S165 E166 K171 L172 N173S165-I169 WeakPolarHBondContact O-CB 3.45Å; S165-I169 VanDerWaalsContact O-CG1 3.29Å; S165-I169 WeakPolarHBondContact O-CG1 3.32Å; S165-I169 PolarHBondContact O-N 2.93Å; E166-I169 PolarHBondContact O-N 3.45Å; I169-K171 VanDerWaalsContact C-N 3.34Å; I169-K171 PolarHBondContact O-N 3.42Å; I169-L172 PolarHBondContact O-N 3.31Å; I169-N173 WeakPolarHBondContact CG2-ND2 3.19Å; I169-N173 WeakPolarHBondContact O-CB 3.44Å; I169-N173 VanDerWaalsContact O-CG 3.29Å; I169-N173 PolarHBondContact O-N 3.43Å; I169-N173 PolarHBondContact O-ND2 3.02Å
170Q89.5Confident89Confident121 Ų12194 Ų9457%0.56549%0.489SS*.Hα-helixtrans-61.3-41.9175.1-74.1178.912.500112E166 F167 T168 N173 K174E166-Q170 WeakPolarHBondContact O-CG 3.46Å; E166-Q170 PolarHBondContact O-N 3.29Å; F167-Q170 PolarHBondContact O-N 3.42Å; T168-Q170 PolarHBondContact O-N 2.68Å; Q170-N173 PolarHBondContact O-N 3.21Å; Q170-K174 PolarHBondContact O-N 2.83Å; Q170-K174 VanDerWaalsContact O-N 3.08Å
171K89.7Confident89Confident113 Ų11394.4 Ų94.449%0.49149%0.488SS..Hα-helixtrans-63.8-48.3176.4-172.2-176.8174.3-165.30111.5F167 T168 I169 N173 K174 E175F167-K171 PolarHBondContact O-N 2.9Å; T168-K171 PolarHBondContact O-N 3.03Å; I169-K171 VanDerWaalsContact C-N 3.34Å; I169-K171 PolarHBondContact O-N 3.42Å; K171-N173 PolarHBondContact O-N 3.05Å; K171-K174 WeakPolarHBondContact O-CB 3.41Å; K171-K174 PolarHBondContact O-N 2.88Å; K171-K174 VanDerWaalsContact O-N 3.12Å; K171-E175 VanDerWaalsContact CE-OE1 3.22Å; K171-E175 WeakPolarHBondContact CE-OE1 3.41Å; K171-E175 PolarHBondContact O-N 3.13Å
172L87.3Confident89Confident67 Ų6794 Ų9435%0.35149%0.489SS..Hα-helixtrans-61.6-41.2176.9-71171.2000111.9T168 I169 K174 E175 I176T168-L172 WeakPolarHBondContact O-CG 3.4Å; T168-L172 PolarHBondContact O-N 3.42Å; I169-L172 PolarHBondContact O-N 3.31Å; L172-K174 VanDerWaalsContact C-N 3.27Å; L172-K174 PolarHBondContact O-N 2.88Å; L172-E175 PolarHBondContact O-N 2.9Å; L172-I176 WeakPolarHBondContact O-CB 3.18Å; L172-I176 VanDerWaalsContact O-CG1 3.27Å; L172-I176 WeakPolarHBondContact O-CG1 3.45Å; L172-I176 PolarHBondContact O-N 3.42Å
173N89.3Confident89.2Confident94 Ų9495.3 Ų95.350%0.50349%0.49SS..Hα-helixtrans-61.9-35.8174.9-79.5-32.9000112.3I169 Q170 K171 A177I169-N173 WeakPolarHBondContact CG2-ND2 3.19Å; I169-N173 WeakPolarHBondContact O-CB 3.44Å; I169-N173 VanDerWaalsContact O-CG 3.29Å; I169-N173 PolarHBondContact O-N 3.43Å; I169-N173 PolarHBondContact O-ND2 3.02Å; Q170-N173 PolarHBondContact O-N 3.21Å; K171-N173 PolarHBondContact O-N 3.05Å; N173-A177 WeakPolarHBondContact O-CB 3.41Å; N173-A177 PolarHBondContact O-N 2.93Å
174K91.8Very high89.2Confident147 Ų14793.1 Ų93.164%0.63949%0.485SS*.Hα-helixtrans-68.4-41.5174-168.9177.3-179.1179.50111.6Q170 K171 L172 A177 N178Q170-K174 PolarHBondContact O-N 2.83Å; Q170-K174 VanDerWaalsContact O-N 3.08Å; K171-K174 WeakPolarHBondContact O-CB 3.41Å; K171-K174 PolarHBondContact O-N 2.88Å; K171-K174 VanDerWaalsContact O-N 3.12Å; L172-K174 VanDerWaalsContact C-N 3.27Å; L172-K174 PolarHBondContact O-N 2.88Å; K174-A177 PolarHBondContact O-N 3.15Å; K174-N178 VanDerWaalsContact O-CG 3.28Å; K174-N178 PolarHBondContact O-N 3.48Å; K174-N178 PolarHBondContact O-OD1 3.43Å
175E90.6Very high89.3Confident90 Ų9092.3 Ų92.342%0.42148%0.478SS..Hα-helixtrans-64-42.6174.7-71.5170.9-168.600111.7K171 L172 A177 N178 G179K171-E175 VanDerWaalsContact CE-OE1 3.22Å; K171-E175 WeakPolarHBondContact CE-OE1 3.41Å; K171-E175 PolarHBondContact O-N 3.13Å; L172-E175 PolarHBondContact O-N 2.9Å; E175-A177 VanDerWaalsContact C-N 3.34Å; E175-A177 PolarHBondContact O-N 3.39Å; E175-N178 PolarHBondContact O-N 3.18Å; E175-G179 PolarHBondContact O-N 2.88Å
176I88.3Confident89.5Confident91 Ų9192.2 Ų92.247%0.46748%0.477SS..Hα-helixtrans-60.8-42.3173.4-69.6165.7000111L172 G179 K180L172-I176 WeakPolarHBondContact O-CB 3.18Å; L172-I176 VanDerWaalsContact O-CG1 3.27Å; L172-I176 WeakPolarHBondContact O-CG1 3.45Å; L172-I176 PolarHBondContact O-N 3.42Å; I176-G179 PolarHBondContact O-N 3.03Å; I176-K180 HydrophobicContact CG2-CD 4.19Å; I176-K180 WeakPolarHBondContact O-CB 3.42Å; I176-K180 VanDerWaalsContact O-CG 3.31Å; I176-K180 WeakPolarHBondContact O-CG 3.37Å; I176-K180 PolarHBondContact O-N 2.97Å
177A90.1Very high89.6Confident57 Ų5791.9 Ų91.947%0.47148%0.477SS..Hα-helixtrans-63.4-41.8176.600000111.8N173 K174 E175 K180 S181N173-A177 WeakPolarHBondContact O-CB 3.41Å; N173-A177 PolarHBondContact O-N 2.93Å; K174-A177 PolarHBondContact O-N 3.15Å; E175-A177 VanDerWaalsContact C-N 3.34Å; E175-A177 PolarHBondContact O-N 3.39Å; A177-K180 PolarHBondContact O-N 3.38Å; A177-S181 PolarHBondContact O-N 3.44Å; A177-S181 VanDerWaalsContact O-N 3.1Å
178N91.2Very high89.8Confident87 Ų8792.7 Ų92.747%0.46548%0.476SS..Hα-helixtrans-64.2-48.9175.4-69.7-9.4000111.6K174 E175 K180 S181 E182K174-N178 VanDerWaalsContact O-CG 3.28Å; K174-N178 PolarHBondContact O-N 3.48Å; K174-N178 PolarHBondContact O-OD1 3.43Å; E175-N178 PolarHBondContact O-N 3.18Å; N178-K180 VanDerWaalsContact C-N 3.31Å; N178-K180 PolarHBondContact O-N 2.94Å; N178-S181 WeakPolarHBondContact O-CA 3.42Å; N178-S181 VanDerWaalsContact O-CB 3.3Å; N178-S181 WeakPolarHBondContact O-CB 3.03Å; N178-S181 PolarHBondContact O-N 2.94Å; N178-E182 PolarHBondContact O-N 3.1Å
179G88.2Confident89.8Confident35 Ų3599.4 Ų99.436%0.36150%0.496SS..Hα-helixtrans-59.9-38.3177.600000112.7E175 I176 S181 E182 L183E175-G179 PolarHBondContact O-N 2.88Å; I176-G179 PolarHBondContact O-N 3.03Å; G179-S181 VanDerWaalsContact C-N 3.34Å; G179-S181 PolarHBondContact O-N 2.72Å; G179-E182 PolarHBondContact O-N 2.9Å; G179-L183 VanDerWaalsContact O-CB 3.3Å; G179-L183 WeakPolarHBondContact O-CB 3.34Å; G179-L183 PolarHBondContact O-N 3.04Å
180K91Very high89.8Confident134 Ų13499.3 Ų99.358%0.58350%0.495SS*.Hα-helixtrans-63.4-36.7171.7-76.8177.5179.6179.30112.7I176 A177 N178 N184I176-K180 HydrophobicContact CG2-CD 4.19Å; I176-K180 WeakPolarHBondContact O-CB 3.42Å; I176-K180 VanDerWaalsContact O-CG 3.31Å; I176-K180 WeakPolarHBondContact O-CG 3.37Å; I176-K180 PolarHBondContact O-N 2.97Å; A177-K180 PolarHBondContact O-N 3.38Å; N178-K180 VanDerWaalsContact C-N 3.31Å; N178-K180 PolarHBondContact O-N 2.94Å; K180-N184 WeakPolarHBondContact O-CB 3.35Å; K180-N184 VanDerWaalsContact O-CG 3.29Å; K180-N184 PolarHBondContact O-N 3.25Å; K180-N184 PolarHBondContact O-ND2 3.14Å
181S90Very high89.8Confident62 Ų6296 Ų9643%0.43449%0.489SS..Hα-helixtrans-66.4-47.2175.3-170.40000111.3A177 N178 G179 L183 N184 D185A177-S181 PolarHBondContact O-N 3.44Å; A177-S181 VanDerWaalsContact O-N 3.1Å; N178-S181 WeakPolarHBondContact O-CA 3.42Å; N178-S181 VanDerWaalsContact O-CB 3.3Å; N178-S181 WeakPolarHBondContact O-CB 3.03Å; N178-S181 PolarHBondContact O-N 2.94Å; G179-S181 VanDerWaalsContact C-N 3.34Å; G179-S181 PolarHBondContact O-N 2.72Å; S181-L183 PolarHBondContact O-N 3.17Å; S181-N184 PolarHBondContact O-N 3.41Å; S181-D185 PolarHBondContact O-N 2.92Å
182E89.8Confident89.8Confident136 Ų13696.4 Ų96.464%0.63649%0.492SS*.Hα-helixtrans-63.3-40.9177.9-69.2177.1-170.700112N178 G179 N184 D185 S186N178-E182 PolarHBondContact O-N 3.1Å; G179-E182 PolarHBondContact O-N 2.9Å; E182-N184 PolarHBondContact O-N 3.46Å; E182-D185 PolarHBondContact O-N 2.91Å; E182-S186 WeakPolarHBondContact O-CB 3.46Å; E182-S186 PolarHBondContact O-N 3.35Å; E182-S186 PolarHBondContact O-OG 2.94Å
183L90.1Very high89.9Confident100 Ų10098.6 Ų98.652%0.52450%0.503SS..Hα-helixtrans-59.4-46.9173.3-178.164.4000110.7G179 S181 D185 S186 M187G179-L183 VanDerWaalsContact O-CB 3.3Å; G179-L183 WeakPolarHBondContact O-CB 3.34Å; G179-L183 PolarHBondContact O-N 3.04Å; S181-L183 PolarHBondContact O-N 3.17Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 3.26Å; L183-S186 PolarHBondContact O-N 3.25Å; L183-S186 PolarHBondContact O-OG 2.93Å; L183-M187 HydrophobicContact CG-SD 4.32Å; L183-M187 WeakPolarHBondContact O-CB 3.44Å; L183-M187 WeakPolarHBondContact O-CG 3.43Å; L183-M187 PolarHBondContact O-N 2.94Å
184N91.6Very high89.9Confident87 Ų87100.3 Ų100.347%0.46551%0.508SS..Hα-helixtrans-63.2-36.3177.5-79.2-31000112.8K180 S181 E182 R188K180-N184 WeakPolarHBondContact O-CB 3.35Å; K180-N184 VanDerWaalsContact O-CG 3.29Å; K180-N184 PolarHBondContact O-N 3.25Å; K180-N184 PolarHBondContact O-ND2 3.14Å; S181-N184 PolarHBondContact O-N 3.41Å; E182-N184 PolarHBondContact O-N 3.46Å; N184-R188 PolarHBondContact O-N 3.42Å
185D90.2Very high89.7Confident65 Ų6598.4 Ų98.435%0.34850%0.502SS..Hα-helixtrans-68.1-41.1174.4-73.6-22.7000111.8S181 E182 L183 R188 R189S181-D185 PolarHBondContact O-N 2.92Å; E182-D185 PolarHBondContact O-N 2.91Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 3.26Å; D185-R188 PolarHBondContact O-N 3.14Å; D185-R188 IonicContact OD1-CZ 3.66Å; D185-R188 IonicContact OD1-NE 3.24Å; D185-R188 IonicContact OD1-NH1 2.74Å; D185-R188 PolarHBondContact OD1-NH1 3.43Å; D185-R188 IonicContact OD1-NH2 2.75Å; D185-R188 PolarHBondContact OD1-NH2 2.91Å; D185-R189 PolarHBondContact O-N 3.02Å
186S88.5Confident89.8Confident51 Ų5197.4 Ų97.436%0.35750%0.499SS..Hα-helixtrans-67.5-40.2177.372.90000111.8E182 L183 R188 R189 I190E182-S186 WeakPolarHBondContact O-CB 3.46Å; E182-S186 PolarHBondContact O-N 3.35Å; E182-S186 PolarHBondContact O-OG 2.94Å; L183-S186 PolarHBondContact O-N 3.25Å; L183-S186 PolarHBondContact O-OG 2.93Å; S186-R188 PolarHBondContact O-N 2.82Å; S186-R189 WeakPolarHBondContact O-CB 3.25Å; S186-R189 PolarHBondContact O-N 3.14Å; S186-R189 VanDerWaalsContact O-N 3.14Å; S186-I190 WeakPolarHBondContact O-CG1 3.39Å; S186-I190 PolarHBondContact O-N 3.31Å
187M90.5Very high89.7Confident108 Ų10898.5 Ų98.553%0.53251%0.505SS..Hα-helixtrans-60.3-44.2172.1-74.4179.568.600111.3L183 R189 I190 A191L183-M187 HydrophobicContact CG-SD 4.32Å; L183-M187 WeakPolarHBondContact O-CB 3.44Å; L183-M187 WeakPolarHBondContact O-CG 3.43Å; L183-M187 PolarHBondContact O-N 2.94Å; M187-R189 VanDerWaalsContact C-N 3.3Å; M187-R189 PolarHBondContact O-N 3.18Å; M187-I190 PolarHBondContact O-N 3.49Å; M187-A191 WeakPolarHBondContact O-CB 3.32Å; M187-A191 PolarHBondContact O-N 3.32Å
188R91Very high89.7Confident161 Ų16198.9 Ų98.961%0.60850%0.504SS*.Hα-helixtrans-60-39.6174.1-84.4-175.5-94.1145.2-0.7112N184 D185 S186 H192N184-R188 PolarHBondContact O-N 3.42Å; D185-R188 PolarHBondContact O-N 3.14Å; D185-R188 IonicContact OD1-CZ 3.66Å; D185-R188 IonicContact OD1-NE 3.24Å; D185-R188 IonicContact OD1-NH1 2.74Å; D185-R188 PolarHBondContact OD1-NH1 3.43Å; D185-R188 IonicContact OD1-NH2 2.75Å; D185-R188 PolarHBondContact OD1-NH2 2.91Å; S186-R188 PolarHBondContact O-N 2.82Å; R188-H192 WeakPolarHBondContact O-CB 3.5Å; R188-H192 PolarHBondContact O-N 3.41Å
189R90.3Very high89.6Confident187 Ų18798.3 Ų98.371%0.70650%0.501SS*.Hα-helixtrans-66.2-42.7175.2-109.8162.5-175.9147.41.9113D185 S186 M187 H192 L193D185-R189 PolarHBondContact O-N 3.02Å; S186-R189 WeakPolarHBondContact O-CB 3.25Å; S186-R189 PolarHBondContact O-N 3.14Å; S186-R189 VanDerWaalsContact O-N 3.14Å; M187-R189 VanDerWaalsContact C-N 3.3Å; M187-R189 PolarHBondContact O-N 3.18Å; R189-H192 PolarHBondContact O-N 3.22Å; R189-L193 WeakPolarHBondContact O-CG 3.27Å; R189-L193 PolarHBondContact O-N 2.82Å
190I87.4Confident89.7Confident92 Ų92101.2 Ų101.247%0.47251%0.508SS..Hα-helixtrans-62.2-46.7175.9-69.4167.5000110.2S186 M187 H192 L193 Q194S186-I190 WeakPolarHBondContact O-CG1 3.39Å; S186-I190 PolarHBondContact O-N 3.31Å; M187-I190 PolarHBondContact O-N 3.49Å; I190-H192 VanDerWaalsContact C-N 3.32Å; I190-H192 PolarHBondContact O-N 3.4Å; I190-L193 PolarHBondContact O-N 3.25Å; I190-Q194 HydrophobicContact CG2-CG 4.31Å; I190-Q194 WeakPolarHBondContact O-CB 3.32Å; I190-Q194 VanDerWaalsContact O-CG 3.32Å; I190-Q194 WeakPolarHBondContact O-CG 3.5Å; I190-Q194 PolarHBondContact O-N 2.85Å
191A88.9Confident89.5Confident52 Ų5298.2 Ų98.243%0.4350%0.503SS..Hα-helixtrans-59.1-42.5176.600000111.9M187 Q194 Q195M187-A191 WeakPolarHBondContact O-CB 3.32Å; M187-A191 PolarHBondContact O-N 3.32Å; A191-Q194 PolarHBondContact O-N 3.27Å; A191-Q195 PolarHBondContact O-N 2.8Å
192H90Very high89.4Confident121 Ų12199.2 Ų99.256%0.5650%0.504SS*.Hα-helixtrans-63-44.1174.7-171.9-24000112.2R188 R189 I190 Q195 I196R188-H192 WeakPolarHBondContact O-CB 3.5Å; R188-H192 PolarHBondContact O-N 3.41Å; R189-H192 PolarHBondContact O-N 3.22Å; I190-H192 VanDerWaalsContact C-N 3.32Å; I190-H192 PolarHBondContact O-N 3.4Å; H192-Q195 WeakPolarHBondContact O-CB 3.4Å; H192-Q195 PolarHBondContact O-N 3Å; H192-I196 WeakPolarHBondContact CE1-CD1 3.34Å; H192-I196 WeakPolarHBondContact ND1-CD1 3.23Å; H192-I196 WeakPolarHBondContact O-CG1 3.34Å; H192-I196 PolarHBondContact O-N 2.91Å
193L88.8Confident89.3Confident113 Ų11398.8 Ų98.859%0.59250%0.502SS*.Hα-helixtrans-66.2-38.1178.3-73.6170.5000111.9R189 I190 Q195 I196 N197R189-L193 WeakPolarHBondContact O-CG 3.27Å; R189-L193 PolarHBondContact O-N 2.82Å; I190-L193 PolarHBondContact O-N 3.25Å; L193-Q195 VanDerWaalsContact C-N 3.34Å; L193-I196 PolarHBondContact O-N 3.26Å; L193-N197 WeakPolarHBondContact O-CB 3.42Å; L193-N197 PolarHBondContact O-N 3.45Å
194Q89.1Confident89.1Confident130 Ų13098.6 Ų98.661%0.60750%0.501SS*.Hα-helixtrans-61.8-41.9173.4-75.4173.7-19.800111.5I190 A191 N197 C198I190-Q194 HydrophobicContact CG2-CG 4.31Å; I190-Q194 WeakPolarHBondContact O-CB 3.32Å; I190-Q194 VanDerWaalsContact O-CG 3.32Å; I190-Q194 WeakPolarHBondContact O-CG 3.5Å; I190-Q194 PolarHBondContact O-N 2.85Å; A191-Q194 PolarHBondContact O-N 3.27Å; Q194-N197 PolarHBondContact O-N 3.47Å; Q194-C198 WeakPolarHBondContact O-CB 3.44Å; Q194-C198 PolarHBondContact O-N 3.49Å
195Q88.7Confident88.9Confident107 Ų10797.1 Ų97.150%0.550%0.501SS..Hα-helixtrans-60.5-50.2174.2-177.160.236.800111.4A191 H192 L193 N197 C198 D199A191-Q195 PolarHBondContact O-N 2.8Å; H192-Q195 WeakPolarHBondContact O-CB 3.4Å; H192-Q195 PolarHBondContact O-N 3Å; L193-Q195 VanDerWaalsContact C-N 3.34Å; Q195-N197 VanDerWaalsContact C-N 3.27Å; Q195-N197 PolarHBondContact O-N 3.05Å; Q195-C198 WeakPolarHBondContact O-CB 3.43Å; Q195-C198 PolarHBondContact O-N 2.98Å; Q195-D199 PolarHBondContact NE2-OD1 3.47Å; Q195-D199 PolarHBondContact NE2-OD2 2.98Å; Q195-D199 VanDerWaalsContact NE2-OD2 3.17Å; Q195-D199 PolarHBondContact O-N 2.94Å
196I91.2Very high88.8Confident70 Ų70101 Ų10136%0.35952%0.515SS..Hα-helixtrans-56.5-43.8176.1-69168.8000110.9H192 L193 D199 L200H192-I196 WeakPolarHBondContact CE1-CD1 3.34Å; H192-I196 WeakPolarHBondContact ND1-CD1 3.23Å; H192-I196 WeakPolarHBondContact O-CG1 3.34Å; H192-I196 PolarHBondContact O-N 2.91Å; L193-I196 PolarHBondContact O-N 3.26Å; I196-D199 PolarHBondContact O-N 3.37Å; I196-L200 HydrophobicContact CG2-CD1 3.78Å; I196-L200 HydrophobicContact CG2-CG 4.24Å; I196-L200 WeakPolarHBondContact O-CB 3.47Å; I196-L200 WeakPolarHBondContact O-CG 3.37Å; I196-L200 PolarHBondContact O-N 3.39Å
197N87.3Confident88.6Confident113 Ų113101.6 Ų101.660%0.60452%0.519SS*.Hα-helixtrans-68.2-36.8-177.8-153.110.3000111.6L193 Q194 Q195 S201L193-N197 WeakPolarHBondContact O-CB 3.42Å; L193-N197 PolarHBondContact O-N 3.45Å; Q194-N197 PolarHBondContact O-N 3.47Å; Q195-N197 VanDerWaalsContact C-N 3.27Å; Q195-N197 PolarHBondContact O-N 3.05Å; N197-S201 WeakPolarHBondContact O-CB 3.34Å; N197-S201 PolarHBondContact O-N 3.24Å
198C90.2Very high88.5Confident66 Ų66102.9 Ų102.945%0.44652%0.521SS..Hα-helixtrans-61.3-46.9171.7-168.90000111.1Q194 Q195 S201 N202Q194-C198 WeakPolarHBondContact O-CB 3.44Å; Q194-C198 PolarHBondContact O-N 3.49Å; Q195-C198 WeakPolarHBondContact O-CB 3.43Å; Q195-C198 PolarHBondContact O-N 2.98Å; C198-S201 PolarHBondContact O-N 2.9Å; C198-N202 WeakPolarHBondContact O-CB 3.45Å; C198-N202 PolarHBondContact O-N 3.45Å; C198-N202 PolarHBondContact O-ND2 3.47Å; C198-N202 VanDerWaalsContact O-ND2 3.14Å
199D89.6Confident88.3Confident75 Ų7599.4 Ų99.440%0.40151%0.514SS..Hα-helixtrans-62.9-46.2179.2-66.5-29.5000111.8Q195 I196 S201 N202 E203Q195-D199 PolarHBondContact NE2-OD1 3.47Å; Q195-D199 PolarHBondContact NE2-OD2 2.98Å; Q195-D199 VanDerWaalsContact NE2-OD2 3.17Å; Q195-D199 PolarHBondContact O-N 2.94Å; I196-D199 PolarHBondContact O-N 3.37Å; D199-S201 PolarHBondContact O-N 3.3Å; D199-N202 WeakPolarHBondContact O-CB 3.38Å; D199-N202 PolarHBondContact O-N 2.89Å; D199-E203 WeakPolarHBondContact O-CG 3.33Å; D199-E203 PolarHBondContact O-N 3.28Å
200L88.7Confident87.9Confident95 Ų9594.5 Ų94.550%0.49751%0.506SS..Hα-helixtrans-63.8-39.1175.7-72.7173.5000112.6I196 N202 E203 L204I196-L200 HydrophobicContact CG2-CD1 3.78Å; I196-L200 HydrophobicContact CG2-CG 4.24Å; I196-L200 WeakPolarHBondContact O-CB 3.47Å; I196-L200 WeakPolarHBondContact O-CG 3.37Å; I196-L200 PolarHBondContact O-N 3.39Å; L200-N202 VanDerWaalsContact C-N 3.32Å; L200-E203 PolarHBondContact O-N 3.25Å; L200-L204 WeakPolarHBondContact O-CB 3.44Å; L200-L204 PolarHBondContact O-N 3.39Å
201S87.6Confident87.7Confident71 Ų7194.3 Ų94.350%0.49751%0.508SS..Hα-helixtrans-65.9-38.1176.8-155.60000111.1N197 C198 D199 L204 A205N197-S201 WeakPolarHBondContact O-CB 3.34Å; N197-S201 PolarHBondContact O-N 3.24Å; C198-S201 PolarHBondContact O-N 2.9Å; D199-S201 PolarHBondContact O-N 3.3Å; S201-L204 PolarHBondContact O-N 2.93Å; S201-A205 WeakPolarHBondContact O-CB 3.48Å; S201-A205 PolarHBondContact O-N 3.49Å
202N88.2Confident87.6Confident83 Ų8398.3 Ų98.344%0.44452%0.518SS..Hα-helixtrans-66-41.8172.8-71.4-32000112.2C198 D199 L200 A205 K206C198-N202 WeakPolarHBondContact O-CB 3.45Å; C198-N202 PolarHBondContact O-N 3.45Å; C198-N202 PolarHBondContact O-ND2 3.47Å; C198-N202 VanDerWaalsContact O-ND2 3.14Å; D199-N202 WeakPolarHBondContact O-CB 3.38Å; D199-N202 PolarHBondContact O-N 2.89Å; L200-N202 VanDerWaalsContact C-N 3.32Å; N202-A205 PolarHBondContact O-N 3.14Å; N202-K206 WeakPolarHBondContact O-CG 3.49Å; N202-K206 PolarHBondContact O-N 2.89Å
203E86.4Confident87.3Confident127 Ų12798.3 Ų98.359%0.59352%0.516SS*.Hα-helixtrans-63.7-41.7173.6-74.4-163.8157.600112.1D199 L200 A205 K206 S207D199-E203 WeakPolarHBondContact O-CG 3.33Å; D199-E203 PolarHBondContact O-N 3.28Å; L200-E203 PolarHBondContact O-N 3.25Å; E203-A205 VanDerWaalsContact C-N 3.34Å; E203-A205 PolarHBondContact O-N 3.4Å; E203-K206 PolarHBondContact O-N 2.91Å; E203-S207 WeakPolarHBondContact O-CB 3.46Å; E203-S207 PolarHBondContact O-N 3.31Å
204L86.9Confident86.9Confident96 Ų9695.9 Ų95.950%0.50351%0.509SS..Hα-helixtrans-62.3-42.3175.6-176.567.1000111.3L200 S201 S207 K208L200-L204 WeakPolarHBondContact O-CB 3.44Å; L200-L204 PolarHBondContact O-N 3.39Å; S201-L204 PolarHBondContact O-N 2.93Å; L204-S207 PolarHBondContact O-N 2.94Å; L204-K208 WeakPolarHBondContact O-CB 3.29Å; L204-K208 WeakPolarHBondContact O-CG 3.36Å; L204-K208 PolarHBondContact O-N 2.97Å
205A87.8Confident86.6Confident56 Ų5692.5 Ų92.546%0.46350%0.5SS..Hα-helixtrans-63-44.4175.600000111.8S201 N202 E203 K208 L209S201-A205 WeakPolarHBondContact O-CB 3.48Å; S201-A205 PolarHBondContact O-N 3.49Å; N202-A205 PolarHBondContact O-N 3.14Å; E203-A205 VanDerWaalsContact C-N 3.34Å; E203-A205 PolarHBondContact O-N 3.4Å; A205-K208 PolarHBondContact O-N 3.23Å; A205-L209 PolarHBondContact O-N 3.44Å
206K87.9Confident86.4Confident147 Ų14789.8 Ų89.864%0.63950%0.495SS*.Hα-helixtrans-59.8-46.2173.4-73.3173.8-176.1173.30111.3N202 E203 L209 T210N202-K206 WeakPolarHBondContact O-CG 3.49Å; N202-K206 PolarHBondContact O-N 2.89Å; E203-K206 PolarHBondContact O-N 2.91Å; K206-L209 WeakPolarHBondContact O-CB 3.4Å; K206-L209 PolarHBondContact O-N 3.4Å; K206-T210 WeakPolarHBondContact O-CG2 3.33Å; K206-T210 PolarHBondContact O-N 2.82Å
207S83.7Confident85.9Confident63 Ų6394.9 Ų94.944%0.44151%0.51SS..Hα-helixtrans-60.3-47.8178-176.50000111.6E203 L204 L209 T210 V211E203-S207 WeakPolarHBondContact O-CB 3.46Å; E203-S207 PolarHBondContact O-N 3.31Å; L204-S207 PolarHBondContact O-N 2.94Å; S207-L209 VanDerWaalsContact C-N 3.32Å; S207-L209 PolarHBondContact O-N 3.44Å; S207-T210 PolarHBondContact O-N 2.85Å; S207-T210 PolarHBondContact O-OG1 3.38Å; S207-V211 WeakPolarHBondContact O-CG2 3.4Å; S207-V211 PolarHBondContact O-N 2.79Å
208K88.2Confident85.6Confident135 Ų13592.2 Ų92.259%0.58750%0.504SS*.Hα-helixtrans-56.2-43.4174-77178.9178.5-179.90112.4L204 A205 T210 V211 Q212L204-K208 WeakPolarHBondContact O-CB 3.29Å; L204-K208 WeakPolarHBondContact O-CG 3.36Å; L204-K208 PolarHBondContact O-N 2.97Å; A205-K208 PolarHBondContact O-N 3.23Å; K208-T210 VanDerWaalsContact C-N 3.33Å; K208-T210 PolarHBondContact O-N 3.21Å; K208-V211 PolarHBondContact O-N 2.9Å; K208-Q212 WeakPolarHBondContact O-CB 3.5Å; K208-Q212 PolarHBondContact O-N 2.94Å
209L86.9Confident85.2Confident88 Ų8894.6 Ų94.646%0.46151%0.509SS..Hα-helixtrans-63.7-38.1177.1-167.476000111.9A205 K206 S207 Q212 K213A205-L209 PolarHBondContact O-N 3.44Å; K206-L209 WeakPolarHBondContact O-CB 3.4Å; K206-L209 PolarHBondContact O-N 3.4Å; S207-L209 VanDerWaalsContact C-N 3.32Å; S207-L209 PolarHBondContact O-N 3.44Å; L209-Q212 PolarHBondContact O-N 2.9Å; L209-K213 WeakPolarHBondContact O-CB 3.26Å; L209-K213 WeakPolarHBondContact O-CG 3.23Å; L209-K213 PolarHBondContact O-N 3.22Å
210T82.6Confident84.8Confident85 Ų8595.4 Ų95.452%0.52151%0.513SS..Hα-helixtrans-67.6-38.4175.962.20000112.7K206 S207 K208 K213 S214K206-T210 WeakPolarHBondContact O-CG2 3.33Å; K206-T210 PolarHBondContact O-N 2.82Å; S207-T210 PolarHBondContact O-N 2.85Å; S207-T210 PolarHBondContact O-OG1 3.38Å; K208-T210 VanDerWaalsContact C-N 3.33Å; K208-T210 PolarHBondContact O-N 3.21Å; T210-K213 PolarHBondContact O-N 3.48Å; T210-S214 PolarHBondContact O-N 2.91Å; T210-S214 PolarHBondContact O-OG 2.91Å
211V83.3Confident84.4Confident88 Ų8896.2 Ų96.253%0.53352%0.517SS..Hα-helixtrans-65.5-43.1173.8174.20000110.7S207 K208 K213 S214 S215S207-V211 WeakPolarHBondContact O-CG2 3.4Å; S207-V211 PolarHBondContact O-N 2.79Å; K208-V211 PolarHBondContact O-N 2.9Å; V211-K213 PolarHBondContact O-N 3.32Å; V211-S214 VanDerWaalsContact CA-OG 3.31Å; V211-S214 WeakPolarHBondContact CA-OG 3.36Å; V211-S214 PolarHBondContact O-N 3.4Å; V211-S214 PolarHBondContact O-OG 3.3Å; V211-S215 WeakPolarHBondContact O-CB 3.3Å; V211-S215 PolarHBondContact O-N 3.28Å
212Q85.7Confident84.1Confident135 Ų13595.3 Ų95.363%0.63151%0.514SS*.Hα-helixtrans-64-43177.3-166.2-179.417.100112K208 L209 S214 S215 A216K208-Q212 WeakPolarHBondContact O-CB 3.5Å; K208-Q212 PolarHBondContact O-N 2.94Å; L209-Q212 PolarHBondContact O-N 2.9Å; Q212-S214 VanDerWaalsContact C-N 3.35Å; Q212-S214 PolarHBondContact O-N 3.4Å; Q212-S215 PolarHBondContact O-N 3.01Å; Q212-A216 WeakPolarHBondContact O-CB 3.47Å; Q212-A216 PolarHBondContact O-N 2.95Å
213K85.3Confident83.8Confident121 Ų12197.3 Ų97.353%0.52652%0.519SS..Hα-helixtrans-63-38.7175.6-76.3177.9-178.9179.70112.5L209 T210 V211 R217L209-K213 WeakPolarHBondContact O-CB 3.26Å; L209-K213 WeakPolarHBondContact O-CG 3.23Å; L209-K213 PolarHBondContact O-N 3.22Å; T210-K213 PolarHBondContact O-N 3.48Å; V211-K213 PolarHBondContact O-N 3.32Å; K213-R217 WeakPolarHBondContact O-CG 3.43Å; K213-R217 PolarHBondContact O-N 3.49Å; K213-R217 VanDerWaalsContact O-N 3.14Å
214S79.6Confident83.7Confident63 Ų6396.7 Ų96.744%0.44152%0.516SS..Hα-helixtrans-71.4-38.6176.747.10000112T210 V211 Q212 R217 A218T210-S214 PolarHBondContact O-N 2.91Å; T210-S214 PolarHBondContact O-OG 2.91Å; V211-S214 VanDerWaalsContact CA-OG 3.31Å; V211-S214 WeakPolarHBondContact CA-OG 3.36Å; V211-S214 PolarHBondContact O-N 3.4Å; V211-S214 PolarHBondContact O-OG 3.3Å; Q212-S214 VanDerWaalsContact C-N 3.35Å; Q212-S214 PolarHBondContact O-N 3.4Å; S214-R217 PolarHBondContact O-N 2.92Å; S214-A218 PolarHBondContact O-N 3.46Å
215S83.3Confident83.3Confident59 Ų59100 Ų10041%0.41352%0.523SS..Hα-helixtrans-59.9-47.8171.7-166.30000111.9V211 Q212 R217 A218 E219V211-S215 WeakPolarHBondContact O-CB 3.3Å; V211-S215 PolarHBondContact O-N 3.28Å; Q212-S215 PolarHBondContact O-N 3.01Å; S215-R217 VanDerWaalsContact C-N 3.3Å; S215-R217 PolarHBondContact O-N 2.91Å; S215-A218 WeakPolarHBondContact O-CB 3.39Å; S215-A218 PolarHBondContact O-N 3.4Å; S215-A218 VanDerWaalsContact O-N 3.11Å; S215-E219 PolarHBondContact O-N 3.49Å
216A83.4Confident82.9Confident49 Ų49101.5 Ų101.541%0.40552%0.523SS..Hα-helixtrans-62.1-36177.900000112.7Q212 N220Q212-A216 WeakPolarHBondContact O-CB 3.47Å; Q212-A216 PolarHBondContact O-N 2.95Å; A216-N220 PolarHBondContact O-N 3.43Å
217R82.3Confident82.6Confident177 Ų177100.2 Ų100.267%0.66852%0.519SS*.Hα-helixtrans-66.2-42.3172.7-75173.5-177.4162.1-0.6112K213 S214 S215 N220 L221K213-R217 WeakPolarHBondContact O-CG 3.43Å; K213-R217 PolarHBondContact O-N 3.49Å; K213-R217 VanDerWaalsContact O-N 3.14Å; S214-R217 PolarHBondContact O-N 2.92Å; S215-R217 VanDerWaalsContact C-N 3.3Å; S215-R217 PolarHBondContact O-N 2.91Å; R217-N220 PolarHBondContact O-N 2.92Å; R217-L221 WeakPolarHBondContact O-CG 3.44Å; R217-L221 PolarHBondContact O-N 3.02Å
218A79.1Confident82.3Confident58 Ų58102.4 Ų102.448%0.47953%0.525SS..Hα-helixtrans-63-42.617700000111.6S214 S215 L221 A222S214-A218 PolarHBondContact O-N 3.46Å; S215-A218 WeakPolarHBondContact O-CB 3.39Å; S215-A218 PolarHBondContact O-N 3.4Å; S215-A218 VanDerWaalsContact O-N 3.11Å; A218-L221 PolarHBondContact O-N 3.38Å; A218-A222 WeakPolarHBondContact O-CB 3.36Å; A218-A222 PolarHBondContact O-N 2.97Å
219E82.1Confident82.1Confident116 Ų116102.5 Ų102.554%0.54252%0.522SS..Hα-helixtrans-62.7-43174.6-76.4177.6-165.100112.6S215 A222 K223S215-E219 PolarHBondContact O-N 3.49Å; E219-A222 PolarHBondContact O-N 2.96Å; E219-K223 WeakPolarHBondContact O-CG 3.44Å; E219-K223 PolarHBondContact O-N 3.36Å
220N81.7Confident81.7Confident92 Ų92102.1 Ų102.149%0.49253%0.526SS..Hα-helixtrans-64.5-40.5176.2-93.8-16.9000112.4A216 R217 A222 K223 Q224A216-N220 PolarHBondContact O-N 3.43Å; R217-N220 PolarHBondContact O-N 2.92Å; N220-A222 VanDerWaalsContact C-N 3.33Å; N220-K223 PolarHBondContact O-N 2.99Å; N220-Q224 WeakPolarHBondContact O-CG 3.45Å; N220-Q224 PolarHBondContact O-N 3.21Å
221L80.9Confident81.5Confident112 Ų112104.5 Ų104.559%0.58653%0.529SS*.Hα-helixtrans-63.3-40.3173.7-78.1167.5000111.6R217 A218 K223 Q224 Y225R217-L221 WeakPolarHBondContact O-CG 3.44Å; R217-L221 PolarHBondContact O-N 3.02Å; A218-L221 PolarHBondContact O-N 3.38Å; L221-K223 PolarHBondContact O-N 2.9Å; L221-Q224 PolarHBondContact O-N 3.5Å; L221-Y225 WeakPolarHBondContact O-CB 3.32Å; L221-Y225 PolarHBondContact O-N 3.32Å
222A79.8Confident81.1Confident52 Ų52104.1 Ų104.143%0.4353%0.527SS..Hα-helixtrans-63.3-40.3175.500000112.1A218 E219 N220 Y225 N226A218-A222 WeakPolarHBondContact O-CB 3.36Å; A218-A222 PolarHBondContact O-N 2.97Å; E219-A222 PolarHBondContact O-N 2.96Å; N220-A222 VanDerWaalsContact C-N 3.33Å; A222-Y225 PolarHBondContact O-N 2.98Å; A222-N226 WeakPolarHBondContact O-CB 3.36Å; A222-N226 PolarHBondContact O-N 3.45Å; A222-N226 PolarHBondContact O-ND2 3.33Å
223K83.5Confident80.8Confident125 Ų125102.2 Ų102.254%0.54352%0.518SS..Hα-helixtrans-62.6-47.4173.6-73.1177.1-175.9175.30111.9E219 N220 L221 Y225 N226 E227E219-K223 WeakPolarHBondContact O-CG 3.44Å; E219-K223 PolarHBondContact O-N 3.36Å; N220-K223 PolarHBondContact O-N 2.99Å; L221-K223 PolarHBondContact O-N 2.9Å; K223-Y225 VanDerWaalsContact C-N 3.32Å; K223-Y225 PolarHBondContact O-N 3.39Å; K223-N226 PolarHBondContact O-N 2.9Å; K223-E227 PolarHBondContact O-N 2.9Å
224Q83.8Confident80.5Confident113 Ų113102.6 Ų102.653%0.52852%0.522SS..Hα-helixtrans-60.6-41.2176.8-71.9178.415.400112N220 L221 E227 L228N220-Q224 WeakPolarHBondContact O-CG 3.45Å; N220-Q224 PolarHBondContact O-N 3.21Å; L221-Q224 PolarHBondContact O-N 3.5Å; Q224-E227 PolarHBondContact O-N 3.26Å; Q224-L228 WeakPolarHBondContact O-CB 3.43Å; Q224-L228 WeakPolarHBondContact O-CG 3.34Å; Q224-L228 PolarHBondContact O-N 3.42Å
225Y79.3Confident80.2Confident166 Ų166102.1 Ų102.165%0.65152%0.522SS*.Hα-helixtrans-62.4-43.1175.8-166.9-90.3000111.7L221 A222 K223 L228 R229L221-Y225 WeakPolarHBondContact O-CB 3.32Å; L221-Y225 PolarHBondContact O-N 3.32Å; A222-Y225 PolarHBondContact O-N 2.98Å; K223-Y225 VanDerWaalsContact C-N 3.32Å; K223-Y225 PolarHBondContact O-N 3.39Å; Y225-L228 PolarHBondContact O-N 3.4Å; Y225-R229 WeakPolarHBondContact O-CB 3.39Å; Y225-R229 PolarHBondContact O-N 2.96Å
226N79.1Confident79.9Confident88 Ų88103.9 Ų103.947%0.47153%0.526SS..Hα-helixtrans-65.4-40.3176.4-77.4-26.4000112.6A222 K223 R229 C230A222-N226 WeakPolarHBondContact O-CB 3.36Å; A222-N226 PolarHBondContact O-N 3.45Å; A222-N226 PolarHBondContact O-ND2 3.33Å; K223-N226 PolarHBondContact O-N 2.9Å; N226-R229 WeakPolarHBondContact O-CB 3.43Å; N226-R229 PolarHBondContact O-N 2.86Å; N226-C230 WeakPolarHBondContact O-CB 3.25Å; N226-C230 PolarHBondContact O-N 3.16Å
227E81.5Confident79.5Confident120 Ų120103.9 Ų103.956%0.56153%0.526SS*.Hα-helixtrans-63.3-44.3174.5-78-178.9-175.400112.3K223 Q224 R229 C230 K231K223-E227 PolarHBondContact O-N 2.9Å; Q224-E227 PolarHBondContact O-N 3.26Å; E227-R229 VanDerWaalsContact C-N 3.32Å; E227-R229 PolarHBondContact O-N 2.82Å; E227-C230 PolarHBondContact O-N 3.5Å; E227-K231 WeakPolarHBondContact O-CG 3.39Å; E227-K231 PolarHBondContact O-N 3.49Å
228L77.4Confident79.2Confident108 Ų108100.2 Ų100.257%0.56552%0.52SS*.Hα-helixtrans-61.1-43.2175-74.4171.6000110.9Q224 Y225 C230 K231 T232Q224-L228 WeakPolarHBondContact O-CB 3.43Å; Q224-L228 WeakPolarHBondContact O-CG 3.34Å; Q224-L228 PolarHBondContact O-N 3.42Å; Y225-L228 PolarHBondContact O-N 3.4Å; L228-C230 PolarHBondContact O-N 2.99Å; L228-K231 PolarHBondContact O-N 3.39Å; L228-T232 WeakPolarHBondContact O-CB 3.35Å; L228-T232 PolarHBondContact O-N 3.07Å; L228-T232 PolarHBondContact O-OG1 3.25Å
229R82.8Confident78.7Confident138 Ų138102.4 Ų102.452%0.52152%0.523SS..Hα-helixtrans-58.8-47.7175.2-165.9-173.8117.9-1661111.5Y225 N226 E227 K231 T232 E233Y225-R229 WeakPolarHBondContact O-CB 3.39Å; Y225-R229 PolarHBondContact O-N 2.96Å; N226-R229 WeakPolarHBondContact O-CB 3.43Å; N226-R229 PolarHBondContact O-N 2.86Å; E227-R229 VanDerWaalsContact C-N 3.32Å; E227-R229 PolarHBondContact O-N 2.82Å; R229-K231 PolarHBondContact O-N 3.32Å; R229-T232 WeakPolarHBondContact O-CB 3.48Å; R229-T232 PolarHBondContact O-N 3.38Å; R229-T232 VanDerWaalsContact O-N 3.14Å; R229-E233 IonicContact CZ-OE1 2.76Å; R229-E233 IonicContact NE-OE1 3.7Å; R229-E233 PolarHBondContact NE-OE1 2.93Å; R229-E233 IonicContact NH2-OE1 3.71Å; R229-E233 PolarHBondContact NH2-OE1 3.12Å; R229-E233 WeakPolarHBondContact O-CG 3.48Å; R229-E233 PolarHBondContact O-N 3.39Å
230C78.5Confident78Confident79 Ų79100 Ų10053%0.53452%0.516SS..Hα-helixtrans-62.4-42.2179.1-133.60000112.2N226 E227 L228 T232 E233 Q234N226-C230 WeakPolarHBondContact O-CB 3.25Å; N226-C230 PolarHBondContact O-N 3.16Å; E227-C230 PolarHBondContact O-N 3.5Å; L228-C230 PolarHBondContact O-N 2.99Å; C230-T232 VanDerWaalsContact C-N 3.3Å; C230-T232 PolarHBondContact O-N 2.9Å; C230-E233 PolarHBondContact O-N 3.23Å; C230-Q234 WeakPolarHBondContact O-CB 3.45Å; C230-Q234 PolarHBondContact O-N 3.44Å
231K78.5Confident77.3Confident136 Ų136102.3 Ų102.359%0.59152%0.524SS*.Hα-helixtrans-62.3-37.7174.3-73.5177.3-177.8174.20112E227 L228 R229 Q234 A235E227-K231 WeakPolarHBondContact O-CG 3.39Å; E227-K231 PolarHBondContact O-N 3.49Å; L228-K231 PolarHBondContact O-N 3.39Å; R229-K231 PolarHBondContact O-N 3.32Å; K231-Q234 PolarHBondContact O-N 3.23Å; K231-A235 WeakPolarHBondContact O-CB 3.4Å; K231-A235 PolarHBondContact O-N 3.28Å
232T75.8Confident76.5Confident79 Ų79103.1 Ų103.149%0.48553%0.529SS..Hα-helixtrans-68.6-43177.4-44.50000111.1L228 R229 C230 Q234 A235 N236L228-T232 WeakPolarHBondContact O-CB 3.35Å; L228-T232 PolarHBondContact O-N 3.07Å; L228-T232 PolarHBondContact O-OG1 3.25Å; R229-T232 WeakPolarHBondContact O-CB 3.48Å; R229-T232 PolarHBondContact O-N 3.38Å; R229-T232 VanDerWaalsContact O-N 3.14Å; C230-T232 VanDerWaalsContact C-N 3.3Å; C230-T232 PolarHBondContact O-N 2.9Å; T232-Q234 PolarHBondContact O-N 3.01Å; T232-A235 PolarHBondContact O-N 3.05Å; T232-N236 WeakPolarHBondContact O-CB 3.48Å; T232-N236 VanDerWaalsContact O-CG 3.25Å; T232-N236 PolarHBondContact O-N 3.41Å; T232-N236 PolarHBondContact O-ND2 2.96Å
233E79.4Confident75.4Confident95 Ų95104 Ų10444%0.44452%0.524SS..Hα-helixtrans-61-42.2173.8-72.5171.2-169.100111.5R229 C230 N236 A237R229-E233 IonicContact CZ-OE1 2.76Å; R229-E233 IonicContact NE-OE1 3.7Å; R229-E233 PolarHBondContact NE-OE1 2.93Å; R229-E233 IonicContact NH2-OE1 3.71Å; R229-E233 PolarHBondContact NH2-OE1 3.12Å; R229-E233 WeakPolarHBondContact O-CG 3.48Å; R229-E233 PolarHBondContact O-N 3.39Å; C230-E233 PolarHBondContact O-N 3.23Å; E233-N236 PolarHBondContact O-N 2.97Å; E233-A237 PolarHBondContact O-N 2.91Å
234Q79Confident74.1Confident130 Ų130105 Ų10561%0.60753%0.529SS*.Hα-helixtrans-67.5-40.2177.5-167.8174.816.900112.8C230 K231 T232 A237 N238C230-Q234 WeakPolarHBondContact O-CB 3.45Å; C230-Q234 PolarHBondContact O-N 3.44Å; K231-Q234 PolarHBondContact O-N 3.23Å; T232-Q234 PolarHBondContact O-N 3.01Å; Q234-A237 PolarHBondContact O-N 3.25Å; Q234-N238 PolarHBondContact O-N 3.24Å; Q234-N238 VanDerWaalsContact O-N 3.12Å
235A73.6Confident72.7Confident53 Ų53103.2 Ų103.244%0.43853%0.533SS..Hα-helixtrans-62.9-42.5174.200000111.6K231 T232 N238 L239K231-A235 WeakPolarHBondContact O-CB 3.4Å; K231-A235 PolarHBondContact O-N 3.28Å; T232-A235 PolarHBondContact O-N 3.05Å; A235-N238 PolarHBondContact O-N 2.97Å; A235-L239 PolarHBondContact O-N 3.15Å; A235-L239 VanDerWaalsContact O-N 3.11Å
236N76.7Confident71.7Confident95 Ų95100.5 Ų100.551%0.50853%0.533SS..Hα-helixtrans-63.1-40.9175.3-73.1-19.7000111.8T232 E233 N238 L239 T240T232-N236 WeakPolarHBondContact O-CB 3.48Å; T232-N236 VanDerWaalsContact O-CG 3.25Å; T232-N236 PolarHBondContact O-N 3.41Å; T232-N236 PolarHBondContact O-ND2 2.96Å; E233-N236 PolarHBondContact O-N 2.97Å; N236-N238 PolarHBondContact O-N 3.41Å; N236-L239 PolarHBondContact O-N 2.97Å; N236-T240 WeakPolarHBondContact O-CG2 3.28Å; N236-T240 PolarHBondContact O-N 2.94Å; N236-T240 PolarHBondContact O-OG1 3.45Å
237A75.3Confident70.3Confident49 Ų49101.5 Ų101.541%0.40553%0.53SS..Hα-helixtrans-60.2-45.4176.500000112.1E233 Q234 L239 T240 Q241E233-A237 PolarHBondContact O-N 2.91Å; Q234-A237 PolarHBondContact O-N 3.25Å; A237-L239 VanDerWaalsContact C-N 3.32Å; A237-L239 PolarHBondContact O-N 2.91Å; A237-T240 WeakPolarHBondContact CA-OG1 3.4Å; A237-T240 PolarHBondContact O-N 3.26Å; A237-T240 PolarHBondContact O-OG1 2.99Å; A237-Q241 PolarHBondContact O-N 3.4Å; A237-Q241 VanDerWaalsContact O-N 3.11Å
238N74.8Confident69Low100 Ų100100.8 Ų100.854%0.53553%0.534SS..Hα-helixtrans-62.5-39.4176.8-70.9-17000112.3Q234 A235 N236 Q241 N242Q234-N238 PolarHBondContact O-N 3.24Å; Q234-N238 VanDerWaalsContact O-N 3.12Å; A235-N238 PolarHBondContact O-N 2.97Å; N236-N238 PolarHBondContact O-N 3.41Å; N238-Q241 PolarHBondContact O-N 3.49Å; N238-N242 PolarHBondContact O-N 3.43Å
239L69.5Low67.8Low105 Ų10599.9 Ų99.955%0.5554%0.543SS..Hα-helixtrans-64.1-43.9177.4-139.7141.1000110.9A235 N236 A237 Q241 N242 E243A235-L239 PolarHBondContact O-N 3.15Å; A235-L239 VanDerWaalsContact O-N 3.11Å; N236-L239 PolarHBondContact O-N 2.97Å; A237-L239 VanDerWaalsContact C-N 3.32Å; A237-L239 PolarHBondContact O-N 2.91Å; L239-Q241 VanDerWaalsContact C-N 3.3Å; L239-Q241 PolarHBondContact O-N 3.36Å; L239-N242 PolarHBondContact O-N 2.95Å; L239-E243 HydrophobicContact CD2-CG 4.5Å; L239-E243 WeakPolarHBondContact O-CG 3.45Å; L239-E243 PolarHBondContact O-N 3Å; L239-E243 VanDerWaalsContact O-N 3.09Å
240T66.4Low66.3Low64 Ų6497.4 Ų97.439%0.39355%0.546SS..Hα-helixtrans-65-28.5176.458.50000114N236 A237 K244N236-T240 WeakPolarHBondContact O-CG2 3.28Å; N236-T240 PolarHBondContact O-N 2.94Å; N236-T240 PolarHBondContact O-OG1 3.45Å; A237-T240 WeakPolarHBondContact CA-OG1 3.4Å; A237-T240 PolarHBondContact O-N 3.26Å; A237-T240 PolarHBondContact O-OG1 2.99Å; T240-K244 WeakPolarHBondContact O-CG 3.46Å; T240-K244 PolarHBondContact O-N 3.3Å
241Q68.2Low64.9Low142 Ų14299.3 Ų99.366%0.66455%0.547SS*.Hα-helixtrans-71.2-38175.4-172.5169.4-10.300112A237 N238 L239A237-Q241 PolarHBondContact O-N 3.4Å; A237-Q241 VanDerWaalsContact O-N 3.11Å; N238-Q241 PolarHBondContact O-N 3.49Å; L239-Q241 VanDerWaalsContact C-N 3.3Å; L239-Q241 PolarHBondContact O-N 3.36Å
242N63.9Low63.4Low129 Ų129104 Ų10469%0.6956%0.561SS**Hα-helixtrans-67.7-39.4173.7-97-6.3000112.4N238 L239 K244 A245N238-N242 PolarHBondContact O-N 3.43Å; L239-N242 PolarHBondContact O-N 2.95Å; N242-K244 VanDerWaalsContact C-N 3.32Å; N242-K244 PolarHBondContact O-N 2.89Å; N242-A245 PolarHBondContact O-N 3.27Å
243E55.5Low61.9Low71 Ų71111.6 Ų111.633%0.33258%0.581SS.*Hα-helixtrans-65.8-33.4178-69.9-176.5154.700113.1L239 A245 V246 R247L239-E243 HydrophobicContact CD2-CG 4.5Å; L239-E243 WeakPolarHBondContact O-CG 3.45Å; L239-E243 PolarHBondContact O-N 3Å; L239-E243 VanDerWaalsContact O-N 3.09Å; E243-A245 PolarHBondContact O-N 3.08Å; E243-V246 PolarHBondContact O-N 3.27Å; E243-V246 VanDerWaalsContact O-N 3.13Å; E243-R247 VanDerWaalsContact CB-NH1 3.34Å; E243-R247 VanDerWaalsContact CD-NH2 3.3Å; E243-R247 WeakPolarHBondContact O-CG 3.42Å; E243-R247 PolarHBondContact O-N 2.85Å; E243-R247 IonicContact OE1-NH2 2.72Å; E243-R247 IonicContact OE2-CZ 2.94Å; E243-R247 VanDerWaalsContact OE2-CZ 3.24Å; E243-R247 IonicContact OE2-NH1 3.56Å; E243-R247 PolarHBondContact OE2-NH1 3.47Å; E243-R247 IonicContact OE2-NH2 3.88Å; E243-R247 PolarHBondContact OE2-NH2 2.85Å
244K56.2Low60.5Low146 Ų146109.9 Ų109.964%0.63558%0.58SS**Hα-helixtrans-62.5-28.8177.3-78.9175.4-179.5178.40113.1T240 N242 V246T240-K244 WeakPolarHBondContact O-CG 3.46Å; T240-K244 PolarHBondContact O-N 3.3Å; N242-K244 VanDerWaalsContact C-N 3.32Å; N242-K244 PolarHBondContact O-N 2.89Å; K244-V246 VanDerWaalsContact C-N 3.34Å
245A56Low59.3Low74 Ų74108.6 Ų108.661%0.61259%0.585SS**Hα-helixtrans-72.6-26.4176.200000113N242 E243 T248N242-A245 PolarHBondContact O-N 3.27Å; E243-A245 PolarHBondContact O-N 3.08Å; A245-T248 PolarHBondContact O-OG1 3.38Å
246V56.8Low58.2Low109 Ų109110.7 Ų110.766%0.66160%0.602SS**Hα-helixtrans-89.7-30.9178.6178.20000111.5E243 K244 T248 A249E243-V246 PolarHBondContact O-N 3.27Å; E243-V246 VanDerWaalsContact O-N 3.13Å; K244-V246 VanDerWaalsContact C-N 3.34Å; V246-T248 PolarHBondContact O-N 3.07Å; V246-A249 PolarHBondContact O-N 3.42Å
247R51Low56.8Low109 Ų109113.8 Ų113.841%0.41161%0.614SS.*Hα-helixtrans-70.6-27.7-177.2-77.3-171-172.61116115.2E243 A249 S250 E251E243-R247 VanDerWaalsContact CB-NH1 3.34Å; E243-R247 VanDerWaalsContact CD-NH2 3.3Å; E243-R247 WeakPolarHBondContact O-CG 3.42Å; E243-R247 PolarHBondContact O-N 2.85Å; E243-R247 IonicContact OE1-NH2 2.72Å; E243-R247 IonicContact OE2-CZ 2.94Å; E243-R247 VanDerWaalsContact OE2-CZ 3.24Å; E243-R247 IonicContact OE2-NH1 3.56Å; E243-R247 PolarHBondContact OE2-NH1 3.47Å; E243-R247 IonicContact OE2-NH2 3.88Å; E243-R247 PolarHBondContact OE2-NH2 2.85Å; R247-A249 PolarHBondContact O-N 3.41Å; R247-A249 VanDerWaalsContact O-N 3.09Å; R247-S250 PolarHBondContact O-N 3.24Å; R247-E251 HydrophobicContact CB-CG 4.49Å; R247-E251 WeakPolarHBondContact O-CG 3.5Å; R247-E251 PolarHBondContact O-N 3.4Å; R247-E251 VanDerWaalsContact O-N 3.15Å
248T53.4Low55.8Low105 Ų105116.5 Ų116.564%0.64462%0.621SS**THydrogen-bonded Turntrans-62-18.6175.7420000114.1A245 V246A245-T248 PolarHBondContact O-OG1 3.38Å; V246-T248 PolarHBondContact O-N 3.07Å
249A52Low54.8Low89 Ų89115.3 Ų115.374%0.73663%0.626SS**THydrogen-bonded Turntrans-86.1-23.8174.500000113.9V246 R247V246-A249 PolarHBondContact O-N 3.42Å; R247-A249 PolarHBondContact O-N 3.41Å; R247-A249 VanDerWaalsContact O-N 3.09Å
250S52.9Low54Low86 Ų86116.9 Ų116.960%0.60163%0.634SS**THydrogen-bonded Turntrans-100.8-27-172.9-1740000113.5R247 R252 R253R247-S250 PolarHBondContact O-N 3.24Å; S250-R252 PolarHBondContact O-N 2.9Å; S250-R253 PolarHBondContact O-N 2.97Å
251E47.7Very low53.6Low119 Ų119118 Ų11856%0.55664%0.64SS**Hα-helixtrans-71.2-2.8-170.1-76171.2174.600116.1R247 R253R247-E251 HydrophobicContact CB-CG 4.49Å; R247-E251 WeakPolarHBondContact O-CG 3.5Å; R247-E251 PolarHBondContact O-N 3.4Å; R247-E251 VanDerWaalsContact O-N 3.15Å; E251-R253 VanDerWaalsContact C-N 3.31Å; E251-R253 PolarHBondContact O-N 2.92Å
252R46.5Very low53.4Low234 Ų234113.4 Ų113.488%0.88363%0.627SS**Hα-helixtrans-74-14.2171.1-71-163-166.1109.92.2114.7S250S250-R252 PolarHBondContact O-N 2.9Å
253R46.2Very low53.5Low240 Ų240110.1 Ų110.191%0.90662%0.617SS**Hα-helixtrans-108.4-24.7-177.5-77.5-171.7-156.1134.15.5116.5S250 E251S250-R253 PolarHBondContact O-N 2.97Å; E251-R253 VanDerWaalsContact C-N 3.31Å; E251-R253 PolarHBondContact O-N 2.92Å
254S49.1Very low54.1Low58 Ų58112.9 Ų112.941%0.40663%0.63SS.*Hα-helixtrans-104.2-5-169.7-173.80000115.1A256 E257S254-A256 PolarHBondContact O-N 3.24Å; S254-A256 VanDerWaalsContact O-N 3.14Å; S254-E257 PolarHBondContact O-N 3.47Å
255S52.9Low54.8Low104 Ų104111.7 Ų111.773%0.72763%0.627SS**THydrogen-bonded Turntrans-69.2-11.8-173.8-147.50000115.2
256A51.1Low55.7Low96 Ų96116.6 Ų116.679%0.79363%0.629SS**THydrogen-bonded Turntrans-86-2617900000113.9S254S254-A256 PolarHBondContact O-N 3.24Å; S254-A256 VanDerWaalsContact O-N 3.14Å
257E46.9Very low56.6Low160 Ų160114.2 Ų114.275%0.74862%0.621SS**THydrogen-bonded Turntrans-93.3-26.5-175.1-91.2166.1157.900114.1S254 A259S254-E257 PolarHBondContact O-N 3.47Å; E257-A259 VanDerWaalsContact C-N 3.32Å; E257-A259 PolarHBondContact O-N 2.94Å
258N54.6Low58Low106 Ų106113.6 Ų113.657%0.56763%0.626SS**Hα-helixtrans-75.4-12.9-175.7-74.2-27.6000115.3L260N258-L260 VanDerWaalsContact C-N 3.33Å; N258-L260 PolarHBondContact O-N 3.11Å
259A54.5Low59.2Low76 Ų76113.4 Ų113.463%0.62862%0.621SS**Hα-helixtrans-70.2-29-179.200000113E257E257-A259 VanDerWaalsContact C-N 3.32Å; E257-A259 PolarHBondContact O-N 2.94Å
260L51.6Low60.6Low137 Ų137115.2 Ų115.272%0.71762%0.617SS**Hα-helixtrans-80.2-35.5-178.6-103.1158.8000113N258N258-L260 VanDerWaalsContact C-N 3.33Å; N258-L260 PolarHBondContact O-N 3.11Å
261V59.7Low62.1Low88 Ų88115.1 Ų115.153%0.53362%0.616SS.*Hα-helixtrans-71.8-33.8-179.31790000112.1A263 H264 H265V261-A263 VanDerWaalsContact C-N 3.28Å; V261-A263 PolarHBondContact O-N 3.28Å; V261-H264 PolarHBondContact O-N 3.01Å; V261-H265 PolarHBondContact O-N 3.01Å
262A62.9Low63.7Low45 Ų45113.3 Ų113.337%0.37261%0.613SS.*Hα-helixtrans-67.2-25.6-179.800000113.8
263A65.8Low65.5Low60 Ų60109 Ų10950%0.49660%0.597SS.*Hα-helixtrans-72.4-39.3176.500000111.7V261V261-A263 VanDerWaalsContact C-N 3.28Å; V261-A263 PolarHBondContact O-N 3.28Å
264H67.8Low67.3Low130 Ų130102.3 Ų102.360%0.60258%0.579SS**Hα-helixtrans-67-45.2178.7-85.2-72.7000112.8V261 R266 A267 D268V261-H264 PolarHBondContact O-N 3.01Å; H264-R266 PolarHBondContact O-N 3Å; H264-A267 PolarHBondContact O-N 3.16Å; H264-A267 VanDerWaalsContact O-N 3.1Å; H264-D268 PolarHBondContact O-N 3.3Å
265H71.4Confident69.1Low121 Ų121102.7 Ų102.756%0.5658%0.579SS**Hα-helixtrans-61.3-30.1179.3-96.544.9000114V261 N269V261-H265 PolarHBondContact O-N 3.01Å; H265-N269 VanDerWaalsContact O-CG 3.28Å; H265-N269 PolarHBondContact O-N 2.9Å; H265-N269 PolarHBondContact O-ND2 2.96Å
266R75Confident70.6Confident177 Ų177102 Ų10267%0.66856%0.564SS**Hα-helixtrans-69.4-36.7176.7-75-177.8-174.2139.61.9112.1H264 L270H264-R266 PolarHBondContact O-N 3Å; R266-L270 WeakPolarHBondContact O-CG 3.43Å; R266-L270 PolarHBondContact O-N 3.23Å
267A76.2Confident72.3Confident58 Ų58100.7 Ų100.748%0.47954%0.543SS..Hα-helixtrans-66.3-43.2177.700000111.4H264 N269 L270 C271H264-A267 PolarHBondContact O-N 3.16Å; H264-A267 VanDerWaalsContact O-N 3.1Å; A267-N269 PolarHBondContact O-N 3.31Å; A267-L270 PolarHBondContact O-N 2.86Å; A267-C271 PolarHBondContact O-N 2.91Å
268D79.5Confident74.2Confident97 Ų9798.5 Ų98.552%0.51953%0.533SS..Hα-helixtrans-66.4-39.3-179.7-65.8-25.3000112.6H264 L270 C271 T272H264-D268 PolarHBondContact O-N 3.3Å; D268-L270 VanDerWaalsContact C-N 3.32Å; D268-L270 PolarHBondContact O-N 3.36Å; D268-C271 PolarHBondContact O-N 2.92Å; D268-T272 WeakPolarHBondContact O-CG2 3.41Å; D268-T272 PolarHBondContact O-N 3.37Å; D268-T272 PolarHBondContact O-OG1 2.91Å
269N78.2Confident75.7Confident101 Ų10199.6 Ų99.654%0.5453%0.533SS..Hα-helixtrans-64.2-36.1175.7-74.3-23.3000112.6H265 A267 T272 R273H265-N269 VanDerWaalsContact O-CG 3.28Å; H265-N269 PolarHBondContact O-N 2.9Å; H265-N269 PolarHBondContact O-ND2 2.96Å; A267-N269 PolarHBondContact O-N 3.31Å; N269-T272 WeakPolarHBondContact CA-OG1 3.42Å; N269-T272 PolarHBondContact O-OG1 2.95Å; N269-R273 WeakPolarHBondContact O-CB 3.46Å; N269-R273 PolarHBondContact O-N 3.5Å
270L82.6Confident77.2Confident126 Ų12699.7 Ų99.766%0.6652%0.52SS*.Hα-helixtrans-70.3-37.8174.7-69.5174.7000111.4R266 A267 D268 R273 N274R266-L270 WeakPolarHBondContact O-CG 3.43Å; R266-L270 PolarHBondContact O-N 3.23Å; A267-L270 PolarHBondContact O-N 2.86Å; D268-L270 VanDerWaalsContact C-N 3.32Å; D268-L270 PolarHBondContact O-N 3.36Å; L270-R273 PolarHBondContact O-N 3.23Å; L270-N274 PolarHBondContact O-N 3.34Å
271C83.5Confident78.8Confident84 Ų8498.9 Ų98.957%0.56852%0.516SS*.Hα-helixtrans-64.1-45.1177.6-145.30000111.7A267 D268 N274 T275A267-C271 PolarHBondContact O-N 2.91Å; D268-C271 PolarHBondContact O-N 2.92Å; C271-N274 PolarHBondContact O-N 3.24Å; C271-T275 PolarHBondContact O-N 2.89Å; C271-T275 PolarHBondContact O-OG1 2.87Å
272T82.3Confident80.2Confident82 Ų8298.5 Ų98.550%0.50351%0.514SS..Hα-helixtrans-64.4-42.7175.652.20000112.4D268 N269 N274 T275 Q276D268-T272 WeakPolarHBondContact O-CG2 3.41Å; D268-T272 PolarHBondContact O-N 3.37Å; D268-T272 PolarHBondContact O-OG1 2.91Å; N269-T272 WeakPolarHBondContact CA-OG1 3.42Å; N269-T272 PolarHBondContact O-OG1 2.95Å; T272-N274 VanDerWaalsContact C-N 3.29Å; T272-N274 PolarHBondContact O-N 3.38Å; T272-T275 WeakPolarHBondContact CA-OG1 3.37Å; T272-T275 PolarHBondContact O-N 3.49Å; T272-T275 PolarHBondContact O-OG1 2.73Å; T272-Q276 PolarHBondContact O-N 2.96Å
273R84.6Confident81.3Confident142 Ų142100 Ų10054%0.53652%0.519SS..Hα-helixtrans-57.1-43173.4-173.582176.9117.41111.4N269 L270 Q276 L277N269-R273 WeakPolarHBondContact O-CB 3.46Å; N269-R273 PolarHBondContact O-N 3.5Å; L270-R273 PolarHBondContact O-N 3.23Å; R273-Q276 PolarHBondContact O-N 3.27Å; R273-L277 HydrophobicContact CG-CD1 4.24Å; R273-L277 WeakPolarHBondContact O-CG 3.5Å; R273-L277 PolarHBondContact O-N 2.83Å
274N82.4Confident82.4Confident100 Ų100102 Ų10254%0.53552%0.52SS..Hα-helixtrans-63.8-47.2178.8-124.8-2.7000111.4L270 C271 T272 Q276 L277 E278L270-N274 PolarHBondContact O-N 3.34Å; C271-N274 PolarHBondContact O-N 3.24Å; T272-N274 VanDerWaalsContact C-N 3.29Å; T272-N274 PolarHBondContact O-N 3.38Å; N274-Q276 VanDerWaalsContact C-N 3.26Å; N274-Q276 PolarHBondContact O-N 3.01Å; N274-L277 PolarHBondContact O-N 3.32Å; N274-L277 VanDerWaalsContact O-N 3.17Å; N274-E278 WeakPolarHBondContact O-CG 3.35Å; N274-E278 PolarHBondContact O-N 3.14Å
275T88.6Confident83.4Confident66 Ų66102.1 Ų102.141%0.40552%0.519SS..Hα-helixtrans-61.7-32.5175.853.40000113.4C271 T272 K279C271-T275 PolarHBondContact O-N 2.89Å; C271-T275 PolarHBondContact O-OG1 2.87Å; T272-T275 WeakPolarHBondContact CA-OG1 3.37Å; T272-T275 PolarHBondContact O-N 3.49Å; T272-T275 PolarHBondContact O-OG1 2.73Å; T275-K279 WeakPolarHBondContact O-CG 3.41Å; T275-K279 PolarHBondContact O-N 3.01Å
276Q83.5Confident84.4Confident91 Ų9199.9 Ų99.943%0.42551%0.513SS..Hα-helixtrans-70.1-43.9175.2-175.763.820.300111.5T272 R273 N274 E278 K279 E280T272-Q276 PolarHBondContact O-N 2.96Å; R273-Q276 PolarHBondContact O-N 3.27Å; N274-Q276 VanDerWaalsContact C-N 3.26Å; N274-Q276 PolarHBondContact O-N 3.01Å; Q276-E278 VanDerWaalsContact C-N 3.32Å; Q276-E278 PolarHBondContact O-N 3.02Å; Q276-K279 WeakPolarHBondContact O-CB 3.28Å; Q276-K279 PolarHBondContact O-N 2.84Å; Q276-E280 PolarHBondContact NE2-OE1 3.47Å; Q276-E280 PolarHBondContact O-N 2.97Å
277L85.9Confident85Confident67 Ų6799.2 Ų99.235%0.35151%0.511SS..Hα-helixtrans-64.4-36.6176.7-72.8172.5000111.8R273 N274 E280 L281R273-L277 HydrophobicContact CG-CD1 4.24Å; R273-L277 WeakPolarHBondContact O-CG 3.5Å; R273-L277 PolarHBondContact O-N 2.83Å; N274-L277 PolarHBondContact O-N 3.32Å; N274-L277 VanDerWaalsContact O-N 3.17Å; L277-E280 PolarHBondContact O-N 3.4Å; L277-L281 WeakPolarHBondContact O-CB 3.47Å; L277-L281 PolarHBondContact O-N 2.83Å
278E87.9Confident85.6Confident115 Ų11599.2 Ų99.254%0.53751%0.511SS..Hα-helixtrans-62.1-41.9172.8-73.5173.6171.700111.7N274 Q276 L281 T282N274-E278 WeakPolarHBondContact O-CG 3.35Å; N274-E278 PolarHBondContact O-N 3.14Å; Q276-E278 VanDerWaalsContact C-N 3.32Å; Q276-E278 PolarHBondContact O-N 3.02Å; E278-L281 PolarHBondContact O-N 3.37Å; E278-T282 VanDerWaalsContact O-CG2 3.3Å; E278-T282 WeakPolarHBondContact O-CG2 3.38Å; E278-T282 PolarHBondContact O-N 3.23Å; E278-T282 PolarHBondContact O-OG1 2.89Å
279K85.9Confident86Confident129 Ų12999.1 Ų99.156%0.56151%0.508SS*.Hα-helixtrans-64-40.8174-71.5173.3-175.4175.80112.4T275 Q276 T282 T283T275-K279 WeakPolarHBondContact O-CG 3.41Å; T275-K279 PolarHBondContact O-N 3.01Å; Q276-K279 WeakPolarHBondContact O-CB 3.28Å; Q276-K279 PolarHBondContact O-N 2.84Å; K279-T282 WeakPolarHBondContact CA-OG1 3.34Å; K279-T282 PolarHBondContact O-N 3.09Å; K279-T282 PolarHBondContact O-OG1 3.3Å; K279-T283 WeakPolarHBondContact O-CG2 3.41Å; K279-T283 PolarHBondContact O-N 3.48Å; K279-T283 PolarHBondContact O-OG1 2.92Å
280E85.6Confident86.6Confident77 Ų7799.7 Ų99.736%0.3651%0.507SS..Hα-helixtrans-64.7-41.7175.1-73.3171.8-161.800111.3Q276 L277 T283 I284Q276-E280 PolarHBondContact NE2-OE1 3.47Å; Q276-E280 PolarHBondContact O-N 2.97Å; L277-E280 PolarHBondContact O-N 3.4Å; E280-T283 WeakPolarHBondContact CA-OG1 3.3Å; E280-T283 PolarHBondContact O-N 3.45Å; E280-T283 PolarHBondContact O-OG1 3.47Å; E280-I284 WeakPolarHBondContact O-CB 3.16Å; E280-I284 VanDerWaalsContact O-CG1 3.26Å; E280-I284 WeakPolarHBondContact O-CG1 3.41Å; E280-I284 PolarHBondContact O-N 3.47Å
281L85.8Confident86.9Confident120 Ų12098.8 Ų98.863%0.62850%0.499SS*.Hα-helixtrans-63-44.9175.7-114.1160.9000111.8L277 E278 I284 K285L277-L281 WeakPolarHBondContact O-CB 3.47Å; L277-L281 PolarHBondContact O-N 2.83Å; E278-L281 PolarHBondContact O-N 3.37Å; L281-I284 PolarHBondContact O-N 2.94Å; L281-K285 VanDerWaalsContact O-CB 3.28Å; L281-K285 WeakPolarHBondContact O-CB 3.44Å; L281-K285 PolarHBondContact O-N 2.96Å
282T88.5Confident87.2Confident81 Ų8197.1 Ų97.150%0.49749%0.492SS..Hα-helixtrans-63.8-41.6176.658.40000112.2E278 K279 K285 V286E278-T282 VanDerWaalsContact O-CG2 3.3Å; E278-T282 WeakPolarHBondContact O-CG2 3.38Å; E278-T282 PolarHBondContact O-N 3.23Å; E278-T282 PolarHBondContact O-OG1 2.89Å; K279-T282 WeakPolarHBondContact CA-OG1 3.34Å; K279-T282 PolarHBondContact O-N 3.09Å; K279-T282 PolarHBondContact O-OG1 3.3Å; T282-K285 PolarHBondContact O-N 3.38Å; T282-V286 WeakPolarHBondContact O-CG2 3.44Å; T282-V286 PolarHBondContact O-N 3.37Å
283T86.2Confident87.7Confident75 Ų7599.5 Ų99.546%0.4650%0.495SS..Hα-helixtrans-68.8-39.1178.345.50000112.7K279 E280 K285 R287K279-T283 WeakPolarHBondContact O-CG2 3.41Å; K279-T283 PolarHBondContact O-N 3.48Å; K279-T283 PolarHBondContact O-OG1 2.92Å; E280-T283 WeakPolarHBondContact CA-OG1 3.3Å; E280-T283 PolarHBondContact O-N 3.45Å; E280-T283 PolarHBondContact O-OG1 3.47Å; T283-K285 VanDerWaalsContact C-N 3.33Å; T283-R287 WeakPolarHBondContact O-CB 3.41Å; T283-R287 PolarHBondContact O-N 3.44Å
284I88.3Confident88Confident102 Ų10296.2 Ų96.252%0.52349%0.491SS..Hα-helixtrans-63.5-41.9172.6-69168.6000110.4E280 L281 R287 A288E280-I284 WeakPolarHBondContact O-CB 3.16Å; E280-I284 VanDerWaalsContact O-CG1 3.26Å; E280-I284 WeakPolarHBondContact O-CG1 3.41Å; E280-I284 PolarHBondContact O-N 3.47Å; L281-I284 PolarHBondContact O-N 2.94Å; I284-R287 PolarHBondContact O-N 3.21Å; I284-A288 WeakPolarHBondContact O-CB 3.47Å; I284-A288 PolarHBondContact O-N 3.46Å
285K90.5Very high88.3Confident133 Ų13395.2 Ų95.258%0.57849%0.485SS*.Hα-helixtrans-63.2-45.9178.1-169.7177.1178.1-175.90112.1L281 T282 T283 R287 A288 E289L281-K285 VanDerWaalsContact O-CB 3.28Å; L281-K285 WeakPolarHBondContact O-CB 3.44Å; L281-K285 PolarHBondContact O-N 2.96Å; T282-K285 PolarHBondContact O-N 3.38Å; T283-K285 VanDerWaalsContact C-N 3.33Å; K285-R287 VanDerWaalsContact C-N 3.34Å; K285-R287 PolarHBondContact O-N 3.43Å; K285-A288 PolarHBondContact O-N 3Å; K285-E289 WeakPolarHBondContact CE-OE1 3.33Å; K285-E289 WeakPolarHBondContact O-CG 3.47Å; K285-E289 PolarHBondContact O-N 2.95Å
286V91.9Very high88.5Confident74 Ų7497.1 Ų97.145%0.44849%0.493SS..Hα-helixtrans-59.3-45.6175.1170.60000111T282 A288 E289 E290T282-V286 WeakPolarHBondContact O-CG2 3.44Å; T282-V286 PolarHBondContact O-N 3.37Å; V286-A288 VanDerWaalsContact C-N 3.33Å; V286-A288 PolarHBondContact O-N 3.34Å; V286-E289 PolarHBondContact O-N 2.96Å; V286-E290 PolarHBondContact O-N 3.32Å
287R87.9Confident88.9Confident163 Ų16397.3 Ų97.362%0.61550%0.496SS*.Hα-helixtrans-63.5-38.2178.6-167.1-176.2-65.4127.9-0.6112.2T283 I284 K285 E290 Q291T283-R287 WeakPolarHBondContact O-CB 3.41Å; T283-R287 PolarHBondContact O-N 3.44Å; I284-R287 PolarHBondContact O-N 3.21Å; K285-R287 VanDerWaalsContact C-N 3.34Å; K285-R287 PolarHBondContact O-N 3.43Å; R287-E290 PolarHBondContact O-N 3.19Å; R287-Q291 WeakPolarHBondContact O-CB 3.46Å; R287-Q291 PolarHBondContact O-N 2.99Å
288A87.3Confident89Confident59 Ų5997.2 Ų97.249%0.48850%0.498SS..Hα-helixtrans-66.8-40.7175.800000111.9I284 K285 V286 Q291 A292I284-A288 WeakPolarHBondContact O-CB 3.47Å; I284-A288 PolarHBondContact O-N 3.46Å; K285-A288 PolarHBondContact O-N 3Å; V286-A288 VanDerWaalsContact C-N 3.33Å; V286-A288 PolarHBondContact O-N 3.34Å; A288-Q291 PolarHBondContact O-N 3.32Å; A288-A292 WeakPolarHBondContact O-CB 3.41Å; A288-A292 PolarHBondContact O-N 2.95Å
289E89.8Confident89Confident95 Ų9594.7 Ų94.744%0.44449%0.491SS..Hα-helixtrans-65.4-39.3174.7-73.3174-166.800112.1K285 V286 A292 K293K285-E289 WeakPolarHBondContact CE-OE1 3.33Å; K285-E289 WeakPolarHBondContact O-CG 3.47Å; K285-E289 PolarHBondContact O-N 2.95Å; V286-E289 PolarHBondContact O-N 2.96Å; E289-A292 PolarHBondContact O-N 3.36Å; E289-K293 WeakPolarHBondContact O-CG 3.29Å; E289-K293 PolarHBondContact O-N 3.46Å
290E89.6Confident89.2Confident113 Ų11391.5 Ų91.553%0.52848%0.482SS..Hα-helixtrans-65.2-43.3173.5-81.6170.4153.200112.1V286 R287 A292 K293 V294V286-E290 PolarHBondContact O-N 3.32Å; R287-E290 PolarHBondContact O-N 3.19Å; E290-A292 VanDerWaalsContact C-N 3.32Å; E290-A292 PolarHBondContact O-N 3.34Å; E290-K293 PolarHBondContact O-N 3.36Å; E290-V294 WeakPolarHBondContact O-CG2 3.31Å; E290-V294 PolarHBondContact O-N 3.3Å
291Q89.6Confident89.5Confident106 Ų10694.1 Ų94.150%0.49549%0.492SS..Hα-helixtrans-64-38.6176.1-170.960.549.600111.8R287 A288 V294 N295R287-Q291 WeakPolarHBondContact O-CB 3.46Å; R287-Q291 PolarHBondContact O-N 2.99Å; A288-Q291 PolarHBondContact O-N 3.32Å; Q291-V294 PolarHBondContact O-N 3.48Å; Q291-N295 PolarHBondContact NE2-OD1 3.48Å; Q291-N295 WeakPolarHBondContact O-CB 3.26Å; Q291-N295 PolarHBondContact O-N 2.87Å; Q291-N295 PolarHBondContact O-OD1 2.89Å
292A88.8Confident89.6Confident49 Ų4994 Ų9441%0.40549%0.491SS..Hα-helixtrans-61.6-44.1174.100000111.5A288 E289 E290 V294 N295 D296A288-A292 WeakPolarHBondContact O-CB 3.41Å; A288-A292 PolarHBondContact O-N 2.95Å; E289-A292 PolarHBondContact O-N 3.36Å; E290-A292 VanDerWaalsContact C-N 3.32Å; E290-A292 PolarHBondContact O-N 3.34Å; A292-V294 PolarHBondContact O-N 2.96Å; A292-N295 PolarHBondContact O-N 2.91Å; A292-D296 PolarHBondContact O-N 3.3Å
293K92.8Very high89.7Confident133 Ų13396.6 Ų96.658%0.57850%0.496SS*.Hα-helixtrans-61.8-43174.9-72.4172.4-175.2173.20112.6E289 E290 N295 D296 I297E289-K293 WeakPolarHBondContact O-CG 3.29Å; E289-K293 PolarHBondContact O-N 3.46Å; E290-K293 PolarHBondContact O-N 3.36Å; K293-N295 VanDerWaalsContact C-N 3.33Å; K293-D296 PolarHBondContact O-N 2.89Å; K293-I297 VanDerWaalsContact O-CG1 3.3Å; K293-I297 WeakPolarHBondContact O-CG1 3.32Å; K293-I297 PolarHBondContact O-N 3.33Å
294V90.9Very high89.9Confident73 Ų73100.9 Ų100.944%0.44250%0.504SS..Hα-helixtrans-61.5-44.2176.2171.80000110.5E290 Q291 A292 I297 T298E290-V294 WeakPolarHBondContact O-CG2 3.31Å; E290-V294 PolarHBondContact O-N 3.3Å; Q291-V294 PolarHBondContact O-N 3.48Å; A292-V294 PolarHBondContact O-N 2.96Å; V294-I297 PolarHBondContact O-N 3.16Å; V294-T298 WeakPolarHBondContact O-CG2 2.86Å; V294-T298 PolarHBondContact O-N 2.87Å
295N89.8Confident90Very high78 Ų78104.7 Ų104.742%0.41751%0.511SS..Hα-helixtrans-64.8-39.6177.2-69.2-7.7000112.1Q291 A292 K293 I297 T298 V299Q291-N295 PolarHBondContact NE2-OD1 3.48Å; Q291-N295 WeakPolarHBondContact O-CB 3.26Å; Q291-N295 PolarHBondContact O-N 2.87Å; Q291-N295 PolarHBondContact O-OD1 2.89Å; A292-N295 PolarHBondContact O-N 2.91Å; K293-N295 VanDerWaalsContact C-N 3.33Å; N295-I297 VanDerWaalsContact C-N 3.31Å; N295-I297 PolarHBondContact O-N 3.4Å; N295-T298 WeakPolarHBondContact CA-OG1 3.42Å; N295-T298 PolarHBondContact O-N 3.4Å; N295-T298 PolarHBondContact O-OG1 3.31Å; N295-V299 WeakPolarHBondContact O-CB 3.35Å; N295-V299 VanDerWaalsContact O-CG2 3.28Å; N295-V299 WeakPolarHBondContact O-CG2 3.25Å; N295-V299 PolarHBondContact O-N 3.47Å
296D92.2Very high89.8Confident107 Ų107103.8 Ų103.857%0.57251%0.512SS*.Hα-helixtrans-62.3-39.2174.4-82-18.7000111.7A292 K293 T300A292-D296 PolarHBondContact O-N 3.3Å; K293-D296 PolarHBondContact O-N 2.89Å; D296-T300 WeakPolarHBondContact O-CB 3.15Å; D296-T300 PolarHBondContact O-N 2.84Å; D296-T300 PolarHBondContact O-OG1 2.93Å
297I91.1Very high89.7Confident95 Ų95105.6 Ų105.649%0.48752%0.519SS..Hα-helixtrans-63.9-44175-67.3164.3000110.9K293 V294 N295 T300 K301K293-I297 VanDerWaalsContact O-CG1 3.3Å; K293-I297 WeakPolarHBondContact O-CG1 3.32Å; K293-I297 PolarHBondContact O-N 3.33Å; V294-I297 PolarHBondContact O-N 3.16Å; N295-I297 VanDerWaalsContact C-N 3.31Å; N295-I297 PolarHBondContact O-N 3.4Å; I297-T300 PolarHBondContact O-N 3.07Å; I297-K301 HydrophobicContact CG2-CD 4.36Å; I297-K301 WeakPolarHBondContact O-CG 3.4Å; I297-K301 PolarHBondContact O-N 2.9Å
298T88.8Confident89.7Confident64 Ų6499.8 Ų99.839%0.39351%0.506SS..Hα-helixtrans-67.1-43.4179.359.20000111.5V294 N295 T300 K301 L302V294-T298 WeakPolarHBondContact O-CG2 2.86Å; V294-T298 PolarHBondContact O-N 2.87Å; N295-T298 WeakPolarHBondContact CA-OG1 3.42Å; N295-T298 PolarHBondContact O-N 3.4Å; N295-T298 PolarHBondContact O-OG1 3.31Å; T298-T300 VanDerWaalsContact C-N 3.3Å; T298-T300 PolarHBondContact O-N 3.48Å; T298-K301 PolarHBondContact O-N 3.15Å; T298-L302 WeakPolarHBondContact O-CG 3.45Å; T298-L302 PolarHBondContact O-N 3.44Å
299V88.7Confident89.7Confident63 Ų63101.4 Ų101.438%0.38251%0.505SS..Hα-helixtrans-59.1-42.3173.9170.20000110.7N295 L302 K303N295-V299 WeakPolarHBondContact O-CB 3.35Å; N295-V299 VanDerWaalsContact O-CG2 3.28Å; N295-V299 WeakPolarHBondContact O-CG2 3.25Å; N295-V299 PolarHBondContact O-N 3.47Å; V299-L302 PolarHBondContact O-N 3.16Å; V299-K303 HydrophobicContact CG1-CD 4.26Å; V299-K303 WeakPolarHBondContact O-CG 3.33Å; V299-K303 PolarHBondContact O-N 3.28Å
300T90.3Very high89.5Confident61 Ų61102.5 Ų102.537%0.37451%0.51SS..Hα-helixtrans-65.1-41.1177.5-52.20000111.8D296 I297 T298 K303 R304D296-T300 WeakPolarHBondContact O-CB 3.15Å; D296-T300 PolarHBondContact O-N 2.84Å; D296-T300 PolarHBondContact O-OG1 2.93Å; I297-T300 PolarHBondContact O-N 3.07Å; T298-T300 VanDerWaalsContact C-N 3.3Å; T298-T300 PolarHBondContact O-N 3.48Å; T300-K303 PolarHBondContact O-N 3.22Å; T300-R304 WeakPolarHBondContact O-CG 3.31Å; T300-R304 PolarHBondContact O-N 3.45Å; T300-R304 VanDerWaalsContact O-N 3.08Å
301K90.3Very high89.5Confident133 Ų13399.8 Ų99.858%0.57850%0.504SS*.Hα-helixtrans-62.9-43.1174.3-74.2177-179179.80111.9I297 T298 R304 R305I297-K301 HydrophobicContact CG2-CD 4.36Å; I297-K301 WeakPolarHBondContact O-CG 3.4Å; I297-K301 PolarHBondContact O-N 2.9Å; T298-K301 PolarHBondContact O-N 3.15Å; K301-R304 PolarHBondContact O-N 2.97Å; K301-R305 PolarHBondContact O-N 3.1Å
302L89.4Confident89.4Confident116 Ų11698.9 Ų98.961%0.60750%0.5SS*.Hα-helixtrans-65-41.8177.7-71173.5000111.9T298 V299 R304 R305 L306T298-L302 WeakPolarHBondContact O-CG 3.45Å; T298-L302 PolarHBondContact O-N 3.44Å; V299-L302 PolarHBondContact O-N 3.16Å; L302-R304 PolarHBondContact O-N 3.35Å; L302-R305 PolarHBondContact O-N 3.23Å; L302-L306 WeakPolarHBondContact O-CB 3.46Å; L302-L306 PolarHBondContact O-N 2.98Å
303K90.5Very high89.3Confident136 Ų13699.4 Ų99.459%0.59150%0.504SS*.Hα-helixtrans-58.9-43.8173.4-76178.8178.8-1800112.2V299 T300 L306 L307V299-K303 HydrophobicContact CG1-CD 4.26Å; V299-K303 WeakPolarHBondContact O-CG 3.33Å; V299-K303 PolarHBondContact O-N 3.28Å; T300-K303 PolarHBondContact O-N 3.22Å; K303-L306 PolarHBondContact O-N 3.5Å; K303-L307 WeakPolarHBondContact O-CG 3.42Å; K303-L307 PolarHBondContact O-N 3.46Å
304R90Very high89.1Confident166 Ų16695.6 Ų95.663%0.62649%0.494SS*.Hα-helixtrans-62.9-41.3175-69.3178.8-160.3149.44.3112.1T300 K301 L302 L307 A308T300-R304 WeakPolarHBondContact O-CG 3.31Å; T300-R304 PolarHBondContact O-N 3.45Å; T300-R304 VanDerWaalsContact O-N 3.08Å; K301-R304 PolarHBondContact O-N 2.97Å; L302-R304 PolarHBondContact O-N 3.35Å; R304-L307 PolarHBondContact O-N 3.41Å; R304-A308 PolarHBondContact O-N 2.92Å
305R89.4Confident89.1Confident181 Ų18198.7 Ų98.768%0.68350%0.498SS*.Hα-helixtrans-65.6-40.3177.9-166.5170.1-176.9162.10.2111.8K301 L302 A308 I309K301-R305 PolarHBondContact O-N 3.1Å; L302-R305 PolarHBondContact O-N 3.23Å; R305-A308 PolarHBondContact O-N 3.24Å; R305-I309 HydrophobicContact CG-CD1 4.3Å; R305-I309 WeakPolarHBondContact O-CG1 3.26Å; R305-I309 PolarHBondContact O-N 3.25Å
306L87.5Confident89Confident115 Ų115104 Ų10460%0.60251%0.512SS*.Hα-helixtrans-62.4-45.2174.7-174.667.3000111.5L302 K303 A308 I309 Q310L302-L306 WeakPolarHBondContact O-CB 3.46Å; L302-L306 PolarHBondContact O-N 2.98Å; K303-L306 PolarHBondContact O-N 3.5Å; L306-A308 VanDerWaalsContact C-N 3.35Å; L306-A308 PolarHBondContact O-N 2.88Å; L306-I309 PolarHBondContact O-N 2.74Å; L306-Q310 WeakPolarHBondContact O-CB 3.4Å; L306-Q310 PolarHBondContact O-N 3.48Å
307L89.4Confident89Confident111 Ų111106.7 Ų106.758%0.58152%0.519SS*.Hα-helixtrans-62.1-40175.4-75.1169.9000112.3K303 R304 Q310 S311K303-L307 WeakPolarHBondContact O-CG 3.42Å; K303-L307 PolarHBondContact O-N 3.46Å; R304-L307 PolarHBondContact O-N 3.41Å; L307-Q310 PolarHBondContact O-N 3.29Å; L307-S311 WeakPolarHBondContact O-CB 3.42Å; L307-S311 PolarHBondContact O-N 3Å
308A87.4Confident88.9Confident42 Ų42109.6 Ų109.635%0.34752%0.523SS..Hα-helixtrans-61.3-48.1175.500000111.4R304 R305 L306 Q310 S311 E312R304-A308 PolarHBondContact O-N 2.92Å; R305-A308 PolarHBondContact O-N 3.24Å; L306-A308 VanDerWaalsContact C-N 3.35Å; L306-A308 PolarHBondContact O-N 2.88Å; A308-Q310 VanDerWaalsContact C-N 3.35Å; A308-Q310 PolarHBondContact O-N 2.98Å; A308-S311 PolarHBondContact O-N 3.39Å; A308-S311 PolarHBondContact O-OG 2.96Å; A308-E312 PolarHBondContact O-N 3.45Å
309I87.6Confident88.9Confident93 Ų93109.6 Ų109.648%0.47753%0.526SS..Hα-helixtrans-61.9-42.6176.6-67.4167.1000111R305 L306 S311 E312 A313R305-I309 HydrophobicContact CG-CD1 4.3Å; R305-I309 WeakPolarHBondContact O-CG1 3.26Å; R305-I309 PolarHBondContact O-N 3.25Å; L306-I309 PolarHBondContact O-N 2.74Å; I309-S311 VanDerWaalsContact C-N 3.3Å; I309-S311 PolarHBondContact O-N 2.98Å; I309-E312 WeakPolarHBondContact O-CB 3.49Å; I309-E312 PolarHBondContact O-N 2.98Å; I309-A313 WeakPolarHBondContact O-CB 3.43Å; I309-A313 PolarHBondContact O-N 3.2Å
310Q85.5Confident88.9Confident118 Ų118114.5 Ų114.555%0.55154%0.539SS*.Hα-helixtrans-64.7-35.9177.6-167.9174.25.600112L306 L307 A308 S314L306-Q310 WeakPolarHBondContact O-CB 3.4Å; L306-Q310 PolarHBondContact O-N 3.48Å; L307-Q310 PolarHBondContact O-N 3.29Å; A308-Q310 VanDerWaalsContact C-N 3.35Å; A308-Q310 PolarHBondContact O-N 2.98Å; Q310-S314 WeakPolarHBondContact O-CB 3.36Å; Q310-S314 PolarHBondContact O-N 3.29Å; Q310-S314 PolarHBondContact O-OG 3.03Å
311S89.3Confident89Confident55 Ų55116 Ų11639%0.38554%0.542SS..Hα-helixtrans-69-36.6173.980.50000112.3L307 A308 I309 S314 R315L307-S311 WeakPolarHBondContact O-CB 3.42Å; L307-S311 PolarHBondContact O-N 3Å; A308-S311 PolarHBondContact O-N 3.39Å; A308-S311 PolarHBondContact O-OG 2.96Å; I309-S311 VanDerWaalsContact C-N 3.3Å; I309-S311 PolarHBondContact O-N 2.98Å; S311-S314 PolarHBondContact O-N 3.42Å; S311-R315 WeakPolarHBondContact O-CG 3.27Å; S311-R315 PolarHBondContact O-N 3.14Å
312E86.9Confident89.1Confident88 Ų88115.6 Ų115.641%0.41154%0.542SS..Hα-helixtrans-66.1-49.9173.2-80.4171.6-168.500111.4A308 I309 S314 R315 W316A308-E312 PolarHBondContact O-N 3.45Å; I309-E312 WeakPolarHBondContact O-CB 3.49Å; I309-E312 PolarHBondContact O-N 2.98Å; E312-S314 PolarHBondContact O-N 3.04Å; E312-R315 CarbonylContact O-C 3.56Å; E312-R315 WeakPolarHBondContact O-CA 3.5Å; E312-R315 WeakPolarHBondContact O-CB 3.4Å; E312-R315 PolarHBondContact O-N 2.94Å; E312-R315 IonicContact OE1-NH2 2.73Å; E312-W316 PolarHBondContact O-N 2.89Å
313A87.6Confident89.1Confident59 Ų59114.1 Ų114.149%0.48853%0.532SS..Hα-helixtrans-57.8-38.9175.700000111.8I309 W316 K317I309-A313 WeakPolarHBondContact O-CB 3.43Å; I309-A313 PolarHBondContact O-N 3.2Å; A313-W316 PolarHBondContact O-N 3.39Å; A313-K317 WeakPolarHBondContact O-CB 3.3Å; A313-K317 PolarHBondContact O-N 2.89Å
314S88.3Confident89.1Confident54 Ų54112.4 Ų112.438%0.37853%0.525SS..Hα-helixtrans-68.2-34.5175-58.90000112.8Q310 S311 E312 R318Q310-S314 WeakPolarHBondContact O-CB 3.36Å; Q310-S314 PolarHBondContact O-N 3.29Å; Q310-S314 PolarHBondContact O-OG 3.03Å; S311-S314 PolarHBondContact O-N 3.42Å; E312-S314 PolarHBondContact O-N 3.04Å; S314-R318 PolarHBondContact O-N 3.03Å; S314-R318 VanDerWaalsContact O-N 3.12Å
315R90.8Very high89.3Confident138 Ų138108.6 Ų108.652%0.52152%0.517SS..Hα-helixtrans-67.8-46.5172.3-78.2-172.2-69.7168.8-1.3111.4S311 E312 K317 R318 S319S311-R315 WeakPolarHBondContact O-CG 3.27Å; S311-R315 PolarHBondContact O-N 3.14Å; E312-R315 CarbonylContact O-C 3.56Å; E312-R315 WeakPolarHBondContact O-CA 3.5Å; E312-R315 WeakPolarHBondContact O-CB 3.4Å; E312-R315 PolarHBondContact O-N 2.94Å; E312-R315 IonicContact OE1-NH2 2.73Å; R315-K317 PolarHBondContact O-N 3.44Å; R315-R318 PolarHBondContact O-N 3.25Å; R315-S319 WeakPolarHBondContact O-CB 3.48Å; R315-S319 PolarHBondContact O-N 3.49Å
316W88.5Confident89.4Confident189 Ų189103.5 Ų103.572%0.71650%0.503SS*.Hα-helixtrans-60.5-43.4176-77.7110.5000111.9E312 A313 R318 S319 Y320E312-W316 PolarHBondContact O-N 2.89Å; A313-W316 PolarHBondContact O-N 3.39Å; W316-R318 VanDerWaalsContact C-N 3.35Å; W316-R318 PolarHBondContact O-N 3.44Å; W316-S319 PolarHBondContact O-N 2.93Å; W316-Y320 VanDerWaalsContact O-CB 3.3Å; W316-Y320 WeakPolarHBondContact O-CB 3.49Å; W316-Y320 PolarHBondContact O-N 2.92Å
317K91.1Very high89.5Confident164 Ų164106 Ų10671%0.71350%0.504SS*.Hα-helixtrans-61.5-41.8175.7-171.7176.4-178.6179.70112.2A313 R315 Q321A313-K317 WeakPolarHBondContact O-CB 3.3Å; A313-K317 PolarHBondContact O-N 2.89Å; R315-K317 PolarHBondContact O-N 3.44Å; K317-Q321 WeakPolarHBondContact O-CB 3.29Å; K317-Q321 PolarHBondContact O-N 3.2Å
318R90.2Very high89.6Confident155 Ų155104.6 Ų104.659%0.58550%0.497SS*.Hα-helixtrans-66.5-47.5175.4-85.8-175.6-88.4105-4.9112.2S314 R315 W316 Y320 Q321 E322S314-R318 PolarHBondContact O-N 3.03Å; S314-R318 VanDerWaalsContact O-N 3.12Å; R315-R318 PolarHBondContact O-N 3.25Å; W316-R318 VanDerWaalsContact C-N 3.35Å; W316-R318 PolarHBondContact O-N 3.44Å; R318-Y320 VanDerWaalsContact C-N 3.33Å; R318-Y320 PolarHBondContact O-N 3.31Å; R318-Q321 PolarHBondContact O-N 3.47Å; R318-E322 WeakPolarHBondContact O-CB 3.29Å; R318-E322 PolarHBondContact O-N 3.33Å
319S88.7Confident89.9Confident65 Ų65106.3 Ų106.346%0.45550%0.5SS..Hα-helixtrans-61.8-40.5178.5177.40000112R315 W316 E322 E323R315-S319 WeakPolarHBondContact O-CB 3.48Å; R315-S319 PolarHBondContact O-N 3.49Å; W316-S319 PolarHBondContact O-N 2.93Å; S319-E322 PolarHBondContact O-N 3.12Å; S319-E323 WeakPolarHBondContact O-CB 3.47Å; S319-E323 PolarHBondContact O-N 2.89Å
320Y89.4Confident90Very high165 Ų165106 Ų10665%0.64750%0.5SS*.Hα-helixtrans-65.4-41174.2179.3-98.3000112.5W316 R318 E322 E323 K324W316-Y320 VanDerWaalsContact O-CB 3.3Å; W316-Y320 WeakPolarHBondContact O-CB 3.49Å; W316-Y320 PolarHBondContact O-N 2.92Å; R318-Y320 VanDerWaalsContact C-N 3.33Å; R318-Y320 PolarHBondContact O-N 3.31Å; Y320-E322 VanDerWaalsContact C-N 3.35Å; Y320-E323 PolarHBondContact O-N 2.93Å; Y320-K324 WeakPolarHBondContact O-CB 3.42Å; Y320-K324 PolarHBondContact O-N 3.28Å
321Q92.3Very high90Very high93 Ų93103.3 Ų103.344%0.43549%0.494SS..Hα-helixtrans-66.2-37.9176.2-172.762.348.500112K317 R318 K324 N325K317-Q321 WeakPolarHBondContact O-CB 3.29Å; K317-Q321 PolarHBondContact O-N 3.2Å; R318-Q321 PolarHBondContact O-N 3.47Å; Q321-K324 PolarHBondContact O-N 2.93Å; Q321-N325 PolarHBondContact NE2-OD1 3.45Å; Q321-N325 WeakPolarHBondContact O-CB 3.43Å; Q321-N325 PolarHBondContact O-N 3.07Å; Q321-N325 PolarHBondContact O-ND2 3.44Å; Q321-N325 PolarHBondContact O-OD1 2.84Å
322E91.3Very high90Very high124 Ų124106 Ų10658%0.57950%0.5SS*.Hα-helixtrans-66.6-45.1175.6-171.6170.2-166.600111.5R318 S319 Y320 K324 N325 N326R318-E322 WeakPolarHBondContact O-CB 3.29Å; R318-E322 PolarHBondContact O-N 3.33Å; S319-E322 PolarHBondContact O-N 3.12Å; Y320-E322 VanDerWaalsContact C-N 3.35Å; E322-K324 VanDerWaalsContact C-N 3.33Å; E322-K324 PolarHBondContact O-N 3.31Å; E322-N325 PolarHBondContact O-N 3.29Å; E322-N326 WeakPolarHBondContact O-CB 3.44Å; E322-N326 VanDerWaalsContact O-CG 3.24Å; E322-N326 PolarHBondContact O-N 2.94Å; E322-N326 PolarHBondContact O-ND2 3.28Å
323E89.7Confident90.2Very high86 Ų86106.9 Ų106.940%0.40250%0.503SS..Hα-helixtrans-60.3-41.6173.6179.662.8-160.900111.8S319 Y320 N326 R327S319-E323 WeakPolarHBondContact O-CB 3.47Å; S319-E323 PolarHBondContact O-N 2.89Å; Y320-E323 PolarHBondContact O-N 2.93Å; E323-N326 PolarHBondContact O-N 3.12Å; E323-R327 WeakPolarHBondContact O-CG 3.44Å; E323-R327 PolarHBondContact O-N 2.96Å; E323-R327 IonicContact OE1-CZ 2.85Å; E323-R327 IonicContact OE1-NE 3.55Å; E323-R327 PolarHBondContact OE1-NE 3.02Å; E323-R327 IonicContact OE1-NH2 3.33Å; E323-R327 PolarHBondContact OE1-NH2 2.71Å
324K90.2Very high90.1Very high100 Ų100107.7 Ų107.744%0.43550%0.501SS..Hα-helixtrans-61.7-48.2174.2-176.6179.7176-179.10111.5Y320 Q321 E322 N326 R327 D328Y320-K324 WeakPolarHBondContact O-CB 3.42Å; Y320-K324 PolarHBondContact O-N 3.28Å; Q321-K324 PolarHBondContact O-N 2.93Å; E322-K324 VanDerWaalsContact C-N 3.33Å; E322-K324 PolarHBondContact O-N 3.31Å; K324-N326 VanDerWaalsContact C-N 3.28Å; K324-N326 PolarHBondContact O-N 3.12Å; K324-R327 PolarHBondContact O-N 3.19Å; K324-D328 VanDerWaalsContact O-CG 3.29Å; K324-D328 PolarHBondContact O-N 2.97Å
325N93.3Very high90.2Very high86 Ų86109.7 Ų109.746%0.4651%0.508SS..Hα-helixtrans-61.8-37.1177.8-66.8-7000111.8Q321 E322 D328 L329Q321-N325 PolarHBondContact NE2-OD1 3.45Å; Q321-N325 WeakPolarHBondContact O-CB 3.43Å; Q321-N325 PolarHBondContact O-N 3.07Å; Q321-N325 PolarHBondContact O-ND2 3.44Å; Q321-N325 PolarHBondContact O-OD1 2.84Å; E322-N325 PolarHBondContact O-N 3.29Å; N325-D328 PolarHBondContact O-N 3.28Å; N325-L329 WeakPolarHBondContact O-CB 3.47Å; N325-L329 PolarHBondContact O-N 2.99Å
326N93Very high90.3Very high74 Ų74109.4 Ų109.440%0.39651%0.512SS..Hα-helixtrans-65.5-44175.8-72.4-18.7000111.5E322 E323 K324 L329 D330E322-N326 WeakPolarHBondContact O-CB 3.44Å; E322-N326 VanDerWaalsContact O-CG 3.24Å; E322-N326 PolarHBondContact O-N 2.94Å; E322-N326 PolarHBondContact O-ND2 3.28Å; E323-N326 PolarHBondContact O-N 3.12Å; K324-N326 VanDerWaalsContact C-N 3.28Å; K324-N326 PolarHBondContact O-N 3.12Å; N326-L329 PolarHBondContact O-N 3.32Å; N326-D330 WeakPolarHBondContact O-CB 3.46Å; N326-D330 PolarHBondContact O-N 3.49Å
327R88.9Confident90.4Very high168 Ų168106.8 Ų106.863%0.63451%0.506SS*.Hα-helixtrans-64.3-40.2175.2-71.1-179.6-172.6-150.7-0.1112.5E323 K324 L329 D330 S331E323-R327 WeakPolarHBondContact O-CG 3.44Å; E323-R327 PolarHBondContact O-N 2.96Å; E323-R327 IonicContact OE1-CZ 2.85Å; E323-R327 IonicContact OE1-NE 3.55Å; E323-R327 PolarHBondContact OE1-NE 3.02Å; E323-R327 IonicContact OE1-NH2 3.33Å; E323-R327 PolarHBondContact OE1-NH2 2.71Å; K324-R327 PolarHBondContact O-N 3.19Å; R327-L329 VanDerWaalsContact C-N 3.33Å; R327-D330 PolarHBondContact O-N 2.86Å; R327-S331 WeakPolarHBondContact O-CB 3.34Å; R327-S331 PolarHBondContact O-N 3.43Å
328D92.2Very high90.4Very high80 Ų80103.2 Ų103.243%0.42849%0.494SS..Hα-helixtrans-64.1-40.5175.9-69.7-19.9000110.6K324 N325 S331 Q332K324-D328 VanDerWaalsContact O-CG 3.29Å; K324-D328 PolarHBondContact O-N 2.97Å; N325-D328 PolarHBondContact O-N 3.28Å; D328-S331 PolarHBondContact O-N 3.33Å; D328-Q332 WeakPolarHBondContact O-CG 3.46Å; D328-Q332 PolarHBondContact O-N 3.46Å
329L92.6Very high90.4Very high78 Ų78100.5 Ų100.541%0.40849%0.488SS..Hα-helixtrans-67.7-42.9175.3-177.470.2000112.4N325 N326 R327 S331 Q332 K333N325-L329 WeakPolarHBondContact O-CB 3.47Å; N325-L329 PolarHBondContact O-N 2.99Å; N326-L329 PolarHBondContact O-N 3.32Å; R327-L329 VanDerWaalsContact C-N 3.33Å; L329-S331 VanDerWaalsContact C-N 3.3Å; L329-S331 PolarHBondContact O-N 2.88Å; L329-Q332 WeakPolarHBondContact O-CB 3.49Å; L329-Q332 PolarHBondContact O-N 3.03Å; L329-Q332 VanDerWaalsContact O-N 3.17Å; L329-K333 WeakPolarHBondContact O-CG 3.33Å; L329-K333 PolarHBondContact O-N 3.32Å
330D90.2Very high90.5Very high88 Ų88100.9 Ų100.947%0.47149%0.488SS..Hα-helixtrans-65.7-36.9176.5-74-17.7000111N326 R327 Q332 K333 T334N326-D330 WeakPolarHBondContact O-CB 3.46Å; N326-D330 PolarHBondContact O-N 3.49Å; R327-D330 PolarHBondContact O-N 2.86Å; D330-Q332 VanDerWaalsContact C-N 3.33Å; D330-K333 PolarHBondContact O-N 2.9Å; D330-K333 IonicContact OD1-NZ 2.91Å; D330-T334 WeakPolarHBondContact O-CG2 3.32Å; D330-T334 PolarHBondContact O-N 3.19Å; D330-T334 PolarHBondContact O-OG1 3.13Å; D330-T334 VanDerWaalsContact O-OG1 3.13Å
331S86.2Confident90.6Very high60 Ų6096.9 Ų96.942%0.4248%0.477SS..Hα-helixtrans-64.6-35.6171.3-172.80000112.6R327 D328 L329 T334 N335R327-S331 WeakPolarHBondContact O-CB 3.34Å; R327-S331 PolarHBondContact O-N 3.43Å; D328-S331 PolarHBondContact O-N 3.33Å; L329-S331 VanDerWaalsContact C-N 3.3Å; L329-S331 PolarHBondContact O-N 2.88Å; S331-T334 WeakPolarHBondContact CA-OG1 3.45Å; S331-T334 PolarHBondContact O-OG1 2.71Å; S331-N335 WeakPolarHBondContact O-CB 3.49Å; S331-N335 PolarHBondContact O-N 3.49Å; S331-N335 VanDerWaalsContact O-N 3.11Å; S331-N335 PolarHBondContact O-ND2 3.41Å; S331-N335 VanDerWaalsContact O-ND2 3.08Å
332Q89.4Confident90.5Very high113 Ų11395.3 Ų95.353%0.52847%0.471SS..Hα-helixtrans-67.1-46.4173.4-75.8173.2-200111.1D328 L329 D330 T334 N335 E336D328-Q332 WeakPolarHBondContact O-CG 3.46Å; D328-Q332 PolarHBondContact O-N 3.46Å; L329-Q332 WeakPolarHBondContact O-CB 3.49Å; L329-Q332 PolarHBondContact O-N 3.03Å; L329-Q332 VanDerWaalsContact O-N 3.17Å; D330-Q332 VanDerWaalsContact C-N 3.33Å; Q332-T334 PolarHBondContact O-N 3.5Å; Q332-N335 PolarHBondContact O-N 2.84Å; Q332-E336 WeakPolarHBondContact O-CG 3.48Å; Q332-E336 PolarHBondContact O-N 2.88Å
333K90.5Very high90.5Very high106 Ų10693.4 Ų93.446%0.46147%0.465SS..Hα-helixtrans-60.4-41.4177.2-71.7173.2-175.4164.40112.7L329 D330 E336 F337L329-K333 WeakPolarHBondContact O-CG 3.33Å; L329-K333 PolarHBondContact O-N 3.32Å; D330-K333 PolarHBondContact O-N 2.9Å; D330-K333 IonicContact OD1-NZ 2.91Å; K333-E336 PolarHBondContact O-N 3.34Å; K333-F337 WeakPolarHBondContact O-CB 3.23Å; K333-F337 PolarHBondContact O-N 2.96Å
334T86.4Confident90.6Very high75 Ų7595.3 Ų95.346%0.4647%0.474SS..Hα-helixtrans-67.6-38.7176.5530000111.5D330 S331 Q332 F337 I338D330-T334 WeakPolarHBondContact O-CG2 3.32Å; D330-T334 PolarHBondContact O-N 3.19Å; D330-T334 PolarHBondContact O-OG1 3.13Å; D330-T334 VanDerWaalsContact O-OG1 3.13Å; S331-T334 WeakPolarHBondContact CA-OG1 3.45Å; S331-T334 PolarHBondContact O-OG1 2.71Å; Q332-T334 PolarHBondContact O-N 3.5Å; T334-F337 PolarHBondContact O-N 3.37Å; T334-I338 WeakPolarHBondContact O-CB 3.37Å; T334-I338 WeakPolarHBondContact O-CD1 3.43Å; T334-I338 WeakPolarHBondContact O-CG1 3.45Å; T334-I338 PolarHBondContact O-N 3.33Å
335N90.3Very high90.6Very high96 Ų9696.6 Ų96.651%0.51348%0.476SS..Hα-helixtrans-65.3-40.7174.4-73.8-25.5000112.3S331 Q332 I338 Q339S331-N335 WeakPolarHBondContact O-CB 3.49Å; S331-N335 PolarHBondContact O-N 3.49Å; S331-N335 VanDerWaalsContact O-N 3.11Å; S331-N335 PolarHBondContact O-ND2 3.41Å; S331-N335 VanDerWaalsContact O-ND2 3.08Å; Q332-N335 PolarHBondContact O-N 2.84Å; N335-I338 PolarHBondContact O-N 2.93Å; N335-Q339 WeakPolarHBondContact O-CB 3.31Å; N335-Q339 PolarHBondContact O-N 3.43Å
336E92.6Very high90.4Very high132 Ų13295.4 Ų95.462%0.61747%0.469SS*.Hα-helixtrans-61.5-44.4172.4-74.2174.4179.900111.3Q332 K333 I338 Q339 T340Q332-E336 WeakPolarHBondContact O-CG 3.48Å; Q332-E336 PolarHBondContact O-N 2.88Å; K333-E336 PolarHBondContact O-N 3.34Å; E336-I338 PolarHBondContact O-N 3.31Å; E336-Q339 WeakPolarHBondContact O-CB 3.38Å; E336-Q339 PolarHBondContact O-N 2.76Å; E336-T340 PolarHBondContact O-N 3.24Å; E336-T340 PolarHBondContact O-OG1 3.28Å; E336-T340 VanDerWaalsContact O-OG1 3.13Å
337F90.8Very high90.4Very high134 Ų13498.8 Ų98.859%0.58848%0.478SS*.Hα-helixtrans-63-42.5177.3-174.8-112.3000112.4K333 T334 Q339 T340 I341K333-F337 WeakPolarHBondContact O-CB 3.23Å; K333-F337 PolarHBondContact O-N 2.96Å; T334-F337 PolarHBondContact O-N 3.37Å; F337-Q339 VanDerWaalsContact C-N 3.32Å; F337-Q339 PolarHBondContact O-N 2.87Å; F337-T340 VanDerWaalsContact C-OG1 3.28Å; F337-T340 VanDerWaalsContact CA-OG1 3.24Å; F337-T340 WeakPolarHBondContact CA-OG1 3.24Å; F337-T340 PolarHBondContact O-N 3.41Å; F337-T340 PolarHBondContact O-OG1 2.83Å; F337-I341 HydrophobicContact CD1-CD1 3.82Å; F337-I341 HydrophobicContact CE1-CD1 3.39Å; F337-I341 HydrophobicContact CE1-CG1 4.38Å; F337-I341 HydrophobicContact CE2-CD1 4.45Å; F337-I341 HydrophobicContact CZ-CD1 3.75Å; F337-I341 HydrophobicContact CZ-CG1 4.38Å; F337-I341 WeakPolarHBondContact O-CG1 3.48Å; F337-I341 PolarHBondContact O-N 2.98Å
338I89.8Confident90.4Very high89 Ų8996.3 Ų96.346%0.45648%0.476SS..Hα-helixtrans-61.2-43.1173.6-70.8164.7000110.2T334 N335 E336 T340 I341 L342T334-I338 WeakPolarHBondContact O-CB 3.37Å; T334-I338 WeakPolarHBondContact O-CD1 3.43Å; T334-I338 WeakPolarHBondContact O-CG1 3.45Å; T334-I338 PolarHBondContact O-N 3.33Å; N335-I338 PolarHBondContact O-N 2.93Å; E336-I338 PolarHBondContact O-N 3.31Å; I338-T340 PolarHBondContact O-N 3.46Å; I338-I341 PolarHBondContact O-N 3.28Å; I338-L342 HydrophobicContact CG2-CD1 4.03Å; I338-L342 HydrophobicContact CG2-CG 4.38Å; I338-L342 WeakPolarHBondContact O-CG 3.45Å; I338-L342 PolarHBondContact O-N 3.01Å
339Q91Very high90.3Very high98 Ų9898.1 Ų98.146%0.45848%0.482SS..Hα-helixtrans-62.2-42.9177.6-172.258.547.300111.6N335 E336 F337 I341 L342 D343N335-Q339 WeakPolarHBondContact O-CB 3.31Å; N335-Q339 PolarHBondContact O-N 3.43Å; E336-Q339 WeakPolarHBondContact O-CB 3.38Å; E336-Q339 PolarHBondContact O-N 2.76Å; F337-Q339 VanDerWaalsContact C-N 3.32Å; F337-Q339 PolarHBondContact O-N 2.87Å; Q339-I341 PolarHBondContact O-N 2.74Å; Q339-L342 PolarHBondContact O-N 3.26Å; Q339-D343 PolarHBondContact NE2-OD1 2.65Å; Q339-D343 VanDerWaalsContact NE2-OD1 3.07Å; Q339-D343 PolarHBondContact NE2-OD2 2.85Å; Q339-D343 VanDerWaalsContact O-CG 3.3Å; Q339-D343 PolarHBondContact O-N 3.11Å
340T91Very high90.1Very high73 Ų73102 Ų10245%0.44850%0.496SS..Hα-helixtrans-60.6-41.4173.836.50000112.9E336 F337 I338 L342 D343 E344E336-T340 PolarHBondContact O-N 3.24Å; E336-T340 PolarHBondContact O-OG1 3.28Å; E336-T340 VanDerWaalsContact O-OG1 3.13Å; F337-T340 VanDerWaalsContact C-OG1 3.28Å; F337-T340 VanDerWaalsContact CA-OG1 3.24Å; F337-T340 WeakPolarHBondContact CA-OG1 3.24Å; F337-T340 PolarHBondContact O-N 3.41Å; F337-T340 PolarHBondContact O-OG1 2.83Å; I338-T340 PolarHBondContact O-N 3.46Å; T340-L342 VanDerWaalsContact C-N 3.34Å; T340-L342 PolarHBondContact O-N 3Å; T340-D343 PolarHBondContact O-N 3.47Å; T340-E344 WeakPolarHBondContact O-CB 3.48Å; T340-E344 WeakPolarHBondContact O-CG 3.22Å; T340-E344 PolarHBondContact O-N 3.42Å
341I90Very high90.1Very high81 Ų81102.3 Ų102.342%0.41550%0.495SS..Hα-helixtrans-64.7-39.6176-69.6171000111.1F337 I338 Q339 D343 E344 R345F337-I341 HydrophobicContact CD1-CD1 3.82Å; F337-I341 HydrophobicContact CE1-CD1 3.39Å; F337-I341 HydrophobicContact CE1-CG1 4.38Å; F337-I341 HydrophobicContact CE2-CD1 4.45Å; F337-I341 HydrophobicContact CZ-CD1 3.75Å; F337-I341 HydrophobicContact CZ-CG1 4.38Å; F337-I341 WeakPolarHBondContact O-CG1 3.48Å; F337-I341 PolarHBondContact O-N 2.98Å; I338-I341 PolarHBondContact O-N 3.28Å; Q339-I341 PolarHBondContact O-N 2.74Å; I341-D343 VanDerWaalsContact C-N 3.35Å; I341-E344 PolarHBondContact O-N 2.99Å; I341-R345 WeakPolarHBondContact O-CB 3.47Å; I341-R345 PolarHBondContact O-N 2.84Å
342L91.2Very high90.2Very high60 Ų60105.2 Ų105.231%0.31451%0.505SS..Hα-helixtrans-65.3-39.6177-71.4173.4000111.6I338 Q339 T340 N346I338-L342 HydrophobicContact CG2-CD1 4.03Å; I338-L342 HydrophobicContact CG2-CG 4.38Å; I338-L342 WeakPolarHBondContact O-CG 3.45Å; I338-L342 PolarHBondContact O-N 3.01Å; Q339-L342 PolarHBondContact O-N 3.26Å; T340-L342 VanDerWaalsContact C-N 3.34Å; T340-L342 PolarHBondContact O-N 3Å; L342-N346 WeakPolarHBondContact O-CB 3.35Å; L342-N346 PolarHBondContact O-N 2.76Å; L342-N346 PolarHBondContact O-ND2 3.27Å; L342-N346 VanDerWaalsContact O-ND2 3.16Å; L342-N346 PolarHBondContact O-OD1 3.46Å
343D92.2Very high90.3Very high84 Ų84104.2 Ų104.245%0.44950%0.503SS..Hα-helixtrans-68.5-41.4176.6-67.8-24.3000111.8Q339 T340 I341 N346 Y347Q339-D343 PolarHBondContact NE2-OD1 2.65Å; Q339-D343 VanDerWaalsContact NE2-OD1 3.07Å; Q339-D343 PolarHBondContact NE2-OD2 2.85Å; Q339-D343 VanDerWaalsContact O-CG 3.3Å; Q339-D343 PolarHBondContact O-N 3.11Å; T340-D343 PolarHBondContact O-N 3.47Å; I341-D343 VanDerWaalsContact C-N 3.35Å; D343-N346 PolarHBondContact O-N 3.38Å; D343-Y347 WeakPolarHBondContact O-CB 3.36Å; D343-Y347 PolarHBondContact O-N 3.38Å
344E91.1Very high90.2Very high127 Ų127101.9 Ų101.959%0.59350%0.5SS*.Hα-helixtrans-62.4-45172.4-77.8179.4-177.700111.9T340 I341 N346 Y347 L348T340-E344 WeakPolarHBondContact O-CB 3.48Å; T340-E344 WeakPolarHBondContact O-CG 3.22Å; T340-E344 PolarHBondContact O-N 3.42Å; I341-E344 PolarHBondContact O-N 2.99Å; E344-N346 VanDerWaalsContact C-N 3.32Å; E344-N346 PolarHBondContact O-N 2.92Å; E344-Y347 WeakPolarHBondContact O-CB 3.4Å; E344-Y347 PolarHBondContact O-N 3.28Å; E344-Y347 VanDerWaalsContact O-N 3.16Å; E344-L348 WeakPolarHBondContact O-CB 3.41Å; E344-L348 WeakPolarHBondContact O-CG 3.37Å; E344-L348 PolarHBondContact O-N 3.05Å
345R89.3Confident90.3Very high126 Ų126101.4 Ų101.448%0.47550%0.497SS..Hα-helixtrans-58.8-45.9174.1-178-149.563.1-163.7-6.2110.7I341 Y347 L348 E349I341-R345 WeakPolarHBondContact O-CB 3.47Å; I341-R345 PolarHBondContact O-N 2.84Å; R345-Y347 VanDerWaalsContact C-N 3.27Å; R345-Y347 PolarHBondContact O-N 2.98Å; R345-L348 PolarHBondContact O-N 3.26Å; R345-E349 VanDerWaalsContact O-CB 3.25Å; R345-E349 WeakPolarHBondContact O-CB 3.29Å; R345-E349 PolarHBondContact O-N 3.11Å
346N90.5Very high90.2Very high61 Ų61102.4 Ų102.433%0.32650%0.497SS..Hα-helixtrans-62.3-35.5177.3-70.4-22.7000112.1L342 D343 E344 K350L342-N346 WeakPolarHBondContact O-CB 3.35Å; L342-N346 PolarHBondContact O-N 2.76Å; L342-N346 PolarHBondContact O-ND2 3.27Å; L342-N346 VanDerWaalsContact O-ND2 3.16Å; L342-N346 PolarHBondContact O-OD1 3.46Å; D343-N346 PolarHBondContact O-N 3.38Å; E344-N346 VanDerWaalsContact C-N 3.32Å; E344-N346 PolarHBondContact O-N 2.92Å; N346-K350 WeakPolarHBondContact O-CG 3.31Å; N346-K350 PolarHBondContact O-N 3Å
347Y93Very high90.1Very high146 Ų14699.4 Ų99.457%0.57349%0.485SS*.Hα-helixtrans-67.2-50.2174.1179.3-91.7000111.5D343 E344 R345 E349 K350 E351D343-Y347 WeakPolarHBondContact O-CB 3.36Å; D343-Y347 PolarHBondContact O-N 3.38Å; E344-Y347 WeakPolarHBondContact O-CB 3.4Å; E344-Y347 PolarHBondContact O-N 3.28Å; E344-Y347 VanDerWaalsContact O-N 3.16Å; R345-Y347 VanDerWaalsContact C-N 3.27Å; R345-Y347 PolarHBondContact O-N 2.98Å; Y347-E349 VanDerWaalsContact C-N 3.29Å; Y347-E349 PolarHBondContact O-N 2.96Å; Y347-K350 WeakPolarHBondContact O-CB 3.45Å; Y347-K350 PolarHBondContact O-N 3.32Å; Y347-K350 VanDerWaalsContact O-N 3.14Å; Y347-E351 HydrophobicContact CD1-CG 4.29Å; Y347-E351 HydrophobicContact CE1-CG 3.79Å; Y347-E351 PolarHBondContact O-N 3.41Å
348L88.9Confident90.1Very high115 Ų11596.9 Ų96.960%0.60248%0.478SS*.Hα-helixtrans-63.2-34.6178.4-69.2174.1000112.3E344 R345 E351 L352E344-L348 WeakPolarHBondContact O-CB 3.41Å; E344-L348 WeakPolarHBondContact O-CG 3.37Å; E344-L348 PolarHBondContact O-N 3.05Å; R345-L348 PolarHBondContact O-N 3.26Å; L348-E351 PolarHBondContact O-N 3.45Å; L348-L352 VanDerWaalsContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CB 3.49Å; L348-L352 PolarHBondContact O-N 2.96Å
349E89.3Confident89.9Confident119 Ų11998.6 Ų98.656%0.55649%0.485SS*.Hα-helixtrans-68-35.2175.7-169166.9-157.100111.8R345 Y347 N353R345-E349 VanDerWaalsContact O-CB 3.25Å; R345-E349 WeakPolarHBondContact O-CB 3.29Å; R345-E349 PolarHBondContact O-N 3.11Å; Y347-E349 VanDerWaalsContact C-N 3.29Å; Y347-E349 PolarHBondContact O-N 2.96Å; E349-N353 WeakPolarHBondContact O-CB 3.44Å; E349-N353 PolarHBondContact O-N 3.49Å
350K89.5Confident89.9Confident158 Ų15898.9 Ų98.969%0.68749%0.485SS*.Hα-helixtrans-66.3-46.3171.1-73.4172.9-177.6177.20111.8N346 Y347 N353 S354N346-K350 WeakPolarHBondContact O-CG 3.31Å; N346-K350 PolarHBondContact O-N 3Å; Y347-K350 WeakPolarHBondContact O-CB 3.45Å; Y347-K350 PolarHBondContact O-N 3.32Å; Y347-K350 VanDerWaalsContact O-N 3.14Å; K350-N353 PolarHBondContact O-N 3.01Å; K350-S354 PolarHBondContact O-N 3.11Å
351E89.3Confident89.9Confident96 Ų96101.6 Ų101.645%0.44949%0.493SS..Hα-helixtrans-60.9-44.4176.3-76.9-71.9115.500111.8Y347 L348 N353 S354 T355Y347-E351 HydrophobicContact CD1-CG 4.29Å; Y347-E351 HydrophobicContact CE1-CG 3.79Å; Y347-E351 PolarHBondContact O-N 3.41Å; L348-E351 PolarHBondContact O-N 3.45Å; E351-N353 VanDerWaalsContact C-N 3.3Å; E351-N353 PolarHBondContact O-N 2.9Å; E351-S354 PolarHBondContact O-N 3.03Å; E351-T355 WeakPolarHBondContact O-CG2 3.44Å; E351-T355 PolarHBondContact O-N 3.37Å; E351-T355 PolarHBondContact O-OG1 3.17Å
352L87.4Confident89.9Confident121 Ų121103.2 Ų103.263%0.63450%0.498SS*.Hα-helixtrans-62.3-38.9176.4-176.667.7000111.3L348 T355 K356L348-L352 VanDerWaalsContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CB 3.49Å; L348-L352 PolarHBondContact O-N 2.96Å; L352-T355 WeakPolarHBondContact CA-OG1 3.32Å; L352-T355 PolarHBondContact O-OG1 3.13Å; L352-K356 WeakPolarHBondContact O-CB 3.34Å; L352-K356 PolarHBondContact O-N 3.42Å
353N91.5Very high89.8Confident91 Ų91104.6 Ų104.649%0.48751%0.505SS..Hα-helixtrans-72.8-33.7177.9-158.445.7000112.1E349 K350 E351 N357E349-N353 WeakPolarHBondContact O-CB 3.44Å; E349-N353 PolarHBondContact O-N 3.49Å; K350-N353 PolarHBondContact O-N 3.01Å; E351-N353 VanDerWaalsContact C-N 3.3Å; E351-N353 PolarHBondContact O-N 2.9Å; N353-N357 VanDerWaalsContact O-CG 3.24Å; N353-N357 PolarHBondContact O-N 3.08Å; N353-N357 VanDerWaalsContact O-N 3.11Å; N353-N357 PolarHBondContact O-ND2 3.18Å; N353-N357 VanDerWaalsContact O-ND2 3.16Å
354S90.1Very high89.6Confident57 Ų57105.1 Ų105.140%0.39951%0.507SS..Hα-helixtrans-63.7-54.7172.7-165.80000111.1K350 E351 K356 N357 D358K350-S354 PolarHBondContact O-N 3.11Å; E351-S354 PolarHBondContact O-N 3.03Å; S354-K356 VanDerWaalsContact C-N 3.27Å; S354-K356 PolarHBondContact O-N 2.93Å; S354-N357 WeakPolarHBondContact O-CA 3.48Å; S354-N357 WeakPolarHBondContact O-CB 3.3Å; S354-N357 PolarHBondContact O-N 2.97Å; S354-D358 PolarHBondContact O-N 2.92Å
355T87.2Confident89.7Confident65 Ų65103.6 Ų103.640%0.39950%0.503SS..Hα-helixtrans-59.8-37.4179.251.60000112.4E351 L352 N357 D358 M359E351-T355 WeakPolarHBondContact O-CG2 3.44Å; E351-T355 PolarHBondContact O-N 3.37Å; E351-T355 PolarHBondContact O-OG1 3.17Å; L352-T355 WeakPolarHBondContact CA-OG1 3.32Å; L352-T355 PolarHBondContact O-OG1 3.13Å; T355-N357 VanDerWaalsContact C-N 3.33Å; T355-N357 PolarHBondContact O-N 3.44Å; T355-D358 PolarHBondContact O-N 3.45Å; T355-M359 WeakPolarHBondContact O-CB 3.32Å; T355-M359 PolarHBondContact O-N 2.91Å
356K89.7Confident89.6Confident117 Ų117101.8 Ų101.851%0.50950%0.501SS..Hα-helixtrans-63.4-36.8173.2-175.9178-176.8177.60112.6L352 S354 K360L352-K356 WeakPolarHBondContact O-CB 3.34Å; L352-K356 PolarHBondContact O-N 3.42Å; S354-K356 VanDerWaalsContact C-N 3.27Å; S354-K356 PolarHBondContact O-N 2.93Å; K356-K360 WeakPolarHBondContact O-CG 3.45Å; K356-K360 PolarHBondContact O-N 3.41Å
357N90Very high89.5Confident70 Ų70103.1 Ų103.137%0.37451%0.506SS..Hα-helixtrans-73.7-40.4175.8-69.5-27.1000111.3N353 S354 T355 M359 K360 E361N353-N357 VanDerWaalsContact O-CG 3.24Å; N353-N357 PolarHBondContact O-N 3.08Å; N353-N357 VanDerWaalsContact O-N 3.11Å; N353-N357 PolarHBondContact O-ND2 3.18Å; N353-N357 VanDerWaalsContact O-ND2 3.16Å; S354-N357 WeakPolarHBondContact O-CA 3.48Å; S354-N357 WeakPolarHBondContact O-CB 3.3Å; S354-N357 PolarHBondContact O-N 2.97Å; T355-N357 VanDerWaalsContact C-N 3.33Å; T355-N357 PolarHBondContact O-N 3.44Å; N357-M359 VanDerWaalsContact C-N 3.32Å; N357-M359 PolarHBondContact O-N 3.5Å; N357-K360 WeakPolarHBondContact O-CB 3.39Å; N357-K360 PolarHBondContact O-N 3.19Å; N357-E361 PolarHBondContact O-N 3.46Å
358D90.2Very high89.3Confident81 Ų81101.7 Ų101.743%0.43350%0.504SS..Hα-helixtrans-59.5-43.1174.4-61.7-29.7000111.3S354 T355 K360 E361 H362S354-D358 PolarHBondContact O-N 2.92Å; T355-D358 PolarHBondContact O-N 3.45Å; D358-K360 VanDerWaalsContact C-N 3.32Å; D358-K360 PolarHBondContact O-N 3.33Å; D358-E361 PolarHBondContact O-N 3.44Å; D358-H362 PolarHBondContact O-CD2 3.44Å; D358-H362 PolarHBondContact O-N 3.2Å
359M86.7Confident89.3Confident124 Ų124101 Ų10161%0.61150%0.501SS*.Hα-helixtrans-60.1-38.8173-94.7170.857.100113T355 N357 H362 I363T355-M359 WeakPolarHBondContact O-CB 3.32Å; T355-M359 PolarHBondContact O-N 2.91Å; N357-M359 VanDerWaalsContact C-N 3.32Å; N357-M359 PolarHBondContact O-N 3.5Å; M359-H362 PolarHBondContact O-N 2.9Å; M359-I363 VanDerWaalsContact O-CG1 3.28Å; M359-I363 WeakPolarHBondContact O-CG1 3.49Å; M359-I363 PolarHBondContact O-N 3.14Å
360K90Very high89.2Confident105 Ų105101.4 Ų101.446%0.45750%0.503SS..Hα-helixtrans-65.2-42.6176.2-73.8171.9-177.2172.60111.5K356 N357 D358 H362 I363 L364K356-K360 WeakPolarHBondContact O-CG 3.45Å; K356-K360 PolarHBondContact O-N 3.41Å; N357-K360 WeakPolarHBondContact O-CB 3.39Å; N357-K360 PolarHBondContact O-N 3.19Å; D358-K360 VanDerWaalsContact C-N 3.32Å; D358-K360 PolarHBondContact O-N 3.33Å; K360-H362 VanDerWaalsContact C-N 3.34Å; K360-I363 PolarHBondContact O-N 2.98Å; K360-L364 WeakPolarHBondContact O-CG 3.42Å; K360-L364 PolarHBondContact O-N 2.89Å
361E91.1Very high89Confident129 Ų129101 Ų10160%0.60350%0.501SS*.Hα-helixtrans-62-42.2175.3-69.7-63.1149.700111.2N357 D358 I363 L364 L365N357-E361 PolarHBondContact O-N 3.46Å; D358-E361 PolarHBondContact O-N 3.44Å; E361-I363 PolarHBondContact O-N 3.03Å; E361-L364 PolarHBondContact O-N 2.91Å; E361-L365 WeakPolarHBondContact O-CB 3.47Å; E361-L365 PolarHBondContact O-N 3.32Å
362H89.6Confident88.9Confident115 Ų115100.5 Ų100.553%0.53250%0.498SS..Hα-helixtrans-62.3-40.7174.5-72.2-51.7000112.9D358 M359 K360 L365 I366D358-H362 PolarHBondContact O-CD2 3.44Å; D358-H362 PolarHBondContact O-N 3.2Å; M359-H362 PolarHBondContact O-N 2.9Å; K360-H362 VanDerWaalsContact C-N 3.34Å; H362-L365 PolarHBondContact O-N 2.96Å; H362-I366 VanDerWaalsContact O-CG1 3.26Å; H362-I366 WeakPolarHBondContact O-CG1 3.42Å; H362-I366 PolarHBondContact O-N 2.82Å
363I88.7Confident88.5Confident89 Ų8997.5 Ų97.546%0.45649%0.491SS..Hα-helixtrans-62.5-45.8175.6-70.3165.4000110.4M359 K360 E361 L365 I366 E367M359-I363 VanDerWaalsContact O-CG1 3.28Å; M359-I363 WeakPolarHBondContact O-CG1 3.49Å; M359-I363 PolarHBondContact O-N 3.14Å; K360-I363 PolarHBondContact O-N 2.98Å; E361-I363 PolarHBondContact O-N 3.03Å; I363-L365 VanDerWaalsContact C-N 3.31Å; I363-L365 PolarHBondContact O-N 3.31Å; I363-I366 PolarHBondContact O-N 3.27Å; I363-E367 WeakPolarHBondContact O-CG 3.36Å; I363-E367 PolarHBondContact O-N 3.34Å
364L88.5Confident88Confident96 Ų9696.2 Ų96.250%0.50349%0.493SS..Hα-helixtrans-61-39.5176.5-71.2173.6000112.1K360 E361 E367 H368K360-L364 WeakPolarHBondContact O-CG 3.42Å; K360-L364 PolarHBondContact O-N 2.89Å; E361-L364 PolarHBondContact O-N 2.91Å; L364-E367 PolarHBondContact O-N 3.39Å; L364-H368 WeakPolarHBondContact O-CB 3.39Å; L364-H368 PolarHBondContact O-N 2.9Å
365L93.5Very high87.6Confident94 Ų9499.3 Ų99.349%0.49250%0.5SS..Hα-helixtrans-65.2-43.1175.5-177.462.3000111.7E361 H362 I363 H368 L369E361-L365 WeakPolarHBondContact O-CB 3.47Å; E361-L365 PolarHBondContact O-N 3.32Å; H362-L365 PolarHBondContact O-N 2.96Å; I363-L365 VanDerWaalsContact C-N 3.31Å; I363-L365 PolarHBondContact O-N 3.31Å; L365-H368 PolarHBondContact O-N 2.96Å; L365-L369 HydrophobicContact CG-CD1 4.26Å; L365-L369 WeakPolarHBondContact O-CG 3.43Å; L365-L369 PolarHBondContact O-N 3.07Å
366I87.3Confident87.4Confident88 Ų88100.1 Ų100.145%0.45150%0.502SS..Hα-helixtrans-62.5-44.8176.4-70.3165000110.5H362 I363 H368 L369 Q370H362-I366 VanDerWaalsContact O-CG1 3.26Å; H362-I366 WeakPolarHBondContact O-CG1 3.42Å; H362-I366 PolarHBondContact O-N 2.82Å; I363-I366 PolarHBondContact O-N 3.27Å; I366-H368 VanDerWaalsContact C-N 3.29Å; I366-H368 PolarHBondContact O-N 3.04Å; I366-L369 PolarHBondContact O-N 2.9Å; I366-Q370 HydrophobicContact CG2-CG 4.33Å; I366-Q370 WeakPolarHBondContact O-CB 3.48Å; I366-Q370 VanDerWaalsContact O-CG 3.3Å; I366-Q370 WeakPolarHBondContact O-CG 3.32Å; I366-Q370 PolarHBondContact O-N 2.87Å
367E88.1Confident86.8Confident89 Ų8997.5 Ų97.542%0.41650%0.502SS..Hα-helixtrans-60.9-38.6176-73.8-178.7176.800112.1I363 L364 K371I363-E367 WeakPolarHBondContact O-CG 3.36Å; I363-E367 PolarHBondContact O-N 3.34Å; L364-E367 PolarHBondContact O-N 3.39Å; E367-K371 WeakPolarHBondContact O-CG 3.36Å; E367-K371 PolarHBondContact O-N 3.31Å
368H89.3Confident86.3Confident116 Ų11697.4 Ų97.454%0.53751%0.506SS..Hα-helixtrans-65-46.3174.8-176.465.3000111.7L364 L365 I366 Q370 K371 Q372L364-H368 WeakPolarHBondContact O-CB 3.39Å; L364-H368 PolarHBondContact O-N 2.9Å; L365-H368 PolarHBondContact O-N 2.96Å; I366-H368 VanDerWaalsContact C-N 3.29Å; I366-H368 PolarHBondContact O-N 3.04Å; H368-Q370 VanDerWaalsContact C-N 3.34Å; H368-Q370 PolarHBondContact O-N 3.41Å; H368-K371 PolarHBondContact O-N 2.89Å; H368-Q372 PolarHBondContact O-N 2.93Å
369L87.7Confident85.7Confident102 Ų10296 Ų9653%0.53450%0.499SS..Hα-helixtrans-63.7-37.8177.3-71.2172.8000112.3L365 I366 Q372 A373L365-L369 HydrophobicContact CG-CD1 4.26Å; L365-L369 WeakPolarHBondContact O-CG 3.43Å; L365-L369 PolarHBondContact O-N 3.07Å; I366-L369 PolarHBondContact O-N 2.9Å; L369-Q372 PolarHBondContact O-N 3.32Å; L369-A373 WeakPolarHBondContact O-CB 3.5Å; L369-A373 PolarHBondContact O-N 3.48Å
370Q86.9Confident85.1Confident127 Ų12792.1 Ų92.159%0.59349%0.487SS*.Hα-helixtrans-65.3-42175-75.2175.8-9.100111.9I366 H368 A373 A374I366-Q370 HydrophobicContact CG2-CG 4.33Å; I366-Q370 WeakPolarHBondContact O-CB 3.48Å; I366-Q370 VanDerWaalsContact O-CG 3.3Å; I366-Q370 WeakPolarHBondContact O-CG 3.32Å; I366-Q370 PolarHBondContact O-N 2.87Å; H368-Q370 VanDerWaalsContact C-N 3.34Å; H368-Q370 PolarHBondContact O-N 3.41Å; Q370-A373 PolarHBondContact O-N 2.72Å; Q370-A374 WeakPolarHBondContact O-CB 3.38Å; Q370-A374 PolarHBondContact O-N 2.92Å
371K85.6Confident84.2Confident149 Ų14990.7 Ų90.765%0.64849%0.49SS*.Hα-helixtrans-63-42.1174.1-75.7172.6-176.5166.90111.8E367 H368 A374 F375E367-K371 WeakPolarHBondContact O-CG 3.36Å; E367-K371 PolarHBondContact O-N 3.31Å; H368-K371 PolarHBondContact O-N 2.89Å; K371-A374 PolarHBondContact O-N 3.46Å; K371-F375 PolarHBondContact O-N 2.83Å
372Q87.8Confident83.3Confident85 Ų8588.8 Ų88.840%0.39749%0.487SS..Hα-helixtrans-62.5-47.4176.1-17561.234.300111.3H368 L369 A374 F375 D376H368-Q372 PolarHBondContact O-N 2.93Å; L369-Q372 PolarHBondContact O-N 3.32Å; Q372-A374 VanDerWaalsContact C-N 3.33Å; Q372-A374 PolarHBondContact O-N 2.96Å; Q372-F375 WeakPolarHBondContact O-CB 3.46Å; Q372-F375 PolarHBondContact O-N 2.91Å; Q372-F375 VanDerWaalsContact O-N 3.15Å; Q372-D376 PolarHBondContact NE2-OD1 3.36Å; Q372-D376 PolarHBondContact NE2-OD2 3.49Å; Q372-D376 PolarHBondContact O-N 2.97Å
373A79.5Confident82.3Confident59 Ų5991.6 Ų91.649%0.48849%0.493SS..Hα-helixtrans-61.9-3917800000112.7L369 Q370 D376 A377L369-A373 WeakPolarHBondContact O-CB 3.5Å; L369-A373 PolarHBondContact O-N 3.48Å; Q370-A373 PolarHBondContact O-N 2.72Å; A373-D376 PolarHBondContact O-N 2.9Å; A373-A377 WeakPolarHBondContact O-CB 3.19Å; A373-A377 PolarHBondContact O-N 3.04Å
374A80.2Confident81.1Confident64 Ų6492.8 Ų92.853%0.52950%0.5SS..Hα-helixtrans-65.5-39175.100000112.2Q370 K371 Q372 S378Q370-A374 WeakPolarHBondContact O-CB 3.38Å; Q370-A374 PolarHBondContact O-N 2.92Å; K371-A374 PolarHBondContact O-N 3.46Å; Q372-A374 VanDerWaalsContact C-N 3.33Å; Q372-A374 PolarHBondContact O-N 2.96Å; A374-S378 WeakPolarHBondContact O-CB 3.3Å; A374-S378 PolarHBondContact O-N 3.43Å
375F81.3Confident79.8Confident122 Ų12294.5 Ų94.554%0.53551%0.509SS..Hα-helixtrans-64.8-43.9175-175.5-101.3000111.7K371 Q372 S378 N379K371-F375 PolarHBondContact O-N 2.83Å; Q372-F375 WeakPolarHBondContact O-CB 3.46Å; Q372-F375 PolarHBondContact O-N 2.91Å; Q372-F375 VanDerWaalsContact O-N 3.15Å; F375-S378 WeakPolarHBondContact O-CB 3.32Å; F375-S378 PolarHBondContact O-N 3.29Å; F375-N379 WeakPolarHBondContact CD1-ND2 3.33Å; F375-N379 WeakPolarHBondContact CE1-ND2 3.3Å; F375-N379 PolarHBondContact O-N 3.45Å; F375-N379 PolarHBondContact O-ND2 3.29Å
376D84.5Confident78.2Confident82 Ų8293.3 Ų93.344%0.43951%0.512SS..Hα-helixtrans-67.2-38.8178.9-67.9-28.4000112.2Q372 A373 N379 A380Q372-D376 PolarHBondContact NE2-OD1 3.36Å; Q372-D376 PolarHBondContact NE2-OD2 3.49Å; Q372-D376 PolarHBondContact O-N 2.97Å; A373-D376 PolarHBondContact O-N 2.9Å; D376-N379 PolarHBondContact O-N 2.87Å; D376-A380 PolarHBondContact O-N 3.33Å
377A76.3Confident76.6Confident62 Ų6292.3 Ų92.351%0.51252%0.517SS..Hα-helixtrans-63.7-41.6173.700000112.3A373 A380 S381A373-A377 WeakPolarHBondContact O-CB 3.19Å; A373-A377 PolarHBondContact O-N 3.04Å; A377-A380 PolarHBondContact O-N 3.44Å; A377-S381 WeakPolarHBondContact O-CB 3.46Å; A377-S381 PolarHBondContact O-N 3.17Å
378S79.5Confident75Confident67 Ų6795 Ų9547%0.46953%0.534SS..Hα-helixtrans-61.2-45.7174.6-177.20000111.6A374 F375 A380 S381 T382A374-S378 WeakPolarHBondContact O-CB 3.3Å; A374-S378 PolarHBondContact O-N 3.43Å; F375-S378 WeakPolarHBondContact O-CB 3.32Å; F375-S378 PolarHBondContact O-N 3.29Å; S378-A380 PolarHBondContact O-N 2.91Å; S378-S381 PolarHBondContact O-N 2.92Å; S378-T382 PolarHBondContact O-N 2.86Å; S378-T382 PolarHBondContact O-OG1 3.44Å
379N77.9Confident73Confident52 Ų5294.1 Ų94.128%0.27854%0.54SS..Hα-helixtrans-61.2-43.5176.1-76.2-27.5000112.3F375 D376 T382 R383F375-N379 WeakPolarHBondContact CD1-ND2 3.33Å; F375-N379 WeakPolarHBondContact CE1-ND2 3.3Å; F375-N379 PolarHBondContact O-N 3.45Å; F375-N379 PolarHBondContact O-ND2 3.29Å; D376-N379 PolarHBondContact O-N 2.87Å; N379-T382 PolarHBondContact O-N 3.08Å; N379-R383 WeakPolarHBondContact O-CG 3.5Å; N379-R383 PolarHBondContact O-N 2.96Å; N379-R383 VanDerWaalsContact O-N 3.11Å
380A74.8Confident71.2Confident43 Ų4393.4 Ų93.436%0.35554%0.541SS..Hα-helixtrans-62.4-43.7176.700000112D376 A377 S378 T382 R383 L384D376-A380 PolarHBondContact O-N 3.33Å; A377-A380 PolarHBondContact O-N 3.44Å; S378-A380 PolarHBondContact O-N 2.91Å; A380-T382 VanDerWaalsContact C-N 3.29Å; A380-T382 PolarHBondContact O-N 3.46Å; A380-R383 PolarHBondContact O-N 2.93Å; A380-L384 PolarHBondContact O-N 3.26Å
381S70.9Confident69Low74 Ų7491 Ų9152%0.51755%0.55SS.*Hα-helixtrans-61.9-37.9177.9-146.50000111.9A377 S378 L384 L385A377-S381 WeakPolarHBondContact O-CB 3.46Å; A377-S381 PolarHBondContact O-N 3.17Å; S378-S381 PolarHBondContact O-N 2.92Å; S381-L384 PolarHBondContact O-N 2.96Å; S381-L385 PolarHBondContact O-N 3.31Å
382T71.2Confident67.1Low89 Ų8993.2 Ų93.255%0.54656%0.563SS.*Hα-helixtrans-68-38177.4-42.20000112S378 N379 A380 L385 A386S378-T382 PolarHBondContact O-N 2.86Å; S378-T382 PolarHBondContact O-OG1 3.44Å; N379-T382 PolarHBondContact O-N 3.08Å; A380-T382 VanDerWaalsContact C-N 3.29Å; A380-T382 PolarHBondContact O-N 3.46Å; T382-L385 PolarHBondContact O-N 3.08Å; T382-A386 PolarHBondContact O-N 3.44Å
383R69.4Low65.5Low175 Ų17594.9 Ų94.966%0.6657%0.571SS**Hα-helixtrans-67.1-40.5174.6-68.2-176.9-158124.32.8112.2N379 A380 L385 A386 A387N379-R383 WeakPolarHBondContact O-CG 3.5Å; N379-R383 PolarHBondContact O-N 2.96Å; N379-R383 VanDerWaalsContact O-N 3.11Å; A380-R383 PolarHBondContact O-N 2.93Å; R383-L385 VanDerWaalsContact C-N 3.33Å; R383-A386 PolarHBondContact O-N 3.32Å; R383-A387 PolarHBondContact O-N 2.86Å; R383-A387 VanDerWaalsContact O-N 3.14Å
384L62.7Low64Low114 Ų11494.1 Ų94.160%0.59757%0.569SS**Hα-helixtrans-62.7-40.2174.6-88.1161.8000111.7A380 S381 A386 A387 L388A380-L384 PolarHBondContact O-N 3.26Å; S381-L384 PolarHBondContact O-N 2.96Å; L384-A386 VanDerWaalsContact C-N 3.31Å; L384-A386 PolarHBondContact O-N 2.97Å; L384-A387 PolarHBondContact O-N 3.35Å; L384-L388 WeakPolarHBondContact O-CG 3.28Å; L384-L388 PolarHBondContact O-N 3.45Å; L384-L388 VanDerWaalsContact O-N 3.15Å
385L61.9Low62.9Low131 Ų13196.7 Ų96.769%0.68658%0.577SS**Hα-helixtrans-62.6-37.6177-132.596000112.5S381 T382 R383S381-L385 PolarHBondContact O-N 3.31Å; T382-L385 PolarHBondContact O-N 3.08Å; R383-L385 VanDerWaalsContact C-N 3.33Å
386A58.8Low61.8Low69 Ų6993.6 Ų93.657%0.5757%0.574SS**Hα-helixtrans-68.3-38.7176.600000112.3T382 R383 L384 L388 S389T382-A386 PolarHBondContact O-N 3.44Å; R383-A386 PolarHBondContact O-N 3.32Å; L384-A386 VanDerWaalsContact C-N 3.31Å; L384-A386 PolarHBondContact O-N 2.97Å; A386-L388 VanDerWaalsContact C-N 3.34Å; A386-L388 PolarHBondContact O-N 3.5Å; A386-S389 WeakPolarHBondContact O-CB 3.41Å; A386-S389 PolarHBondContact O-N 3.48Å
387A54.8Low60.7Low67 Ų6792.2 Ų92.255%0.55457%0.569SS**Hα-helixtrans-68.8-30.617900000112.9R383 L384 S389R383-A387 PolarHBondContact O-N 2.86Å; R383-A387 VanDerWaalsContact O-N 3.14Å; L384-A387 PolarHBondContact O-N 3.35Å; A387-S389 PolarHBondContact O-N 2.96Å
388L53.1Low60.1Low146 Ų14692 Ų9276%0.76457%0.567SS**THydrogen-bonded Turntrans-74.9-2.7178.9-67.9171.6000114.1L384 A386L384-L388 WeakPolarHBondContact O-CG 3.28Å; L384-L388 PolarHBondContact O-N 3.45Å; L384-L388 VanDerWaalsContact O-N 3.15Å; A386-L388 VanDerWaalsContact C-N 3.34Å; A386-L388 PolarHBondContact O-N 3.5Å
389S48.9Very low59.6Low97 Ų9795 Ų9568%0.67858%0.577SS**THydrogen-bonded Turntrans-85.2-6.4-176.1-1790000115.5A386 A387A386-S389 WeakPolarHBondContact O-CB 3.41Å; A386-S389 PolarHBondContact O-N 3.48Å; A387-S389 PolarHBondContact O-N 2.96Å
390T49.5Very low59.1Low88 Ų8898.7 Ų98.754%0.5459%0.592SS.*  trans-125.891.2-175.446.20000111.9E392T390-E392 PolarHBondContact O-N 2.85Å
391G40.6Very low58.9Low77 Ų77101.7 Ų101.779%0.79460%0.602SS**THydrogen-bonded Turntrans-79.719.4-160.200000119.6
392E46Very low59.2Low194 Ų194104.1 Ų104.191%0.90760%0.603SS**THydrogen-bonded Turntrans-113-3.7168.9-82.5-177.5164.400114.2T390 G394T390-E392 PolarHBondContact O-N 2.85Å; E392-G394 PolarHBondContact O-N 3.23Å
393E53.6Low59.5Low121 Ų121105 Ų10557%0.56560%0.601SS**THydrogen-bonded Turntrans-79.40.9163.7-72.4179.416700112.5V395 A396 T397E393-V395 PolarHBondContact O-N 3.39Å; E393-V395 VanDerWaalsContact O-N 3.09Å; E393-A396 PolarHBondContact O-N 2.94Å; E393-T397 HydrophobicContact CB-CG2 4.21Å; E393-T397 WeakPolarHBondContact O-CB 3.37Å; E393-T397 WeakPolarHBondContact O-CG2 3.48Å; E393-T397 PolarHBondContact O-N 3.43Å; E393-T397 PolarHBondContact O-OG1 3.35Å
394G47.2Very low59.9Low43 Ų4399.1 Ų99.144%0.44359%0.586SS.*Hα-helixtrans-55.7-29-178.900000114.9E392 T397 A398E392-G394 PolarHBondContact O-N 3.23Å; G394-T397 VanDerWaalsContact C-OG1 3.3Å; G394-T397 WeakPolarHBondContact CA-OG1 3.45Å; G394-T397 PolarHBondContact O-OG1 3.2Å; G394-T397 VanDerWaalsContact O-OG1 3.13Å; G394-A398 WeakPolarHBondContact O-CB 3.37Å; G394-A398 PolarHBondContact O-N 2.96Å
395V58.2Low60.7Low118 Ų11898 Ų9872%0.71558%0.58SS**Hα-helixtrans-86.6-33177.8-1770000111.9E393E393-V395 PolarHBondContact O-N 3.39Å; E393-V395 VanDerWaalsContact O-N 3.09Å
396A57.4Low61.5Low56 Ų5697.5 Ų97.546%0.46357%0.574SS.*Hα-helixtrans-72.7-43.7173.800000111.4E393 A398 L399 E400E393-A396 PolarHBondContact O-N 2.94Å; A396-A398 VanDerWaalsContact C-N 3.28Å; A396-A398 PolarHBondContact O-N 3.24Å; A396-L399 PolarHBondContact O-N 3.37Å; A396-E400 PolarHBondContact O-N 3.26Å
397T62.3Low62.5Low53 Ų5399.7 Ų99.733%0.32557%0.573SS.*Hα-helixtrans-61.8-32.5173.852.40000112E393 G394 L399 E400 L401E393-T397 HydrophobicContact CB-CG2 4.21Å; E393-T397 WeakPolarHBondContact O-CB 3.37Å; E393-T397 WeakPolarHBondContact O-CG2 3.48Å; E393-T397 PolarHBondContact O-N 3.43Å; E393-T397 PolarHBondContact O-OG1 3.35Å; G394-T397 VanDerWaalsContact C-OG1 3.3Å; G394-T397 WeakPolarHBondContact CA-OG1 3.45Å; G394-T397 PolarHBondContact O-OG1 3.2Å; G394-T397 VanDerWaalsContact O-OG1 3.13Å; T397-L399 VanDerWaalsContact C-N 3.32Å; T397-L399 PolarHBondContact O-N 2.89Å; T397-E400 PolarHBondContact O-N 3.01Å; T397-L401 WeakPolarHBondContact O-CA 3.38Å; T397-L401 WeakPolarHBondContact O-CB 3.34Å; T397-L401 WeakPolarHBondContact O-CD1 3.32Å; T397-L401 WeakPolarHBondContact O-CG 3.47Å; T397-L401 PolarHBondContact O-N 3.46Å
398A63.2Low63.7Low57 Ų57102.1 Ų102.147%0.47157%0.572SS.*Hα-helixtrans-63.6-35.8172.600000112.9G394 A396 K402G394-A398 WeakPolarHBondContact O-CB 3.37Å; G394-A398 PolarHBondContact O-N 2.96Å; A396-A398 VanDerWaalsContact C-N 3.28Å; A396-A398 PolarHBondContact O-N 3.24Å; A398-K402 PolarHBondContact O-N 3.21Å
399L68.1Low64.7Low130 Ų13099.4 Ų99.468%0.68156%0.558SS**Hα-helixtrans-76.2-41.4175.3-82168.7000112.1A396 T397 L401 K402 Q403A396-L399 PolarHBondContact O-N 3.37Å; T397-L399 VanDerWaalsContact C-N 3.32Å; T397-L399 PolarHBondContact O-N 2.89Å; L399-L401 VanDerWaalsContact C-N 3.33Å; L399-L401 PolarHBondContact O-N 3.42Å; L399-K402 PolarHBondContact O-N 2.87Å; L399-Q403 PolarHBondContact O-N 3.28Å; L399-Q403 VanDerWaalsContact O-N 3.12Å
400E68Low66.3Low130 Ų13099.5 Ų99.561%0.60755%0.548SS*.Hα-helixtrans-64.1-37173-72.8-177.7164.600112.1A396 T397 K402 Q403 C404A396-E400 PolarHBondContact O-N 3.26Å; T397-E400 PolarHBondContact O-N 3.01Å; E400-K402 VanDerWaalsContact C-N 3.32Å; E400-K402 PolarHBondContact O-N 3.37Å; E400-Q403 PolarHBondContact O-N 3.42Å; E400-C404 WeakPolarHBondContact O-CB 3.37Å; E400-C404 PolarHBondContact O-N 2.92Å
401L71.6Confident67.8Low106 Ų10698.3 Ų98.356%0.55554%0.542SS*.Hα-helixtrans-61.1-41.6174.5-81.8165.9000110.9T397 L399 C404 I405T397-L401 WeakPolarHBondContact O-CA 3.38Å; T397-L401 WeakPolarHBondContact O-CB 3.34Å; T397-L401 WeakPolarHBondContact O-CD1 3.32Å; T397-L401 WeakPolarHBondContact O-CG 3.47Å; T397-L401 PolarHBondContact O-N 3.46Å; L399-L401 VanDerWaalsContact C-N 3.33Å; L399-L401 PolarHBondContact O-N 3.42Å; L401-C404 PolarHBondContact O-N 3.4Å; L401-I405 WeakPolarHBondContact O-CB 3.34Å; L401-I405 WeakPolarHBondContact O-CD1 3.4Å; L401-I405 WeakPolarHBondContact O-CG1 3.47Å; L401-I405 PolarHBondContact O-N 2.91Å
402K77Confident69.7Low126 Ų126100.5 Ų100.555%0.54853%0.531SS..Hα-helixtrans-62.5-45.4174.9-171.7-175.5175.3-171.80111.5A398 L399 E400 I405 E406A398-K402 PolarHBondContact O-N 3.21Å; L399-K402 PolarHBondContact O-N 2.87Å; E400-K402 VanDerWaalsContact C-N 3.32Å; E400-K402 PolarHBondContact O-N 3.37Å; K402-I405 PolarHBondContact O-N 3.43Å; K402-E406 PolarHBondContact O-N 2.97Å; K402-E406 VanDerWaalsContact O-N 3.13Å
403Q77.2Confident71.4Confident107 Ų10796 Ų9650%0.551%0.513SS..Hα-helixtrans-66.2-38.5178.5-171.3172.9-3.700112.1L399 E400 I405 E406 Q407L399-Q403 PolarHBondContact O-N 3.28Å; L399-Q403 VanDerWaalsContact O-N 3.12Å; E400-Q403 PolarHBondContact O-N 3.42Å; Q403-I405 VanDerWaalsContact C-N 3.34Å; Q403-E406 PolarHBondContact O-N 2.96Å; Q403-Q407 HydrophobicContact CG-CG 4.33Å; Q403-Q407 WeakPolarHBondContact O-CB 3.42Å; Q403-Q407 WeakPolarHBondContact O-CG 3.48Å; Q403-Q407 PolarHBondContact O-N 2.74Å
404C77.7Confident72.9Confident51 Ų5196.5 Ų96.535%0.34551%0.513SS..Hα-helixtrans-63.8-39.3174.7-173.50000111.6E400 L401 E406 H408 L409E400-C404 WeakPolarHBondContact O-CB 3.37Å; E400-C404 PolarHBondContact O-N 2.92Å; L401-C404 PolarHBondContact O-N 3.4Å; C404-E406 PolarHBondContact O-N 3.37Å; C404-H408 WeakPolarHBondContact O-CA 3.44Å; C404-H408 WeakPolarHBondContact O-CB 3.46Å; C404-H408 PolarHBondContact O-N 3.48Å; C404-L409 PolarHBondContact O-N 3.03Å
405I80.2Confident74.6Confident92 Ų9298.1 Ų98.147%0.47252%0.517SS..Iπ-helixtrans-61-44.9173.9-70.4161.8000111L401 K402 Q403 L409 Q410L401-I405 WeakPolarHBondContact O-CB 3.34Å; L401-I405 WeakPolarHBondContact O-CD1 3.4Å; L401-I405 WeakPolarHBondContact O-CG1 3.47Å; L401-I405 PolarHBondContact O-N 2.91Å; K402-I405 PolarHBondContact O-N 3.43Å; Q403-I405 VanDerWaalsContact C-N 3.34Å; I405-L409 HydrophobicContact CB-CD1 4.48Å; I405-L409 HydrophobicContact CG1-CD1 4.01Å; I405-L409 PolarHBondContact O-N 3.37Å; I405-Q410 PolarHBondContact O-N 3.05Å
406E78.9Confident75.7Confident120 Ų12097.4 Ų97.456%0.56151%0.508SS*.Iπ-helixtrans-73.6-37.2-178.5-76.1175.8-174.200113.5K402 Q403 C404 Q410K402-E406 PolarHBondContact O-N 2.97Å; K402-E406 VanDerWaalsContact O-N 3.13Å; Q403-E406 PolarHBondContact O-N 2.96Å; C404-E406 PolarHBondContact O-N 3.37Å; E406-Q410 WeakPolarHBondContact O-CB 3.5Å
407Q79.6Confident77.2Confident115 Ų11598.8 Ų98.854%0.53751%0.507SS..Iπ-helixtrans-92.7-28.6-174.4-67.6-170.3-10.800114.5Q403 P411Q403-Q407 HydrophobicContact CG-CG 4.33Å; Q403-Q407 WeakPolarHBondContact O-CB 3.42Å; Q403-Q407 WeakPolarHBondContact O-CG 3.48Å; Q403-Q407 PolarHBondContact O-N 2.74Å; Q407-P411 WeakPolarHBondContact O-CG 3.47Å
408H78.4Confident78.3Confident118 Ų118102.7 Ų102.755%0.54652%0.522SS..Iπ-helixtrans-114-52.8-175.7-63.5-63.5000112C404 P411 E412C404-H408 WeakPolarHBondContact O-CA 3.44Å; C404-H408 WeakPolarHBondContact O-CB 3.46Å; C404-H408 PolarHBondContact O-N 3.48Å; H408-P411 WeakPolarHBondContact O-CD 3.46Å; H408-P411 WeakPolarHBondContact O-CG 3.45Å; H408-E412 WeakPolarHBondContact O-CB 3.38Å; H408-E412 PolarHBondContact O-N 3.45Å
409L75.7Confident79.4Confident89 Ų89106.7 Ų106.747%0.46653%0.529SS..Iπ-helixtrans-72.9-37-176.4-75.4111.3000113.6C404 I405 E412 L413C404-L409 PolarHBondContact O-N 3.03Å; I405-L409 HydrophobicContact CB-CD1 4.48Å; I405-L409 HydrophobicContact CG1-CD1 4.01Å; I405-L409 PolarHBondContact O-N 3.37Å; L409-E412 PolarHBondContact O-N 2.98Å; L409-L413 VanDerWaalsContact O-CB 3.23Å; L409-L413 WeakPolarHBondContact O-CB 3.45Å; L409-L413 PolarHBondContact O-N 3.37Å
410Q81.2Confident80.1Confident98 Ų98103.6 Ų103.646%0.45852%0.517SS..Hα-helixtrans-59.7-49.8175.9-104.7-83.4-21.300113I405 E406 L413 K414I405-Q410 PolarHBondContact O-N 3.05Å; E406-Q410 WeakPolarHBondContact O-CB 3.5Å; Q410-L413 PolarHBondContact O-N 3.08Å; Q410-K414 PolarHBondContact O-N 2.86Å
411P82.2Confident81Confident64 Ų64103.5 Ų103.542%0.41652%0.515SS..Hα-helixtrans-69.3-34.6174.519.5-25.5000113.2Q407 H408 L413 K414 C415Q407-P411 WeakPolarHBondContact O-CG 3.47Å; H408-P411 WeakPolarHBondContact O-CD 3.46Å; H408-P411 WeakPolarHBondContact O-CG 3.45Å; P411-L413 VanDerWaalsContact C-N 3.33Å; P411-L413 PolarHBondContact O-N 3.35Å; P411-K414 PolarHBondContact O-N 2.96Å; P411-C415 WeakPolarHBondContact O-CB 3.48Å; P411-C415 PolarHBondContact O-N 3.48Å
412E80.3Confident81.7Confident122 Ų122104 Ų10457%0.5751%0.514SS*.Hα-helixtrans-60.6-43.1170.8-87-172.715800111.7H408 L409 K414 C415 L416H408-E412 WeakPolarHBondContact O-CB 3.38Å; H408-E412 PolarHBondContact O-N 3.45Å; L409-E412 PolarHBondContact O-N 2.98Å; E412-K414 PolarHBondContact O-N 3.38Å; E412-C415 WeakPolarHBondContact O-CB 3.44Å; E412-C415 PolarHBondContact O-N 3.24Å; E412-L416 WeakPolarHBondContact O-CB 3.4Å; E412-L416 PolarHBondContact O-N 3.12Å
413L81.6Confident82.1Confident100 Ų100102.7 Ų102.752%0.52451%0.512SS..Hα-helixtrans-62.9-42.1176.8-175.466.8000111.1L409 Q410 P411 L416 I417L409-L413 VanDerWaalsContact O-CB 3.23Å; L409-L413 WeakPolarHBondContact O-CB 3.45Å; L409-L413 PolarHBondContact O-N 3.37Å; Q410-L413 PolarHBondContact O-N 3.08Å; P411-L413 VanDerWaalsContact C-N 3.33Å; P411-L413 PolarHBondContact O-N 3.35Å; L413-L416 PolarHBondContact O-N 3.05Å; L413-I417 HydrophobicContact CG-CD1 4.21Å; L413-I417 WeakPolarHBondContact O-CD1 3.38Å; L413-I417 VanDerWaalsContact O-CG1 3.23Å; L413-I417 WeakPolarHBondContact O-CG1 3.47Å; L413-I417 PolarHBondContact O-N 2.84Å
414K85.4Confident82.6Confident131 Ų131103.7 Ų103.757%0.5752%0.517SS*.Hα-helixtrans-62-45.3172.6-81.8-175.2178.6177.80112.1Q410 P411 E412 L416 I417 E418Q410-K414 PolarHBondContact O-N 2.86Å; P411-K414 PolarHBondContact O-N 2.96Å; E412-K414 PolarHBondContact O-N 3.38Å; K414-L416 VanDerWaalsContact C-N 3.31Å; K414-L416 PolarHBondContact O-N 3.19Å; K414-I417 PolarHBondContact O-N 2.87Å; K414-E418 PolarHBondContact O-N 3.44Å
415C82.7Confident83Confident77 Ų77104.8 Ų104.852%0.5253%0.525SS..Hα-helixtrans-61.8-39.2177-174.30000111.6P411 E412 E418 K419P411-C415 WeakPolarHBondContact O-CB 3.48Å; P411-C415 PolarHBondContact O-N 3.48Å; E412-C415 WeakPolarHBondContact O-CB 3.44Å; E412-C415 PolarHBondContact O-N 3.24Å; C415-E418 PolarHBondContact O-N 2.85Å; C415-K419 WeakPolarHBondContact O-CB 3.46Å; C415-K419 PolarHBondContact O-N 3.45Å
416L81.2Confident83.3Confident104 Ų104105 Ų10555%0.54552%0.524SS..Hα-helixtrans-65.6-41.8174.1-103.6132.9000111.7E412 L413 K414 E418 K419 C420E412-L416 WeakPolarHBondContact O-CB 3.4Å; E412-L416 PolarHBondContact O-N 3.12Å; L413-L416 PolarHBondContact O-N 3.05Å; K414-L416 VanDerWaalsContact C-N 3.31Å; K414-L416 PolarHBondContact O-N 3.19Å; L416-E418 VanDerWaalsContact C-N 3.34Å; L416-E418 PolarHBondContact O-N 2.94Å; L416-K419 PolarHBondContact O-N 3.18Å; L416-C420 WeakPolarHBondContact O-CB 3.38Å; L416-C420 PolarHBondContact O-N 3.24Å; L416-C420 PolarHBondContact O-SG 2.9Å
417I87.8Confident83.7Confident85 Ų85104.5 Ų104.544%0.43653%0.525SS..Hα-helixtrans-61.6-43.1175-70.7163.8000110.7L413 K414 C420 K421L413-I417 HydrophobicContact CG-CD1 4.21Å; L413-I417 WeakPolarHBondContact O-CD1 3.38Å; L413-I417 VanDerWaalsContact O-CG1 3.23Å; L413-I417 WeakPolarHBondContact O-CG1 3.47Å; L413-I417 PolarHBondContact O-N 2.84Å; K414-I417 PolarHBondContact O-N 2.87Å; I417-C420 PolarHBondContact O-N 3.49Å; I417-K421 WeakPolarHBondContact O-CG 3.41Å; I417-K421 PolarHBondContact O-N 3.4Å
418E86Confident84.1Confident135 Ų135106.2 Ų106.263%0.63153%0.534SS*.Hα-helixtrans-64.3-40.6174.7-75.8179.5172.400111.9K414 C415 L416 C420 K421 H422K414-E418 PolarHBondContact O-N 3.44Å; C415-E418 PolarHBondContact O-N 2.85Å; L416-E418 VanDerWaalsContact C-N 3.34Å; L416-E418 PolarHBondContact O-N 2.94Å; E418-C420 PolarHBondContact O-N 3.24Å; E418-K421 PolarHBondContact O-N 2.89Å; E418-H422 PolarHBondContact O-N 3.22Å
419K86.5Confident84.6Confident141 Ų141105.8 Ų105.861%0.61353%0.533SS*.Hα-helixtrans-64.5-39.4176-155.6171.5-171.3176.40112C415 L416 H422 L423C415-K419 WeakPolarHBondContact O-CB 3.46Å; C415-K419 PolarHBondContact O-N 3.45Å; L416-K419 PolarHBondContact O-N 3.18Å; K419-H422 PolarHBondContact O-N 2.84Å; K419-L423 WeakPolarHBondContact O-CG 3.36Å; K419-L423 PolarHBondContact O-N 3.42Å
420C82.4Confident85.1Confident65 Ų65104.8 Ų104.844%0.43953%0.533SS..Hα-helixtrans-62.5-45.1172.6-71.30000111.5L416 I417 E418 H422 L423 E424L416-C420 WeakPolarHBondContact O-CB 3.38Å; L416-C420 PolarHBondContact O-N 3.24Å; L416-C420 PolarHBondContact O-SG 2.9Å; I417-C420 PolarHBondContact O-N 3.49Å; E418-C420 PolarHBondContact O-N 3.24Å; C420-H422 VanDerWaalsContact C-N 3.29Å; C420-H422 PolarHBondContact O-N 3.34Å; C420-L423 PolarHBondContact O-N 3.5Å; C420-E424 WeakPolarHBondContact O-CG 3.41Å; C420-E424 PolarHBondContact O-N 2.98Å
421K87.8Confident85.5Confident128 Ų128103.9 Ų103.956%0.55753%0.532SS*.Hα-helixtrans-62.3-35.9175.3-74.3179.8179.2-1790112.8I417 E418 S425I417-K421 WeakPolarHBondContact O-CG 3.41Å; I417-K421 PolarHBondContact O-N 3.4Å; E418-K421 PolarHBondContact O-N 2.89Å; K421-S425 PolarHBondContact O-N 2.93Å; K421-S425 VanDerWaalsContact O-N 3.08Å; K421-S425 PolarHBondContact O-OG 3.49Å
422H85.3Confident85.8Confident116 Ų116104.2 Ų104.254%0.53754%0.536SS..Hα-helixtrans-67.3-46.2175.7-167.452.4000111.3E418 K419 C420 E424 S425 E426E418-H422 PolarHBondContact O-N 3.22Å; K419-H422 PolarHBondContact O-N 2.84Å; C420-H422 VanDerWaalsContact C-N 3.29Å; C420-H422 PolarHBondContact O-N 3.34Å; H422-E424 VanDerWaalsContact C-N 3.32Å; H422-E424 PolarHBondContact O-N 2.86Å; H422-S425 WeakPolarHBondContact O-CA 3.44Å; H422-S425 WeakPolarHBondContact O-CB 3.37Å; H422-S425 PolarHBondContact O-N 3.31Å; H422-S425 VanDerWaalsContact O-N 3.07Å; H422-E426 IonicContact NE2-OE1 3.57Å; H422-E426 PolarHBondContact O-N 3.05Å
423L85.2Confident86.3Confident98 Ų98104.1 Ų104.151%0.51353%0.533SS..Hα-helixtrans-62.2-37.2174.6-72.3170.7000112.5K419 C420 S425 E426 L427K419-L423 WeakPolarHBondContact O-CG 3.36Å; K419-L423 PolarHBondContact O-N 3.42Å; C420-L423 PolarHBondContact O-N 3.5Å; L423-S425 VanDerWaalsContact C-N 3.3Å; L423-S425 PolarHBondContact O-N 2.89Å; L423-E426 PolarHBondContact O-N 2.87Å; L423-L427 VanDerWaalsContact O-CB 3.28Å; L423-L427 WeakPolarHBondContact O-CB 3.36Å; L423-L427 PolarHBondContact O-N 3.41Å
424E87.8Confident86.6Confident128 Ų128104.3 Ų104.360%0.59854%0.535SS*.Hα-helixtrans-62.5-37.5172.7-76.5173.3171.400111.8C420 H422 M428C420-E424 WeakPolarHBondContact O-CG 3.41Å; C420-E424 PolarHBondContact O-N 2.98Å; H422-E424 VanDerWaalsContact C-N 3.32Å; H422-E424 PolarHBondContact O-N 2.86Å; E424-M428 PolarHBondContact O-N 3.45Å
425S86.1Confident86.8Confident74 Ų74104.7 Ų104.752%0.51754%0.538SS..Hα-helixtrans-70.9-42.4175.8-59.20000112K421 H422 L423 L427 M428 E429K421-S425 PolarHBondContact O-N 2.93Å; K421-S425 VanDerWaalsContact O-N 3.08Å; K421-S425 PolarHBondContact O-OG 3.49Å; H422-S425 WeakPolarHBondContact O-CA 3.44Å; H422-S425 WeakPolarHBondContact O-CB 3.37Å; H422-S425 PolarHBondContact O-N 3.31Å; H422-S425 VanDerWaalsContact O-N 3.07Å; L423-S425 VanDerWaalsContact C-N 3.3Å; L423-S425 PolarHBondContact O-N 2.89Å; S425-L427 VanDerWaalsContact C-N 3.31Å; S425-L427 PolarHBondContact O-N 3.31Å; S425-M428 PolarHBondContact O-N 3.33Å; S425-E429 PolarHBondContact O-N 3.22Å
426E87.5Confident87.1Confident97 Ų97107.4 Ų107.445%0.45354%0.541SS..Hα-helixtrans-62.3-38.6173.2-74.9-174.5159.400111.7H422 L423 E429 S430H422-E426 IonicContact NE2-OE1 3.57Å; H422-E426 PolarHBondContact O-N 3.05Å; L423-E426 PolarHBondContact O-N 2.87Å; E426-E429 PolarHBondContact O-N 3.49Å; E426-S430 VanDerWaalsContact O-CB 3.31Å; E426-S430 WeakPolarHBondContact O-CB 3.14Å; E426-S430 PolarHBondContact O-N 2.9Å
427L87.3Confident87.4Confident109 Ų109107.8 Ų107.857%0.57154%0.544SS*.Hα-helixtrans-64.2-43.1174.9-169.381.8000111.2L423 S425 S430 N431L423-L427 VanDerWaalsContact O-CB 3.28Å; L423-L427 WeakPolarHBondContact O-CB 3.36Å; L423-L427 PolarHBondContact O-N 3.41Å; S425-L427 VanDerWaalsContact C-N 3.31Å; S425-L427 PolarHBondContact O-N 3.31Å; L427-S430 PolarHBondContact O-N 3.42Å; L427-N431 WeakPolarHBondContact O-CB 3.39Å; L427-N431 VanDerWaalsContact O-CG 3.24Å; L427-N431 PolarHBondContact O-N 3.25Å; L427-N431 PolarHBondContact O-ND2 3.06Å
428M88.1Confident87.5Confident151 Ų151108.5 Ų108.574%0.74455%0.545SS*.Hα-helixtrans-60.5-44.2173.5-88-155.3-166.800112E424 S425 N431 S432E424-M428 PolarHBondContact O-N 3.45Å; S425-M428 PolarHBondContact O-N 3.33Å; M428-N431 PolarHBondContact O-N 2.86Å; M428-S432 PolarHBondContact O-N 3.39Å
429E88.3Confident87.6Confident109 Ų109106.7 Ų106.751%0.50954%0.536SS..Hα-helixtrans-65.6-41.7178.3-163.4-170.8148.100111.5S425 E426 N431 S432 K433S425-E429 PolarHBondContact O-N 3.22Å; E426-E429 PolarHBondContact O-N 3.49Å; E429-N431 VanDerWaalsContact C-N 3.34Å; E429-N431 PolarHBondContact O-N 2.95Å; E429-S432 PolarHBondContact O-N 2.77Å; E429-K433 PolarHBondContact O-N 3.37Å; E429-K433 VanDerWaalsContact OE1-CE 3.29Å; E429-K433 WeakPolarHBondContact OE1-CE 3.45Å; E429-K433 IonicContact OE1-NZ 2.66Å; E429-K433 PolarHBondContact OE1-NZ 3.03Å
430S85.5Confident87.8Confident68 Ų68103.7 Ų103.748%0.47653%0.527SS..Hα-helixtrans-61.6-41.1174.3-172.80000111.6E426 L427 K433 N434E426-S430 VanDerWaalsContact O-CB 3.31Å; E426-S430 WeakPolarHBondContact O-CB 3.14Å; E426-S430 PolarHBondContact O-N 2.9Å; L427-S430 PolarHBondContact O-N 3.42Å; S430-K433 PolarHBondContact O-N 3.5Å; S430-N434 WeakPolarHBondContact O-CB 3.44Å; S430-N434 PolarHBondContact O-N 3.48Å
431N90.1Very high88Confident80 Ų80104.9 Ų104.943%0.42853%0.529SS..Hα-helixtrans-63.8-43175.9-76-24.4000111.6L427 M428 E429 K433 N434 E435L427-N431 WeakPolarHBondContact O-CB 3.39Å; L427-N431 VanDerWaalsContact O-CG 3.24Å; L427-N431 PolarHBondContact O-N 3.25Å; L427-N431 PolarHBondContact O-ND2 3.06Å; M428-N431 PolarHBondContact O-N 2.86Å; E429-N431 VanDerWaalsContact C-N 3.34Å; E429-N431 PolarHBondContact O-N 2.95Å; N431-K433 VanDerWaalsContact C-N 3.35Å; N431-K433 PolarHBondContact O-N 3.48Å; N431-N434 WeakPolarHBondContact O-CB 3.34Å; N431-N434 PolarHBondContact O-N 2.96Å; N431-N434 VanDerWaalsContact O-N 3.14Å; N431-E435 WeakPolarHBondContact O-CG 3.41Å; N431-E435 PolarHBondContact O-N 3.19Å
432S89.1Confident88.2Confident71 Ų71102.7 Ų102.750%0.49752%0.523SS..Hα-helixtrans-63.6-38.8175.8-173.60000112.4M428 E429 N434 E435 K436M428-S432 PolarHBondContact O-N 3.39Å; E429-S432 PolarHBondContact O-N 2.77Å; S432-N434 VanDerWaalsContact C-N 3.34Å; S432-E435 PolarHBondContact O-N 2.9Å; S432-K436 PolarHBondContact O-N 3.03Å
433K90.9Very high88.4Confident119 Ų119101.6 Ų101.652%0.51752%0.517SS..Hα-helixtrans-63.7-39.6171.9-75.3174.1-173.9160.30111.8E429 S430 N431 K436 L437E429-K433 PolarHBondContact O-N 3.37Å; E429-K433 VanDerWaalsContact OE1-CE 3.29Å; E429-K433 WeakPolarHBondContact OE1-CE 3.45Å; E429-K433 IonicContact OE1-NZ 2.66Å; E429-K433 PolarHBondContact OE1-NZ 3.03Å; S430-K433 PolarHBondContact O-N 3.5Å; N431-K433 VanDerWaalsContact C-N 3.35Å; N431-K433 PolarHBondContact O-N 3.48Å; K433-K436 WeakPolarHBondContact O-CB 3.3Å; K433-K436 PolarHBondContact O-N 3.42Å; K433-L437 WeakPolarHBondContact O-CG 3.37Å; K433-L437 PolarHBondContact O-N 2.9Å
434N86.7Confident88.5Confident104 Ų10499 Ų9956%0.55651%0.51SS*.Hα-helixtrans-66.8-40178.3-138.28.2000111.5S430 N431 S432 K436 L437 Q438S430-N434 WeakPolarHBondContact O-CB 3.44Å; S430-N434 PolarHBondContact O-N 3.48Å; N431-N434 WeakPolarHBondContact O-CB 3.34Å; N431-N434 PolarHBondContact O-N 2.96Å; N431-N434 VanDerWaalsContact O-N 3.14Å; S432-N434 VanDerWaalsContact C-N 3.34Å; N434-K436 VanDerWaalsContact C-N 3.35Å; N434-L437 PolarHBondContact O-N 3.3Å; N434-Q438 WeakPolarHBondContact O-CB 3.44Å; N434-Q438 PolarHBondContact O-N 3.3Å
435E90Very high88.5Confident139 Ų13996.7 Ų96.765%0.6550%0.502SS*.Hα-helixtrans-60.9-42.5172.1-74.1175.7174.200111.7N431 S432 Q438 E439N431-E435 WeakPolarHBondContact O-CG 3.41Å; N431-E435 PolarHBondContact O-N 3.19Å; S432-E435 PolarHBondContact O-N 2.9Å; E435-Q438 PolarHBondContact O-N 3.1Å; E435-E439 PolarHBondContact O-N 3.01Å
436K89.4Confident88.7Confident134 Ų13499.1 Ų99.158%0.58351%0.505SS*.Hα-helixtrans-61.4-48175.6-158.490.3179.2-176.10112S432 K433 N434 Q438 E439 D440S432-K436 PolarHBondContact O-N 3.03Å; K433-K436 WeakPolarHBondContact O-CB 3.3Å; K433-K436 PolarHBondContact O-N 3.42Å; N434-K436 VanDerWaalsContact C-N 3.35Å; K436-Q438 VanDerWaalsContact C-N 3.3Å; K436-Q438 PolarHBondContact O-N 3.33Å; K436-E439 WeakPolarHBondContact O-CB 3.48Å; K436-E439 PolarHBondContact O-N 3.36Å; K436-D440 PolarHBondContact O-N 3.21Å
437L87.5Confident88.7Confident113 Ų11399.5 Ų99.559%0.59251%0.509SS*.Hα-helixtrans-63.2-36.7177.3-74.9170.8000111.8K433 N434 D440 L441K433-L437 WeakPolarHBondContact O-CG 3.37Å; K433-L437 PolarHBondContact O-N 2.9Å; N434-L437 PolarHBondContact O-N 3.3Å; L437-D440 PolarHBondContact O-N 3.09Å; L437-L441 VanDerWaalsContact O-CB 3.31Å; L437-L441 WeakPolarHBondContact O-CB 3.41Å; L437-L441 PolarHBondContact O-N 3.46Å
438Q89.7Confident88.7Confident100 Ų10098 Ų9847%0.46750%0.5SS..Hα-helixtrans-65.7-39.1175-170.962.944.200111.5N434 E435 K436 N442N434-Q438 WeakPolarHBondContact O-CB 3.44Å; N434-Q438 PolarHBondContact O-N 3.3Å; E435-Q438 PolarHBondContact O-N 3.1Å; K436-Q438 VanDerWaalsContact C-N 3.3Å; K436-Q438 PolarHBondContact O-N 3.33Å; Q438-N442 PolarHBondContact O-N 2.91Å; Q438-N442 PolarHBondContact O-ND2 3.09Å; Q438-N442 PolarHBondContact O-OD1 3.04Å
439E88.6Confident88.7Confident96 Ų9695.5 Ų95.545%0.44949%0.487SS..Hα-helixtrans-65-43.1174.6-158.2-168.5148.300111.7E435 K436 N442 K443E435-E439 PolarHBondContact O-N 3.01Å; K436-E439 WeakPolarHBondContact O-CB 3.48Å; K436-E439 PolarHBondContact O-N 3.36Å; E439-N442 WeakPolarHBondContact O-CB 3.43Å; E439-N442 PolarHBondContact O-N 3.48Å; E439-K443 WeakPolarHBondContact O-CG 3.49Å; E439-K443 PolarHBondContact O-N 3.03Å; E439-K443 WeakPolarHBondContact OE1-CE 3.46Å; E439-K443 IonicContact OE1-NZ 3.99Å; E439-K443 PolarHBondContact OE1-NZ 3.35Å
440D90Very high88.6Confident79 Ų7996 Ų9642%0.42249%0.49SS..Hα-helixtrans-67.9-37.2177.4-70.9-19.4000112.2K436 L437 N442 K443 A444K436-D440 PolarHBondContact O-N 3.21Å; L437-D440 PolarHBondContact O-N 3.09Å; D440-N442 VanDerWaalsContact C-N 3.33Å; D440-N442 PolarHBondContact O-N 2.94Å; D440-K443 PolarHBondContact O-N 3Å; D440-A444 WeakPolarHBondContact O-CB 3.3Å; D440-A444 PolarHBondContact O-N 2.83Å
441L87.4Confident88.5Confident90 Ų9096.6 Ų96.647%0.47149%0.49SS..Hα-helixtrans-61-42.4171.8-172.878000111.2L437 A444 N445L437-L441 VanDerWaalsContact O-CB 3.31Å; L437-L441 WeakPolarHBondContact O-CB 3.41Å; L437-L441 PolarHBondContact O-N 3.46Å; L441-A444 PolarHBondContact O-N 2.69Å; L441-N445 WeakPolarHBondContact O-CB 3.5Å; L441-N445 PolarHBondContact O-N 2.66Å; L441-N445 PolarHBondContact O-ND2 3Å; L441-N445 VanDerWaalsContact O-ND2 3.11Å
442N90.9Very high88.3Confident82 Ų8297.7 Ų97.744%0.43949%0.491SS..Hα-helixtrans-63.4-44176.6-69-17.9000111.3Q438 E439 D440 N445 E446Q438-N442 PolarHBondContact O-N 2.91Å; Q438-N442 PolarHBondContact O-ND2 3.09Å; Q438-N442 PolarHBondContact O-OD1 3.04Å; E439-N442 WeakPolarHBondContact O-CB 3.43Å; E439-N442 PolarHBondContact O-N 3.48Å; D440-N442 VanDerWaalsContact C-N 3.33Å; D440-N442 PolarHBondContact O-N 2.94Å; N442-N445 PolarHBondContact O-N 2.99Å; N442-E446 PolarHBondContact O-N 3.44Å
443K90Very high88.3Confident92 Ų9298.9 Ų98.940%0.449%0.491SS..Hα-helixtrans-62.7-42.6175.3-71.1169.8-173.21580112.4E439 D440 N445 E446 I447E439-K443 WeakPolarHBondContact O-CG 3.49Å; E439-K443 PolarHBondContact O-N 3.03Å; E439-K443 WeakPolarHBondContact OE1-CE 3.46Å; E439-K443 IonicContact OE1-NZ 3.99Å; E439-K443 PolarHBondContact OE1-NZ 3.35Å; D440-K443 PolarHBondContact O-N 3Å; K443-N445 VanDerWaalsContact C-N 3.32Å; K443-N445 PolarHBondContact O-N 3.25Å; K443-E446 PolarHBondContact O-N 3.45Å; K443-I447 WeakPolarHBondContact O-CG1 3.44Å; K443-I447 PolarHBondContact O-N 2.93Å
444A86.8Confident88.2Confident45 Ų4597.7 Ų97.737%0.37249%0.491SS..Hα-helixtrans-61.7-41.2176.100000111.6D440 L441 I447 I448D440-A444 WeakPolarHBondContact O-CB 3.3Å; D440-A444 PolarHBondContact O-N 2.83Å; L441-A444 PolarHBondContact O-N 2.69Å; A444-I447 PolarHBondContact O-N 3.35Å; A444-I448 VanDerWaalsContact O-CG1 3.3Å; A444-I448 WeakPolarHBondContact O-CG1 3.48Å; A444-I448 PolarHBondContact O-N 3.3Å
445N89.3Confident88.1Confident79 Ų7998.1 Ų98.142%0.42249%0.492SS..Hα-helixtrans-63.9-39.7175.2-75.4-37.8000112.4L441 N442 K443 I448 E449L441-N445 WeakPolarHBondContact O-CB 3.5Å; L441-N445 PolarHBondContact O-N 2.66Å; L441-N445 PolarHBondContact O-ND2 3Å; L441-N445 VanDerWaalsContact O-ND2 3.11Å; N442-N445 PolarHBondContact O-N 2.99Å; K443-N445 VanDerWaalsContact C-N 3.32Å; K443-N445 PolarHBondContact O-N 3.25Å; N445-I448 PolarHBondContact O-N 2.97Å; N445-E449 PolarHBondContact O-N 3.47Å
446E89Confident87.9Confident125 Ų12596 Ų9658%0.58449%0.486SS*.Hα-helixtrans-62.1-42.2174.1-75.1-179.2174.800112.3N442 K443 E449 Q450N442-E446 PolarHBondContact O-N 3.44Å; K443-E446 PolarHBondContact O-N 3.45Å; E446-E449 PolarHBondContact O-N 3.03Å; E446-Q450 WeakPolarHBondContact O-CG 3.48Å; E446-Q450 PolarHBondContact O-N 3.38Å
447I88.5Confident87.7Confident105 Ų10595.9 Ų95.954%0.53849%0.485SS..Hα-helixtrans-64.7-40.4176-65.7167.8000111K443 A444 Q450 T451K443-I447 WeakPolarHBondContact O-CG1 3.44Å; K443-I447 PolarHBondContact O-N 2.93Å; A444-I447 PolarHBondContact O-N 3.35Å; I447-Q450 PolarHBondContact O-N 3.11Å; I447-T451 HydrophobicContact CG2-CG2 4.45Å; I447-T451 WeakPolarHBondContact O-CB 3.37Å; I447-T451 WeakPolarHBondContact O-CG2 3.41Å; I447-T451 PolarHBondContact O-N 3.49Å; I447-T451 PolarHBondContact O-OG1 3.26Å
448I86.4Confident87.6Confident76 Ų7695.6 Ų95.639%0.3948%0.481SS..Hα-helixtrans-62.5-42.3175.4-71.2167.1000111.1A444 N445 T451 K452A444-I448 VanDerWaalsContact O-CG1 3.3Å; A444-I448 WeakPolarHBondContact O-CG1 3.48Å; A444-I448 PolarHBondContact O-N 3.3Å; N445-I448 PolarHBondContact O-N 2.97Å; I448-T451 WeakPolarHBondContact CA-OG1 3.43Å; I448-T451 PolarHBondContact O-N 2.9Å; I448-T451 PolarHBondContact O-OG1 2.89Å; I448-K452 HydrophobicContact CG2-CD 4.19Å; I448-K452 WeakPolarHBondContact O-CB 3.39Å; I448-K452 WeakPolarHBondContact O-CG 3.5Å; I448-K452 PolarHBondContact O-N 2.9Å
449E88.5Confident87.4Confident99 Ų9995.4 Ų95.446%0.46348%0.483SS..Hα-helixtrans-69.9-38.1177.6-73.8-56.4132.400112.4N445 E446 K452 L453N445-E449 PolarHBondContact O-N 3.47Å; E446-E449 PolarHBondContact O-N 3.03Å; E449-K452 PolarHBondContact O-N 3.27Å; E449-K452 WeakPolarHBondContact OE1-CD 3.41Å; E449-K452 IonicContact OE1-NZ 3.96Å; E449-K452 PolarHBondContact OE1-NZ 3.37Å; E449-L453 WeakPolarHBondContact O-CB 3.37Å; E449-L453 WeakPolarHBondContact O-CG 3.4Å; E449-L453 PolarHBondContact O-N 3.48Å
450Q85.9Confident87.3Confident121 Ų12194.4 Ų94.457%0.56548%0.48SS*.Hα-helixtrans-63.9-41.6173.3-74.4178.410.100112.5E446 I447 L453 N454E446-Q450 WeakPolarHBondContact O-CG 3.48Å; E446-Q450 PolarHBondContact O-N 3.38Å; I447-Q450 PolarHBondContact O-N 3.11Å; Q450-L453 PolarHBondContact O-N 2.77Å; Q450-N454 PolarHBondContact O-N 2.86Å
451T83.1Confident87.1Confident79 Ų7995 Ų9549%0.48548%0.483SS..Hα-helixtrans-68-39.1177.148.60000112.1I447 I448 N454 L455I447-T451 HydrophobicContact CG2-CG2 4.45Å; I447-T451 WeakPolarHBondContact O-CB 3.37Å; I447-T451 WeakPolarHBondContact O-CG2 3.41Å; I447-T451 PolarHBondContact O-N 3.49Å; I447-T451 PolarHBondContact O-OG1 3.26Å; I448-T451 WeakPolarHBondContact CA-OG1 3.43Å; I448-T451 PolarHBondContact O-N 2.9Å; I448-T451 PolarHBondContact O-OG1 2.89Å; T451-N454 PolarHBondContact O-N 3.45Å; T451-L455 WeakPolarHBondContact O-CB 3.46Å; T451-L455 PolarHBondContact O-N 2.99Å
452K87.8Confident87Confident103 Ų10396.2 Ų96.245%0.44849%0.485SS..Hα-helixtrans-59.7-44.3170.2-77.6168.7177.7166.70112.4I448 E449 N454 L455 N456I448-K452 HydrophobicContact CG2-CD 4.19Å; I448-K452 WeakPolarHBondContact O-CB 3.39Å; I448-K452 WeakPolarHBondContact O-CG 3.5Å; I448-K452 PolarHBondContact O-N 2.9Å; E449-K452 PolarHBondContact O-N 3.27Å; E449-K452 WeakPolarHBondContact OE1-CD 3.41Å; E449-K452 IonicContact OE1-NZ 3.96Å; E449-K452 PolarHBondContact OE1-NZ 3.37Å; K452-N454 VanDerWaalsContact C-N 3.35Å; K452-N454 PolarHBondContact O-N 2.86Å; K452-L455 PolarHBondContact O-N 3.26Å; K452-N456 WeakPolarHBondContact O-CB 3.48Å; K452-N456 PolarHBondContact O-N 2.94Å
453L87.9Confident86.9Confident96 Ų9695.4 Ų95.450%0.50348%0.483SS..Hα-helixtrans-62.8-40.6176.7-81.2167.7000112E449 Q450 K457E449-L453 WeakPolarHBondContact O-CB 3.37Å; E449-L453 WeakPolarHBondContact O-CG 3.4Å; E449-L453 PolarHBondContact O-N 3.48Å; Q450-L453 PolarHBondContact O-N 2.77Å; L453-K457 WeakPolarHBondContact O-CG 3.35Å; L453-K457 PolarHBondContact O-N 3.41Å
454N88.4Confident86.5Confident95 Ų9593.6 Ų93.651%0.50848%0.478SS..Hα-helixtrans-68.3-40.6175.9-76.6-15.3000112.4Q450 T451 K452 K457 Q458Q450-N454 PolarHBondContact O-N 2.86Å; T451-N454 PolarHBondContact O-N 3.45Å; K452-N454 VanDerWaalsContact C-N 3.35Å; K452-N454 PolarHBondContact O-N 2.86Å; N454-K457 PolarHBondContact O-N 3.07Å; N454-Q458 PolarHBondContact O-N 2.68Å
455L85Confident86.4Confident113 Ų11397 Ų9759%0.59249%0.486SS*.Hα-helixtrans-64-42.9175.7-171.968.9000111.2T451 K452 K457 Q458 N459T451-L455 WeakPolarHBondContact O-CB 3.46Å; T451-L455 PolarHBondContact O-N 2.99Å; K452-L455 PolarHBondContact O-N 3.26Å; L455-K457 PolarHBondContact O-N 3.43Å; L455-Q458 PolarHBondContact O-N 2.98Å; L455-N459 WeakPolarHBondContact O-CB 3.36Å; L455-N459 PolarHBondContact O-N 3.34Å
456N85.9Confident86.1Confident95 Ų9598 Ų9851%0.50849%0.491SS..Hα-helixtrans-60.8-44.6174.5-80.9-14.5000111.7K452 Q458 N459 D460K452-N456 WeakPolarHBondContact O-CB 3.48Å; K452-N456 PolarHBondContact O-N 2.94Å; N456-Q458 VanDerWaalsContact C-N 3.34Å; N456-Q458 PolarHBondContact O-N 3.38Å; N456-N459 PolarHBondContact O-N 3.04Å; N456-D460 VanDerWaalsContact O-CG 3.3Å; N456-D460 PolarHBondContact O-N 2.9Å
457K86Confident85.9Confident130 Ų13095.9 Ų95.957%0.56548%0.484SS*.Hα-helixtrans-60.7-40.5174.6-74.6174.8-178.3174.80112.7L453 N454 L455 N461L453-K457 WeakPolarHBondContact O-CG 3.35Å; L453-K457 PolarHBondContact O-N 3.41Å; N454-K457 PolarHBondContact O-N 3.07Å; L455-K457 PolarHBondContact O-N 3.43Å; K457-N461 PolarHBondContact O-N 3.1Å; K457-N461 PolarHBondContact O-ND2 2.91Å
458Q85.3Confident85.7Confident108 Ų10895.5 Ų95.551%0.50548%0.482SS..Hα-helixtrans-65.4-41.5174.2-81.1-171.9-19.900111.7N454 L455 N456 N461 F462N454-Q458 PolarHBondContact O-N 2.68Å; L455-Q458 PolarHBondContact O-N 2.98Å; N456-Q458 VanDerWaalsContact C-N 3.34Å; N456-Q458 PolarHBondContact O-N 3.38Å; Q458-N461 WeakPolarHBondContact O-CB 3.35Å; Q458-N461 PolarHBondContact O-N 2.89Å; Q458-F462 HydrophobicContact CB-CE2 4.24Å; Q458-F462 WeakPolarHBondContact O-CD2 3.45Å; Q458-F462 WeakPolarHBondContact O-CG 3.42Å; Q458-F462 PolarHBondContact O-N 3.42Å
459N84.7Confident85.4Confident95 Ų9596.1 Ų96.151%0.50849%0.486SS..Hα-helixtrans-64.3-42.7178.5-147.928.7000111.2L455 N456 N461 F462 V463L455-N459 WeakPolarHBondContact O-CB 3.36Å; L455-N459 PolarHBondContact O-N 3.34Å; N456-N459 PolarHBondContact O-N 3.04Å; N459-N461 VanDerWaalsContact C-N 3.32Å; N459-N461 PolarHBondContact O-N 3.13Å; N459-F462 PolarHBondContact O-N 2.89Å; N459-V463 WeakPolarHBondContact O-CB 3.34Å; N459-V463 VanDerWaalsContact O-CG2 3.27Å; N459-V463 WeakPolarHBondContact O-CG2 3.31Å; N459-V463 PolarHBondContact O-N 2.88Å
460D87.1Confident85.3Confident75 Ų7597.8 Ų97.840%0.40149%0.491SS..Hα-helixtrans-61.3-40.7173.5-68.3-23.5000111.5N456 V463 N464N456-D460 VanDerWaalsContact O-CG 3.3Å; N456-D460 PolarHBondContact O-N 2.9Å; D460-V463 PolarHBondContact O-N 2.88Å; D460-N464 WeakPolarHBondContact O-CB 3.48Å; D460-N464 PolarHBondContact O-N 3.32Å; D460-N464 PolarHBondContact O-ND2 3.44Å; D460-N464 VanDerWaalsContact O-ND2 3.07Å
461N86.2Confident85.2Confident91 Ų9197.6 Ų97.649%0.48749%0.491SS..Hα-helixtrans-62.9-45.6174.5-72.4-15.6000111.9K457 Q458 N459 V463 N464 E465K457-N461 PolarHBondContact O-N 3.1Å; K457-N461 PolarHBondContact O-ND2 2.91Å; Q458-N461 WeakPolarHBondContact O-CB 3.35Å; Q458-N461 PolarHBondContact O-N 2.89Å; N459-N461 VanDerWaalsContact C-N 3.32Å; N459-N461 PolarHBondContact O-N 3.13Å; N461-V463 VanDerWaalsContact C-N 3.34Å; N461-V463 PolarHBondContact O-N 3.48Å; N461-N464 PolarHBondContact O-N 3.06Å; N461-E465 WeakPolarHBondContact O-CB 3.32Å; N461-E465 PolarHBondContact O-N 3.37Å
462F85.1Confident85.2Confident116 Ų11698.7 Ų98.751%0.50949%0.49SS..Hα-helixtrans-65.3-36176.9-69.1-48.6000112.6Q458 N459 E465 L466Q458-F462 HydrophobicContact CB-CE2 4.24Å; Q458-F462 WeakPolarHBondContact O-CD2 3.45Å; Q458-F462 WeakPolarHBondContact O-CG 3.42Å; Q458-F462 PolarHBondContact O-N 3.42Å; N459-F462 PolarHBondContact O-N 2.89Å; F462-E465 PolarHBondContact O-N 3.17Å; F462-L466 VanDerWaalsContact O-CB 3.31Å; F462-L466 WeakPolarHBondContact O-CB 3.45Å; F462-L466 WeakPolarHBondContact O-CG 3.27Å; F462-L466 PolarHBondContact O-N 2.99Å
463V87.7Confident84.9Confident65 Ų6598.7 Ų98.739%0.39449%0.494SS..Hα-helixtrans-64.9-43.3173.9169.20000110.6N459 D460 N461 L466 N467N459-V463 WeakPolarHBondContact O-CB 3.34Å; N459-V463 VanDerWaalsContact O-CG2 3.27Å; N459-V463 WeakPolarHBondContact O-CG2 3.31Å; N459-V463 PolarHBondContact O-N 2.88Å; D460-V463 PolarHBondContact O-N 2.88Å; N461-V463 VanDerWaalsContact C-N 3.34Å; N461-V463 PolarHBondContact O-N 3.48Å; V463-L466 PolarHBondContact O-N 3.47Å; V463-N467 WeakPolarHBondContact O-CB 3.44Å; V463-N467 PolarHBondContact O-N 2.95Å; V463-N467 PolarHBondContact O-ND2 2.93Å
464N82.8Confident84.8Confident55 Ų5597.7 Ų97.729%0.29450%0.495SS..Hα-helixtrans-63.9-42.1175.9-68.5-28.3000111.8D460 N461 N467 L468D460-N464 WeakPolarHBondContact O-CB 3.48Å; D460-N464 PolarHBondContact O-N 3.32Å; D460-N464 PolarHBondContact O-ND2 3.44Å; D460-N464 VanDerWaalsContact O-ND2 3.07Å; N461-N464 PolarHBondContact O-N 3.06Å; N464-N467 PolarHBondContact O-N 3.29Å; N464-L468 WeakPolarHBondContact O-CB 3.41Å; N464-L468 PolarHBondContact O-N 3Å
465E83.7Confident84.5Confident116 Ų11698.1 Ų98.154%0.54249%0.494SS..Hα-helixtrans-66.5-40.4177.4-160.1170.8-153.400111.8N461 F462 N467 L468 L469N461-E465 WeakPolarHBondContact O-CB 3.32Å; N461-E465 PolarHBondContact O-N 3.37Å; F462-E465 PolarHBondContact O-N 3.17Å; E465-N467 VanDerWaalsContact C-N 3.35Å; E465-N467 PolarHBondContact O-N 3.31Å; E465-L468 PolarHBondContact O-N 2.86Å; E465-L469 WeakPolarHBondContact O-CB 3.33Å; E465-L469 WeakPolarHBondContact O-CG 3.3Å; E465-L469 PolarHBondContact O-N 3.18Å
466L82.6Confident84.3Confident99 Ų9995 Ų9552%0.51848%0.484SS..Hα-helixtrans-62.4-39.5171.6-87.2170.8000112.5F462 V463 K470F462-L466 VanDerWaalsContact O-CB 3.31Å; F462-L466 WeakPolarHBondContact O-CB 3.45Å; F462-L466 WeakPolarHBondContact O-CG 3.27Å; F462-L466 PolarHBondContact O-N 2.99Å; V463-L466 PolarHBondContact O-N 3.47Å; L466-K470 WeakPolarHBondContact O-CB 3.36Å; L466-K470 VanDerWaalsContact O-CG 3.29Å; L466-K470 WeakPolarHBondContact O-CG 3.5Å; L466-K470 PolarHBondContact O-N 3.26Å
467N85.9Confident84.2Confident81 Ų8195.1 Ų95.143%0.43349%0.485SS..Hα-helixtrans-67.3-42.4176.7-72.1-24.9000111.2V463 N464 E465 K470 E471V463-N467 WeakPolarHBondContact O-CB 3.44Å; V463-N467 PolarHBondContact O-N 2.95Å; V463-N467 PolarHBondContact O-ND2 2.93Å; N464-N467 PolarHBondContact O-N 3.29Å; E465-N467 VanDerWaalsContact C-N 3.35Å; E465-N467 PolarHBondContact O-N 3.31Å; N467-K470 PolarHBondContact O-N 3.43Å; N467-E471 PolarHBondContact O-N 2.87Å
468L83Confident84Confident97 Ų9794.9 Ų94.951%0.50849%0.486SS..Hα-helixtrans-62.3-43.6175.9-167.673000111.7N464 E465 E471 Q472N464-L468 WeakPolarHBondContact O-CB 3.41Å; N464-L468 PolarHBondContact O-N 3Å; E465-L468 PolarHBondContact O-N 2.86Å; L468-E471 PolarHBondContact O-N 3.42Å; L468-Q472 WeakPolarHBondContact O-CG 3.48Å; L468-Q472 PolarHBondContact O-N 3.43Å
469L80.2Confident83.9Confident89 Ų8995 Ų9547%0.46649%0.486SS..Hα-helixtrans-64.9-38175.5-75.1169.8000112.2E465 Q472 I473E465-L469 WeakPolarHBondContact O-CB 3.33Å; E465-L469 WeakPolarHBondContact O-CG 3.3Å; E465-L469 PolarHBondContact O-N 3.18Å; L469-Q472 PolarHBondContact O-N 2.94Å; L469-I473 WeakPolarHBondContact O-CB 3.42Å; L469-I473 VanDerWaalsContact O-CG1 3.24Å; L469-I473 WeakPolarHBondContact O-CG1 3.41Å; L469-I473 PolarHBondContact O-N 3.38Å
470K86.7Confident83.8Confident134 Ų13495.2 Ų95.258%0.58349%0.486SS*.Hα-helixtrans-64.3-41.8174.2-79.2174.7-179.3176.90111.9L466 N467 I473 S474L466-K470 WeakPolarHBondContact O-CB 3.36Å; L466-K470 VanDerWaalsContact O-CG 3.29Å; L466-K470 WeakPolarHBondContact O-CG 3.5Å; L466-K470 PolarHBondContact O-N 3.26Å; N467-K470 PolarHBondContact O-N 3.43Å; K470-I473 PolarHBondContact O-N 3.46Å; K470-S474 WeakPolarHBondContact O-CB 3.14Å; K470-S474 PolarHBondContact O-N 3.4Å
471E84.6Confident83.7Confident118 Ų11895.8 Ų95.855%0.55149%0.49SS*.Hα-helixtrans-64.3-45.4176.5-166.8166.6-155.600110.7N467 L468 I473 S474 E475N467-E471 PolarHBondContact O-N 2.87Å; L468-E471 PolarHBondContact O-N 3.42Å; E471-I473 VanDerWaalsContact C-N 3.35Å; E471-I473 PolarHBondContact O-N 3.06Å; E471-S474 WeakPolarHBondContact O-CA 3.4Å; E471-S474 WeakPolarHBondContact O-CB 3.25Å; E471-S474 PolarHBondContact O-N 2.96Å; E471-S474 VanDerWaalsContact O-N 3.08Å; E471-E475 PolarHBondContact O-N 3.23Å
472Q83.5Confident83.6Confident102 Ų10295.9 Ų95.948%0.47749%0.489SS..Hα-helixtrans-59.3-40.3173.4-73.6177.6-600113.1L468 L469 A476L468-Q472 WeakPolarHBondContact O-CG 3.48Å; L468-Q472 PolarHBondContact O-N 3.43Å; L469-Q472 PolarHBondContact O-N 2.94Å; Q472-A476 VanDerWaalsContact O-CB 3.26Å; Q472-A476 WeakPolarHBondContact O-CB 3.39Å; Q472-A476 PolarHBondContact O-N 2.95Å
473I81.7Confident83.6Confident102 Ų10296.9 Ų96.952%0.52349%0.493SS..Hα-helixtrans-65.8-40174.4-72165.7000110.8L469 K470 E471 A476 N477L469-I473 WeakPolarHBondContact O-CB 3.42Å; L469-I473 VanDerWaalsContact O-CG1 3.24Å; L469-I473 WeakPolarHBondContact O-CG1 3.41Å; L469-I473 PolarHBondContact O-N 3.38Å; K470-I473 PolarHBondContact O-N 3.46Å; E471-I473 VanDerWaalsContact C-N 3.35Å; E471-I473 PolarHBondContact O-N 3.06Å; I473-A476 PolarHBondContact O-N 2.97Å; I473-N477 WeakPolarHBondContact O-CB 3.22Å; I473-N477 VanDerWaalsContact O-CG 3.29Å; I473-N477 PolarHBondContact O-N 3.4Å; I473-N477 PolarHBondContact O-ND2 3.11Å
474S84.2Confident83.2Confident75 Ų7596.8 Ų96.852%0.52450%0.496SS..Hα-helixtrans-64.1-47.2176.5-168.60000111.6K470 E471 A476 N477 E478K470-S474 WeakPolarHBondContact O-CB 3.14Å; K470-S474 PolarHBondContact O-N 3.4Å; E471-S474 WeakPolarHBondContact O-CA 3.4Å; E471-S474 WeakPolarHBondContact O-CB 3.25Å; E471-S474 PolarHBondContact O-N 2.96Å; E471-S474 VanDerWaalsContact O-N 3.08Å; S474-A476 PolarHBondContact O-N 2.92Å; S474-N477 PolarHBondContact O-N 3.03Å; S474-E478 PolarHBondContact O-N 2.75Å
475E82.8Confident83.3Confident105 Ų105100.5 Ų100.549%0.49151%0.509SS..Hα-helixtrans-61.3-42.4174.9-73.7-175.1171.500111.8E471 N477 E478 Q479E471-E475 PolarHBondContact O-N 3.23Å; E475-N477 PolarHBondContact O-N 3.07Å; E475-E478 PolarHBondContact O-N 2.93Å; E475-Q479 WeakPolarHBondContact O-CB 3.15Å; E475-Q479 WeakPolarHBondContact O-CG 3.49Å; E475-Q479 PolarHBondContact O-N 3.01Å
476A80.7Confident83.2Confident46 Ų46100.2 Ų100.238%0.3851%0.511SS..Hα-helixtrans-63.3-41176.500000111.9Q472 I473 S474 Q479 I480Q472-A476 VanDerWaalsContact O-CB 3.26Å; Q472-A476 WeakPolarHBondContact O-CB 3.39Å; Q472-A476 PolarHBondContact O-N 2.95Å; I473-A476 PolarHBondContact O-N 2.97Å; S474-A476 PolarHBondContact O-N 2.92Å; A476-Q479 PolarHBondContact O-N 3.14Å; A476-I480 WeakPolarHBondContact O-CB 3.29Å; A476-I480 VanDerWaalsContact O-CG1 3.27Å; A476-I480 WeakPolarHBondContact O-CG1 3.49Å; A476-I480 PolarHBondContact O-N 2.67Å
477N83.4Confident83.2Confident98 Ų98100 Ų10052%0.52451%0.51SS..Hα-helixtrans-64.9-39.8174.8-78.1-32000112I473 S474 E475 I480 N481I473-N477 WeakPolarHBondContact O-CB 3.22Å; I473-N477 VanDerWaalsContact O-CG 3.29Å; I473-N477 PolarHBondContact O-N 3.4Å; I473-N477 PolarHBondContact O-ND2 3.11Å; S474-N477 PolarHBondContact O-N 3.03Å; E475-N477 PolarHBondContact O-N 3.07Å; N477-I480 PolarHBondContact O-N 3.48Å; N477-N481 WeakPolarHBondContact O-CB 3.29Å; N477-N481 PolarHBondContact O-N 3.39Å
478E82.2Confident83.2Confident126 Ų126101.6 Ų101.659%0.58952%0.515SS*.Hα-helixtrans-66.5-41.8175.7-155.5-179.9-16600111.2S474 E475 I480 N481 I482S474-E478 PolarHBondContact O-N 2.75Å; E475-E478 PolarHBondContact O-N 2.93Å; E478-I480 PolarHBondContact O-N 3.28Å; E478-N481 PolarHBondContact O-N 3.13Å; E478-I482 HydrophobicContact CG-CD1 4.47Å; E478-I482 VanDerWaalsContact O-CG1 3.31Å; E478-I482 WeakPolarHBondContact O-CG1 3.49Å; E478-I482 PolarHBondContact O-N 3Å
479Q83Confident83.3Confident109 Ų109103.3 Ų103.351%0.50952%0.518SS..Hα-helixtrans-62.2-40.7172.8-75.1-172.727.300112.7E475 A476 I482 K483E475-Q479 WeakPolarHBondContact O-CB 3.15Å; E475-Q479 WeakPolarHBondContact O-CG 3.49Å; E475-Q479 PolarHBondContact O-N 3.01Å; A476-Q479 PolarHBondContact O-N 3.14Å; Q479-I482 PolarHBondContact O-N 2.9Å; Q479-K483 WeakPolarHBondContact O-CB 3.39Å; Q479-K483 WeakPolarHBondContact O-CG 3.49Å; Q479-K483 PolarHBondContact O-N 3.21Å
480I83.4Confident83.2Confident100 Ų100101.1 Ų101.151%0.51351%0.51SS..Hα-helixtrans-62-45.3174.1-72.7166000109.8A476 N477 E478 I482 K483 S484A476-I480 WeakPolarHBondContact O-CB 3.29Å; A476-I480 VanDerWaalsContact O-CG1 3.27Å; A476-I480 WeakPolarHBondContact O-CG1 3.49Å; A476-I480 PolarHBondContact O-N 2.67Å; N477-I480 PolarHBondContact O-N 3.48Å; E478-I480 PolarHBondContact O-N 3.28Å; I480-I482 PolarHBondContact O-N 2.9Å; I480-K483 PolarHBondContact O-N 3.21Å; I480-S484 WeakPolarHBondContact O-CB 3.38Å; I480-S484 PolarHBondContact O-N 3.47Å; I480-S484 PolarHBondContact O-OG 2.88Å; I480-S484 VanDerWaalsContact O-OG 3.07Å
481N85.1Confident83.1Confident87 Ų8799.8 Ų99.847%0.46551%0.506SS..Hα-helixtrans-62.3-44.1178.7-166-12.8000112N477 E478 S484 K485N477-N481 WeakPolarHBondContact O-CB 3.29Å; N477-N481 PolarHBondContact O-N 3.39Å; E478-N481 PolarHBondContact O-N 3.13Å; N481-S484 PolarHBondContact O-N 2.91Å; N481-K485 WeakPolarHBondContact O-CG 3.39Å; N481-K485 PolarHBondContact O-N 3.2Å
482I83.9Confident83.2Confident94 Ų9498 Ų9848%0.48250%0.5SS..Hα-helixtrans-61.7-44.8174.7-67165.8000110.7E478 Q479 I480 K485 L486E478-I482 HydrophobicContact CG-CD1 4.47Å; E478-I482 VanDerWaalsContact O-CG1 3.31Å; E478-I482 WeakPolarHBondContact O-CG1 3.49Å; E478-I482 PolarHBondContact O-N 3Å; Q479-I482 PolarHBondContact O-N 2.9Å; I480-I482 PolarHBondContact O-N 2.9Å; I482-K485 PolarHBondContact O-N 2.99Å; I482-L486 HydrophobicContact CG2-CD1 4.06Å; I482-L486 WeakPolarHBondContact O-CG 3.46Å; I482-L486 PolarHBondContact O-N 3.39Å
483K84.4Confident83.2Confident136 Ų13697.4 Ų97.459%0.59150%0.497SS*.Hα-helixtrans-63-41.8176.7-78.2177.5-178.5173.10112.1Q479 I480 L486 L487Q479-K483 WeakPolarHBondContact O-CB 3.39Å; Q479-K483 WeakPolarHBondContact O-CG 3.49Å; Q479-K483 PolarHBondContact O-N 3.21Å; I480-K483 PolarHBondContact O-N 3.21Å; K483-L486 PolarHBondContact O-N 3.32Å; K483-L487 WeakPolarHBondContact O-CB 3.4Å; K483-L487 PolarHBondContact O-N 2.85Å
484S79.9Confident83.2Confident64 Ų6497 Ų9745%0.44850%0.495SS..Hα-helixtrans-61.8-42.8176.5-64.40000111.8I480 N481 L487 E488I480-S484 WeakPolarHBondContact O-CB 3.38Å; I480-S484 PolarHBondContact O-N 3.47Å; I480-S484 PolarHBondContact O-OG 2.88Å; I480-S484 VanDerWaalsContact O-OG 3.07Å; N481-S484 PolarHBondContact O-N 2.91Å; S484-L487 WeakPolarHBondContact O-CB 3.29Å; S484-L487 PolarHBondContact O-N 2.84Å; S484-E488 WeakPolarHBondContact O-CB 3.44Å; S484-E488 PolarHBondContact O-N 3.42Å
485K84.8Confident83.2Confident133 Ų13398.9 Ų98.958%0.57850%0.496SS*.Hα-helixtrans-66.3-37175.4-72.1-177.7180-178.90113.1N481 I482 K489N481-K485 WeakPolarHBondContact O-CG 3.39Å; N481-K485 PolarHBondContact O-N 3.2Å; I482-K485 PolarHBondContact O-N 2.99Å; K485-K489 WeakPolarHBondContact O-CB 3.24Å; K485-K489 PolarHBondContact O-N 3.28Å; K485-K489 VanDerWaalsContact O-N 3.07Å
486L80.6Confident83.3Confident109 Ų10999.8 Ų99.857%0.57150%0.5SS*.Hα-helixtrans-68.6-38.5174-74.9170.8000111.6I482 K483 K489 S490I482-L486 HydrophobicContact CG2-CD1 4.06Å; I482-L486 WeakPolarHBondContact O-CG 3.46Å; I482-L486 PolarHBondContact O-N 3.39Å; K483-L486 PolarHBondContact O-N 3.32Å; L486-K489 PolarHBondContact O-N 2.94Å; L486-S490 PolarHBondContact O-N 2.92Å; L486-S490 PolarHBondContact O-OG 2.92Å
487L83.4Confident83.4Confident96 Ų96104.3 Ų104.350%0.50351%0.508SS..Hα-helixtrans-62.2-51.3175.2-170.477.7000110.1K483 S484 K489 S490 E491K483-L487 WeakPolarHBondContact O-CB 3.4Å; K483-L487 PolarHBondContact O-N 2.85Å; S484-L487 WeakPolarHBondContact O-CB 3.29Å; S484-L487 PolarHBondContact O-N 2.84Å; L487-K489 VanDerWaalsContact C-N 3.29Å; L487-K489 PolarHBondContact O-N 3.36Å; L487-S490 WeakPolarHBondContact CA-OG 3.4Å; L487-S490 CarbonylContact O-C 3.46Å; L487-S490 WeakPolarHBondContact O-CA 3.47Å; L487-S490 PolarHBondContact O-N 3.25Å; L487-S490 PolarHBondContact O-OG 3.47Å; L487-E491 HydrophobicContact CG-CG 4.38Å; L487-E491 WeakPolarHBondContact O-CG 3.44Å; L487-E491 PolarHBondContact O-N 3.42Å
488E86.2Confident83.4Confident114 Ų114104.9 Ų104.953%0.53351%0.508SS..Hα-helixtrans-55.5-43.4176.4-175.7-176.4-177.500111.6S484 S490 E491 N492S484-E488 WeakPolarHBondContact O-CB 3.44Å; S484-E488 PolarHBondContact O-N 3.42Å; E488-S490 VanDerWaalsContact C-N 3.35Å; E488-S490 PolarHBondContact O-N 2.91Å; E488-E491 PolarHBondContact O-N 2.89Å; E488-N492 WeakPolarHBondContact O-CB 3.49Å; E488-N492 PolarHBondContact O-N 3.17Å; E488-N492 PolarHBondContact O-ND2 2.92Å; E488-N492 VanDerWaalsContact O-ND2 3.14Å
489K83.9Confident83.4Confident133 Ų133104.2 Ų104.258%0.57851%0.508SS*.Hα-helixtrans-63-39.6174.7-171.9178179.8-179.80112.4K485 L486 L487 Q493K485-K489 WeakPolarHBondContact O-CB 3.24Å; K485-K489 PolarHBondContact O-N 3.28Å; K485-K489 VanDerWaalsContact O-N 3.07Å; L486-K489 PolarHBondContact O-N 2.94Å; L487-K489 VanDerWaalsContact C-N 3.29Å; L487-K489 PolarHBondContact O-N 3.36Å; K489-Q493 WeakPolarHBondContact O-CG 3.33Å; K489-Q493 PolarHBondContact O-N 3.49Å; K489-Q493 VanDerWaalsContact O-N 3.09Å
490S79.2Confident83.4Confident43 Ų43104.3 Ų104.330%0.30151%0.508SS..Hα-helixtrans-71.6-36.5177.669.70000112.7L486 L487 E488 Q493 I494L486-S490 PolarHBondContact O-N 2.92Å; L486-S490 PolarHBondContact O-OG 2.92Å; L487-S490 WeakPolarHBondContact CA-OG 3.4Å; L487-S490 CarbonylContact O-C 3.46Å; L487-S490 WeakPolarHBondContact O-CA 3.47Å; L487-S490 PolarHBondContact O-N 3.25Å; L487-S490 PolarHBondContact O-OG 3.47Å; E488-S490 VanDerWaalsContact C-N 3.35Å; E488-S490 PolarHBondContact O-N 2.91Å; S490-Q493 PolarHBondContact O-N 2.98Å; S490-I494 VanDerWaalsContact O-CG1 3.28Å; S490-I494 WeakPolarHBondContact O-CG1 3.27Å; S490-I494 PolarHBondContact O-N 3.24Å
491E84.3Confident83.3Confident106 Ų106105.1 Ų105.150%0.49551%0.513SS..Hα-helixtrans-64.3-46.4174.3-73.4173.5162.600110.4L487 E488 Q493 I494 E495L487-E491 HydrophobicContact CG-CG 4.38Å; L487-E491 WeakPolarHBondContact O-CG 3.44Å; L487-E491 PolarHBondContact O-N 3.42Å; E488-E491 PolarHBondContact O-N 2.89Å; E491-Q493 VanDerWaalsContact C-N 3.29Å; E491-Q493 PolarHBondContact O-N 3.5Å; E491-I494 PolarHBondContact O-N 2.97Å; E491-I494 VanDerWaalsContact O-N 3.12Å; E491-E495 PolarHBondContact O-N 3.37Å
492N85.8Confident83.2Confident79 Ų79105.7 Ų105.742%0.42252%0.516SS..Hα-helixtrans-59.7-37.4173.7-72.4-29.5000112.5E488 Q496E488-N492 WeakPolarHBondContact O-CB 3.49Å; E488-N492 PolarHBondContact O-N 3.17Å; E488-N492 PolarHBondContact O-ND2 2.92Å; E488-N492 VanDerWaalsContact O-ND2 3.14Å; N492-Q496 WeakPolarHBondContact O-CG 3.34Å; N492-Q496 PolarHBondContact O-N 2.92Å
493Q83.7Confident83.1Confident90 Ų90104.6 Ų104.642%0.42152%0.516SS..Hα-helixtrans-68.5-40.6174.2-79.1-178.9-26.400112.2K489 S490 E491 E495 Q496 Y497K489-Q493 WeakPolarHBondContact O-CG 3.33Å; K489-Q493 PolarHBondContact O-N 3.49Å; K489-Q493 VanDerWaalsContact O-N 3.09Å; S490-Q493 PolarHBondContact O-N 2.98Å; E491-Q493 VanDerWaalsContact C-N 3.29Å; E491-Q493 PolarHBondContact O-N 3.5Å; Q493-E495 VanDerWaalsContact C-N 3.32Å; Q493-Q496 PolarHBondContact O-N 3.37Å; Q493-Y497 HydrophobicContact CB-CE2 4.42Å; Q493-Y497 WeakPolarHBondContact O-CD2 3.38Å; Q493-Y497 PolarHBondContact O-N 2.9Å
494I82.1Confident83Confident95 Ų95104 Ų10449%0.48752%0.519SS..Hα-helixtrans-62.9-42175.2-71165.2000110.3S490 E491 Y497 Q498S490-I494 VanDerWaalsContact O-CG1 3.28Å; S490-I494 WeakPolarHBondContact O-CG1 3.27Å; S490-I494 PolarHBondContact O-N 3.24Å; E491-I494 PolarHBondContact O-N 2.97Å; E491-I494 VanDerWaalsContact O-N 3.12Å; I494-Y497 PolarHBondContact O-N 3.44Å; I494-Q498 HydrophobicContact CG2-CG 4.47Å; I494-Q498 WeakPolarHBondContact O-CB 3.45Å; I494-Q498 WeakPolarHBondContact O-CG 3.5Å; I494-Q498 PolarHBondContact O-N 3.4Å
495E85.3Confident83Confident114 Ų114106.7 Ų106.753%0.53352%0.524SS..Hα-helixtrans-64.2-42.1177.1-167.9172.1-159.600111.4E491 Q493 Q498 L499E491-E495 PolarHBondContact O-N 3.37Å; Q493-E495 VanDerWaalsContact C-N 3.32Å; E495-Q498 PolarHBondContact O-N 3.04Å; E495-L499 WeakPolarHBondContact O-CG 3.35Å; E495-L499 PolarHBondContact O-N 3.34Å
496Q83.2Confident82.8Confident124 Ų124104.1 Ų104.158%0.57952%0.52SS*.Hα-helixtrans-59.4-47.2170.6-80.6-175.5-7.600112.2N492 Q493 Q498 L499 E500N492-Q496 WeakPolarHBondContact O-CG 3.34Å; N492-Q496 PolarHBondContact O-N 2.92Å; Q493-Q496 PolarHBondContact O-N 3.37Å; Q496-Q498 VanDerWaalsContact C-N 3.29Å; Q496-Q498 PolarHBondContact O-N 3.3Å; Q496-L499 PolarHBondContact O-N 2.88Å; Q496-E500 PolarHBondContact O-N 3.37Å
497Y83Confident83Confident141 Ų141102.6 Ų102.655%0.55352%0.519SS*.Hα-helixtrans-65.3-31.7177.1-70.4-45.9000112.9Q493 I494 L501Q493-Y497 HydrophobicContact CB-CE2 4.42Å; Q493-Y497 WeakPolarHBondContact O-CD2 3.38Å; Q493-Y497 PolarHBondContact O-N 2.9Å; I494-Y497 PolarHBondContact O-N 3.44Å; Y497-L501 VanDerWaalsContact O-CB 3.28Å; Y497-L501 WeakPolarHBondContact O-CB 3.39Å; Y497-L501 VanDerWaalsContact O-CG 3.29Å; Y497-L501 WeakPolarHBondContact O-CG 3.4Å; Y497-L501 PolarHBondContact O-N 3.49Å
498Q83.9Confident82.9Confident109 Ų109104.1 Ų104.151%0.50952%0.521SS..Hα-helixtrans-68.6-41.8172.6-81.1173.8-18.200111.7I494 E495 Q496 L501 N502I494-Q498 HydrophobicContact CG2-CG 4.47Å; I494-Q498 WeakPolarHBondContact O-CB 3.45Å; I494-Q498 WeakPolarHBondContact O-CG 3.5Å; I494-Q498 PolarHBondContact O-N 3.4Å; E495-Q498 PolarHBondContact O-N 3.04Å; Q496-Q498 VanDerWaalsContact C-N 3.29Å; Q496-Q498 PolarHBondContact O-N 3.3Å; Q498-L501 PolarHBondContact O-N 3.12Å; Q498-N502 VanDerWaalsContact O-CB 3.3Å; Q498-N502 WeakPolarHBondContact O-CB 3.33Å; Q498-N502 PolarHBondContact O-N 2.94Å; Q498-N502 PolarHBondContact O-ND2 3.47Å
499L81.7Confident82.8Confident113 Ų113101.8 Ų101.859%0.59252%0.515SS*.Hα-helixtrans-63.1-44.1173.4-72.4170.3000111.5E495 Q496 N502 S503E495-L499 WeakPolarHBondContact O-CG 3.35Å; E495-L499 PolarHBondContact O-N 3.34Å; Q496-L499 PolarHBondContact O-N 2.88Å; L499-N502 PolarHBondContact O-N 3.12Å; L499-S503 WeakPolarHBondContact O-CB 3.3Å; L499-S503 PolarHBondContact O-N 3.08Å; L499-S503 PolarHBondContact O-OG 3.21Å
500E84.7Confident82.7Confident111 Ų11199.8 Ų99.852%0.51951%0.51SS..Hα-helixtrans-60.8-47.5173.6-76.5-178-176.100111.3Q496 N502 S503 L504Q496-E500 PolarHBondContact O-N 3.37Å; E500-N502 VanDerWaalsContact C-N 3.34Å; E500-N502 PolarHBondContact O-N 2.95Å; E500-S503 WeakPolarHBondContact CA-OG 3.26Å; E500-S503 PolarHBondContact O-N 3.19Å; E500-S503 PolarHBondContact O-OG 3.44Å; E500-L504 WeakPolarHBondContact O-CB 3.5Å; E500-L504 PolarHBondContact O-N 3.45Å
501L80.4Confident82.8Confident117 Ų117104.2 Ų104.261%0.61352%0.524SS*.Hα-helixtrans-60.6-41.3175.8-81.7170.4000112.4Y497 Q498 L504 H505Y497-L501 VanDerWaalsContact O-CB 3.28Å; Y497-L501 WeakPolarHBondContact O-CB 3.39Å; Y497-L501 VanDerWaalsContact O-CG 3.29Å; Y497-L501 WeakPolarHBondContact O-CG 3.4Å; Y497-L501 PolarHBondContact O-N 3.49Å; Q498-L501 PolarHBondContact O-N 3.12Å; L501-L504 PolarHBondContact O-N 2.86Å; L501-H505 WeakPolarHBondContact O-CB 3.48Å; L501-H505 PolarHBondContact O-N 3.42Å
502N83.6Confident82.6Confident99 Ų99102.6 Ų102.653%0.52952%0.519SS..Hα-helixtrans-66-41.6177.7-74.1-21.3000111.6Q498 L499 E500 H505 T506Q498-N502 VanDerWaalsContact O-CB 3.3Å; Q498-N502 WeakPolarHBondContact O-CB 3.33Å; Q498-N502 PolarHBondContact O-N 2.94Å; Q498-N502 PolarHBondContact O-ND2 3.47Å; L499-N502 PolarHBondContact O-N 3.12Å; E500-N502 VanDerWaalsContact C-N 3.34Å; E500-N502 PolarHBondContact O-N 2.95Å; N502-H505 PolarHBondContact O-N 3.01Å; N502-T506 WeakPolarHBondContact O-CB 3.38Å; N502-T506 PolarHBondContact O-N 3.01Å; N502-T506 PolarHBondContact O-OG1 3.47Å
503S81.7Confident82.4Confident70 Ų70105.1 Ų105.149%0.4953%0.528SS..Hα-helixtrans-66.1-41.2174.866.30000112.2L499 E500 H505 T506 S507L499-S503 WeakPolarHBondContact O-CB 3.3Å; L499-S503 PolarHBondContact O-N 3.08Å; L499-S503 PolarHBondContact O-OG 3.21Å; E500-S503 WeakPolarHBondContact CA-OG 3.26Å; E500-S503 PolarHBondContact O-N 3.19Å; E500-S503 PolarHBondContact O-OG 3.44Å; S503-H505 VanDerWaalsContact C-N 3.33Å; S503-T506 PolarHBondContact O-N 2.92Å; S503-S507 WeakPolarHBondContact O-CB 3.42Å; S503-S507 PolarHBondContact O-N 3.33Å
504L81.5Confident82.2Confident125 Ų125103.9 Ų103.965%0.65453%0.529SS*.Hα-helixtrans-65.4-38.3174-130.6104.7000111.4E500 L501 S507 K508E500-L504 WeakPolarHBondContact O-CB 3.5Å; E500-L504 PolarHBondContact O-N 3.45Å; L501-L504 PolarHBondContact O-N 2.86Å; L504-S507 PolarHBondContact O-N 3.08Å; L504-K508 VanDerWaalsContact O-CB 3.24Å; L504-K508 WeakPolarHBondContact O-CB 3.48Å; L504-K508 PolarHBondContact O-N 3.38Å
505H80Confident81.8Confident119 Ų119101.1 Ų101.155%0.55152%0.517SS*.Hα-helixtrans-66.1-45.1176.9-165.553.2000110.8L501 N502 S503 K508 V509L501-H505 WeakPolarHBondContact O-CB 3.48Å; L501-H505 PolarHBondContact O-N 3.42Å; N502-H505 PolarHBondContact O-N 3.01Å; S503-H505 VanDerWaalsContact C-N 3.33Å; H505-K508 PolarHBondContact O-N 3.33Å; H505-V509 WeakPolarHBondContact O-CB 3.49Å; H505-V509 VanDerWaalsContact O-CG2 3.28Å; H505-V509 WeakPolarHBondContact O-CG2 3.37Å; H505-V509 PolarHBondContact O-N 3.39Å
506T81.5Confident81.5Confident80 Ų80102 Ų10249%0.49152%0.523SS..Hα-helixtrans-60.9-45.8174.8-52.20000111N502 S503 K508 V509 N510N502-T506 WeakPolarHBondContact O-CB 3.38Å; N502-T506 PolarHBondContact O-N 3.01Å; N502-T506 PolarHBondContact O-OG1 3.47Å; S503-T506 PolarHBondContact O-N 2.92Å; T506-K508 PolarHBondContact O-N 3.37Å; T506-V509 PolarHBondContact O-N 3.2Å; T506-N510 WeakPolarHBondContact O-CB 3.38Å; T506-N510 PolarHBondContact O-N 3.01Å; T506-N510 PolarHBondContact O-OD1 3.32Å
507S84.2Confident81.4Confident77 Ų77100.4 Ų100.454%0.53852%0.516SS..Hα-helixtrans-60.8-43175.3178.20000112.2S503 L504 N510 F511S503-S507 WeakPolarHBondContact O-CB 3.42Å; S503-S507 PolarHBondContact O-N 3.33Å; L504-S507 PolarHBondContact O-N 3.08Å; S507-N510 PolarHBondContact O-N 3.32Å; S507-F511 WeakPolarHBondContact O-CB 3.41Å; S507-F511 PolarHBondContact O-N 2.91Å
508K81.7Confident81.2Confident128 Ų12899.2 Ų99.256%0.55752%0.515SS*.Hα-helixtrans-66-40.6176.4-178.1179.7178.4-179.40112.2L504 H505 T506 F511 N512L504-K508 VanDerWaalsContact O-CB 3.24Å; L504-K508 WeakPolarHBondContact O-CB 3.48Å; L504-K508 PolarHBondContact O-N 3.38Å; H505-K508 PolarHBondContact O-N 3.33Å; T506-K508 PolarHBondContact O-N 3.37Å; K508-F511 PolarHBondContact O-N 2.9Å; K508-N512 VanDerWaalsContact O-CB 3.23Å; K508-N512 WeakPolarHBondContact O-CB 3.27Å; K508-N512 VanDerWaalsContact O-CG 3.23Å; K508-N512 PolarHBondContact O-N 2.84Å
509V83.7Confident81Confident65 Ų6599.2 Ų99.239%0.39452%0.518SS..Hα-helixtrans-62.4-49175.8168.90000109.5H505 T506 F511 N512 E513H505-V509 WeakPolarHBondContact O-CB 3.49Å; H505-V509 VanDerWaalsContact O-CG2 3.28Å; H505-V509 WeakPolarHBondContact O-CG2 3.37Å; H505-V509 PolarHBondContact O-N 3.39Å; T506-V509 PolarHBondContact O-N 3.2Å; V509-F511 VanDerWaalsContact C-N 3.34Å; V509-F511 PolarHBondContact O-N 2.92Å; V509-N512 PolarHBondContact O-N 3.27Å; V509-N512 VanDerWaalsContact O-N 3.17Å; V509-E513 WeakPolarHBondContact O-CB 3.48Å; V509-E513 PolarHBondContact O-N 3.28Å
510N81.7Confident81Confident91 Ų91100.1 Ų100.149%0.48752%0.517SS..Hα-helixtrans-60.6-41.7177.4-65.3-7.2000112.1T506 S507 E513 S514T506-N510 WeakPolarHBondContact O-CB 3.38Å; T506-N510 PolarHBondContact O-N 3.01Å; T506-N510 PolarHBondContact O-OD1 3.32Å; S507-N510 PolarHBondContact O-N 3.32Å; N510-E513 PolarHBondContact O-N 3.39Å; N510-S514 WeakPolarHBondContact O-CB 3.27Å; N510-S514 PolarHBondContact O-N 2.89Å
511F80.1Confident80.9Confident136 Ų13698.6 Ų98.660%0.59651%0.512SS*.Hα-helixtrans-66.7-41175.8-173.9-95000112S507 K508 V509 E513 S514 T515S507-F511 WeakPolarHBondContact O-CB 3.41Å; S507-F511 PolarHBondContact O-N 2.91Å; K508-F511 PolarHBondContact O-N 2.9Å; V509-F511 VanDerWaalsContact C-N 3.34Å; V509-F511 PolarHBondContact O-N 2.92Å; F511-E513 VanDerWaalsContact C-N 3.33Å; F511-S514 PolarHBondContact O-N 3.45Å; F511-T515 HydrophobicContact CD1-CG2 4Å; F511-T515 HydrophobicContact CE1-CG2 3.59Å; F511-T515 HydrophobicContact CE2-CG2 4.32Å; F511-T515 HydrophobicContact CZ-CG2 3.76Å; F511-T515 WeakPolarHBondContact O-CB 3.49Å; F511-T515 VanDerWaalsContact O-CG2 3.3Å; F511-T515 WeakPolarHBondContact O-CG2 3.49Å; F511-T515 PolarHBondContact O-N 2.81Å; F511-T515 PolarHBondContact O-OG1 3.27Å
512N81.9Confident80.8Confident72 Ų7297.9 Ų97.939%0.38551%0.509SS..Hα-helixtrans-64.4-37.8175-81.3-5.9000112K508 V509 T515 M516K508-N512 VanDerWaalsContact O-CB 3.23Å; K508-N512 WeakPolarHBondContact O-CB 3.27Å; K508-N512 VanDerWaalsContact O-CG 3.23Å; K508-N512 PolarHBondContact O-N 2.84Å; V509-N512 PolarHBondContact O-N 3.27Å; V509-N512 VanDerWaalsContact O-N 3.17Å; N512-T515 VanDerWaalsContact CA-OG1 3.28Å; N512-T515 WeakPolarHBondContact CA-OG1 3.4Å; N512-T515 PolarHBondContact O-OG1 3.04Å; N512-T515 VanDerWaalsContact O-OG1 3.09Å; N512-M516 VanDerWaalsContact O-CB 3.28Å; N512-M516 WeakPolarHBondContact O-CB 3.45Å; N512-M516 PolarHBondContact O-N 3.45Å
513E81.4Confident80.6Confident131 Ų13196.6 Ų96.661%0.61250%0.504SS*.Hα-helixtrans-70.2-44.1178.6-159.8161.8-145.900110.6V509 N510 F511 M516 E517V509-E513 WeakPolarHBondContact O-CB 3.48Å; V509-E513 PolarHBondContact O-N 3.28Å; N510-E513 PolarHBondContact O-N 3.39Å; F511-E513 VanDerWaalsContact C-N 3.33Å; E513-M516 PolarHBondContact O-N 2.96Å; E513-E517 PolarHBondContact O-N 3.36Å
514S78.9Confident80.6Confident64 Ų6499.7 Ų99.745%0.44851%0.509SS..Hα-helixtrans-61-44.4172.1-178.50000112.4N510 F511 E517 E518N510-S514 WeakPolarHBondContact O-CB 3.27Å; N510-S514 PolarHBondContact O-N 2.89Å; F511-S514 PolarHBondContact O-N 3.45Å; S514-E517 PolarHBondContact O-N 3.34Å; S514-E518 WeakPolarHBondContact O-CG 3.5Å; S514-E518 PolarHBondContact O-N 2.92Å
515T74Confident80.6Confident38 Ų3899.9 Ų99.923%0.23351%0.507CS..Hα-helixtrans-72.2-31.2177.9510000112.7F511 N512 L519F511-T515 HydrophobicContact CD1-CG2 4Å; F511-T515 HydrophobicContact CE1-CG2 3.59Å; F511-T515 HydrophobicContact CE2-CG2 4.32Å; F511-T515 HydrophobicContact CZ-CG2 3.76Å; F511-T515 WeakPolarHBondContact O-CB 3.49Å; F511-T515 VanDerWaalsContact O-CG2 3.3Å; F511-T515 WeakPolarHBondContact O-CG2 3.49Å; F511-T515 PolarHBondContact O-N 2.81Å; F511-T515 PolarHBondContact O-OG1 3.27Å; N512-T515 VanDerWaalsContact CA-OG1 3.28Å; N512-T515 WeakPolarHBondContact CA-OG1 3.4Å; N512-T515 PolarHBondContact O-OG1 3.04Å; N512-T515 VanDerWaalsContact O-OG1 3.09Å; T515-L519 VanDerWaalsContact O-CB 3.31Å; T515-L519 WeakPolarHBondContact O-CB 3.43Å; T515-L519 WeakPolarHBondContact O-CG 3.27Å; T515-L519 PolarHBondContact O-N 3.44Å
516M78Confident80.6Confident133 Ų13398.4 Ų98.466%0.65550%0.502SS*.Hα-helixtrans-66.2-41.7170.6-102.2-158.6-102.200111.5N512 E513 L519 K520N512-M516 VanDerWaalsContact O-CB 3.28Å; N512-M516 WeakPolarHBondContact O-CB 3.45Å; N512-M516 PolarHBondContact O-N 3.45Å; E513-M516 PolarHBondContact O-N 2.96Å; M516-L519 PolarHBondContact O-N 3.48Å; M516-K520 VanDerWaalsContact O-CB 3.24Å; M516-K520 WeakPolarHBondContact O-CB 3.33Å; M516-K520 PolarHBondContact O-N 2.95Å
517E81.3Confident80.6Confident90 Ų9098.7 Ų98.742%0.42150%0.501SS..Hα-helixtrans-67.4-40.1177.7-164.560-15700111E513 S514 K520 N521E513-E517 PolarHBondContact O-N 3.36Å; S514-E517 PolarHBondContact O-N 3.34Å; E517-K520 PolarHBondContact O-N 3.36Å; E517-K520 IonicContact OE2-NZ 3.81Å; E517-N521 WeakPolarHBondContact O-CB 3.49Å; E517-N521 PolarHBondContact O-N 3.29Å; E517-N521 PolarHBondContact O-ND2 3.17Å
518E79.6Confident80.5Confident115 Ų11599.2 Ų99.254%0.53750%0.498SS..Hα-helixtrans-60.5-47.2170-78-178.918000112.2S514 K520 N521 L522S514-E518 WeakPolarHBondContact O-CG 3.5Å; S514-E518 PolarHBondContact O-N 2.92Å; E518-K520 VanDerWaalsContact C-N 3.3Å; E518-K520 PolarHBondContact O-N 3.44Å; E518-N521 PolarHBondContact O-N 3.45Å; E518-L522 WeakPolarHBondContact O-CB 3.47Å; E518-L522 PolarHBondContact O-N 3.39Å
519L79.4Confident80.5Confident109 Ų10998.9 Ų98.957%0.57150%0.501SS*.Hα-helixtrans-61.9-38176.7-83172.4000112.1T515 M516 T523T515-L519 VanDerWaalsContact O-CB 3.31Å; T515-L519 WeakPolarHBondContact O-CB 3.43Å; T515-L519 WeakPolarHBondContact O-CG 3.27Å; T515-L519 PolarHBondContact O-N 3.44Å; M516-L519 PolarHBondContact O-N 3.48Å; L519-T523 WeakPolarHBondContact O-CB 3.44Å; L519-T523 PolarHBondContact O-N 3.31Å; L519-T523 PolarHBondContact O-OG1 3.18Å
520K82.5Confident80.3Confident132 Ų132101.4 Ų101.457%0.57451%0.507SS*.Hα-helixtrans-66.5-42.1176.8-173.9-176.3174.8-165.40110.9M516 E517 E518 T523 K524M516-K520 VanDerWaalsContact O-CB 3.24Å; M516-K520 WeakPolarHBondContact O-CB 3.33Å; M516-K520 PolarHBondContact O-N 2.95Å; E517-K520 PolarHBondContact O-N 3.36Å; E517-K520 IonicContact OE2-NZ 3.81Å; E518-K520 VanDerWaalsContact C-N 3.3Å; E518-K520 PolarHBondContact O-N 3.44Å; K520-T523 PolarHBondContact O-N 2.97Å; K520-K524 WeakPolarHBondContact O-CB 3.4Å; K520-K524 PolarHBondContact O-N 2.96Å
521N82Confident80.4Confident79 Ų79102.4 Ų102.442%0.42251%0.512SS..Hα-helixtrans-64.9-47.9174.4-74.4-26.7000111.8E517 E518 T523 K524 E525E517-N521 WeakPolarHBondContact O-CB 3.49Å; E517-N521 PolarHBondContact O-N 3.29Å; E517-N521 PolarHBondContact O-ND2 3.17Å; E518-N521 PolarHBondContact O-N 3.45Å; N521-T523 VanDerWaalsContact C-N 3.29Å; N521-T523 PolarHBondContact O-N 2.82Å; N521-K524 WeakPolarHBondContact O-CB 3.3Å; N521-K524 PolarHBondContact O-N 3.36Å; N521-K524 VanDerWaalsContact O-N 3.14Å; N521-E525 WeakPolarHBondContact O-CG 3.3Å; N521-E525 PolarHBondContact O-N 3.47Å
522L77.2Confident80.4Confident103 Ų10399.1 Ų99.154%0.53950%0.503SS..Hα-helixtrans-60.7-36.9173.8-91.8145.8000112.4E518 E525 L526E518-L522 WeakPolarHBondContact O-CB 3.47Å; E518-L522 PolarHBondContact O-N 3.39Å; L522-E525 PolarHBondContact O-N 3.44Å; L522-L526 WeakPolarHBondContact O-CB 3.41Å; L522-L526 PolarHBondContact O-N 3.08Å
523T80.3Confident80.4Confident71 Ų71101.2 Ų101.244%0.43651%0.51SS..Hα-helixtrans-67.9-39.6176-60.70000111L519 K520 N521 L526 N527L519-T523 WeakPolarHBondContact O-CB 3.44Å; L519-T523 PolarHBondContact O-N 3.31Å; L519-T523 PolarHBondContact O-OG1 3.18Å; K520-T523 PolarHBondContact O-N 2.97Å; N521-T523 VanDerWaalsContact C-N 3.29Å; N521-T523 PolarHBondContact O-N 2.82Å; T523-L526 PolarHBondContact O-N 2.83Å; T523-N527 WeakPolarHBondContact O-CB 3.38Å; T523-N527 PolarHBondContact O-N 3.23Å; T523-N527 PolarHBondContact O-ND2 2.88Å
524K81.5Confident80.4Confident135 Ų13598 Ų9859%0.58750%0.5SS*.Hα-helixtrans-63.2-49.2173.7-173.2-178.2175.7-174.30110.8K520 N521 L526 N527 D528K520-K524 WeakPolarHBondContact O-CB 3.4Å; K520-K524 PolarHBondContact O-N 2.96Å; N521-K524 WeakPolarHBondContact O-CB 3.3Å; N521-K524 PolarHBondContact O-N 3.36Å; N521-K524 VanDerWaalsContact O-N 3.14Å; K524-L526 VanDerWaalsContact C-N 3.33Å; K524-L526 PolarHBondContact O-N 3.45Å; K524-N527 PolarHBondContact O-N 3.46Å; K524-N527 VanDerWaalsContact O-N 3.15Å; K524-D528 PolarHBondContact O-N 3.2Å
525E82.2Confident80.6Confident130 Ų13099.2 Ų99.261%0.60750%0.5SS*.Hα-helixtrans-59.1-42.5175.1-73.3-177.2-177.300112.2N521 L522 N527 D528 L529N521-E525 WeakPolarHBondContact O-CG 3.3Å; N521-E525 PolarHBondContact O-N 3.47Å; L522-E525 PolarHBondContact O-N 3.44Å; E525-N527 VanDerWaalsContact C-N 3.33Å; E525-N527 PolarHBondContact O-N 2.91Å; E525-D528 PolarHBondContact O-N 2.99Å; E525-L529 VanDerWaalsContact O-CB 3.27Å; E525-L529 WeakPolarHBondContact O-CB 3.31Å; E525-L529 PolarHBondContact O-N 2.88Å
526L79.9Confident80.9Confident88 Ų88101.9 Ų101.946%0.46152%0.516SS..Hα-helixtrans-63.5-39.4176.5-176.968.4000111.7L522 T523 K524 K530L522-L526 WeakPolarHBondContact O-CB 3.41Å; L522-L526 PolarHBondContact O-N 3.08Å; T523-L526 PolarHBondContact O-N 2.83Å; K524-L526 VanDerWaalsContact C-N 3.33Å; K524-L526 PolarHBondContact O-N 3.45Å; L526-K530 WeakPolarHBondContact O-CB 3.32Å; L526-K530 VanDerWaalsContact O-CG 3.29Å; L526-K530 WeakPolarHBondContact O-CG 3.31Å; L526-K530 PolarHBondContact O-N 3.34Å
527N82.1Confident81.2Confident85 Ų85100 Ų10046%0.45551%0.506SS..Hα-helixtrans-69.6-41.2177.1-74.6-25.8000111.7T523 K524 E525 L529 K530 L531T523-N527 WeakPolarHBondContact O-CB 3.38Å; T523-N527 PolarHBondContact O-N 3.23Å; T523-N527 PolarHBondContact O-ND2 2.88Å; K524-N527 PolarHBondContact O-N 3.46Å; K524-N527 VanDerWaalsContact O-N 3.15Å; E525-N527 VanDerWaalsContact C-N 3.33Å; E525-N527 PolarHBondContact O-N 2.91Å; N527-L529 VanDerWaalsContact C-N 3.33Å; N527-K530 PolarHBondContact O-N 3.48Å; N527-L531 WeakPolarHBondContact O-CB 3.34Å; N527-L531 PolarHBondContact O-N 2.86Å
528D81.1Confident81.2Confident89 Ų89102.7 Ų102.748%0.47652%0.516SS..Hα-helixtrans-63.9-39.8174.2-69.3-20.8000111K524 E525 L531 T532K524-D528 PolarHBondContact O-N 3.2Å; E525-D528 PolarHBondContact O-N 2.99Å; D528-L531 PolarHBondContact O-N 3.29Å; D528-T532 WeakPolarHBondContact O-CG2 3.38Å; D528-T532 PolarHBondContact O-N 3.49Å; D528-T532 PolarHBondContact O-OG1 3.44Å
529L81.3Confident81.4Confident120 Ų120102.8 Ų102.863%0.62852%0.516SS*.Hα-helixtrans-68-36.9175.3-161.469.9000112.1E525 N527 T532 H533E525-L529 VanDerWaalsContact O-CB 3.27Å; E525-L529 WeakPolarHBondContact O-CB 3.31Å; E525-L529 PolarHBondContact O-N 2.88Å; N527-L529 VanDerWaalsContact C-N 3.33Å; L529-T532 VanDerWaalsContact CA-OG1 3.25Å; L529-T532 WeakPolarHBondContact CA-OG1 3.41Å; L529-T532 PolarHBondContact O-OG1 3.49Å; L529-H533 VanDerWaalsContact O-CB 3.25Å; L529-H533 WeakPolarHBondContact O-CB 3.47Å; L529-H533 PolarHBondContact O-N 3.28Å
530K80.9Confident81.6Confident118 Ų118102.5 Ų102.551%0.51352%0.515SS..Hα-helixtrans-66.1-40.9171.8-80.2175.4-179.2174.60111.9L526 N527 H533 T534L526-K530 WeakPolarHBondContact O-CB 3.32Å; L526-K530 VanDerWaalsContact O-CG 3.29Å; L526-K530 WeakPolarHBondContact O-CG 3.31Å; L526-K530 PolarHBondContact O-N 3.34Å; N527-K530 PolarHBondContact O-N 3.48Å; K530-H533 PolarHBondContact O-N 3.38Å; K530-T534 WeakPolarHBondContact O-CB 3.36Å; K530-T534 PolarHBondContact O-N 3.39Å; K530-T534 PolarHBondContact O-OG1 3.42Å
531L82.4Confident81.6Confident113 Ų113101.8 Ų101.859%0.59251%0.514SS*.Hα-helixtrans-62.8-48.2177.2-163.291.2000110.3N527 D528 T534 I535N527-L531 WeakPolarHBondContact O-CB 3.34Å; N527-L531 PolarHBondContact O-N 2.86Å; D528-L531 PolarHBondContact O-N 3.29Å; L531-T534 PolarHBondContact O-N 2.81Å; L531-I535 HydrophobicContact CD2-CD1 4.39Å; L531-I535 HydrophobicContact CG-CD1 4.39Å; L531-I535 VanDerWaalsContact O-CG1 3.31Å; L531-I535 WeakPolarHBondContact O-CG1 3.43Å; L531-I535 PolarHBondContact O-N 3.43Å
532T81.3Confident81.6Confident67 Ų67101.5 Ų101.541%0.41151%0.514SS..Hα-helixtrans-63.6-41.5176.151.90000112D528 L529 T534 I535 V536D528-T532 WeakPolarHBondContact O-CG2 3.38Å; D528-T532 PolarHBondContact O-N 3.49Å; D528-T532 PolarHBondContact O-OG1 3.44Å; L529-T532 VanDerWaalsContact CA-OG1 3.25Å; L529-T532 WeakPolarHBondContact CA-OG1 3.41Å; L529-T532 PolarHBondContact O-OG1 3.49Å; T532-T534 VanDerWaalsContact C-N 3.33Å; T532-T534 PolarHBondContact O-N 3.24Å; T532-I535 PolarHBondContact O-N 2.95Å; T532-V536 WeakPolarHBondContact O-CB 3.5Å; T532-V536 VanDerWaalsContact O-CG2 3.32Å; T532-V536 WeakPolarHBondContact O-CG2 3.49Å; T532-V536 PolarHBondContact O-N 2.92Å
533H81.1Confident81.9Confident116 Ų116100.6 Ų100.654%0.53751%0.51SS..Hα-helixtrans-58.8-44.3172.7-17678.6000111.8L529 K530 I535 V536 Q537L529-H533 VanDerWaalsContact O-CB 3.25Å; L529-H533 WeakPolarHBondContact O-CB 3.47Å; L529-H533 PolarHBondContact O-N 3.28Å; K530-H533 PolarHBondContact O-N 3.38Å; H533-I535 VanDerWaalsContact C-N 3.33Å; H533-I535 PolarHBondContact O-N 3.2Å; H533-V536 PolarHBondContact O-N 3.07Å; H533-Q537 WeakPolarHBondContact O-CB 3.46Å; H533-Q537 PolarHBondContact O-N 2.93Å
534T81Confident81.9Confident64 Ų64101.5 Ų101.539%0.39351%0.509SS..Hα-helixtrans-63.4-40178.4-52.70000111.4K530 L531 T532 K538K530-T534 WeakPolarHBondContact O-CB 3.36Å; K530-T534 PolarHBondContact O-N 3.39Å; K530-T534 PolarHBondContact O-OG1 3.42Å; L531-T534 PolarHBondContact O-N 2.81Å; T532-T534 VanDerWaalsContact C-N 3.33Å; T532-T534 PolarHBondContact O-N 3.24Å; T534-K538 WeakPolarHBondContact O-CB 3.46Å; T534-K538 WeakPolarHBondContact O-CG 3.3Å; T534-K538 PolarHBondContact O-N 3.48Å
535I83.4Confident81.9Confident89 Ų89104.1 Ų104.146%0.45652%0.516SS..Hα-helixtrans-63.9-50.7175-68164.8000110.3L531 T532 H533 Q537 K538 Q539L531-I535 HydrophobicContact CD2-CD1 4.39Å; L531-I535 HydrophobicContact CG-CD1 4.39Å; L531-I535 VanDerWaalsContact O-CG1 3.31Å; L531-I535 WeakPolarHBondContact O-CG1 3.43Å; L531-I535 PolarHBondContact O-N 3.43Å; T532-I535 PolarHBondContact O-N 2.95Å; H533-I535 VanDerWaalsContact C-N 3.33Å; H533-I535 PolarHBondContact O-N 3.2Å; I535-Q537 VanDerWaalsContact C-N 3.33Å; I535-Q537 PolarHBondContact O-N 3.49Å; I535-K538 PolarHBondContact O-N 3.4Å; I535-Q539 WeakPolarHBondContact O-CB 3.42Å; I535-Q539 PolarHBondContact O-N 3Å
536V81.2Confident81.8Confident93 Ų93102.3 Ų102.356%0.56451%0.509SS*.Hα-helixtrans-62.5-39.7179.3172.50000111.4T532 H533 Q539 L540T532-V536 WeakPolarHBondContact O-CB 3.5Å; T532-V536 VanDerWaalsContact O-CG2 3.32Å; T532-V536 WeakPolarHBondContact O-CG2 3.49Å; T532-V536 PolarHBondContact O-N 2.92Å; H533-V536 PolarHBondContact O-N 3.07Å; V536-Q539 WeakPolarHBondContact O-CB 3.35Å; V536-Q539 PolarHBondContact O-N 3.04Å; V536-L540 WeakPolarHBondContact O-CB 3.44Å; V536-L540 PolarHBondContact O-N 3.48Å
537Q83.3Confident81.9Confident94 Ų94101.6 Ų101.644%0.43951%0.505SS..Hα-helixtrans-66.5-41.6178.4-168178.123.900111.7H533 I535 L540 H541H533-Q537 WeakPolarHBondContact O-CB 3.46Å; H533-Q537 PolarHBondContact O-N 2.93Å; I535-Q537 VanDerWaalsContact C-N 3.33Å; I535-Q537 PolarHBondContact O-N 3.49Å; Q537-L540 PolarHBondContact O-N 2.93Å; Q537-H541 PolarHBondContact O-N 2.97Å; Q537-H541 PolarHBondContact O-ND1 3.4Å; Q537-H541 VanDerWaalsContact O-ND1 3.08Å
538K82.5Confident81.9Confident146 Ų146101.5 Ų101.564%0.63551%0.505SS*.Hα-helixtrans-59.9-47.7170.1-77178.4179.9178.70110.6T534 I535 L540 H541 T542T534-K538 WeakPolarHBondContact O-CB 3.46Å; T534-K538 WeakPolarHBondContact O-CG 3.3Å; T534-K538 PolarHBondContact O-N 3.48Å; I535-K538 PolarHBondContact O-N 3.4Å; K538-L540 VanDerWaalsContact C-N 3.33Å; K538-L540 PolarHBondContact O-N 2.91Å; K538-H541 WeakPolarHBondContact O-CB 3.47Å; K538-H541 PolarHBondContact O-N 2.8Å; K538-H541 VanDerWaalsContact O-N 3.13Å; K538-T542 PolarHBondContact O-N 3.35Å; K538-T542 PolarHBondContact O-OG1 3.1Å
539Q83.8Confident82Confident117 Ų117104.8 Ų104.855%0.54752%0.515SS..Hα-helixtrans-56.3-46.9177.4-149.991.5-1.200111.3I535 V536 H541 T542 N543I535-Q539 WeakPolarHBondContact O-CB 3.42Å; I535-Q539 PolarHBondContact O-N 3Å; V536-Q539 WeakPolarHBondContact O-CB 3.35Å; V536-Q539 PolarHBondContact O-N 3.04Å; Q539-H541 PolarHBondContact O-N 2.94Å; Q539-T542 WeakPolarHBondContact CA-OG1 3.35Å; Q539-T542 PolarHBondContact O-N 2.98Å; Q539-T542 PolarHBondContact O-OG1 3.47Å; Q539-N543 PolarHBondContact O-N 3.39Å
540L83.4Confident82Confident104 Ų104104.3 Ų104.355%0.54551%0.512SS..Hα-helixtrans-59.9-43.4176.5-170.888.7000111.3V536 Q537 K538 N543 Q544V536-L540 WeakPolarHBondContact O-CB 3.44Å; V536-L540 PolarHBondContact O-N 3.48Å; Q537-L540 PolarHBondContact O-N 2.93Å; K538-L540 VanDerWaalsContact C-N 3.33Å; K538-L540 PolarHBondContact O-N 2.91Å; L540-N543 PolarHBondContact O-N 3.18Å; L540-Q544 VanDerWaalsContact O-CB 3.32Å; L540-Q544 WeakPolarHBondContact O-CB 3.44Å; L540-Q544 PolarHBondContact O-N 3.49Å
541H81.6Confident82Confident117 Ų117104.5 Ų104.554%0.54251%0.513SS..Hα-helixtrans-63.7-41.2176.9-81.642.4000112.1Q537 K538 Q539 Q544 R545Q537-H541 PolarHBondContact O-N 2.97Å; Q537-H541 PolarHBondContact O-ND1 3.4Å; Q537-H541 VanDerWaalsContact O-ND1 3.08Å; K538-H541 WeakPolarHBondContact O-CB 3.47Å; K538-H541 PolarHBondContact O-N 2.8Å; K538-H541 VanDerWaalsContact O-N 3.13Å; Q539-H541 PolarHBondContact O-N 2.94Å; H541-Q544 PolarHBondContact O-N 2.65Å; H541-R545 PolarHBondContact O-N 3.39Å
542T82.5Confident81.9Confident72 Ų72105 Ų10544%0.44252%0.516SS..Hα-helixtrans-61.9-46.8171.713.10000111.8K538 Q539 Q544 R545 I546K538-T542 PolarHBondContact O-N 3.35Å; K538-T542 PolarHBondContact O-OG1 3.1Å; Q539-T542 WeakPolarHBondContact CA-OG1 3.35Å; Q539-T542 PolarHBondContact O-N 2.98Å; Q539-T542 PolarHBondContact O-OG1 3.47Å; T542-Q544 VanDerWaalsContact C-N 3.32Å; T542-Q544 PolarHBondContact O-N 2.9Å; T542-R545 WeakPolarHBondContact O-CB 3.35Å; T542-R545 PolarHBondContact O-N 3.36Å; T542-I546 WeakPolarHBondContact O-CG1 3.43Å; T542-I546 PolarHBondContact O-N 2.9Å
543N82.5Confident81.8Confident84 Ų84106.1 Ų106.145%0.44952%0.522SS..Hα-helixtrans-62.3-40.1177.8-72.9-10.8000111.5Q539 L540 R545 I546 I547Q539-N543 PolarHBondContact O-N 3.39Å; L540-N543 PolarHBondContact O-N 3.18Å; N543-R545 PolarHBondContact O-N 3.34Å; N543-I546 PolarHBondContact O-N 2.87Å; N543-I547 WeakPolarHBondContact O-CB 3.43Å; N543-I547 VanDerWaalsContact O-CG1 3.29Å; N543-I547 WeakPolarHBondContact O-CG1 3.28Å; N543-I547 PolarHBondContact O-N 3.49Å
544Q82Confident81.8Confident90 Ų90107 Ų10742%0.42152%0.524SS..Hα-helixtrans-64.7-40.3176-163.566.726.700111.6L540 H541 T542 I546 I547 N548L540-Q544 VanDerWaalsContact O-CB 3.32Å; L540-Q544 WeakPolarHBondContact O-CB 3.44Å; L540-Q544 PolarHBondContact O-N 3.49Å; H541-Q544 PolarHBondContact O-N 2.65Å; T542-Q544 VanDerWaalsContact C-N 3.32Å; T542-Q544 PolarHBondContact O-N 2.9Å; Q544-I546 VanDerWaalsContact C-N 3.35Å; Q544-I547 PolarHBondContact O-N 3.2Å; Q544-N548 WeakPolarHBondContact O-CB 3.48Å; Q544-N548 VanDerWaalsContact O-CG 3.27Å; Q544-N548 PolarHBondContact O-N 2.96Å
545R80.1Confident81.8Confident191 Ų191108.3 Ų108.372%0.72153%0.529SS*.Hα-helixtrans-61.6-41.9172.1-83.2-179.2167.9171.9-2.2111.8H541 T542 N543 N548 K549H541-R545 PolarHBondContact O-N 3.39Å; T542-R545 WeakPolarHBondContact O-CB 3.35Å; T542-R545 PolarHBondContact O-N 3.36Å; N543-R545 PolarHBondContact O-N 3.34Å; R545-N548 PolarHBondContact O-N 2.9Å; R545-K549 WeakPolarHBondContact O-CG 3.28Å; R545-K549 PolarHBondContact O-N 2.89Å
546I81.3Confident81.7Confident91 Ų91107.4 Ų107.447%0.46753%0.528SS..Hα-helixtrans-64.8-46.1176.5-67.1165.7000110.4T542 N543 Q544 N548 K549 L550T542-I546 WeakPolarHBondContact O-CG1 3.43Å; T542-I546 PolarHBondContact O-N 2.9Å; N543-I546 PolarHBondContact O-N 2.87Å; Q544-I546 VanDerWaalsContact C-N 3.35Å; I546-N548 VanDerWaalsContact C-N 3.34Å; I546-N548 PolarHBondContact O-N 3.49Å; I546-K549 WeakPolarHBondContact O-CB 3.46Å; I546-K549 PolarHBondContact O-N 2.81Å; I546-L550 HydrophobicContact CG2-CD1 3.9Å; I546-L550 HydrophobicContact CG2-CG 4.32Å; I546-L550 WeakPolarHBondContact O-CB 3.48Å; I546-L550 WeakPolarHBondContact O-CG 3.44Å; I546-L550 PolarHBondContact O-N 3.37Å
547I82.2Confident81.5Confident74 Ų74105.6 Ų105.638%0.37952%0.523SS..Hα-helixtrans-60-43.6176.5-71.6166.4000111.1N543 Q544 L550 K551N543-I547 WeakPolarHBondContact O-CB 3.43Å; N543-I547 VanDerWaalsContact O-CG1 3.29Å; N543-I547 WeakPolarHBondContact O-CG1 3.28Å; N543-I547 PolarHBondContact O-N 3.49Å; Q544-I547 PolarHBondContact O-N 3.2Å; I547-L550 PolarHBondContact O-N 3.02Å; I547-K551 HydrophobicContact CG2-CD 4.38Å; I547-K551 WeakPolarHBondContact O-CB 3.4Å; I547-K551 PolarHBondContact O-N 2.94Å
548N81Confident81.4Confident83 Ų83104.5 Ų104.544%0.44452%0.519SS..Hα-helixtrans-64.5-41.3177.8-74.7-11.8000111.5Q544 R545 I546 K551 L552Q544-N548 WeakPolarHBondContact O-CB 3.48Å; Q544-N548 VanDerWaalsContact O-CG 3.27Å; Q544-N548 PolarHBondContact O-N 2.96Å; R545-N548 PolarHBondContact O-N 2.9Å; I546-N548 VanDerWaalsContact C-N 3.34Å; I546-N548 PolarHBondContact O-N 3.49Å; N548-K551 PolarHBondContact O-N 2.89Å; N548-L552 PolarHBondContact O-N 3.23Å
549K82.9Confident81.3Confident157 Ų157102 Ų10268%0.68351%0.512SS*.Hα-helixtrans-59.5-50.5171.6-78.2-176.3176.9-175.20111R545 I546 K551 L552 T553R545-K549 WeakPolarHBondContact O-CG 3.28Å; R545-K549 PolarHBondContact O-N 2.89Å; I546-K549 WeakPolarHBondContact O-CB 3.46Å; I546-K549 PolarHBondContact O-N 2.81Å; K549-K551 VanDerWaalsContact C-N 3.33Å; K549-K551 PolarHBondContact O-N 3.28Å; K549-L552 WeakPolarHBondContact O-CB 3.38Å; K549-L552 PolarHBondContact O-N 2.91Å; K549-L552 VanDerWaalsContact O-N 3.08Å; K549-T553 PolarHBondContact O-N 3.34Å; K549-T553 PolarHBondContact O-OG1 2.99Å
550L80.8Confident81Confident110 Ų110100.2 Ų100.258%0.57651%0.506SS*.Hα-helixtrans-61-38.4179.2-71.3172.6000112.7I546 I547 T553 K554I546-L550 HydrophobicContact CG2-CD1 3.9Å; I546-L550 HydrophobicContact CG2-CG 4.32Å; I546-L550 WeakPolarHBondContact O-CB 3.48Å; I546-L550 WeakPolarHBondContact O-CG 3.44Å; I546-L550 PolarHBondContact O-N 3.37Å; I547-L550 PolarHBondContact O-N 3.02Å; L550-T553 PolarHBondContact O-N 3.26Å; L550-K554 VanDerWaalsContact O-CB 3.26Å; L550-K554 WeakPolarHBondContact O-CB 3.44Å; L550-K554 PolarHBondContact O-N 2.98Å
551K81.5Confident80.7Confident123 Ų12399.7 Ų99.754%0.53550%0.504SS..Hα-helixtrans-62.3-42.6172.7-84.5-177.1176.2179.80111.6I547 N548 K549 K554 N555I547-K551 HydrophobicContact CG2-CD 4.38Å; I547-K551 WeakPolarHBondContact O-CB 3.4Å; I547-K551 PolarHBondContact O-N 2.94Å; N548-K551 PolarHBondContact O-N 2.89Å; K549-K551 VanDerWaalsContact C-N 3.33Å; K549-K551 PolarHBondContact O-N 3.28Å; K551-K554 PolarHBondContact O-N 2.88Å; K551-N555 WeakPolarHBondContact O-CB 3.48Å; K551-N555 VanDerWaalsContact O-CG 3.28Å; K551-N555 PolarHBondContact O-N 3.3Å
552L81.7Confident80.6Confident124 Ų12497.6 Ų97.665%0.64950%0.496SS*.Hα-helixtrans-65.3-44.1177.4-135.7115.4000111.1N548 K549 K554 N555 T556N548-L552 PolarHBondContact O-N 3.23Å; K549-L552 WeakPolarHBondContact O-CB 3.38Å; K549-L552 PolarHBondContact O-N 2.91Å; K549-L552 VanDerWaalsContact O-N 3.08Å; L552-K554 PolarHBondContact O-N 3.35Å; L552-N555 PolarHBondContact O-N 3.49Å; L552-T556 WeakPolarHBondContact O-CB 3.4Å; L552-T556 PolarHBondContact O-N 3.4Å; L552-T556 PolarHBondContact O-OG1 3.22Å
553T77.9Confident80.3Confident89 Ų89100 Ų10055%0.54650%0.5SS..Hα-helixtrans-62.8-41.9175.4-38.20000111.3K549 L550 T556 A557K549-T553 PolarHBondContact O-N 3.34Å; K549-T553 PolarHBondContact O-OG1 2.99Å; L550-T553 PolarHBondContact O-N 3.26Å; T553-T556 PolarHBondContact O-N 3.41Å; T553-A557 WeakPolarHBondContact O-CB 3.33Å; T553-A557 PolarHBondContact O-N 3.28Å
554K81.2Confident80Confident134 Ų134101 Ų10158%0.58351%0.505SS*.Hα-helixtrans-60.5-48.5174.1177.8-174170.5-179.30111.4L550 K551 L552 T556 A557 I558L550-K554 VanDerWaalsContact O-CB 3.26Å; L550-K554 WeakPolarHBondContact O-CB 3.44Å; L550-K554 PolarHBondContact O-N 2.98Å; K551-K554 PolarHBondContact O-N 2.88Å; L552-K554 PolarHBondContact O-N 3.35Å; K554-T556 VanDerWaalsContact C-N 3.31Å; K554-T556 PolarHBondContact O-N 3.48Å; K554-A557 CarbonylContact O-C 3.54Å; K554-A557 WeakPolarHBondContact O-CB 3.49Å; K554-A557 PolarHBondContact O-N 2.86Å; K554-I558 HydrophobicContact CD-CD1 4.47Å; K554-I558 HydrophobicContact CG-CD1 3.93Å; K554-I558 HydrophobicContact CG-CG1 4.49Å; K554-I558 WeakPolarHBondContact O-CG1 3.34Å; K554-I558 PolarHBondContact O-N 2.66Å
555N81.2Confident79.6Confident93 Ų93102.4 Ų102.450%0.49751%0.51SS..Hα-helixtrans-63.5-40.2179.3-72.6-5.8000111.3K551 L552 A557 I558 I559K551-N555 WeakPolarHBondContact O-CB 3.48Å; K551-N555 VanDerWaalsContact O-CG 3.28Å; K551-N555 PolarHBondContact O-N 3.3Å; L552-N555 PolarHBondContact O-N 3.49Å; N555-A557 VanDerWaalsContact C-N 3.34Å; N555-I558 PolarHBondContact O-N 3.4Å; N555-I559 WeakPolarHBondContact O-CG1 3.43Å; N555-I559 PolarHBondContact O-N 3.04Å
556T81.1Confident79.5Confident69 Ų6998.3 Ų98.342%0.42350%0.501SS..Hα-helixtrans-62.7-42.4174.3-49.50000111L552 T553 K554 I559 N560L552-T556 WeakPolarHBondContact O-CB 3.4Å; L552-T556 PolarHBondContact O-N 3.4Å; L552-T556 PolarHBondContact O-OG1 3.22Å; T553-T556 PolarHBondContact O-N 3.41Å; K554-T556 VanDerWaalsContact C-N 3.31Å; K554-T556 PolarHBondContact O-N 3.48Å; T556-I559 PolarHBondContact O-N 3.02Å; T556-N560 WeakPolarHBondContact O-CB 3.48Å; T556-N560 PolarHBondContact O-N 2.96Å; T556-N560 PolarHBondContact O-ND2 2.79Å
557A77.9Confident79.1Confident56 Ų5698.9 Ų98.946%0.46350%0.502SS..Hα-helixtrans-64.8-37.5175.200000112.4T553 K554 N555 N560 L561T553-A557 WeakPolarHBondContact O-CB 3.33Å; T553-A557 PolarHBondContact O-N 3.28Å; K554-A557 CarbonylContact O-C 3.54Å; K554-A557 WeakPolarHBondContact O-CB 3.49Å; K554-A557 PolarHBondContact O-N 2.86Å; N555-A557 VanDerWaalsContact C-N 3.34Å; A557-N560 PolarHBondContact O-N 3.25Å; A557-L561 VanDerWaalsContact O-CB 3.28Å; A557-L561 WeakPolarHBondContact O-CB 3.42Å; A557-L561 PolarHBondContact O-N 3.48Å
558I81Confident78.8Confident70 Ų70100.4 Ų100.436%0.35951%0.511SS..Hα-helixtrans-66.2-45.9174.6-69.9167000110.7K554 N555 N560 L561 D562K554-I558 HydrophobicContact CD-CD1 4.47Å; K554-I558 HydrophobicContact CG-CD1 3.93Å; K554-I558 HydrophobicContact CG-CG1 4.49Å; K554-I558 WeakPolarHBondContact O-CG1 3.34Å; K554-I558 PolarHBondContact O-N 2.66Å; N555-I558 PolarHBondContact O-N 3.4Å; I558-N560 VanDerWaalsContact C-N 3.29Å; I558-N560 PolarHBondContact O-N 2.93Å; I558-L561 CarbonylContact O-C 3.6Å; I558-L561 WeakPolarHBondContact O-CA 3.39Å; I558-L561 WeakPolarHBondContact O-CB 3.39Å; I558-L561 PolarHBondContact O-N 3.42Å; I558-L561 VanDerWaalsContact O-N 3.1Å; I558-D562 PolarHBondContact O-N 3.01Å
559I79.3Confident78.6Confident95 Ų95103.2 Ų103.249%0.48752%0.519SS..Hα-helixtrans-60.3-42.9175.9-68165.5000110.3N555 T556 L561 D562 K563N555-I559 WeakPolarHBondContact O-CG1 3.43Å; N555-I559 PolarHBondContact O-N 3.04Å; T556-I559 PolarHBondContact O-N 3.02Å; I559-L561 VanDerWaalsContact C-N 3.33Å; I559-D562 PolarHBondContact O-N 3.24Å; I559-K563 HydrophobicContact CG2-CD 4.48Å; I559-K563 WeakPolarHBondContact O-CG 3.47Å; I559-K563 PolarHBondContact O-N 3.03Å
560N78.4Confident78.3Confident78 Ų78101.7 Ų101.742%0.41751%0.514SS..Hα-helixtrans-65.5-36.8175.6-70.9-14.5000111.8T556 A557 I558 L564T556-N560 WeakPolarHBondContact O-CB 3.48Å; T556-N560 PolarHBondContact O-N 2.96Å; T556-N560 PolarHBondContact O-ND2 2.79Å; A557-N560 PolarHBondContact O-N 3.25Å; I558-N560 VanDerWaalsContact C-N 3.29Å; I558-N560 PolarHBondContact O-N 2.93Å; N560-L564 VanDerWaalsContact O-CB 3.28Å; N560-L564 WeakPolarHBondContact O-CB 3.42Å; N560-L564 WeakPolarHBondContact O-CG 3.39Å; N560-L564 PolarHBondContact O-N 3.4Å
561L77.3Confident77.9Confident94 Ų94102.3 Ų102.349%0.49251%0.512SS..Hα-helixtrans-65-41.4174-167.994.9000111.2A557 I558 I559 L564 K565A557-L561 VanDerWaalsContact O-CB 3.28Å; A557-L561 WeakPolarHBondContact O-CB 3.42Å; A557-L561 PolarHBondContact O-N 3.48Å; I558-L561 CarbonylContact O-C 3.6Å; I558-L561 WeakPolarHBondContact O-CA 3.39Å; I558-L561 WeakPolarHBondContact O-CB 3.39Å; I558-L561 PolarHBondContact O-N 3.42Å; I558-L561 VanDerWaalsContact O-N 3.1Å; I559-L561 VanDerWaalsContact C-N 3.33Å; L561-L564 CarbonylContact O-C 3.59Å; L561-L564 PolarHBondContact O-N 3.22Å; L561-K565 WeakPolarHBondContact O-CB 3.4Å; L561-K565 WeakPolarHBondContact O-CG 3.43Å; L561-K565 PolarHBondContact O-N 3.49Å
562D79Confident77.4Confident73 Ų7399.6 Ų99.639%0.3951%0.508SS..Hα-helixtrans-70.8-38178.3-73-24.6000111.4I558 I559 K565 I566I558-D562 PolarHBondContact O-N 3.01Å; I559-D562 PolarHBondContact O-N 3.24Å; D562-K565 WeakPolarHBondContact O-CB 3.37Å; D562-K565 PolarHBondContact O-N 3.42Å; D562-K565 IonicContact OD1-NZ 2.63Å; D562-I566 WeakPolarHBondContact O-CG1 3.11Å; D562-I566 PolarHBondContact O-N 2.85Å
563K76Confident77Confident121 Ų12197.8 Ų97.853%0.52650%0.499SS..Hα-helixtrans-60-48.4168.3-75.1-179.5179.2-175.50111.4I559 K565 I566 E567I559-K563 HydrophobicContact CG2-CD 4.48Å; I559-K563 WeakPolarHBondContact O-CG 3.47Å; I559-K563 PolarHBondContact O-N 3.03Å; K563-K565 VanDerWaalsContact C-N 3.26Å; K563-K565 PolarHBondContact O-N 3.26Å; K563-I566 PolarHBondContact O-N 3.24Å; K563-I566 VanDerWaalsContact O-N 3.11Å; K563-E567 WeakPolarHBondContact O-CG 3.37Å; K563-E567 PolarHBondContact O-N 3.03Å
564L75.2Confident76.8Confident106 Ų10696.3 Ų96.356%0.55549%0.492SS*.Hα-helixtrans-60.2-35.3174.8-88.7159.8000111.9N560 L561 L568N560-L564 VanDerWaalsContact O-CB 3.28Å; N560-L564 WeakPolarHBondContact O-CB 3.42Å; N560-L564 WeakPolarHBondContact O-CG 3.39Å; N560-L564 PolarHBondContact O-N 3.4Å; L561-L564 CarbonylContact O-C 3.59Å; L561-L564 PolarHBondContact O-N 3.22Å; L564-L568 WeakPolarHBondContact O-CA 3.44Å; L564-L568 WeakPolarHBondContact O-CB 3.47Å; L564-L568 PolarHBondContact O-N 3.34Å
565K75.6Confident76.1Confident120 Ų12096 Ų9652%0.52249%0.488SS..Hα-helixtrans-67.3-39.1174-81.7176.5-177.6170.50112.2L561 D562 K563 K569L561-K565 WeakPolarHBondContact O-CB 3.4Å; L561-K565 WeakPolarHBondContact O-CG 3.43Å; L561-K565 PolarHBondContact O-N 3.49Å; D562-K565 WeakPolarHBondContact O-CB 3.37Å; D562-K565 PolarHBondContact O-N 3.42Å; D562-K565 IonicContact OD1-NZ 2.63Å; K563-K565 VanDerWaalsContact C-N 3.26Å; K563-K565 PolarHBondContact O-N 3.26Å; K565-K569 VanDerWaalsContact O-CB 3.29Å; K565-K569 WeakPolarHBondContact O-CB 3.27Å; K565-K569 PolarHBondContact O-N 2.86Å
566I76.3Confident75.7Confident104 Ų10497.9 Ų97.953%0.53349%0.494SS..Hα-helixtrans-66.3-49.9175.1-66.7166.3000109.6D562 K563 L568 K569 E570D562-I566 WeakPolarHBondContact O-CG1 3.11Å; D562-I566 PolarHBondContact O-N 2.85Å; K563-I566 PolarHBondContact O-N 3.24Å; K563-I566 VanDerWaalsContact O-N 3.11Å; I566-L568 VanDerWaalsContact C-N 3.27Å; I566-L568 PolarHBondContact O-N 3.27Å; I566-K569 WeakPolarHBondContact O-CA 3.45Å; I566-K569 WeakPolarHBondContact O-CB 3.33Å; I566-K569 PolarHBondContact O-N 2.94Å; I566-E570 WeakPolarHBondContact O-CG 3.47Å; I566-E570 PolarHBondContact O-N 3.49Å
567E73.9Confident75.1Confident103 Ų103102.3 Ų102.348%0.48151%0.508SS..Hα-helixtrans-59.6-38175.6-71.6175.1-16800111.9K563 K571K563-E567 WeakPolarHBondContact O-CG 3.37Å; K563-E567 PolarHBondContact O-N 3.03Å; E567-K571 VanDerWaalsContact O-CB 3.27Å; E567-K571 WeakPolarHBondContact O-CB 3.49Å; E567-K571 WeakPolarHBondContact O-CG 3.3Å; E567-K571 PolarHBondContact O-N 2.86Å
568L74.6Confident74.6Confident107 Ų107104.1 Ų104.156%0.5651%0.506SS*.Hα-helixtrans-67.6-38.8174.6-168.281.6000110.6L564 I566 K571 C572L564-L568 WeakPolarHBondContact O-CA 3.44Å; L564-L568 WeakPolarHBondContact O-CB 3.47Å; L564-L568 PolarHBondContact O-N 3.34Å; I566-L568 VanDerWaalsContact C-N 3.27Å; I566-L568 PolarHBondContact O-N 3.27Å; L568-K571 CarbonylContact O-C 3.58Å; L568-K571 PolarHBondContact O-N 3.18Å; L568-C572 VanDerWaalsContact O-CB 3.26Å; L568-C572 WeakPolarHBondContact O-CB 3.4Å; L568-C572 PolarHBondContact O-N 2.77Å; L568-C572 PolarHBondContact O-SG 3.05Å
569K77.6Confident73.7Confident141 Ų141105.2 Ų105.261%0.61351%0.512SS*.Hα-helixtrans-67.1-45.5177-172.5165.6-177.71770111.4K565 I566 K571 C572 D573K565-K569 VanDerWaalsContact O-CB 3.29Å; K565-K569 WeakPolarHBondContact O-CB 3.27Å; K565-K569 PolarHBondContact O-N 2.86Å; I566-K569 WeakPolarHBondContact O-CA 3.45Å; I566-K569 WeakPolarHBondContact O-CB 3.33Å; I566-K569 PolarHBondContact O-N 2.94Å; K569-K571 VanDerWaalsContact C-N 3.32Å; K569-K571 PolarHBondContact O-N 3Å; K569-C572 CarbonylContact O-C 3.38Å; K569-C572 WeakPolarHBondContact O-CA 3.44Å; K569-C572 WeakPolarHBondContact O-CB 3.4Å; K569-C572 PolarHBondContact O-N 3.46Å; K569-C572 VanDerWaalsContact O-N 3.08Å; K569-D573 VanDerWaalsContact O-CG 3.24Å; K569-D573 PolarHBondContact O-N 2.78Å
570E76.6Confident73.1Confident126 Ų126106 Ų10659%0.58952%0.518SS*.Hα-helixtrans-61.5-41.3173.6-70.2176.7167.500111.6I566 D573 S574I566-E570 WeakPolarHBondContact O-CG 3.47Å; I566-E570 PolarHBondContact O-N 3.49Å; E570-D573 PolarHBondContact O-N 3.39Å; E570-S574 WeakPolarHBondContact O-CB 3.44Å; E570-S574 PolarHBondContact O-N 2.96Å
571K72.7Confident72.6Confident123 Ų123107.2 Ų107.254%0.53552%0.524SS..Hα-helixtrans-64-40171.1-84.3-174.4178.4176.10111.9E567 L568 K569 S574 Y575E567-K571 VanDerWaalsContact O-CB 3.27Å; E567-K571 WeakPolarHBondContact O-CB 3.49Å; E567-K571 WeakPolarHBondContact O-CG 3.3Å; E567-K571 PolarHBondContact O-N 2.86Å; L568-K571 CarbonylContact O-C 3.58Å; L568-K571 PolarHBondContact O-N 3.18Å; K569-K571 VanDerWaalsContact C-N 3.32Å; K569-K571 PolarHBondContact O-N 3Å; K571-S574 CarbonylContact O-C 3.59Å; K571-S574 PolarHBondContact O-N 2.96Å; K571-Y575 HydrophobicContact CB-CD2 4.12Å; K571-Y575 HydrophobicContact CB-CE2 4.07Å; K571-Y575 HydrophobicContact CD-CE2 4.45Å; K571-Y575 WeakPolarHBondContact O-CA 3.32Å; K571-Y575 WeakPolarHBondContact O-CB 3.34Å; K571-Y575 WeakPolarHBondContact O-CD2 3.44Å; K571-Y575 VanDerWaalsContact O-CG 3.26Å; K571-Y575 PolarHBondContact O-N 3.3Å
572C70.3Confident71.7Confident65 Ų65107.7 Ų107.744%0.43952%0.522SS..Hα-helixtrans-64.1-42.3176.2-81.80000111L568 K569 Y575 E576L568-C572 VanDerWaalsContact O-CB 3.26Å; L568-C572 WeakPolarHBondContact O-CB 3.4Å; L568-C572 PolarHBondContact O-N 2.77Å; L568-C572 PolarHBondContact O-SG 3.05Å; K569-C572 CarbonylContact O-C 3.38Å; K569-C572 WeakPolarHBondContact O-CA 3.44Å; K569-C572 WeakPolarHBondContact O-CB 3.4Å; K569-C572 PolarHBondContact O-N 3.46Å; K569-C572 VanDerWaalsContact O-N 3.08Å; C572-Y575 CarbonylContact O-C 3.59Å; C572-Y575 PolarHBondContact O-N 2.89Å; C572-E576 VanDerWaalsContact O-CB 3.25Å; C572-E576 WeakPolarHBondContact O-CB 3.36Å; C572-E576 PolarHBondContact O-N 3.29Å
573D74.8Confident70.7Confident87 Ų87106.9 Ų106.947%0.46552%0.522SS..Hα-helixtrans-66.3-41.3176.9-62.9-15.4000110.7K569 E570 E576 K577K569-D573 VanDerWaalsContact O-CG 3.24Å; K569-D573 PolarHBondContact O-N 2.78Å; E570-D573 PolarHBondContact O-N 3.39Å; D573-E576 PolarHBondContact O-N 2.68Å; D573-K577 PolarHBondContact O-N 3.42Å; D573-K577 VanDerWaalsContact O-N 3.13Å
574S72.8Confident69.7Low58 Ų58106.5 Ų106.541%0.40653%0.526SS..Hα-helixtrans-62.5-41.6170.9174.20000111.9E570 K571 Q578E570-S574 WeakPolarHBondContact O-CB 3.44Å; E570-S574 PolarHBondContact O-N 2.96Å; K571-S574 CarbonylContact O-C 3.59Å; K571-S574 PolarHBondContact O-N 2.96Å; S574-Q578 WeakPolarHBondContact O-CG 3.48Å; S574-Q578 PolarHBondContact O-N 3.45Å
575Y66.4Low68.7Low126 Ų126106.2 Ų106.249%0.49452%0.522SS..Hα-helixtrans-73.8-31.4179.5-80.5-50.3000111.8K571 C572 K577 Q578 L579K571-Y575 HydrophobicContact CB-CD2 4.12Å; K571-Y575 HydrophobicContact CB-CE2 4.07Å; K571-Y575 HydrophobicContact CD-CE2 4.45Å; K571-Y575 WeakPolarHBondContact O-CA 3.32Å; K571-Y575 WeakPolarHBondContact O-CB 3.34Å; K571-Y575 WeakPolarHBondContact O-CD2 3.44Å; K571-Y575 VanDerWaalsContact O-CG 3.26Å; K571-Y575 PolarHBondContact O-N 3.3Å; C572-Y575 CarbonylContact O-C 3.59Å; C572-Y575 PolarHBondContact O-N 2.89Å; Y575-K577 VanDerWaalsContact C-N 3.33Å; Y575-Q578 CarbonylContact O-C 3.37Å; Y575-Q578 PolarHBondContact O-N 3.12Å; Y575-L579 WeakPolarHBondContact O-CA 3.45Å; Y575-L579 WeakPolarHBondContact O-CB 3.47Å; Y575-L579 PolarHBondContact O-N 2.93Å
576E71.9Confident67.6Low134 Ų134102.9 Ų102.963%0.62651%0.509SS*.Hα-helixtrans-68.3-38.7175.9-170.6171-15700109.7C572 D573 L579 N580C572-E576 VanDerWaalsContact O-CB 3.25Å; C572-E576 WeakPolarHBondContact O-CB 3.36Å; C572-E576 PolarHBondContact O-N 3.29Å; D573-E576 PolarHBondContact O-N 2.68Å; E576-L579 PolarHBondContact O-N 3.14Å; E576-N580 PolarHBondContact O-N 3.42Å
577K70.3Confident66.5Low162 Ų162105.6 Ų105.670%0.70452%0.52SS*.Hα-helixtrans-60.3-48.7168.1-158.3179.5-175.3-176.30111.5D573 Y575 L579 N580 D581D573-K577 PolarHBondContact O-N 3.42Å; D573-K577 VanDerWaalsContact O-N 3.13Å; Y575-K577 VanDerWaalsContact C-N 3.33Å; K577-L579 VanDerWaalsContact C-N 3.31Å; K577-L579 PolarHBondContact O-N 2.91Å; K577-N580 PolarHBondContact O-N 3.07Å; K577-D581 PolarHBondContact O-N 2.85Å
578Q66.5Low65.3Low94 Ų94108 Ų10844%0.43953%0.53SS..Hα-helixtrans-68-27.2175.2-69.1174.625.200113.1S574 Y575 D581 K582S574-Q578 WeakPolarHBondContact O-CG 3.48Å; S574-Q578 PolarHBondContact O-N 3.45Å; Y575-Q578 CarbonylContact O-C 3.37Å; Y575-Q578 PolarHBondContact O-N 3.12Å; Q578-D581 PolarHBondContact O-N 2.89Å; Q578-K582 WeakPolarHBondContact O-CA 3.32Å; Q578-K582 WeakPolarHBondContact O-CB 3.21Å; Q578-K582 WeakPolarHBondContact O-CG 3.28Å; Q578-K582 PolarHBondContact O-N 3.34Å
579L61.7Low64.1Low93 Ų93107.3 Ų107.349%0.48753%0.526SS..Hα-helixtrans-79.5-27.2178.7-115.4146.4000110.2Y575 E576 K577 D581 K582 S583Y575-L579 WeakPolarHBondContact O-CA 3.45Å; Y575-L579 WeakPolarHBondContact O-CB 3.47Å; Y575-L579 PolarHBondContact O-N 2.93Å; E576-L579 PolarHBondContact O-N 3.14Å; K577-L579 VanDerWaalsContact C-N 3.31Å; K577-L579 PolarHBondContact O-N 2.91Å; L579-D581 VanDerWaalsContact C-N 3.34Å; L579-K582 CarbonylContact O-C 3.58Å; L579-S583 VanDerWaalsContact O-CA 3.28Å; L579-S583 WeakPolarHBondContact O-CA 3.28Å; L579-S583 WeakPolarHBondContact O-CB 3.44Å; L579-S583 PolarHBondContact O-N 3.4Å
580N68Low62.7Low111 Ų111109 Ų10959%0.59453%0.529SS*.Hα-helixtrans-67.1-43168.9-157.245.2000109.8E576 K577 N584E576-N580 PolarHBondContact O-N 3.42Å; K577-N580 PolarHBondContact O-N 3.07Å; N580-N584 PolarHBondContact O-N 2.92Å; N580-N584 PolarHBondContact O-ND2 3.31Å
581D67.9Low61.3Low104 Ų104111.1 Ų111.156%0.55654%0.539SS*.Hα-helixtrans-66.7-43.4174.6-62.2-22.9000111.9K577 Q578 L579 E585K577-D581 PolarHBondContact O-N 2.85Å; Q578-D581 PolarHBondContact O-N 2.89Å; L579-D581 VanDerWaalsContact C-N 3.34Å; D581-E585 PolarHBondContact O-N 3.17Å
582K58Low60Low104 Ų104113.7 Ų113.745%0.45255%0.55SS..Hα-helixtrans-78.1-22.8178.2-68.4-74.5169.7-168.60112.9Q578 L579 N584 E585 I586Q578-K582 WeakPolarHBondContact O-CA 3.32Å; Q578-K582 WeakPolarHBondContact O-CB 3.21Å; Q578-K582 WeakPolarHBondContact O-CG 3.28Å; Q578-K582 PolarHBondContact O-N 3.34Å; L579-K582 CarbonylContact O-C 3.58Å; K582-N584 VanDerWaalsContact C-N 3.29Å; K582-E585 HydrophobicContact CD-CB 4.47Å; K582-E585 WeakPolarHBondContact CD-OE2 3.48Å; K582-E585 VanDerWaalsContact CE-OE2 3.32Å; K582-E585 WeakPolarHBondContact CE-OE2 3.47Å; K582-E585 IonicContact NZ-OE2 3.24Å; K582-E585 PolarHBondContact NZ-OE2 3.35Å; K582-E585 CarbonylContact O-C 3.53Å; K582-E585 WeakPolarHBondContact O-CA 3.29Å; K582-E585 PolarHBondContact O-N 2.95Å; K582-I586 HydrophobicContact CB-CD1 4.01Å; K582-I586 HydrophobicContact CB-CG1 4.42Å; K582-I586 WeakPolarHBondContact O-CA 3.28Å; K582-I586 WeakPolarHBondContact O-CB 3.43Å; K582-I586 WeakPolarHBondContact O-CG1 3.44Å; K582-I586 PolarHBondContact O-N 3.25Å
583S57.9Low58.6Low56 Ų56115.4 Ų115.439%0.39255%0.554SS.*Hα-helixtrans-67.6-36.9174.8179.90000109.8L579 E585 I586 Q587L579-S583 VanDerWaalsContact O-CA 3.28Å; L579-S583 WeakPolarHBondContact O-CA 3.28Å; L579-S583 WeakPolarHBondContact O-CB 3.44Å; L579-S583 PolarHBondContact O-N 3.4Å; S583-E585 VanDerWaalsContact C-N 3.26Å; S583-E585 PolarHBondContact O-N 3.29Å; S583-I586 PolarHBondContact O-N 2.96Å; S583-Q587 PolarHBondContact O-N 3.34Å
584N55Low57Low112 Ų112120.1 Ų120.160%0.59957%0.571SS**Hα-helixtrans-62.6-33.5168.6-63.9-26.8000111.7N580 K582N580-N584 PolarHBondContact O-N 2.92Å; N580-N584 PolarHBondContact O-ND2 3.31Å; K582-N584 VanDerWaalsContact C-N 3.29Å
585E54Low55.4Low100 Ų100125.8 Ų125.847%0.46759%0.591SS.*Hα-helixtrans-85-28.5176.3-112.4-179.8-178.700114.6D581 K582 S583 H588 I589D581-E585 PolarHBondContact O-N 3.17Å; K582-E585 HydrophobicContact CD-CB 4.47Å; K582-E585 WeakPolarHBondContact CD-OE2 3.48Å; K582-E585 VanDerWaalsContact CE-OE2 3.32Å; K582-E585 WeakPolarHBondContact CE-OE2 3.47Å; K582-E585 IonicContact NZ-OE2 3.24Å; K582-E585 PolarHBondContact NZ-OE2 3.35Å; K582-E585 CarbonylContact O-C 3.53Å; K582-E585 WeakPolarHBondContact O-CA 3.29Å; K582-E585 PolarHBondContact O-N 2.95Å; S583-E585 VanDerWaalsContact C-N 3.26Å; S583-E585 PolarHBondContact O-N 3.29Å; E585-H588 WeakPolarHBondContact O-CA 3.42Å; E585-H588 WeakPolarHBondContact O-CB 3.35Å; E585-H588 PolarHBondContact O-N 2.97Å; E585-H588 VanDerWaalsContact O-N 3.14Å; E585-I589 PolarHBondContact O-N 2.97Å
586I52Low54.1Low50 Ų50124.2 Ų124.226%0.25659%0.594SS.*Hα-helixtrans-91.4-18.2-173.7-73.8175.1000110.8K582 S583 H588 I589 R590K582-I586 HydrophobicContact CB-CD1 4.01Å; K582-I586 HydrophobicContact CB-CG1 4.42Å; K582-I586 WeakPolarHBondContact O-CA 3.28Å; K582-I586 WeakPolarHBondContact O-CB 3.43Å; K582-I586 WeakPolarHBondContact O-CG1 3.44Å; K582-I586 PolarHBondContact O-N 3.25Å; S583-I586 PolarHBondContact O-N 2.96Å; I586-H588 PolarHBondContact O-N 3.28Å; I586-I589 PolarHBondContact O-N 3.26Å; I586-R590 HydrophobicContact CG2-CB 4.43Å; I586-R590 HydrophobicContact CG2-CG 3.54Å; I586-R590 VanDerWaalsContact CG2-NE 3.34Å; I586-R590 VanDerWaalsContact O-CB 3.27Å; I586-R590 WeakPolarHBondContact O-CB 3.49Å; I586-R590 PolarHBondContact O-N 3.14Å
587Q52.9Low52.5Low162 Ų162125.3 Ų125.376%0.75760%0.599SS**Hα-helixtrans-54.9-30.1156.3-171.3172.8-3.700110.6S583S583-Q587 PolarHBondContact O-N 3.34Å
588H49.4Very low51.1Low153 Ų153125.1 Ų125.171%0.70860%0.604SS**Hα-helixtrans-85.3-28177.1-117-31.1000114.7E585 I586E585-H588 WeakPolarHBondContact O-CA 3.42Å; E585-H588 WeakPolarHBondContact O-CB 3.35Å; E585-H588 PolarHBondContact O-N 2.97Å; E585-H588 VanDerWaalsContact O-N 3.14Å; I586-H588 PolarHBondContact O-N 3.28Å
589I48.8Very low49.8Very low92 Ų92130 Ų13047%0.47262%0.624SS.*Hα-helixtrans-101.7-20.2-175.1-61.9173.9000113.3E585 I586 Q591 K592 L593E585-I589 PolarHBondContact O-N 2.97Å; I586-I589 PolarHBondContact O-N 3.26Å; I589-Q591 PolarHBondContact O-N 2.98Å; I589-Q591 VanDerWaalsContact O-N 3.16Å; I589-K592 PolarHBondContact O-N 3.34Å; I589-L593 PolarHBondContact O-N 3.41Å
590R48.7Very low48.4Very low177 Ų177133.3 Ų133.367%0.66864%0.641SS**THydrogen-bonded Turntrans-65.9-13.4173.9-87.9172.5-176.9164.61.5114.5I586 K592I586-R590 HydrophobicContact CG2-CB 4.43Å; I586-R590 HydrophobicContact CG2-CG 3.54Å; I586-R590 VanDerWaalsContact CG2-NE 3.34Å; I586-R590 VanDerWaalsContact O-CB 3.27Å; I586-R590 WeakPolarHBondContact O-CB 3.49Å; I586-R590 PolarHBondContact O-N 3.14Å; R590-K592 VanDerWaalsContact C-N 3.34Å
591Q47.7Very low46.9Very low171 Ų171137.4 Ų137.480%0.79965%0.654SS**THydrogen-bonded Turntrans-74.4-22.4164.9-83.3-177.7-17.200113.2I589I589-Q591 PolarHBondContact O-N 2.98Å; I589-Q591 VanDerWaalsContact O-N 3.16Å
592K45.8Very low45.6Very low176 Ų176142.2 Ų142.277%0.76567%0.673SS**THydrogen-bonded Turntrans-104-15.9-174.4-71.8-170.8176.1-1800115.5I589 R590I589-K592 PolarHBondContact O-N 3.34Å; R590-K592 VanDerWaalsContact C-N 3.34Å
593L39.9Very low44.8Very low101 Ų101142.5 Ų142.553%0.52970%0.695SS.*SBendtrans-102.91.6-176.4-142.9106.3000115.7I589 Q595I589-L593 PolarHBondContact O-N 3.41Å; L593-Q595 PolarHBondContact O-N 3.04Å
594K41.9Very low44Very low187 Ų187146.8 Ų146.881%0.81371%0.713SS**THydrogen-bonded Turntrans-76.31.4174.8-143.4176.9-174.7-1790113.8
595Q39.5Very low43.4Very low177 Ų177148.9 Ų148.983%0.82773%0.725SS**THydrogen-bonded Turntrans-113.9-1.4-174.2-96.2177.7-1.200115.7L593L593-Q595 PolarHBondContact O-N 3.04Å
596T39.1Very low43.1Very low92 Ų92153.4 Ų153.456%0.56474%0.743SS**SBendtrans-123.3-2.3-17750.10000115.4I598 K599T596-I598 PolarHBondContact O-N 2.89Å; T596-K599 PolarHBondContact O-N 3.49Å
597E37.5Very low43.3Very low158 Ų158155.2 Ų155.274%0.73877%0.765SS**THydrogen-bonded Turntrans-67.92.5171.5-76.8-179.2149.800114.9
598I41Very low43.5Very low158 Ų158152.5 Ų152.581%0.8176%0.76SS**THydrogen-bonded Turntrans-84.1-14.5173.3-67.4176.7000112.4T596 L600T596-I598 PolarHBondContact O-N 2.89Å; I598-L600 PolarHBondContact O-N 3.43Å
599K39.9Very low43.8Very low197 Ų197150 Ų15086%0.85776%0.755SS**SBendtrans-96.526.2-172.6-70.1-169.7176.1-177.60116.3T596T596-K599 PolarHBondContact O-N 3.49Å
600L32.2Very low44.1Very low161 Ų161151.9 Ų151.984%0.84377%0.766SS**SBendtrans-138.448.2-178.6-143.3154.8000114.1I598I598-L600 PolarHBondContact O-N 3.43Å
601K36.8Very low44.8Very low198 Ų198150.5 Ų150.586%0.86177%0.767SS**  trans-140.119.3178.6-124.1-179.1-175.7-178.60119.3
602E39.6Very low45.4Very low205 Ų205149.8 Ų149.896%0.95876%0.764SS**SBendtrans-124.220.6-177.8-73-173.8159.100117.2
603A40.4Very low46.2Very low110 Ų110147.6 Ų147.691%0.90976%0.76SS**  trans-113.946.9177.600000114.5
604N42.5Very low47.4Very low146 Ų146145.5 Ų145.578%0.78176%0.757SS**  trans-123.834.2-171.6-166.743000116.7
605N41.1Very low48.7Very low156 Ų156141.3 Ų141.383%0.83474%0.743SS**  trans-13250-173.9-85.7-15.9000116.7
606K48.9Very low50.1Low194 Ų194136.7 Ų136.784%0.84373%0.731SS**SBendtrans-125.5-2.2171.2-156.4170.9177.4-178.10116.6
607A55.1Low51.8Low89 Ų89137.8 Ų137.874%0.73673%0.733SS**SBendtrans-90.8-4.2-177.200000115.5
608T58.5Low53.5Low104 Ų104137.3 Ų137.364%0.63873%0.729SS**SBendtrans-90.5-12.5-172.932.70000115.3
609V54.8Low55.2Low100 Ų100134.5 Ų134.561%0.60672%0.719SS**SBendtrans-86.1-30.2-176.71780000112.9Q611V609-Q611 PolarHBondContact O-N 2.93Å
610D55.1Low56.9Low132 Ų132129.3 Ų129.371%0.70670%0.704SS**Hα-helixtrans-75.7-21.6-175.1-66.6-27.2000113.9
611Q63.4Low59.1Low148 Ų148127.8 Ų127.869%0.69269%0.692SS**Hα-helixtrans-74.2-28-179.3-163.489.523.600112.9V609V609-Q611 PolarHBondContact O-N 2.93Å
612Q61.3Low61.1Low157 Ų157125 Ų12573%0.73468%0.68SS**Hα-helixtrans-80.2-29.3-175.5-73-176.4-19.900112.9
613L61.2Low62.8Low130 Ų130118.5 Ų118.568%0.68166%0.657SS**Hα-helixtrans-72.7-31.2-177.9-132.5118.3000112.8N615L613-N615 PolarHBondContact O-N 3.36Å
614A65.6Low64.6Low57 Ų57116.5 Ų116.547%0.47163%0.634SS.*Hα-helixtrans-72.7-24.9-17800000114.3
615N70Confident66.4Low98 Ų98113.7 Ų113.752%0.52462%0.619SS.*Hα-helixtrans-82-30.1-177.6-74-16.7000112.8L613 T619L613-N615 PolarHBondContact O-N 3.36Å; N615-T619 PolarHBondContact O-OG1 2.91Å
616S68.4Low68.3Low80 Ų80110.7 Ų110.756%0.55960%0.603SS**Hα-helixtrans-68.8-38-178.6-155.60000112.7K618 T619S616-K618 PolarHBondContact O-N 3.4Å; S616-T619 PolarHBondContact O-N 3.45Å
617N73.9Confident69.7Low116 Ų116107.7 Ų107.762%0.6259%0.591SS**Hα-helixtrans-67-33.8-178.6-77.5-12.3000113.6T619 V620 E621N617-T619 VanDerWaalsContact C-N 3.29Å; N617-T619 PolarHBondContact O-N 2.96Å; N617-V620 PolarHBondContact O-N 3.33Å; N617-E621 PolarHBondContact O-N 3.49Å
618K74.7Confident71Confident148 Ų148109.6 Ų109.664%0.64358%0.583SS**Hα-helixtrans-66.3-32.1178.6-74.5-180178.1174.50112.7S616 F622S616-K618 PolarHBondContact O-N 3.4Å; K618-F622 PolarHBondContact O-N 2.93Å
619T76.4Confident72Confident98 Ų98110.7 Ų110.760%0.60158%0.581SS**Hα-helixtrans-72.8-31.8-177.3-32.70000112.2N615 S616 N617 S623N615-T619 PolarHBondContact O-OG1 2.91Å; S616-T619 PolarHBondContact O-N 3.45Å; N617-T619 VanDerWaalsContact C-N 3.29Å; N617-T619 PolarHBondContact O-N 2.96Å; T619-S623 PolarHBondContact O-OG 3.26Å; T619-S623 VanDerWaalsContact O-OG 3.06Å
620V74.8Confident73Confident88 Ų88109.6 Ų109.653%0.53358%0.578SS.*Hα-helixtrans-74.6-38.7178.4177.20000111.4N617 F622 S623 T624N617-V620 PolarHBondContact O-N 3.33Å; V620-F622 PolarHBondContact O-N 3.09Å; V620-S623 PolarHBondContact O-N 3.28Å; V620-S623 PolarHBondContact O-OG 2.86Å; V620-S623 VanDerWaalsContact O-OG 3.08Å; V620-T624 PolarHBondContact O-N 2.9Å
621E77.7Confident74.3Confident129 Ų129109.2 Ų109.260%0.60357%0.572SS**Hα-helixtrans-66.5-38.2-179.4-160.9172.6-165.800111.9N617 S623 T624 N625N617-E621 PolarHBondContact O-N 3.49Å; E621-S623 PolarHBondContact O-N 2.92Å; E621-T624 PolarHBondContact O-N 2.95Å; E621-T624 PolarHBondContact O-OG1 2.8Å; E621-N625 PolarHBondContact O-N 3.37Å; E621-N625 PolarHBondContact O-ND2 3.26Å
622F79.1Confident75.2Confident139 Ų139106.8 Ų106.861%0.6156%0.563SS**Hα-helixtrans-63.6-42.5178-175.3-105.6000113.2K618 V620 N625 L626K618-F622 PolarHBondContact O-N 2.93Å; V620-F622 PolarHBondContact O-N 3.09Å; F622-N625 PolarHBondContact O-N 2.99Å; F622-L626 HydrophobicContact CD1-CD1 3.86Å; F622-L626 HydrophobicContact CE1-CD1 3.3Å; F622-L626 HydrophobicContact CE2-CD1 4.49Å; F622-L626 HydrophobicContact CZ-CD1 3.67Å; F622-L626 PolarHBondContact O-N 3.4Å
623S76.3Confident76.2Confident69 Ų69105.4 Ų105.448%0.48356%0.556SS.*Hα-helixtrans-69.6-32.4-179.935.10000112.7T619 V620 E621 H627T619-S623 PolarHBondContact O-OG 3.26Å; T619-S623 VanDerWaalsContact O-OG 3.06Å; V620-S623 PolarHBondContact O-N 3.28Å; V620-S623 PolarHBondContact O-OG 2.86Å; V620-S623 VanDerWaalsContact O-OG 3.08Å; E621-S623 PolarHBondContact O-N 2.92Å; S623-H627 PolarHBondContact O-N 3.26Å
624T78.1Confident77.2Confident69 Ų69105.5 Ų105.542%0.42355%0.551SS.*Hα-helixtrans-67.7-33.2174.458.90000113.7V620 E621 K628V620-T624 PolarHBondContact O-N 2.9Å; E621-T624 PolarHBondContact O-N 2.95Å; E621-T624 PolarHBondContact O-OG1 2.8Å; T624-K628 PolarHBondContact O-N 2.9Å
625N79.5Confident77.9Confident87 Ų87106.1 Ų106.147%0.46555%0.552SS.*Hα-helixtrans-72.7-41.7178.3-72.5-28.3000112E621 F622 H627 K628 E629E621-N625 PolarHBondContact O-N 3.37Å; E621-N625 PolarHBondContact O-ND2 3.26Å; F622-N625 PolarHBondContact O-N 2.99Å; N625-H627 VanDerWaalsContact C-N 3.27Å; N625-H627 PolarHBondContact O-N 2.84Å; N625-K628 PolarHBondContact O-N 3.22Å; N625-E629 PolarHBondContact O-N 3.4Å
626L80.8Confident78.6Confident92 Ų92108 Ų10848%0.48256%0.555SS.*Hα-helixtrans-58.9-37.2174.9-94159000112.7F622 E629 S630F622-L626 HydrophobicContact CD1-CD1 3.86Å; F622-L626 HydrophobicContact CE1-CD1 3.3Å; F622-L626 HydrophobicContact CE2-CD1 4.49Å; F622-L626 HydrophobicContact CZ-CD1 3.67Å; F622-L626 PolarHBondContact O-N 3.4Å; L626-E629 PolarHBondContact O-N 3.44Å; L626-S630 PolarHBondContact O-N 2.92Å
627H77.9Confident79.2Confident131 Ų131109.6 Ų109.661%0.60656%0.557SS**Hα-helixtrans-67.4-42.3179.9-16248.2000112.6S623 N625 E629 S630 E631S623-H627 PolarHBondContact O-N 3.26Å; N625-H627 VanDerWaalsContact C-N 3.27Å; N625-H627 PolarHBondContact O-N 2.84Å; H627-E629 VanDerWaalsContact C-N 3.32Å; H627-E629 PolarHBondContact O-N 3.37Å; H627-S630 PolarHBondContact O-N 3.38Å; H627-E631 PolarHBondContact O-N 2.93Å
628K83.4Confident79.8Confident129 Ų129109.1 Ų109.156%0.56155%0.551SS**Hα-helixtrans-62.2-39.5176.5-70.5177.1-179.5174.20112.3T624 N625 S630 E631 I632T624-K628 PolarHBondContact O-N 2.9Å; N625-K628 PolarHBondContact O-N 3.22Å; K628-S630 VanDerWaalsContact C-N 3.29Å; K628-S630 PolarHBondContact O-N 3.32Å; K628-E631 PolarHBondContact O-N 3.46Å; K628-I632 WeakPolarHBondContact O-CG1 3.5Å; K628-I632 PolarHBondContact O-N 2.97Å
629E79.6Confident80.2Confident128 Ų128107.8 Ų107.860%0.59855%0.547SS*.Hα-helixtrans-66.3-35.4-179.5-147.1161.1-151.200111.6N625 L626 H627 Q633N625-E629 PolarHBondContact O-N 3.4Å; L626-E629 PolarHBondContact O-N 3.44Å; H627-E629 VanDerWaalsContact C-N 3.32Å; H627-E629 PolarHBondContact O-N 3.37Å; E629-Q633 PolarHBondContact O-N 3.03Å
630S76.6Confident80.7Confident77 Ų77108.7 Ų108.754%0.53854%0.544SS..Hα-helixtrans-69.6-38.5175.9-149.20000113L626 H627 K628 Q633 K634L626-S630 PolarHBondContact O-N 2.92Å; H627-S630 PolarHBondContact O-N 3.38Å; K628-S630 VanDerWaalsContact C-N 3.29Å; K628-S630 PolarHBondContact O-N 3.32Å; S630-Q633 PolarHBondContact O-N 3.25Å; S630-K634 PolarHBondContact O-N 3.03Å; S630-K634 VanDerWaalsContact O-N 3.08Å
631E81Confident81.2Confident123 Ų123109.1 Ų109.158%0.57554%0.543SS*.Hα-helixtrans-64.8-38.7174.8-83.8-165.214100113.1H627 K628 Q633 K634 S635H627-E631 PolarHBondContact O-N 2.93Å; K628-E631 PolarHBondContact O-N 3.46Å; E631-Q633 VanDerWaalsContact C-N 3.32Å; E631-Q633 PolarHBondContact O-N 2.98Å; E631-K634 PolarHBondContact O-N 3.2Å; E631-S635 PolarHBondContact O-N 3.34Å; E631-S635 PolarHBondContact O-OG 3.4Å
632I82.3Confident81.6Confident98 Ų98106.4 Ų106.450%0.50354%0.538SS..Hα-helixtrans-63.9-40.9177.2-67.5167.8000110.4K628 S635 K636K628-I632 WeakPolarHBondContact O-CG1 3.5Å; K628-I632 PolarHBondContact O-N 2.97Å; I632-S635 PolarHBondContact O-N 3.43Å; I632-K636 WeakPolarHBondContact O-CG 3.42Å; I632-K636 PolarHBondContact O-N 3.23Å
633Q82.6Confident81.9Confident128 Ų128103.8 Ų103.860%0.59853%0.528SS*.Hα-helixtrans-66.6-40.1176.9-72.4-165.7-5.500112.5E629 S630 E631 S635 K636 L637E629-Q633 PolarHBondContact O-N 3.03Å; S630-Q633 PolarHBondContact O-N 3.25Å; E631-Q633 VanDerWaalsContact C-N 3.32Å; E631-Q633 PolarHBondContact O-N 2.98Å; Q633-S635 VanDerWaalsContact C-N 3.35Å; Q633-S635 PolarHBondContact O-N 2.91Å; Q633-K636 PolarHBondContact O-N 2.84Å; Q633-L637 PolarHBondContact O-N 3.37Å; Q633-L637 VanDerWaalsContact O-N 3.15Å
634K82.6Confident82.4Confident131 Ų131105.4 Ų105.457%0.5753%0.531SS*.Hα-helixtrans-59.3-45.3175.7-174.6-177.7170.9-167.80111.8S630 E631 K636 L637 E638S630-K634 PolarHBondContact O-N 3.03Å; S630-K634 VanDerWaalsContact O-N 3.08Å; E631-K634 PolarHBondContact O-N 3.2Å; K634-K636 VanDerWaalsContact C-N 3.32Å; K634-K636 PolarHBondContact O-N 3.41Å; K634-L637 PolarHBondContact O-N 2.89Å; K634-E638 WeakPolarHBondContact CE-OE1 3.48Å; K634-E638 IonicContact NZ-OE1 2.87Å; K634-E638 PolarHBondContact O-N 3.18Å; K634-E638 VanDerWaalsContact O-N 3.07Å
635S79.6Confident82.8Confident71 Ų71108 Ų10850%0.49754%0.538SS..Hα-helixtrans-61.4-39.1179.3-56.80000112.4E631 I632 Q633 E638 E639E631-S635 PolarHBondContact O-N 3.34Å; E631-S635 PolarHBondContact O-OG 3.4Å; I632-S635 PolarHBondContact O-N 3.43Å; Q633-S635 VanDerWaalsContact C-N 3.35Å; Q633-S635 PolarHBondContact O-N 2.91Å; S635-E638 PolarHBondContact O-N 3.45Å; S635-E639 PolarHBondContact O-N 2.99Å; S635-E639 VanDerWaalsContact O-N 3.13Å
636K84.3Confident83.1Confident137 Ų137110 Ų11060%0.59654%0.544SS*.Hα-helixtrans-66.1-38.7176.4-71.8178179.2-179.50112.8I632 Q633 K634 E639 H640I632-K636 WeakPolarHBondContact O-CG 3.42Å; I632-K636 PolarHBondContact O-N 3.23Å; Q633-K636 PolarHBondContact O-N 2.84Å; K634-K636 VanDerWaalsContact C-N 3.32Å; K634-K636 PolarHBondContact O-N 3.41Å; K636-E639 PolarHBondContact O-N 3.3Å; K636-H640 PolarHBondContact O-N 3.4Å; K636-H640 VanDerWaalsContact O-N 3.14Å
637L81.9Confident83.4Confident114 Ų114111 Ų11160%0.59755%0.546SS*.Hα-helixtrans-67.8-38.1177.5-72.5171000111.7Q633 K634 H640 I641Q633-L637 PolarHBondContact O-N 3.37Å; Q633-L637 VanDerWaalsContact O-N 3.15Å; K634-L637 PolarHBondContact O-N 2.89Å; L637-H640 PolarHBondContact O-N 3Å; L637-I641 VanDerWaalsContact O-CG1 3.32Å; L637-I641 WeakPolarHBondContact O-CG1 3.3Å; L637-I641 PolarHBondContact O-N 3.31Å
638E86.6Confident83.9Confident105 Ų105109.6 Ų109.649%0.49154%0.543SS..Hα-helixtrans-64.3-40.7175.7-72.8173.7175.300112.2K634 S635 I641 S642K634-E638 WeakPolarHBondContact CE-OE1 3.48Å; K634-E638 IonicContact NZ-OE1 2.87Å; K634-E638 PolarHBondContact O-N 3.18Å; K634-E638 VanDerWaalsContact O-N 3.07Å; S635-E638 PolarHBondContact O-N 3.45Å; E638-I641 PolarHBondContact O-N 2.92Å; E638-S642 PolarHBondContact O-N 2.78Å; E638-S642 VanDerWaalsContact O-N 3.11Å
639E84Confident84.1Confident121 Ų121107.8 Ų107.857%0.56554%0.539SS*.Hα-helixtrans-61.1-44173.9-171.6179.8179.400111.8S635 K636 I641 S642 Q643S635-E639 PolarHBondContact O-N 2.99Å; S635-E639 VanDerWaalsContact O-N 3.13Å; K636-E639 PolarHBondContact O-N 3.3Å; E639-I641 PolarHBondContact O-N 2.92Å; E639-S642 WeakPolarHBondContact O-CB 3.46Å; E639-S642 PolarHBondContact O-N 3.41Å; E639-Q643 WeakPolarHBondContact O-CG 3.35Å; E639-Q643 PolarHBondContact O-N 2.83Å
640H85.9Confident84.4Confident117 Ų117107.3 Ų107.354%0.54254%0.537SS..Hα-helixtrans-67.3-36.8-180-128.612000112.8K636 L637 S642 Q643 L644K636-H640 PolarHBondContact O-N 3.4Å; K636-H640 VanDerWaalsContact O-N 3.14Å; L637-H640 PolarHBondContact O-N 3Å; H640-S642 VanDerWaalsContact C-N 3.34Å; H640-Q643 PolarHBondContact ND1-OE1 3.28Å; H640-Q643 PolarHBondContact O-N 2.98Å; H640-L644 WeakPolarHBondContact O-CG 3.35Å; H640-L644 PolarHBondContact O-N 3.25Å
641I84.9Confident84.9Confident96 Ų96108.1 Ų108.149%0.49254%0.538SS..Hα-helixtrans-63.5-41173.7-70.4167.7000110.7L637 E638 E639 L644 Q645L637-I641 VanDerWaalsContact O-CG1 3.32Å; L637-I641 WeakPolarHBondContact O-CG1 3.3Å; L637-I641 PolarHBondContact O-N 3.31Å; E638-I641 PolarHBondContact O-N 2.92Å; E639-I641 PolarHBondContact O-N 2.92Å; I641-L644 PolarHBondContact O-N 2.86Å; I641-Q645 VanDerWaalsContact O-CG 3.32Å; I641-Q645 WeakPolarHBondContact O-CG 3.26Å; I641-Q645 PolarHBondContact O-N 3.4Å
642S86.4Confident85.2Confident73 Ų73107.9 Ų107.951%0.5154%0.537SS..Hα-helixtrans-62.2-42.8175-98.50000112.7E638 E639 H640 Q645 Q646E638-S642 PolarHBondContact O-N 2.78Å; E638-S642 VanDerWaalsContact O-N 3.11Å; E639-S642 WeakPolarHBondContact O-CB 3.46Å; E639-S642 PolarHBondContact O-N 3.41Å; H640-S642 VanDerWaalsContact C-N 3.34Å; S642-Q645 PolarHBondContact O-N 3.41Å; S642-Q646 PolarHBondContact O-N 3.34Å; S642-Q646 VanDerWaalsContact O-N 3.11Å
643Q86.2Confident85.6Confident83 Ų83109.7 Ų109.739%0.38854%0.541SS..Hα-helixtrans-61.7-48.3177.1-71.8169.8-6.400111.7E639 H640 Q645 Q646 E647E639-Q643 WeakPolarHBondContact O-CG 3.35Å; E639-Q643 PolarHBondContact O-N 2.83Å; H640-Q643 PolarHBondContact ND1-OE1 3.28Å; H640-Q643 PolarHBondContact O-N 2.98Å; Q643-Q645 VanDerWaalsContact C-N 3.3Å; Q643-Q645 PolarHBondContact O-N 2.85Å; Q643-Q646 WeakPolarHBondContact O-CB 3.4Å; Q643-Q646 PolarHBondContact O-N 2.73Å; Q643-Q646 VanDerWaalsContact O-N 3.09Å; Q643-E647 PolarHBondContact O-N 3.36Å
644L85.4Confident86Confident104 Ų104109.8 Ų109.855%0.54554%0.543SS..Hα-helixtrans-62.4-35.3178.3-74170.8000112.8H640 I641 Q646 L648H640-L644 WeakPolarHBondContact O-CG 3.35Å; H640-L644 PolarHBondContact O-N 3.25Å; I641-L644 PolarHBondContact O-N 2.86Å; L644-Q646 VanDerWaalsContact C-N 3.34Å; L644-L648 WeakPolarHBondContact O-CB 3.44Å; L644-L648 PolarHBondContact O-N 2.89Å
645Q86.4Confident86.3Confident123 Ų123107.6 Ų107.658%0.57554%0.538SS*.Hα-helixtrans-66.5-36.4174.7-76.6177.2-13.400112.3I641 S642 Q643 L649I641-Q645 VanDerWaalsContact O-CG 3.32Å; I641-Q645 WeakPolarHBondContact O-CG 3.26Å; I641-Q645 PolarHBondContact O-N 3.4Å; S642-Q645 PolarHBondContact O-N 3.41Å; Q643-Q645 VanDerWaalsContact C-N 3.3Å; Q643-Q645 PolarHBondContact O-N 2.85Å; Q645-L649 PolarHBondContact O-N 2.75Å; Q645-L649 VanDerWaalsContact O-N 3.17Å
646Q86.8Confident86.7Confident128 Ų128113.2 Ų113.260%0.59855%0.548SS*.Hα-helixtrans-70.2-44.2177.3-171163.4-13.600111.7S642 Q643 L644 L648 L649 E650S642-Q646 PolarHBondContact O-N 3.34Å; S642-Q646 VanDerWaalsContact O-N 3.11Å; Q643-Q646 WeakPolarHBondContact O-CB 3.4Å; Q643-Q646 PolarHBondContact O-N 2.73Å; Q643-Q646 VanDerWaalsContact O-N 3.09Å; L644-Q646 VanDerWaalsContact C-N 3.34Å; Q646-L648 VanDerWaalsContact C-N 3.34Å; Q646-L648 PolarHBondContact O-N 2.86Å; Q646-L649 WeakPolarHBondContact O-CB 3.22Å; Q646-L649 PolarHBondContact O-N 3.26Å; Q646-E650 PolarHBondContact O-N 2.81Å; Q646-E650 VanDerWaalsContact O-N 3.09Å
647E87Confident87Confident113 Ų113111.4 Ų111.453%0.52854%0.542SS..Hα-helixtrans-59.9-43173.9-71176.8-17500111.7Q643 L649 E650 V651Q643-E647 PolarHBondContact O-N 3.36Å; E647-L649 VanDerWaalsContact C-N 3.29Å; E647-L649 PolarHBondContact O-N 3.25Å; E647-E650 PolarHBondContact O-N 2.89Å; E647-V651 WeakPolarHBondContact O-CG2 3.23Å; E647-V651 PolarHBondContact O-N 3.49Å
648L88.1Confident87.3Confident103 Ų103110.2 Ų110.254%0.53954%0.536SS..Hα-helixtrans-60-39.8176.6-17568000111.9L644 Q646 Q652L644-L648 WeakPolarHBondContact O-CB 3.44Å; L644-L648 PolarHBondContact O-N 2.89Å; Q646-L648 VanDerWaalsContact C-N 3.34Å; Q646-L648 PolarHBondContact O-N 2.86Å; L648-Q652 WeakPolarHBondContact O-CB 3.24Å; L648-Q652 VanDerWaalsContact O-CG 3.3Å; L648-Q652 WeakPolarHBondContact O-CG 3.44Å; L648-Q652 PolarHBondContact O-N 3.45Å
649L87.7Confident87.4Confident91 Ų91109.5 Ų109.548%0.47653%0.532SS..Hα-helixtrans-68-37178.6-162.3111.9000112Q645 Q646 E647 Q652 K653Q645-L649 PolarHBondContact O-N 2.75Å; Q645-L649 VanDerWaalsContact O-N 3.17Å; Q646-L649 WeakPolarHBondContact O-CB 3.22Å; Q646-L649 PolarHBondContact O-N 3.26Å; E647-L649 VanDerWaalsContact C-N 3.29Å; E647-L649 PolarHBondContact O-N 3.25Å; L649-Q652 PolarHBondContact O-N 3.2Å; L649-K653 WeakPolarHBondContact O-CG 3.34Å; L649-K653 PolarHBondContact O-N 3.16Å; L649-K653 VanDerWaalsContact O-N 3.09Å
650E86.6Confident87.5Confident118 Ų118107.5 Ų107.555%0.55153%0.525SS*.Hα-helixtrans-67.2-44.3175.1-73.6-175.5-179.800112Q646 E647 Q652 K653 M654Q646-E650 PolarHBondContact O-N 2.81Å; Q646-E650 VanDerWaalsContact O-N 3.09Å; E647-E650 PolarHBondContact O-N 2.89Å; E650-Q652 VanDerWaalsContact C-N 3.29Å; E650-Q652 PolarHBondContact O-N 3.09Å; E650-K653 PolarHBondContact O-N 3.09Å; E650-K653 VanDerWaalsContact O-N 3.16Å; E650-M654 PolarHBondContact O-N 3.38Å
651V86.2Confident87.7Confident94 Ų94105.2 Ų105.257%0.5752%0.517SS*.Hα-helixtrans-61.4-39175.2173.40000111.3E647 M654 N655E647-V651 WeakPolarHBondContact O-CG2 3.23Å; E647-V651 PolarHBondContact O-N 3.49Å; V651-M654 PolarHBondContact O-N 3.48Å; V651-N655 WeakPolarHBondContact O-CB 3.39Å; V651-N655 PolarHBondContact O-N 3.03Å
652Q88.3Confident87.8Confident117 Ų117105.1 Ų105.155%0.54752%0.516SS..Hα-helixtrans-64.9-39.3175.4-76.4178.5-4.300112.8L648 L649 E650 R656L648-Q652 WeakPolarHBondContact O-CB 3.24Å; L648-Q652 VanDerWaalsContact O-CG 3.3Å; L648-Q652 WeakPolarHBondContact O-CG 3.44Å; L648-Q652 PolarHBondContact O-N 3.45Å; L649-Q652 PolarHBondContact O-N 3.2Å; E650-Q652 VanDerWaalsContact C-N 3.29Å; E650-Q652 PolarHBondContact O-N 3.09Å; Q652-R656 WeakPolarHBondContact O-CB 3.48Å; Q652-R656 PolarHBondContact O-N 3.21Å
653K89.7Confident88Confident137 Ų137107.9 Ų107.960%0.59652%0.516SS*.Hα-helixtrans-64.4-44.9173.7-74.4175.4-178.8174.90111.4L649 E650 N655 R656 Q657L649-K653 WeakPolarHBondContact O-CG 3.34Å; L649-K653 PolarHBondContact O-N 3.16Å; L649-K653 VanDerWaalsContact O-N 3.09Å; E650-K653 PolarHBondContact O-N 3.09Å; E650-K653 VanDerWaalsContact O-N 3.16Å; K653-N655 PolarHBondContact O-N 3.02Å; K653-R656 PolarHBondContact O-N 3.27Å; K653-Q657 PolarHBondContact O-N 2.89Å
654M90.5Very high88.1Confident129 Ų129107.2 Ų107.264%0.63552%0.515SS*.Hα-helixtrans-60-46177.2-163.686.2179.700111.3E650 V651 R656 Q657 L658E650-M654 PolarHBondContact O-N 3.38Å; V651-M654 PolarHBondContact O-N 3.48Å; M654-R656 VanDerWaalsContact C-N 3.33Å; M654-R656 PolarHBondContact O-N 2.86Å; M654-Q657 PolarHBondContact O-N 3.29Å; M654-L658 WeakPolarHBondContact O-CG 3.5Å; M654-L658 PolarHBondContact O-N 2.87Å
655N90Very high88.1Confident85 Ų85107.6 Ų107.646%0.45552%0.517SS..Hα-helixtrans-62.8-40.1177.8-166.2-25.2000111.4V651 K653 Q657 L658 Q659V651-N655 WeakPolarHBondContact O-CB 3.39Å; V651-N655 PolarHBondContact O-N 3.03Å; K653-N655 PolarHBondContact O-N 3.02Å; N655-Q657 VanDerWaalsContact C-N 3.33Å; N655-Q657 PolarHBondContact O-N 2.95Å; N655-L658 PolarHBondContact O-N 3.44Å; N655-Q659 WeakPolarHBondContact O-CG 3.35Å; N655-Q659 PolarHBondContact O-N 2.97Å; N655-Q659 PolarHBondContact OD1-NE2 2.91Å
656R88.9Confident88.3Confident189 Ų189107.4 Ų107.471%0.71352%0.516SS*.Hα-helixtrans-65.2-36.2175.7-162.6167.7-175.5140.7-1.3112.5Q652 K653 M654 L660Q652-R656 WeakPolarHBondContact O-CB 3.48Å; Q652-R656 PolarHBondContact O-N 3.21Å; K653-R656 PolarHBondContact O-N 3.27Å; M654-R656 VanDerWaalsContact C-N 3.33Å; M654-R656 PolarHBondContact O-N 2.86Å; R656-L660 WeakPolarHBondContact O-CG 3.35Å; R656-L660 PolarHBondContact O-N 2.94Å
657Q89Confident88.3Confident99 Ų99108.8 Ų108.846%0.46352%0.516SS..Hα-helixtrans-66.8-48.4174-173.658.846.100111.3K653 M654 N655 Q659 L660 D661K653-Q657 PolarHBondContact O-N 2.89Å; M654-Q657 PolarHBondContact O-N 3.29Å; N655-Q657 VanDerWaalsContact C-N 3.33Å; N655-Q657 PolarHBondContact O-N 2.95Å; Q657-Q659 VanDerWaalsContact C-N 3.28Å; Q657-Q659 PolarHBondContact O-N 3.31Å; Q657-L660 WeakPolarHBondContact O-CA 3.39Å; Q657-L660 WeakPolarHBondContact O-CB 3.34Å; Q657-L660 PolarHBondContact O-N 3.31Å; Q657-D661 PolarHBondContact NE2-OD1 2.96Å; Q657-D661 PolarHBondContact O-N 3.18Å
658L88.1Confident88.4Confident90 Ų90110 Ų11047%0.47152%0.519SS..Hα-helixtrans-59.7-37.5177.8-71.4171.4000112.4M654 N655 L660 D661 I662M654-L658 WeakPolarHBondContact O-CG 3.5Å; M654-L658 PolarHBondContact O-N 2.87Å; N655-L658 PolarHBondContact O-N 3.44Å; L658-L660 VanDerWaalsContact C-N 3.3Å; L658-L660 PolarHBondContact O-N 3.32Å; L658-D661 PolarHBondContact O-N 3.48Å; L658-I662 VanDerWaalsContact O-CG1 3.27Å; L658-I662 WeakPolarHBondContact O-CG1 3.37Å; L658-I662 PolarHBondContact O-N 2.84Å
659Q88.5Confident88.3Confident89 Ų89109.9 Ų109.942%0.41652%0.519SS..Hα-helixtrans-65.8-30.5174.2-74178.319.800113.5N655 Q657 R663N655-Q659 WeakPolarHBondContact O-CG 3.35Å; N655-Q659 PolarHBondContact O-N 2.97Å; N655-Q659 PolarHBondContact OD1-NE2 2.91Å; Q657-Q659 VanDerWaalsContact C-N 3.28Å; Q657-Q659 PolarHBondContact O-N 3.31Å; Q659-R663 WeakPolarHBondContact O-CG 3.5Å; Q659-R663 PolarHBondContact O-N 3.31Å
660L86.8Confident88.4Confident80 Ų80111.9 Ų111.942%0.41953%0.529SS..Hα-helixtrans-72.3-44.4172.9-71.4168.5000110.5R656 Q657 L658 I662 R663 D664R656-L660 WeakPolarHBondContact O-CG 3.35Å; R656-L660 PolarHBondContact O-N 2.94Å; Q657-L660 WeakPolarHBondContact O-CA 3.39Å; Q657-L660 WeakPolarHBondContact O-CB 3.34Å; Q657-L660 PolarHBondContact O-N 3.31Å; L658-L660 VanDerWaalsContact C-N 3.3Å; L658-L660 PolarHBondContact O-N 3.32Å; L660-I662 VanDerWaalsContact C-N 3.32Å; L660-I662 PolarHBondContact O-N 2.92Å; L660-R663 PolarHBondContact O-N 2.91Å; L660-R663 VanDerWaalsContact O-N 3.17Å; L660-D664 PolarHBondContact O-N 3.31Å
661D90Very high88.4Confident68 Ų68112.1 Ų112.136%0.36453%0.53SS..Hα-helixtrans-61.6-40.7178.9-61-16.6000111.5Q657 L658 D664 L665Q657-D661 PolarHBondContact NE2-OD1 2.96Å; Q657-D661 PolarHBondContact O-N 3.18Å; L658-D661 PolarHBondContact O-N 3.48Å; D661-D664 PolarHBondContact O-N 2.85Å; D661-L665 WeakPolarHBondContact O-CB 3.3Å; D661-L665 WeakPolarHBondContact O-CG 3.41Å; D661-L665 PolarHBondContact O-N 3.37Å
662I87.9Confident88.5Confident95 Ų95112.9 Ų112.949%0.48753%0.528SS..Hα-helixtrans-60.4-48.1174.2-70.9166.7000110.9L658 L660 D664 L665 E666L658-I662 VanDerWaalsContact O-CG1 3.27Å; L658-I662 WeakPolarHBondContact O-CG1 3.37Å; L658-I662 PolarHBondContact O-N 2.84Å; L660-I662 VanDerWaalsContact C-N 3.32Å; L660-I662 PolarHBondContact O-N 2.92Å; I662-D664 VanDerWaalsContact C-N 3.28Å; I662-D664 PolarHBondContact O-N 2.81Å; I662-L665 PolarHBondContact O-N 3.45Å; I662-E666 HydrophobicContact CG2-CG 4.41Å; I662-E666 WeakPolarHBondContact O-CG 3.47Å; I662-E666 PolarHBondContact O-N 3.47Å
663R90.3Very high88.5Confident130 Ų130111.8 Ų111.849%0.49153%0.525SS..Hα-helixtrans-62.7-35.5178.3-73.9-172.6-158.51022.4112.7Q659 L660 R667Q659-R663 WeakPolarHBondContact O-CG 3.5Å; Q659-R663 PolarHBondContact O-N 3.31Å; L660-R663 PolarHBondContact O-N 2.91Å; L660-R663 VanDerWaalsContact O-N 3.17Å; R663-R667 WeakPolarHBondContact O-CB 3.45Å; R663-R667 PolarHBondContact O-N 2.86Å
664D87.3Confident88.5Confident69 Ų69110.6 Ų110.637%0.36952%0.522SS..Hα-helixtrans-73.5-34.8178.4-76.7-13.2000112.1L660 D661 I662 R667 K668L660-D664 PolarHBondContact O-N 3.31Å; D661-D664 PolarHBondContact O-N 2.85Å; I662-D664 VanDerWaalsContact C-N 3.28Å; I662-D664 PolarHBondContact O-N 2.81Å; D664-R667 PolarHBondContact O-N 2.82Å; D664-R667 IonicContact OD1-CZ 3.82Å; D664-R667 IonicContact OD1-NE 3.81Å; D664-R667 IonicContact OD1-NH2 3.63Å; D664-R667 PolarHBondContact OD1-NH2 3.41Å; D664-K668 WeakPolarHBondContact O-CG 3.36Å; D664-K668 PolarHBondContact O-N 3.45Å
665L86.6Confident88.3Confident113 Ų113108.3 Ų108.359%0.59251%0.512SS*.Hα-helixtrans-67.3-42.9171.1-72.8171000112D661 I662 R667 K668 L669D661-L665 WeakPolarHBondContact O-CB 3.3Å; D661-L665 WeakPolarHBondContact O-CG 3.41Å; D661-L665 PolarHBondContact O-N 3.37Å; I662-L665 PolarHBondContact O-N 3.45Å; L665-R667 VanDerWaalsContact C-N 3.29Å; L665-R667 PolarHBondContact O-N 2.82Å; L665-K668 PolarHBondContact O-N 3.46Å; L665-L669 WeakPolarHBondContact O-CB 3.44Å; L665-L669 PolarHBondContact O-N 3.17Å
666E89.5Confident88Confident119 Ų119108.8 Ų108.856%0.55651%0.511SS*.Hα-helixtrans-59.4-41.1174.3-73.9174.2160.600111.5I662 L669 L670I662-E666 HydrophobicContact CG2-CG 4.41Å; I662-E666 WeakPolarHBondContact O-CG 3.47Å; I662-E666 PolarHBondContact O-N 3.47Å; E666-L669 PolarHBondContact O-N 3.38Å; E666-L670 WeakPolarHBondContact O-CB 3.35Å; E666-L670 PolarHBondContact O-N 2.99Å
667R87.6Confident88Confident156 Ų156103.6 Ų103.659%0.58950%0.501SS*.Hα-helixtrans-63.7-45.4175.7-165.1-172.6-42.3-176.914.2112.1R663 D664 L665 L669 L670 E671R663-R667 WeakPolarHBondContact O-CB 3.45Å; R663-R667 PolarHBondContact O-N 2.86Å; D664-R667 PolarHBondContact O-N 2.82Å; D664-R667 IonicContact OD1-CZ 3.82Å; D664-R667 IonicContact OD1-NE 3.81Å; D664-R667 IonicContact OD1-NH2 3.63Å; D664-R667 PolarHBondContact OD1-NH2 3.41Å; L665-R667 VanDerWaalsContact C-N 3.29Å; L665-R667 PolarHBondContact O-N 2.82Å; R667-L669 VanDerWaalsContact C-N 3.34Å; R667-L669 PolarHBondContact O-N 3.35Å; R667-L670 PolarHBondContact O-N 3.35Å; R667-E671 WeakPolarHBondContact O-CB 3.43Å; R667-E671 PolarHBondContact O-N 2.99Å
668K88.3Confident87.8Confident138 Ų138102.5 Ų102.560%0.650%0.498SS*.Hα-helixtrans-61.9-40.9176.4-74.9174.3-178.3176.10111.9D664 L665 E671 Q672D664-K668 WeakPolarHBondContact O-CG 3.36Å; D664-K668 PolarHBondContact O-N 3.45Å; L665-K668 PolarHBondContact O-N 3.46Å; K668-E671 PolarHBondContact O-N 2.94Å; K668-Q672 WeakPolarHBondContact O-CB 3.39Å; K668-Q672 PolarHBondContact O-N 3.17Å
669L87Confident87.7Confident102 Ų102104 Ų10453%0.53450%0.503SS..Hα-helixtrans-64.2-41.3176.6-169.776.4000111.5L665 E666 R667 Q672 N673L665-L669 WeakPolarHBondContact O-CB 3.44Å; L665-L669 PolarHBondContact O-N 3.17Å; E666-L669 PolarHBondContact O-N 3.38Å; R667-L669 VanDerWaalsContact C-N 3.34Å; R667-L669 PolarHBondContact O-N 3.35Å; L669-Q672 PolarHBondContact O-N 3.36Å; L669-N673 WeakPolarHBondContact O-CB 3.34Å; L669-N673 PolarHBondContact O-N 3.47Å; L669-N673 PolarHBondContact O-ND2 2.89Å
670L89.1Confident87.5Confident132 Ų132104.5 Ų104.569%0.69151%0.507SS*.Hα-helixtrans-64.6-41.9176.9-159.9108.4000111.9E666 R667 N673 H674E666-L670 WeakPolarHBondContact O-CB 3.35Å; E666-L670 PolarHBondContact O-N 2.99Å; R667-L670 PolarHBondContact O-N 3.35Å; L670-N673 PolarHBondContact O-N 2.88Å; L670-H674 PolarHBondContact O-N 3.2Å
671E86.9Confident87.5Confident124 Ų124103.9 Ų103.958%0.57951%0.509SS*.Hα-helixtrans-64.9-44.2176.7-162.6164.9-156.400111.3R667 K668 N673 H674 D675R667-E671 WeakPolarHBondContact O-CB 3.43Å; R667-E671 PolarHBondContact O-N 2.99Å; K668-E671 PolarHBondContact O-N 2.94Å; E671-N673 VanDerWaalsContact C-N 3.35Å; E671-N673 PolarHBondContact O-N 3.17Å; E671-H674 WeakPolarHBondContact O-CB 3.44Å; E671-H674 PolarHBondContact O-N 3.34Å; E671-D675 PolarHBondContact O-N 3.09Å
672Q89.2Confident87.2Confident110 Ų110103.1 Ų103.151%0.51451%0.513SS..Hα-helixtrans-61.6-39.2174.7-175.1179.5-14.300112.8K668 L669 D675 H676K668-Q672 WeakPolarHBondContact O-CB 3.39Å; K668-Q672 PolarHBondContact O-N 3.17Å; L669-Q672 PolarHBondContact O-N 3.36Å; Q672-D675 PolarHBondContact O-N 3.11Å; Q672-H676 PolarHBondContact O-N 3.25Å; Q672-H676 PolarHBondContact O-ND1 2.96Å
673N87.6Confident87.3Confident93 Ų93105.6 Ų105.650%0.49752%0.517SS..Hα-helixtrans-68.4-36.3175.5-78.8-26.6000112.2L669 L670 E671 T677L669-N673 WeakPolarHBondContact O-CB 3.34Å; L669-N673 PolarHBondContact O-N 3.47Å; L669-N673 PolarHBondContact O-ND2 2.89Å; L670-N673 PolarHBondContact O-N 2.88Å; E671-N673 VanDerWaalsContact C-N 3.35Å; E671-N673 PolarHBondContact O-N 3.17Å; N673-T677 PolarHBondContact O-N 3.3Å; N673-T677 PolarHBondContact O-OG1 3.21Å
674H88.7Confident87.1Confident112 Ų112103.5 Ų103.552%0.51952%0.515SS..Hα-helixtrans-64.2-44.8173.1-171.763.4000111L670 E671 H676 T677 N678L670-H674 PolarHBondContact O-N 3.2Å; E671-H674 WeakPolarHBondContact O-CB 3.44Å; E671-H674 PolarHBondContact O-N 3.34Å; H674-H676 PolarHBondContact O-N 2.91Å; H674-T677 WeakPolarHBondContact O-CB 3.28Å; H674-T677 PolarHBondContact O-N 2.86Å; H674-N678 PolarHBondContact CD2-ND2 3.39Å; H674-N678 VanDerWaalsContact CD2-ND2 3.34Å; H674-N678 PolarHBondContact NE2-ND2 3.42Å; H674-N678 VanDerWaalsContact NE2-ND2 3.17Å; H674-N678 VanDerWaalsContact O-CG 3.31Å; H674-N678 PolarHBondContact O-N 3.36Å; H674-N678 PolarHBondContact O-ND2 2.93Å
675D86.5Confident87.1Confident82 Ų82104.8 Ų104.844%0.43952%0.519SS..Hα-helixtrans-62.3-42.4176-74-17.3000112.6E671 Q672 T677 N678 Q679E671-D675 PolarHBondContact O-N 3.09Å; Q672-D675 PolarHBondContact O-N 3.11Å; D675-T677 VanDerWaalsContact C-N 3.33Å; D675-T677 PolarHBondContact O-N 3.19Å; D675-N678 PolarHBondContact O-N 3.46Å; D675-Q679 VanDerWaalsContact O-CG 3.3Å; D675-Q679 WeakPolarHBondContact O-CG 3.28Å; D675-Q679 PolarHBondContact O-N 2.84Å
676H84.4Confident87Confident95 Ų95104.1 Ų104.144%0.4452%0.515SS..Hα-helixtrans-60.5-42.1173.9-94.859.2000112Q672 H674 N678 Q679 I680Q672-H676 PolarHBondContact O-N 3.25Å; Q672-H676 PolarHBondContact O-ND1 2.96Å; H674-H676 PolarHBondContact O-N 2.91Å; H676-N678 VanDerWaalsContact C-N 3.34Å; H676-N678 PolarHBondContact O-N 3.47Å; H676-Q679 PolarHBondContact O-N 3.3Å; H676-I680 VanDerWaalsContact O-CG1 3.27Å; H676-I680 WeakPolarHBondContact O-CG1 3.32Å; H676-I680 PolarHBondContact O-N 2.82Å
677T88Confident87Confident80 Ų80104.4 Ų104.449%0.49152%0.515SS..Hα-helixtrans-64.1-40.9177.8-55.20000111.2N673 H674 D675 I680 S681N673-T677 PolarHBondContact O-N 3.3Å; N673-T677 PolarHBondContact O-OG1 3.21Å; H674-T677 WeakPolarHBondContact O-CB 3.28Å; H674-T677 PolarHBondContact O-N 2.86Å; D675-T677 VanDerWaalsContact C-N 3.33Å; D675-T677 PolarHBondContact O-N 3.19Å; T677-I680 PolarHBondContact O-N 3.33Å; T677-S681 WeakPolarHBondContact O-CB 3.31Å; T677-S681 PolarHBondContact O-N 3.17Å; T677-S681 PolarHBondContact O-OG 3.33Å
678N85.4Confident87Confident75 Ų75104.3 Ų104.340%0.40152%0.516SS..Hα-helixtrans-65.5-41.1175.4-69.4-23.5000112.1H674 D675 H676 S681 A682H674-N678 PolarHBondContact CD2-ND2 3.39Å; H674-N678 VanDerWaalsContact CD2-ND2 3.34Å; H674-N678 PolarHBondContact NE2-ND2 3.42Å; H674-N678 VanDerWaalsContact NE2-ND2 3.17Å; H674-N678 VanDerWaalsContact O-CG 3.31Å; H674-N678 PolarHBondContact O-N 3.36Å; H674-N678 PolarHBondContact O-ND2 2.93Å; D675-N678 PolarHBondContact O-N 3.46Å; H676-N678 VanDerWaalsContact C-N 3.34Å; H676-N678 PolarHBondContact O-N 3.47Å; N678-S681 PolarHBondContact O-N 2.95Å; N678-A682 PolarHBondContact O-N 3.09Å
679Q86.1Confident86.9Confident123 Ų123102.5 Ų102.558%0.57551%0.509SS*.Hα-helixtrans-63.1-42.9175.2-73.217415.600112.3D675 H676 S681 A682 Y683D675-Q679 VanDerWaalsContact O-CG 3.3Å; D675-Q679 WeakPolarHBondContact O-CG 3.28Å; D675-Q679 PolarHBondContact O-N 2.84Å; H676-Q679 PolarHBondContact O-N 3.3Å; Q679-S681 VanDerWaalsContact C-N 3.29Å; Q679-S681 PolarHBondContact O-N 2.82Å; Q679-A682 PolarHBondContact O-N 2.78Å; Q679-Y683 WeakPolarHBondContact O-CB 3.38Å; Q679-Y683 PolarHBondContact O-N 3.5Å
680I85.1Confident86.8Confident98 Ų98102.6 Ų102.650%0.50351%0.51SS..Hα-helixtrans-61.7-40.6175.5-69.3165000110.6H676 T677 Y683 N684H676-I680 VanDerWaalsContact O-CG1 3.27Å; H676-I680 WeakPolarHBondContact O-CG1 3.32Å; H676-I680 PolarHBondContact O-N 2.82Å; T677-I680 PolarHBondContact O-N 3.33Å; I680-Y683 PolarHBondContact O-N 2.92Å; I680-N684 PolarHBondContact O-N 3.14Å; I680-N684 PolarHBondContact O-ND2 2.93Å
681S85.8Confident86.8Confident67 Ų67102.6 Ų102.647%0.46950%0.504SS..Hα-helixtrans-66.7-44.5179.2-56.10000111.5T677 N678 Q679 Y683 N684 E685T677-S681 WeakPolarHBondContact O-CB 3.31Å; T677-S681 PolarHBondContact O-N 3.17Å; T677-S681 PolarHBondContact O-OG 3.33Å; N678-S681 PolarHBondContact O-N 2.95Å; Q679-S681 VanDerWaalsContact C-N 3.29Å; Q679-S681 PolarHBondContact O-N 2.82Å; S681-Y683 PolarHBondContact O-N 2.82Å; S681-N684 PolarHBondContact O-N 3.34Å; S681-E685 PolarHBondContact O-N 3.39Å
682A84.8Confident86.8Confident53 Ų5399.9 Ų99.944%0.43850%0.496SS..Hα-helixtrans-63.3-39.7174.300000112.6N678 Q679 E685 I686N678-A682 PolarHBondContact O-N 3.09Å; Q679-A682 PolarHBondContact O-N 2.78Å; A682-E685 PolarHBondContact O-N 2.86Å; A682-I686 WeakPolarHBondContact O-CG1 3.37Å; A682-I686 PolarHBondContact O-N 2.85Å
683Y88.2Confident86.4Confident147 Ų14799.9 Ų99.958%0.57650%0.499SS*.Hα-helixtrans-62-43.4175174.9-98.8000111.9Q679 I680 S681 I686 K687Q679-Y683 WeakPolarHBondContact O-CB 3.38Å; Q679-Y683 PolarHBondContact O-N 3.5Å; I680-Y683 PolarHBondContact O-N 2.92Å; S681-Y683 PolarHBondContact O-N 2.82Å; Y683-I686 PolarHBondContact O-N 2.92Å; Y683-K687 HydrophobicContact CE1-CD 4.31Å; Y683-K687 VanDerWaalsContact O-CB 3.27Å; Y683-K687 WeakPolarHBondContact O-CB 3.24Å; Y683-K687 PolarHBondContact O-N 3.03Å
684N87.8Confident86.2Confident85 Ų8599 Ų9946%0.45550%0.497SS..Hα-helixtrans-66-37.8177.7-73.6-29.5000112.2I680 S681 K687 Y688I680-N684 PolarHBondContact O-N 3.14Å; I680-N684 PolarHBondContact O-ND2 2.93Å; S681-N684 PolarHBondContact O-N 3.34Å; N684-K687 PolarHBondContact O-N 3.36Å; N684-Y688 WeakPolarHBondContact O-CB 3.3Å; N684-Y688 PolarHBondContact O-N 3.48Å
685E86.3Confident86.1Confident97 Ų9798.8 Ų98.845%0.45350%0.496SS..Hα-helixtrans-64.1-47.9174.5-176.556.2-146.500111.6S681 A682 K687 Y688 Q689S681-E685 PolarHBondContact O-N 3.39Å; A682-E685 PolarHBondContact O-N 2.86Å; E685-K687 VanDerWaalsContact C-N 3.3Å; E685-K687 PolarHBondContact O-N 3.04Å; E685-Y688 PolarHBondContact O-N 3.49Å; E685-Q689 WeakPolarHBondContact O-CG 3.47Å; E685-Q689 PolarHBondContact O-N 3.13Å; E685-Q689 PolarHBondContact OE1-NE2 3.05Å
686I85.1Confident86.1Confident98 Ų98100.6 Ų100.650%0.50350%0.5SS..Hα-helixtrans-60.4-41.1175.4-68.9167.8000111A682 Y683 Q689 L690A682-I686 WeakPolarHBondContact O-CG1 3.37Å; A682-I686 PolarHBondContact O-N 2.85Å; Y683-I686 PolarHBondContact O-N 2.92Å; I686-Q689 PolarHBondContact O-N 2.96Å; I686-L690 HydrophobicContact CG2-CD1 4.11Å; I686-L690 WeakPolarHBondContact O-CB 3.48Å; I686-L690 PolarHBondContact O-N 3.24Å
687K88.7Confident86Confident125 Ų125101.6 Ų101.654%0.54351%0.505SS..Hα-helixtrans-63.7-40.1176.9-175179.5178.4-176.50111.9Y683 N684 E685 K691Y683-K687 HydrophobicContact CE1-CD 4.31Å; Y683-K687 VanDerWaalsContact O-CB 3.27Å; Y683-K687 WeakPolarHBondContact O-CB 3.24Å; Y683-K687 PolarHBondContact O-N 3.03Å; N684-K687 PolarHBondContact O-N 3.36Å; E685-K687 VanDerWaalsContact C-N 3.3Å; E685-K687 PolarHBondContact O-N 3.04Å; K687-K691 PolarHBondContact O-N 3.49Å; K687-K691 VanDerWaalsContact O-N 3.13Å
688Y88.1Confident85.9Confident155 Ų155102.3 Ų102.361%0.60851%0.506SS*.Hα-helixtrans-65.6-45.8174.8-177.2-100.4000111.4N684 E685 L690 K691 V692N684-Y688 WeakPolarHBondContact O-CB 3.3Å; N684-Y688 PolarHBondContact O-N 3.48Å; E685-Y688 PolarHBondContact O-N 3.49Å; Y688-L690 PolarHBondContact O-N 3.11Å; Y688-K691 WeakPolarHBondContact O-CB 3.46Å; Y688-K691 PolarHBondContact O-N 3.42Å; Y688-K691 VanDerWaalsContact O-N 3.1Å; Y688-V692 HydrophobicContact CD1-CG2 4.31Å; Y688-V692 HydrophobicContact CE1-CG2 3.91Å; Y688-V692 WeakPolarHBondContact O-CG2 3.32Å; Y688-V692 PolarHBondContact O-N 3.34Å
689Q87.2Confident85.9Confident99 Ų99102.6 Ų102.646%0.46351%0.51SS..Hα-helixtrans-60.8-41176.2-69.4177.314.700112.5E685 I686 K691 V692 L693E685-Q689 WeakPolarHBondContact O-CG 3.47Å; E685-Q689 PolarHBondContact O-N 3.13Å; E685-Q689 PolarHBondContact OE1-NE2 3.05Å; I686-Q689 PolarHBondContact O-N 2.96Å; Q689-K691 VanDerWaalsContact C-N 3.32Å; Q689-K691 PolarHBondContact O-N 3.01Å; Q689-V692 PolarHBondContact O-N 3.14Å; Q689-L693 WeakPolarHBondContact O-CB 3.42Å; Q689-L693 WeakPolarHBondContact O-CG 3.47Å; Q689-L693 PolarHBondContact O-N 2.77Å
690L84.1Confident85.8Confident105 Ų105101.7 Ų101.755%0.5551%0.506SS..Hα-helixtrans-60.7-39.8173.4-85.4166.8000112.1I686 Y688 L693 T694I686-L690 HydrophobicContact CG2-CD1 4.11Å; I686-L690 WeakPolarHBondContact O-CB 3.48Å; I686-L690 PolarHBondContact O-N 3.24Å; Y688-L690 PolarHBondContact O-N 3.11Å; L690-L693 PolarHBondContact O-N 3.41Å; L690-T694 WeakPolarHBondContact O-CB 3.31Å; L690-T694 PolarHBondContact O-N 3.37Å; L690-T694 PolarHBondContact O-OG1 3.3Å
691K88.9Confident85.7Confident131 Ų13199.5 Ų99.557%0.5750%0.497SS*.Hα-helixtrans-63.8-46.9176.8-169.5-179.9177.1-173.40111.3K687 Y688 Q689 L693 T694 E695K687-K691 PolarHBondContact O-N 3.49Å; K687-K691 VanDerWaalsContact O-N 3.13Å; Y688-K691 WeakPolarHBondContact O-CB 3.46Å; Y688-K691 PolarHBondContact O-N 3.42Å; Y688-K691 VanDerWaalsContact O-N 3.1Å; Q689-K691 VanDerWaalsContact C-N 3.32Å; Q689-K691 PolarHBondContact O-N 3.01Å; K691-L693 PolarHBondContact O-N 3.29Å; K691-T694 PolarHBondContact O-N 2.97Å; K691-E695 WeakPolarHBondContact CE-OE1 3.49Å; K691-E695 PolarHBondContact O-N 2.98Å
692V87.3Confident85.7Confident68 Ų68103 Ų10341%0.41250%0.504SS..Hα-helixtrans-62.4-43.2177.11760000111.5Y688 Q689 T694 E695 K696Y688-V692 HydrophobicContact CD1-CG2 4.31Å; Y688-V692 HydrophobicContact CE1-CG2 3.91Å; Y688-V692 WeakPolarHBondContact O-CG2 3.32Å; Y688-V692 PolarHBondContact O-N 3.34Å; Q689-V692 PolarHBondContact O-N 3.14Å; V692-T694 VanDerWaalsContact C-N 3.34Å; V692-T694 PolarHBondContact O-N 3.25Å; V692-E695 PolarHBondContact O-N 2.66Å; V692-K696 WeakPolarHBondContact O-CB 3.46Å; V692-K696 PolarHBondContact O-N 3.04Å
693L80.6Confident85.6Confident109 Ų109106.7 Ų106.757%0.57151%0.512SS*.Hα-helixtrans-64.8-37.2176-76.8172.3000112.5Q689 L690 K691 K696 H697Q689-L693 WeakPolarHBondContact O-CB 3.42Å; Q689-L693 WeakPolarHBondContact O-CG 3.47Å; Q689-L693 PolarHBondContact O-N 2.77Å; L690-L693 PolarHBondContact O-N 3.41Å; K691-L693 PolarHBondContact O-N 3.29Å; L693-K696 PolarHBondContact O-N 3.04Å; L693-H697 WeakPolarHBondContact O-CB 3.37Å; L693-H697 PolarHBondContact O-N 3.33Å
694T83.9Confident85.4Confident76 Ų76104 Ų10447%0.46651%0.508SS..Hα-helixtrans-65.7-43.4176.2-56.40000111L690 K691 V692 K696 H697 N698L690-T694 WeakPolarHBondContact O-CB 3.31Å; L690-T694 PolarHBondContact O-N 3.37Å; L690-T694 PolarHBondContact O-OG1 3.3Å; K691-T694 PolarHBondContact O-N 2.97Å; V692-T694 VanDerWaalsContact C-N 3.34Å; V692-T694 PolarHBondContact O-N 3.25Å; T694-K696 VanDerWaalsContact C-N 3.34Å; T694-K696 PolarHBondContact O-N 3.3Å; T694-H697 PolarHBondContact O-N 3.01Å; T694-N698 WeakPolarHBondContact O-CB 3.43Å; T694-N698 PolarHBondContact O-N 3.28Å; T694-N698 PolarHBondContact O-ND2 3.4Å
695E86Confident85.3Confident107 Ų107104 Ų10450%0.551%0.507SS..Hα-helixtrans-62.9-40174.8-73.3172.6-168.200111.9K691 V692 N698 T699K691-E695 WeakPolarHBondContact CE-OE1 3.49Å; K691-E695 PolarHBondContact O-N 2.98Å; V692-E695 PolarHBondContact O-N 2.66Å; E695-N698 PolarHBondContact O-N 3.04Å; E695-T699 PolarHBondContact O-N 2.97Å; E695-T699 PolarHBondContact O-OG1 3.42Å
696K85.8Confident85.3Confident120 Ų120103.8 Ų103.852%0.52251%0.509SS..Hα-helixtrans-64.3-43.1173.8-171.6178.1179.4179.60112.6V692 L693 T694 N698 T699 Q700V692-K696 WeakPolarHBondContact O-CB 3.46Å; V692-K696 PolarHBondContact O-N 3.04Å; L693-K696 PolarHBondContact O-N 3.04Å; T694-K696 VanDerWaalsContact C-N 3.34Å; T694-K696 PolarHBondContact O-N 3.3Å; K696-N698 VanDerWaalsContact C-N 3.35Å; K696-T699 VanDerWaalsContact CA-OG1 3.3Å; K696-T699 WeakPolarHBondContact CA-OG1 3.35Å; K696-T699 PolarHBondContact O-N 3.42Å; K696-T699 PolarHBondContact O-OG1 3.07Å; K696-Q700 WeakPolarHBondContact O-CG 3.46Å; K696-Q700 PolarHBondContact O-N 3.06Å
697H82.4Confident85.2Confident115 Ų115102.8 Ų102.853%0.53251%0.508SS..Hα-helixtrans-62.9-42.5176.3-179.2-82.7000111.3L693 T694 T699 Q700 T701L693-H697 WeakPolarHBondContact O-CB 3.37Å; L693-H697 PolarHBondContact O-N 3.33Å; T694-H697 PolarHBondContact O-N 3.01Å; H697-T699 PolarHBondContact O-N 3.23Å; H697-Q700 PolarHBondContact O-N 2.96Å; H697-T701 PolarHBondContact CE1-OG1 2.97Å; H697-T701 PolarHBondContact ND1-OG1 3.14Å; H697-T701 WeakPolarHBondContact O-CB 3.38Å; H697-T701 PolarHBondContact O-N 3.02Å; H697-T701 PolarHBondContact O-OG1 3.23Å
698N86.5Confident85Confident96 Ų96102 Ų10251%0.51351%0.505SS..Hα-helixtrans-63.9-40.1177.5-70.5-16.1000112.1T694 E695 K696 T701 K702T694-N698 WeakPolarHBondContact O-CB 3.43Å; T694-N698 PolarHBondContact O-N 3.28Å; T694-N698 PolarHBondContact O-ND2 3.4Å; E695-N698 PolarHBondContact O-N 3.04Å; K696-N698 VanDerWaalsContact C-N 3.35Å; N698-T701 PolarHBondContact O-N 3.22Å; N698-K702 PolarHBondContact O-N 2.92Å
699T85.1Confident84.9Confident81 Ų81100.1 Ų100.150%0.49750%0.504SS..Hα-helixtrans-67.3-41.517526.90000112.4E695 K696 H697 T701 K702 Q703E695-T699 PolarHBondContact O-N 2.97Å; E695-T699 PolarHBondContact O-OG1 3.42Å; K696-T699 VanDerWaalsContact CA-OG1 3.3Å; K696-T699 WeakPolarHBondContact CA-OG1 3.35Å; K696-T699 PolarHBondContact O-N 3.42Å; K696-T699 PolarHBondContact O-OG1 3.07Å; H697-T699 PolarHBondContact O-N 3.23Å; T699-T701 VanDerWaalsContact C-N 3.35Å; T699-K702 PolarHBondContact O-N 2.65Å; T699-Q703 WeakPolarHBondContact O-CG 3.38Å; T699-Q703 PolarHBondContact O-N 3.46Å
700Q84.5Confident85Confident104 Ų10499.8 Ų99.849%0.48651%0.506SS..Hα-helixtrans-64.2-38.4174.4-73.8-179.9-37.500112.5K696 H697 Q703 L704K696-Q700 WeakPolarHBondContact O-CG 3.46Å; K696-Q700 PolarHBondContact O-N 3.06Å; H697-Q700 PolarHBondContact O-N 2.96Å; Q700-Q703 PolarHBondContact O-N 2.93Å; Q700-L704 WeakPolarHBondContact O-CB 3.2Å; Q700-L704 PolarHBondContact O-N 3.36Å
701T83.5Confident84.9Confident52 Ų5298.9 Ų98.932%0.31951%0.505SS..Hα-helixtrans-63-45.1176-54.80000110.6H697 N698 T699 Q703 L704 D705H697-T701 PolarHBondContact CE1-OG1 2.97Å; H697-T701 PolarHBondContact ND1-OG1 3.14Å; H697-T701 WeakPolarHBondContact O-CB 3.38Å; H697-T701 PolarHBondContact O-N 3.02Å; H697-T701 PolarHBondContact O-OG1 3.23Å; N698-T701 PolarHBondContact O-N 3.22Å; T699-T701 VanDerWaalsContact C-N 3.35Å; T701-Q703 PolarHBondContact O-N 2.89Å; T701-L704 WeakPolarHBondContact O-CB 3.46Å; T701-L704 PolarHBondContact O-N 3.38Å; T701-L704 VanDerWaalsContact O-N 3.17Å; T701-D705 PolarHBondContact O-N 2.82Å
702K84.9Confident84.8Confident140 Ų14098.2 Ų98.261%0.60950%0.503SS*.Hα-helixtrans-60.8-43.9175.8-168.7179.7179-175.30112.3N698 T699 L704 D705 D706N698-K702 PolarHBondContact O-N 2.92Å; T699-K702 PolarHBondContact O-N 2.65Å; K702-L704 VanDerWaalsContact C-N 3.32Å; K702-L704 PolarHBondContact O-N 2.8Å; K702-D705 PolarHBondContact O-N 3.25Å; K702-D706 VanDerWaalsContact O-CG 3.29Å; K702-D706 PolarHBondContact O-N 3.4Å
703Q83.5Confident84.7Confident130 Ų13098.3 Ų98.361%0.60750%0.504SS*.Hα-helixtrans-62.7-37.4175-72.8177.2-12.300112.5T699 Q700 T701 T707T699-Q703 WeakPolarHBondContact O-CG 3.38Å; T699-Q703 PolarHBondContact O-N 3.46Å; Q700-Q703 PolarHBondContact O-N 2.93Å; T701-Q703 PolarHBondContact O-N 2.89Å; Q703-T707 WeakPolarHBondContact O-CB 3.39Å; Q703-T707 VanDerWaalsContact O-CG2 3.3Å; Q703-T707 WeakPolarHBondContact O-CG2 3.44Å; Q703-T707 PolarHBondContact O-N 3.34Å; Q703-T707 PolarHBondContact O-OG1 3.32Å
704L84.3Confident84.8Confident92 Ų9296.9 Ų96.948%0.48250%0.497SS..Hα-helixtrans-65.9-39.4175.8-174.866.4000111.6Q700 T701 K702 T707 K708Q700-L704 WeakPolarHBondContact O-CB 3.2Å; Q700-L704 PolarHBondContact O-N 3.36Å; T701-L704 WeakPolarHBondContact O-CB 3.46Å; T701-L704 PolarHBondContact O-N 3.38Å; T701-L704 VanDerWaalsContact O-N 3.17Å; K702-L704 VanDerWaalsContact C-N 3.32Å; K702-L704 PolarHBondContact O-N 2.8Å; L704-T707 WeakPolarHBondContact CA-OG1 3.41Å; L704-T707 PolarHBondContact O-OG1 2.86Å; L704-K708 VanDerWaalsContact O-CG 3.32Å; L704-K708 WeakPolarHBondContact O-CG 3.48Å; L704-K708 PolarHBondContact O-N 3.15Å
705D85.6Confident84.9Confident83 Ų8396.6 Ų96.644%0.44450%0.495SS..Hα-helixtrans-70.5-40.7177.5-68.2-24.1000111.8T701 K702 T707 K708 L709T701-D705 PolarHBondContact O-N 2.82Å; K702-D705 PolarHBondContact O-N 3.25Å; D705-T707 VanDerWaalsContact C-N 3.34Å; D705-T707 PolarHBondContact O-N 2.92Å; D705-K708 PolarHBondContact O-N 3.21Å; D705-K708 IonicContact OD1-NZ 3.91Å; D705-L709 PolarHBondContact O-N 3.38Å
706D85.8Confident84.9Confident93 Ų9397.7 Ų97.750%0.49750%0.498SS..Hα-helixtrans-61.8-41.3174.1-69.1-22.3000111.4K702 L709 N710K702-D706 VanDerWaalsContact O-CG 3.29Å; K702-D706 PolarHBondContact O-N 3.4Å; D706-L709 PolarHBondContact O-N 3.26Å; D706-N710 WeakPolarHBondContact O-CB 3.49Å; D706-N710 PolarHBondContact O-N 3.43Å
707T81.8Confident84.9Confident78 Ų7897.4 Ų97.448%0.47950%0.498SS..Hα-helixtrans-69.3-37.6176.550.50000112.7Q703 L704 D705 N710 V711Q703-T707 WeakPolarHBondContact O-CB 3.39Å; Q703-T707 VanDerWaalsContact O-CG2 3.3Å; Q703-T707 WeakPolarHBondContact O-CG2 3.44Å; Q703-T707 PolarHBondContact O-N 3.34Å; Q703-T707 PolarHBondContact O-OG1 3.32Å; L704-T707 WeakPolarHBondContact CA-OG1 3.41Å; L704-T707 PolarHBondContact O-OG1 2.86Å; D705-T707 VanDerWaalsContact C-N 3.34Å; D705-T707 PolarHBondContact O-N 2.92Å; T707-N710 PolarHBondContact O-N 3.07Å; T707-V711 VanDerWaalsContact O-CG2 3.32Å; T707-V711 WeakPolarHBondContact O-CG2 3.32Å; T707-V711 PolarHBondContact O-N 3.03Å
708K85.1Confident85Confident109 Ų10996.5 Ų96.547%0.47450%0.498SS..Hα-helixtrans-60.7-46171.6-78.2173.5-176.3168.50111.7L704 D705 N710 V711 E712L704-K708 VanDerWaalsContact O-CG 3.32Å; L704-K708 WeakPolarHBondContact O-CG 3.48Å; L704-K708 PolarHBondContact O-N 3.15Å; D705-K708 PolarHBondContact O-N 3.21Å; D705-K708 IonicContact OD1-NZ 3.91Å; K708-N710 VanDerWaalsContact C-N 3.28Å; K708-N710 PolarHBondContact O-N 3.31Å; K708-V711 PolarHBondContact O-N 3.06Å; K708-E712 PolarHBondContact O-N 3.01Å
709L87.1Confident85.1Confident114 Ų11497.5 Ų97.560%0.59750%0.499SS*.Hα-helixtrans-59-42.9177.3-159.888.6000111D705 D706 E712 T713D705-L709 PolarHBondContact O-N 3.38Å; D706-L709 PolarHBondContact O-N 3.26Å; L709-E712 PolarHBondContact O-N 3.48Å; L709-T713 PolarHBondContact O-N 3.3Å; L709-T713 PolarHBondContact O-OG1 2.96Å
710N88Confident85.2Confident93 Ų9399.1 Ų99.150%0.49750%0.504SS..Hα-helixtrans-66.9-37.6177.3-169.550.3000113D706 T707 K708 T713 L714D706-N710 WeakPolarHBondContact O-CB 3.49Å; D706-N710 PolarHBondContact O-N 3.43Å; T707-N710 PolarHBondContact O-N 3.07Å; K708-N710 VanDerWaalsContact C-N 3.28Å; K708-N710 PolarHBondContact O-N 3.31Å; N710-T713 VanDerWaalsContact CA-OG1 3.3Å; N710-T713 WeakPolarHBondContact CA-OG1 3.12Å; N710-T713 PolarHBondContact O-N 3.26Å; N710-T713 PolarHBondContact O-OG1 3.15Å; N710-L714 WeakPolarHBondContact O-CB 3.5Å; N710-L714 WeakPolarHBondContact O-CG 3.44Å; N710-L714 PolarHBondContact O-N 3.43Å
711V83.4Confident85.2Confident86 Ų8698.7 Ų98.752%0.52151%0.505SS..Hα-helixtrans-64.7-41.5173.5169.10000110.5T707 K708 L714 T715T707-V711 VanDerWaalsContact O-CG2 3.32Å; T707-V711 WeakPolarHBondContact O-CG2 3.32Å; T707-V711 PolarHBondContact O-N 3.03Å; K708-V711 PolarHBondContact O-N 3.06Å; V711-L714 PolarHBondContact O-N 2.87Å; V711-T715 VanDerWaalsContact O-CB 3.31Å; V711-T715 WeakPolarHBondContact O-CB 3.46Å; V711-T715 PolarHBondContact O-N 2.87Å; V711-T715 PolarHBondContact O-OG1 3.25Å
712E85.3Confident85.3Confident116 Ų116101.8 Ų101.854%0.54252%0.519SS..Hα-helixtrans-62.4-42.1175.9-76.2-178.4-17500112.3K708 L709 T715 K716K708-E712 PolarHBondContact O-N 3.01Å; L709-E712 PolarHBondContact O-N 3.48Å; E712-T715 PolarHBondContact O-N 3.45Å; E712-K716 WeakPolarHBondContact O-CG 3.42Å; E712-K716 PolarHBondContact O-N 3.2Å; E712-K716 VanDerWaalsContact O-N 3.11Å
713T85.6Confident85.3Confident71 Ų71100.8 Ų100.844%0.43652%0.516SS..Hα-helixtrans-64.8-45.917647.40000112L709 N710 T715 K716 E717L709-T713 PolarHBondContact O-N 3.3Å; L709-T713 PolarHBondContact O-OG1 2.96Å; N710-T713 VanDerWaalsContact CA-OG1 3.3Å; N710-T713 WeakPolarHBondContact CA-OG1 3.12Å; N710-T713 PolarHBondContact O-N 3.26Å; N710-T713 PolarHBondContact O-OG1 3.15Å; T713-T715 VanDerWaalsContact C-N 3.28Å; T713-T715 PolarHBondContact O-N 3.48Å; T713-K716 PolarHBondContact O-N 2.91Å; T713-E717 PolarHBondContact O-N 3.11Å
714L83.5Confident85.5Confident79 Ų7998.7 Ų98.741%0.41451%0.507SS..Hα-helixtrans-65.6-30.5176.8-72.1171.5000112.6N710 V711 N718N710-L714 WeakPolarHBondContact O-CB 3.5Å; N710-L714 WeakPolarHBondContact O-CG 3.44Å; N710-L714 PolarHBondContact O-N 3.43Å; V711-L714 PolarHBondContact O-N 2.87Å; L714-N718 WeakPolarHBondContact O-CB 3.46Å; L714-N718 PolarHBondContact O-N 3.34Å; L714-N718 PolarHBondContact O-ND2 3.3Å; L714-N718 VanDerWaalsContact O-ND2 3.12Å
715T84.9Confident85.6Confident69 Ų6998.4 Ų98.442%0.42351%0.505SS..Hα-helixtrans-68.7-41.7175.9-56.90000111V711 E712 T713 N718 Q719V711-T715 VanDerWaalsContact O-CB 3.31Å; V711-T715 WeakPolarHBondContact O-CB 3.46Å; V711-T715 PolarHBondContact O-N 2.87Å; V711-T715 PolarHBondContact O-OG1 3.25Å; E712-T715 PolarHBondContact O-N 3.45Å; T713-T715 VanDerWaalsContact C-N 3.28Å; T713-T715 PolarHBondContact O-N 3.48Å; T715-N718 PolarHBondContact O-N 3.36Å; T715-Q719 WeakPolarHBondContact O-CG 3.47Å; T715-Q719 PolarHBondContact O-N 2.92Å
716K86.7Confident85.6Confident131 Ų13198 Ų9857%0.5750%0.5SS*.Hα-helixtrans-64.8-42174.4-71173.9-177.4172.60111.9E712 T713 Q719 L720E712-K716 WeakPolarHBondContact O-CG 3.42Å; E712-K716 PolarHBondContact O-N 3.2Å; E712-K716 VanDerWaalsContact O-N 3.11Å; T713-K716 PolarHBondContact O-N 2.91Å; K716-Q719 PolarHBondContact O-N 3.47Å; K716-L720 PolarHBondContact O-N 3.45Å
717E86.5Confident85.6Confident113 Ų11398.2 Ų98.253%0.52850%0.498SS..Hα-helixtrans-63.7-42.9176.4-169.4175-174.200111.8T713 Q719 L720 L721T713-E717 PolarHBondContact O-N 3.11Å; E717-Q719 VanDerWaalsContact C-N 3.34Å; E717-Q719 PolarHBondContact O-N 3.31Å; E717-L720 PolarHBondContact O-N 3.46Å; E717-L721 HydrophobicContact CG-CD1 4.49Å; E717-L721 WeakPolarHBondContact O-CG 3.35Å; E717-L721 PolarHBondContact O-N 3.15Å
718N84.1Confident85.8Confident96 Ų9698 Ų9851%0.51349%0.494SS..Hα-helixtrans-62-38.4173.5-86.4-47.6000112.8L714 T715 L721 L722L714-N718 WeakPolarHBondContact O-CB 3.46Å; L714-N718 PolarHBondContact O-N 3.34Å; L714-N718 PolarHBondContact O-ND2 3.3Å; L714-N718 VanDerWaalsContact O-ND2 3.12Å; T715-N718 PolarHBondContact O-N 3.36Å; N718-L721 PolarHBondContact O-N 2.88Å; N718-L722 WeakPolarHBondContact O-CB 3.29Å; N718-L722 VanDerWaalsContact O-CG 3.29Å; N718-L722 WeakPolarHBondContact O-CG 3.39Å; N718-L722 PolarHBondContact O-N 2.96Å
719Q87.3Confident85.9Confident117 Ų11798 Ų9855%0.54749%0.494SS..Hα-helixtrans-61.8-46.1174.8-80.8177.3-19.100111.6T715 K716 E717 L721 L722 E723T715-Q719 WeakPolarHBondContact O-CG 3.47Å; T715-Q719 PolarHBondContact O-N 2.92Å; K716-Q719 PolarHBondContact O-N 3.47Å; E717-Q719 VanDerWaalsContact C-N 3.34Å; E717-Q719 PolarHBondContact O-N 3.31Å; Q719-L721 PolarHBondContact O-N 3.48Å; Q719-L722 PolarHBondContact O-N 2.96Å; Q719-E723 PolarHBondContact O-N 3.4Å
720L87.2Confident85.9Confident116 Ų11697.1 Ų97.161%0.60749%0.487SS*.Hα-helixtrans-62.3-42.1177-71.8169.3000112.3K716 E717 E723 Q724K716-L720 PolarHBondContact O-N 3.45Å; E717-L720 PolarHBondContact O-N 3.46Å; L720-E723 PolarHBondContact O-N 3.5Å; L720-Q724 WeakPolarHBondContact O-CB 3.19Å; L720-Q724 PolarHBondContact O-N 2.72Å
721L85Confident85.8Confident94 Ų9497.9 Ų97.949%0.49249%0.486SS..Hα-helixtrans-64.8-38176-73.4171.7000112.2E717 N718 Q719 Q724 I725E717-L721 HydrophobicContact CG-CD1 4.49Å; E717-L721 WeakPolarHBondContact O-CG 3.35Å; E717-L721 PolarHBondContact O-N 3.15Å; N718-L721 PolarHBondContact O-N 2.88Å; Q719-L721 PolarHBondContact O-N 3.48Å; L721-Q724 PolarHBondContact O-N 2.88Å; L721-I725 VanDerWaalsContact O-CG1 3.26Å; L721-I725 WeakPolarHBondContact O-CG1 3.42Å; L721-I725 PolarHBondContact O-N 2.86Å
722L85.4Confident86Confident117 Ų117102 Ų10261%0.61349%0.492SS*.Hα-helixtrans-66.3-41.1175.6-76.7170.1000112.2N718 Q719 I725 E726N718-L722 WeakPolarHBondContact O-CB 3.29Å; N718-L722 VanDerWaalsContact O-CG 3.29Å; N718-L722 WeakPolarHBondContact O-CG 3.39Å; N718-L722 PolarHBondContact O-N 2.96Å; Q719-L722 PolarHBondContact O-N 2.96Å; L722-I725 PolarHBondContact O-N 2.87Å; L722-E726 PolarHBondContact O-N 2.81Å
723E85.9Confident86Confident120 Ų120102.9 Ų102.956%0.56149%0.49SS*.Hα-helixtrans-61.8-44.5173.6-76.7178177.900111.4Q719 L720 I725 E726 Q727Q719-E723 PolarHBondContact O-N 3.4Å; L720-E723 PolarHBondContact O-N 3.5Å; E723-I725 PolarHBondContact O-N 3.28Å; E723-E726 PolarHBondContact O-N 2.98Å; E723-Q727 WeakPolarHBondContact O-CG 3.46Å; E723-Q727 PolarHBondContact O-N 2.88Å
724Q86.8Confident86Confident86 Ų86104.5 Ų104.540%0.40249%0.493SS..Hα-helixtrans-60.4-44175.9-174.46045.100111.9L720 L721 E726 Q727 D728L720-Q724 WeakPolarHBondContact O-CB 3.19Å; L720-Q724 PolarHBondContact O-N 2.72Å; L721-Q724 PolarHBondContact O-N 2.88Å; Q724-E726 VanDerWaalsContact C-N 3.33Å; Q724-E726 PolarHBondContact O-N 2.91Å; Q724-Q727 PolarHBondContact O-N 3.28Å; Q724-D728 PolarHBondContact NE2-OD1 3.48Å; Q724-D728 PolarHBondContact NE2-OD2 3.32Å; Q724-D728 PolarHBondContact O-N 3.42Å
725I86.2Confident86Confident86 Ų86105.3 Ų105.344%0.44150%0.497SS..Hα-helixtrans-62.1-39.7176.4-72.2166.3000111.3L721 L722 E723 D728 K729L721-I725 VanDerWaalsContact O-CG1 3.26Å; L721-I725 WeakPolarHBondContact O-CG1 3.42Å; L721-I725 PolarHBondContact O-N 2.86Å; L722-I725 PolarHBondContact O-N 2.87Å; E723-I725 PolarHBondContact O-N 3.28Å; I725-D728 PolarHBondContact O-N 2.83Å; I725-K729 HydrophobicContact CG2-CD 4.3Å; I725-K729 WeakPolarHBondContact O-CB 3.38Å; I725-K729 WeakPolarHBondContact O-CG 3.27Å; I725-K729 PolarHBondContact O-N 3.36Å
726E86.5Confident86.1Confident73 Ų73107.2 Ų107.234%0.34150%0.501SS..Hα-helixtrans-70.1-38.6178.7-168.156.8-148.800111.8L722 E723 Q724 D728 K729 Q730 R733L722-E726 PolarHBondContact O-N 2.81Å; E723-E726 PolarHBondContact O-N 2.98Å; Q724-E726 VanDerWaalsContact C-N 3.33Å; Q724-E726 PolarHBondContact O-N 2.91Å; E726-D728 VanDerWaalsContact C-N 3.35Å; E726-D728 PolarHBondContact O-N 3.37Å; E726-K729 PolarHBondContact O-N 3.48Å; E726-K729 WeakPolarHBondContact OE2-CD 3.39Å; E726-K729 IonicContact OE2-NZ 3.09Å; E726-Q730 WeakPolarHBondContact O-CG 3.45Å; E726-Q730 PolarHBondContact O-N 3.21Å; E726-R733 IonicContact OE1-CZ 3.4Å; E726-R733 IonicContact OE1-NH2 2.84Å; E726-R733 PolarHBondContact OE1-NH2 2.93Å
727Q86.2Confident85.9Confident98 Ų98106.8 Ų106.846%0.45850%0.501SS..Hα-helixtrans-60.5-44171.9-71-1781200111.7E723 Q724 Q730 K731E723-Q727 WeakPolarHBondContact O-CG 3.46Å; E723-Q727 PolarHBondContact O-N 2.88Å; Q724-Q727 PolarHBondContact O-N 3.28Å; Q727-Q730 PolarHBondContact O-N 3.34Å; Q727-K731 WeakPolarHBondContact O-CG 3.34Å; Q727-K731 PolarHBondContact O-N 3.08Å
728D86.3Confident85.9Confident74 Ų74108.8 Ų108.840%0.39650%0.504SS..Hα-helixtrans-69.1-35.2178.5-71.5-21.2000111.9Q724 I725 E726 Q730 K731 R732Q724-D728 PolarHBondContact NE2-OD1 3.48Å; Q724-D728 PolarHBondContact NE2-OD2 3.32Å; Q724-D728 PolarHBondContact O-N 3.42Å; I725-D728 PolarHBondContact O-N 2.83Å; E726-D728 VanDerWaalsContact C-N 3.35Å; E726-D728 PolarHBondContact O-N 3.37Å; D728-Q730 VanDerWaalsContact C-N 3.35Å; D728-Q730 PolarHBondContact O-N 3.38Å; D728-K731 PolarHBondContact O-N 3.21Å; D728-K731 IonicContact OD1-NZ 3.71Å; D728-R732 WeakPolarHBondContact O-CB 3.44Å; D728-R732 PolarHBondContact O-N 3.37Å
729K86.5Confident86Confident108 Ų108109.3 Ų109.347%0.4751%0.505SS..Hα-helixtrans-61.2-41.3169.8-79.5175.3-177.3172.20112I725 E726 R732 R733I725-K729 HydrophobicContact CG2-CD 4.3Å; I725-K729 WeakPolarHBondContact O-CB 3.38Å; I725-K729 WeakPolarHBondContact O-CG 3.27Å; I725-K729 PolarHBondContact O-N 3.36Å; E726-K729 PolarHBondContact O-N 3.48Å; E726-K729 WeakPolarHBondContact OE2-CD 3.39Å; E726-K729 IonicContact OE2-NZ 3.09Å; K729-R732 PolarHBondContact O-N 3.46Å; K729-R733 WeakPolarHBondContact O-CG 3.25Å; K729-R733 PolarHBondContact O-N 3.2Å
730Q85.8Confident86.1Confident97 Ų97109.1 Ų109.145%0.45351%0.505SS..Hα-helixtrans-64.8-45.6176.2-73.1-177.82.500111.6E726 Q727 D728 R732 R733 Q734E726-Q730 WeakPolarHBondContact O-CG 3.45Å; E726-Q730 PolarHBondContact O-N 3.21Å; Q727-Q730 PolarHBondContact O-N 3.34Å; D728-Q730 VanDerWaalsContact C-N 3.35Å; D728-Q730 PolarHBondContact O-N 3.38Å; Q730-R732 VanDerWaalsContact C-N 3.27Å; Q730-R732 PolarHBondContact O-N 3.18Å; Q730-R733 PolarHBondContact O-N 3.45Å; Q730-Q734 WeakPolarHBondContact O-CG 3.35Å; Q730-Q734 PolarHBondContact O-N 3.28Å
731K87.3Confident86Confident108 Ų108107.8 Ų107.847%0.4750%0.498SS..Hα-helixtrans-57.9-41.1173.4-71174.2-172.3163.70111.6Q727 D728 Q734 L735Q727-K731 WeakPolarHBondContact O-CG 3.34Å; Q727-K731 PolarHBondContact O-N 3.08Å; D728-K731 PolarHBondContact O-N 3.21Å; D728-K731 IonicContact OD1-NZ 3.71Å; K731-Q734 PolarHBondContact O-N 3.37Å; K731-L735 WeakPolarHBondContact O-CG 3.48Å; K731-L735 PolarHBondContact O-N 2.97Å
732R86.5Confident86.2Confident172 Ų172108.6 Ų108.665%0.64950%0.499SS*.Hα-helixtrans-64.4-43.6177.5-149.7177.1-160.3-1347.7112.2D728 K729 Q730 Q734 L735 E736D728-R732 WeakPolarHBondContact O-CB 3.44Å; D728-R732 PolarHBondContact O-N 3.37Å; K729-R732 PolarHBondContact O-N 3.46Å; Q730-R732 VanDerWaalsContact C-N 3.27Å; Q730-R732 PolarHBondContact O-N 3.18Å; R732-Q734 VanDerWaalsContact C-N 3.33Å; R732-Q734 PolarHBondContact O-N 3.36Å; R732-L735 PolarHBondContact O-N 3.14Å; R732-E736 WeakPolarHBondContact O-CB 3.2Å; R732-E736 WeakPolarHBondContact O-CG 3.32Å; R732-E736 PolarHBondContact O-N 3.31Å
733R85.8Confident86.2Confident135 Ų135106.6 Ų106.651%0.50950%0.495SS..Hα-helixtrans-59.9-42173.2-72.4-177.7-136.5147.210.2111.9E726 K729 Q730 E736 Q737E726-R733 IonicContact OE1-CZ 3.4Å; E726-R733 IonicContact OE1-NH2 2.84Å; E726-R733 PolarHBondContact OE1-NH2 2.93Å; K729-R733 WeakPolarHBondContact O-CG 3.25Å; K729-R733 PolarHBondContact O-N 3.2Å; Q730-R733 PolarHBondContact O-N 3.45Å; R733-E736 PolarHBondContact O-N 3.1Å; R733-Q737 WeakPolarHBondContact O-CB 3.5Å; R733-Q737 PolarHBondContact O-N 3.39Å
734Q85.3Confident86.2Confident105 Ų105106.4 Ų106.449%0.49149%0.493SS..Hα-helixtrans-64.3-41.5176.9-70.6176-0.700112Q730 K731 R732 Q737 R738Q730-Q734 WeakPolarHBondContact O-CG 3.35Å; Q730-Q734 PolarHBondContact O-N 3.28Å; K731-Q734 PolarHBondContact O-N 3.37Å; R732-Q734 VanDerWaalsContact C-N 3.33Å; R732-Q734 PolarHBondContact O-N 3.36Å; Q734-Q737 PolarHBondContact O-N 2.93Å; Q734-R738 WeakPolarHBondContact O-CG 3.31Å; Q734-R738 PolarHBondContact O-N 3.44Å
735L84.7Confident86.3Confident96 Ų96105.5 Ų105.550%0.50350%0.496SS..Hα-helixtrans-66-43.5175.4-74.4169.9000111.9K731 R732 Q737 R738 I739K731-L735 WeakPolarHBondContact O-CG 3.48Å; K731-L735 PolarHBondContact O-N 2.97Å; R732-L735 PolarHBondContact O-N 3.14Å; L735-Q737 VanDerWaalsContact C-N 3.28Å; L735-Q737 PolarHBondContact O-N 3.01Å; L735-R738 PolarHBondContact O-N 3.24Å; L735-I739 WeakPolarHBondContact O-CG1 3.46Å; L735-I739 PolarHBondContact O-N 3.04Å
736E85.8Confident86.4Confident110 Ų110107.7 Ų107.751%0.51450%0.504SS..Hα-helixtrans-58-41.8174.1-78.9169.6-176.100111.3R732 R733 I739 Q740R732-E736 WeakPolarHBondContact O-CB 3.2Å; R732-E736 WeakPolarHBondContact O-CG 3.32Å; R732-E736 PolarHBondContact O-N 3.31Å; R733-E736 PolarHBondContact O-N 3.1Å; E736-I739 PolarHBondContact O-N 3.33Å; E736-Q740 WeakPolarHBondContact O-CB 3.25Å; E736-Q740 PolarHBondContact O-N 2.96Å
737Q83.8Confident86.6Confident121 Ų121108.8 Ų108.857%0.56551%0.509SS*.Hα-helixtrans-67.5-39.1176.9-164.4172.214.300112.4R733 Q734 L735 Q740 N741R733-Q737 WeakPolarHBondContact O-CB 3.5Å; R733-Q737 PolarHBondContact O-N 3.39Å; Q734-Q737 PolarHBondContact O-N 2.93Å; L735-Q737 VanDerWaalsContact C-N 3.28Å; L735-Q737 PolarHBondContact O-N 3.01Å; Q737-Q740 PolarHBondContact O-N 3.42Å; Q737-N741 WeakPolarHBondContact O-CB 3.39Å; Q737-N741 PolarHBondContact O-N 3.33Å; Q737-N741 PolarHBondContact O-ND2 2.9Å
738R86.5Confident86.7Confident156 Ų156109.9 Ų109.959%0.58951%0.514SS*.Hα-helixtrans-62.6-47.8173.6-74178.2-172.5177.83.2111.6Q734 L735 Q740 N741 E742Q734-R738 WeakPolarHBondContact O-CG 3.31Å; Q734-R738 PolarHBondContact O-N 3.44Å; L735-R738 PolarHBondContact O-N 3.24Å; R738-Q740 VanDerWaalsContact C-N 3.3Å; R738-Q740 PolarHBondContact O-N 3.23Å; R738-N741 PolarHBondContact O-N 2.78Å; R738-N741 VanDerWaalsContact O-N 3.14Å; R738-E742 WeakPolarHBondContact O-CG 3.35Å; R738-E742 PolarHBondContact O-N 3.31Å
739I85.9Confident86.9Confident106 Ų106109.1 Ų109.154%0.54451%0.514SS..Hα-helixtrans-60.9-40.7176.9-68.4168.1000110.7L735 E736 N741 E742 S743L735-I739 WeakPolarHBondContact O-CG1 3.46Å; L735-I739 PolarHBondContact O-N 3.04Å; E736-I739 PolarHBondContact O-N 3.33Å; I739-N741 VanDerWaalsContact C-N 3.34Å; I739-N741 PolarHBondContact O-N 2.84Å; I739-E742 PolarHBondContact O-N 3.46Å; I739-S743 VanDerWaalsContact O-CB 3.27Å; I739-S743 WeakPolarHBondContact O-CB 3.48Å; I739-S743 PolarHBondContact O-N 3.2Å
740Q88Confident87Confident114 Ų114109.2 Ų109.253%0.53352%0.515SS..Hα-helixtrans-63.9-40.3176.4-171.1176.815.500111.9E736 Q737 R738 K744E736-Q740 WeakPolarHBondContact O-CB 3.25Å; E736-Q740 PolarHBondContact O-N 2.96Å; Q737-Q740 PolarHBondContact O-N 3.42Å; R738-Q740 VanDerWaalsContact C-N 3.3Å; R738-Q740 PolarHBondContact O-N 3.23Å; Q740-K744 WeakPolarHBondContact O-CG 3.48Å; Q740-K744 PolarHBondContact O-N 3.28Å
741N86.8Confident87.1Confident87 Ų87107.9 Ų107.947%0.46551%0.513SS..Hα-helixtrans-68-43.6176.7-69-16.5000111.7Q737 R738 I739 K744 S745Q737-N741 WeakPolarHBondContact O-CB 3.39Å; Q737-N741 PolarHBondContact O-N 3.33Å; Q737-N741 PolarHBondContact O-ND2 2.9Å; R738-N741 PolarHBondContact O-N 2.78Å; R738-N741 VanDerWaalsContact O-N 3.14Å; I739-N741 VanDerWaalsContact C-N 3.34Å; I739-N741 PolarHBondContact O-N 2.84Å; N741-K744 PolarHBondContact O-N 2.86Å; N741-S745 WeakPolarHBondContact O-CB 3.39Å; N741-S745 PolarHBondContact O-N 3.35Å
742E87.5Confident87.3Confident111 Ų111107.2 Ų107.252%0.51951%0.514SS..Hα-helixtrans-61.3-43.7174.3-73.6171.8-170.800111.2R738 I739 K744 S745 H746R738-E742 WeakPolarHBondContact O-CG 3.35Å; R738-E742 PolarHBondContact O-N 3.31Å; I739-E742 PolarHBondContact O-N 3.46Å; E742-K744 VanDerWaalsContact C-N 3.34Å; E742-K744 PolarHBondContact O-N 3.25Å; E742-S745 PolarHBondContact O-N 3.5Å; E742-H746 WeakPolarHBondContact O-CB 3.47Å; E742-H746 PolarHBondContact O-CD2 3.33Å; E742-H746 PolarHBondContact O-N 2.89Å
743S86Confident87.4Confident75 Ų75103.3 Ų103.352%0.52451%0.505SS..Hα-helixtrans-62-39.9176.3-177.70000112.2I739 E747I739-S743 VanDerWaalsContact O-CB 3.27Å; I739-S743 WeakPolarHBondContact O-CB 3.48Å; I739-S743 PolarHBondContact O-N 3.2Å; S743-E747 PolarHBondContact O-N 3.46Å
744K87.3Confident87.5Confident117 Ų117100.6 Ų100.651%0.50950%0.504SS..Hα-helixtrans-64.4-46.4173.8-77178.9179.2-179.80111.5Q740 N741 E742 H746 E747 E748Q740-K744 WeakPolarHBondContact O-CG 3.48Å; Q740-K744 PolarHBondContact O-N 3.28Å; N741-K744 PolarHBondContact O-N 2.86Å; E742-K744 VanDerWaalsContact C-N 3.34Å; E742-K744 PolarHBondContact O-N 3.25Å; K744-H746 VanDerWaalsContact C-N 3.32Å; K744-H746 PolarHBondContact O-N 3.43Å; K744-E747 PolarHBondContact O-N 3.47Å; K744-E747 VanDerWaalsContact O-N 3.14Å; K744-E748 WeakPolarHBondContact O-CG 3.48Å; K744-E748 PolarHBondContact O-N 3.37Å
745S88.9Confident87.6Confident67 Ų67100.6 Ų100.647%0.46951%0.507SS..Hα-helixtrans-62.2-39178.1-176.70000112.2N741 E742 E748 S749N741-S745 WeakPolarHBondContact O-CB 3.39Å; N741-S745 PolarHBondContact O-N 3.35Å; E742-S745 PolarHBondContact O-N 3.5Å; S745-E748 PolarHBondContact O-N 2.92Å; S745-S749 WeakPolarHBondContact O-CB 3.36Å; S745-S749 PolarHBondContact O-N 2.98Å
746H87.8Confident87.9Confident131 Ų131100.9 Ų100.961%0.60651%0.506SS*.Hα-helixtrans-65.9-38.1173.3-77.6-52.8000112.4E742 K744 S749 K750E742-H746 WeakPolarHBondContact O-CB 3.47Å; E742-H746 PolarHBondContact O-CD2 3.33Å; E742-H746 PolarHBondContact O-N 2.89Å; K744-H746 VanDerWaalsContact C-N 3.32Å; K744-H746 PolarHBondContact O-N 3.43Å; H746-S749 PolarHBondContact O-N 3.19Å; H746-K750 WeakPolarHBondContact O-CB 3.32Å; H746-K750 PolarHBondContact O-N 3.43Å
747E89.5Confident88.1Confident97 Ų97100.2 Ų100.245%0.45351%0.505SS..Hα-helixtrans-69.4-36.8176-158.162.4-152.800111.9S743 K744 K750 T751S743-E747 PolarHBondContact O-N 3.46Å; K744-E747 PolarHBondContact O-N 3.47Å; K744-E747 VanDerWaalsContact O-N 3.14Å; E747-K750 PolarHBondContact O-N 2.85Å; E747-K750 IonicContact OE1-NZ 3.03Å; E747-K750 PolarHBondContact OE1-NZ 2.89Å; E747-K750 IonicContact OE2-NZ 3.4Å; E747-K750 PolarHBondContact OE2-NZ 3.44Å; E747-T751 WeakPolarHBondContact O-CG2 3.48Å; E747-T751 PolarHBondContact O-N 3.41Å; E747-T751 PolarHBondContact O-OG1 3.32Å
748E88.1Confident88.2Confident120 Ų12097.6 Ų97.656%0.56150%0.5SS*.Hα-helixtrans-62.5-46.1170.2-73171.3-173.600111.6K744 S745 K750 T751 I752K744-E748 WeakPolarHBondContact O-CG 3.48Å; K744-E748 PolarHBondContact O-N 3.37Å; S745-E748 PolarHBondContact O-N 2.92Å; E748-K750 VanDerWaalsContact C-N 3.34Å; E748-K750 PolarHBondContact O-N 3.34Å; E748-T751 VanDerWaalsContact CA-OG1 3.3Å; E748-T751 WeakPolarHBondContact CA-OG1 3.36Å; E748-T751 PolarHBondContact O-N 2.91Å; E748-T751 PolarHBondContact O-OG1 3.33Å; E748-I752 VanDerWaalsContact O-CG1 3.28Å; E748-I752 WeakPolarHBondContact O-CG1 3.43Å; E748-I752 PolarHBondContact O-N 3.08Å
749S90.5Very high88.4Confident58 Ų5894.8 Ų94.841%0.40650%0.497SS..Hα-helixtrans-65.1-40177.7-162.30000111.7S745 H746 I752 L753S745-S749 WeakPolarHBondContact O-CB 3.36Å; S745-S749 PolarHBondContact O-N 2.98Å; H746-S749 PolarHBondContact O-N 3.19Å; S749-I752 PolarHBondContact O-N 3.13Å; S749-L753 WeakPolarHBondContact O-CB 3.37Å; S749-L753 WeakPolarHBondContact O-CG 3.5Å; S749-L753 PolarHBondContact O-N 2.96Å
750K89.9Confident88.6Confident111 Ų11194.8 Ų94.848%0.48350%0.497SS..Hα-helixtrans-63.1-41.4174.7178.5-178.5161.5-146.80111.8H746 E747 E748 L753 T754H746-K750 WeakPolarHBondContact O-CB 3.32Å; H746-K750 PolarHBondContact O-N 3.43Å; E747-K750 PolarHBondContact O-N 2.85Å; E747-K750 IonicContact OE1-NZ 3.03Å; E747-K750 PolarHBondContact OE1-NZ 2.89Å; E747-K750 IonicContact OE2-NZ 3.4Å; E747-K750 PolarHBondContact OE2-NZ 3.44Å; E748-K750 VanDerWaalsContact C-N 3.34Å; E748-K750 PolarHBondContact O-N 3.34Å; K750-L753 PolarHBondContact O-N 3.41Å; K750-T754 VanDerWaalsContact O-CB 3.31Å; K750-T754 WeakPolarHBondContact O-CB 3.44Å; K750-T754 PolarHBondContact O-N 2.8Å; K750-T754 PolarHBondContact O-OG1 3.39Å
751T88Confident88.6Confident68 Ų6894 Ų9442%0.41750%0.497SS..Hα-helixtrans-66-41.3175.844.40000111.4E747 E748 T754 N755E747-T751 WeakPolarHBondContact O-CG2 3.48Å; E747-T751 PolarHBondContact O-N 3.41Å; E747-T751 PolarHBondContact O-OG1 3.32Å; E748-T751 VanDerWaalsContact CA-OG1 3.3Å; E748-T751 WeakPolarHBondContact CA-OG1 3.36Å; E748-T751 PolarHBondContact O-N 2.91Å; E748-T751 PolarHBondContact O-OG1 3.33Å; T751-T754 PolarHBondContact O-N 2.97Å; T751-N755 VanDerWaalsContact O-CG 3.22Å; T751-N755 PolarHBondContact O-N 3.3Å; T751-N755 PolarHBondContact O-ND2 2.99Å
752I90.2Very high88.7Confident94 Ų9493.3 Ų93.348%0.48250%0.496SS..Hα-helixtrans-59.4-49.8173-67.1164.9000111.2E748 S749 T754 N755 Q756E748-I752 VanDerWaalsContact O-CG1 3.28Å; E748-I752 WeakPolarHBondContact O-CG1 3.43Å; E748-I752 PolarHBondContact O-N 3.08Å; S749-I752 PolarHBondContact O-N 3.13Å; I752-T754 VanDerWaalsContact C-N 3.32Å; I752-T754 PolarHBondContact O-N 3.47Å; I752-N755 PolarHBondContact O-N 3.41Å; I752-Q756 WeakPolarHBondContact O-CG 3.45Å; I752-Q756 PolarHBondContact O-N 3.26Å
753L88.4Confident88.9Confident90 Ų9094.2 Ų94.247%0.47150%0.498SS..Hα-helixtrans-63.6-38.7179-73.4170.1000111.9S749 K750 N755 Q756 I757S749-L753 WeakPolarHBondContact O-CB 3.37Å; S749-L753 WeakPolarHBondContact O-CG 3.5Å; S749-L753 PolarHBondContact O-N 2.96Å; K750-L753 PolarHBondContact O-N 3.41Å; L753-N755 VanDerWaalsContact C-N 3.33Å; L753-N755 PolarHBondContact O-N 3.25Å; L753-Q756 PolarHBondContact O-N 2.88Å; L753-I757 WeakPolarHBondContact O-CB 3.4Å; L753-I757 VanDerWaalsContact O-CG1 3.29Å; L753-I757 WeakPolarHBondContact O-CG1 3.32Å; L753-I757 PolarHBondContact O-N 2.88Å
754T88.9Confident89Confident79 Ų7994.9 Ų94.949%0.48550%0.495SS..Hα-helixtrans-62.1-43.4175.9-56.70000110.8K750 T751 I752 I757 S758K750-T754 VanDerWaalsContact O-CB 3.31Å; K750-T754 WeakPolarHBondContact O-CB 3.44Å; K750-T754 PolarHBondContact O-N 2.8Å; K750-T754 PolarHBondContact O-OG1 3.39Å; T751-T754 PolarHBondContact O-N 2.97Å; I752-T754 VanDerWaalsContact C-N 3.32Å; I752-T754 PolarHBondContact O-N 3.47Å; T754-I757 PolarHBondContact O-N 3.44Å; T754-S758 PolarHBondContact O-N 3.28Å
755N88Confident89.1Confident104 Ų10493.6 Ų93.656%0.55649%0.488SS*.Hα-helixtrans-64.3-42.3175.5-68.1-16.3000111.7T751 I752 L753 I757 S758 D759T751-N755 VanDerWaalsContact O-CG 3.22Å; T751-N755 PolarHBondContact O-N 3.3Å; T751-N755 PolarHBondContact O-ND2 2.99Å; I752-N755 PolarHBondContact O-N 3.41Å; L753-N755 VanDerWaalsContact C-N 3.33Å; L753-N755 PolarHBondContact O-N 3.25Å; N755-I757 PolarHBondContact O-N 2.83Å; N755-S758 WeakPolarHBondContact O-CB 3.49Å; N755-S758 PolarHBondContact O-N 2.84Å; N755-D759 PolarHBondContact O-N 3.34Å
756Q90.7Very high89.1Confident102 Ų10294.3 Ų94.348%0.47749%0.486SS..Hα-helixtrans-63.1-40.9175.7-73.4177.9-7.300112.6I752 L753 S758 D759 L760I752-Q756 WeakPolarHBondContact O-CG 3.45Å; I752-Q756 PolarHBondContact O-N 3.26Å; L753-Q756 PolarHBondContact O-N 2.88Å; Q756-S758 VanDerWaalsContact C-N 3.33Å; Q756-D759 PolarHBondContact O-N 3.3Å; Q756-L760 WeakPolarHBondContact O-CB 3.49Å; Q756-L760 WeakPolarHBondContact O-CG 3.41Å; Q756-L760 PolarHBondContact O-N 3.49Å
757I88.6Confident89Confident97 Ų9792 Ų9250%0.49748%0.482SS..Hα-helixtrans-62.8-42.7174.3-71.1166.9000110.1L753 T754 N755 D759 L760 N761L753-I757 WeakPolarHBondContact O-CB 3.4Å; L753-I757 VanDerWaalsContact O-CG1 3.29Å; L753-I757 WeakPolarHBondContact O-CG1 3.32Å; L753-I757 PolarHBondContact O-N 2.88Å; T754-I757 PolarHBondContact O-N 3.44Å; N755-I757 PolarHBondContact O-N 2.83Å; I757-D759 PolarHBondContact O-N 2.8Å; I757-L760 PolarHBondContact O-N 3.42Å; I757-N761 VanDerWaalsContact O-CB 3.31Å; I757-N761 WeakPolarHBondContact O-CB 3.34Å; I757-N761 VanDerWaalsContact O-CG 3.23Å; I757-N761 PolarHBondContact O-N 3.31Å; I757-N761 PolarHBondContact O-ND2 3.3Å
758S87.7Confident88.9Confident65 Ų6592.8 Ų92.846%0.45549%0.485SS..Hα-helixtrans-59.1-46174.8-174.50000111.9T754 N755 Q756 N761 T762T754-S758 PolarHBondContact O-N 3.28Å; N755-S758 WeakPolarHBondContact O-CB 3.49Å; N755-S758 PolarHBondContact O-N 2.84Å; Q756-S758 VanDerWaalsContact C-N 3.33Å; S758-N761 PolarHBondContact O-N 3.36Å; S758-T762 WeakPolarHBondContact O-CB 3.29Å; S758-T762 PolarHBondContact O-N 3.35Å; S758-T762 PolarHBondContact O-OG1 2.65Å
759D89.9Confident88.9Confident97 Ų9792.2 Ų92.252%0.51948%0.481SS..Hα-helixtrans-64.8-42.9177.3-83.5-2.2000112.5N755 Q756 I757 T762 K763N755-D759 PolarHBondContact O-N 3.34Å; Q756-D759 PolarHBondContact O-N 3.3Å; I757-D759 PolarHBondContact O-N 2.8Å; D759-T762 PolarHBondContact O-N 3.35Å; D759-K763 WeakPolarHBondContact O-CG 3.42Å; D759-K763 PolarHBondContact O-N 3.14Å
760L89.1Confident88.7Confident106 Ų10698.1 Ų98.156%0.55549%0.494SS*.Hα-helixtrans-65.5-43.3177-76.2172.5000111.4Q756 I757 T762 K763 L764Q756-L760 WeakPolarHBondContact O-CB 3.49Å; Q756-L760 WeakPolarHBondContact O-CG 3.41Å; Q756-L760 PolarHBondContact O-N 3.49Å; I757-L760 PolarHBondContact O-N 3.42Å; L760-T762 VanDerWaalsContact C-N 3.28Å; L760-T762 PolarHBondContact O-N 2.89Å; L760-K763 PolarHBondContact O-N 2.95Å; L760-L764 VanDerWaalsContact O-CB 3.26Å; L760-L764 WeakPolarHBondContact O-CB 3.44Å; L760-L764 PolarHBondContact O-N 3.46Å
761N89.7Confident88.5Confident98 Ų9897.6 Ų97.652%0.52450%0.496SS..Hα-helixtrans-60.7-39.5174.1-75.9-23000111.3I757 S758 L764 Y765I757-N761 VanDerWaalsContact O-CB 3.31Å; I757-N761 WeakPolarHBondContact O-CB 3.34Å; I757-N761 VanDerWaalsContact O-CG 3.23Å; I757-N761 PolarHBondContact O-N 3.31Å; I757-N761 PolarHBondContact O-ND2 3.3Å; S758-N761 PolarHBondContact O-N 3.36Å; N761-L764 PolarHBondContact O-N 3.49Å; N761-Y765 WeakPolarHBondContact O-CB 3.43Å; N761-Y765 PolarHBondContact O-N 3.41Å
762T88.3Confident88.4Confident73 Ų7399.2 Ų99.245%0.44850%0.499SS..Hα-helixtrans-65.1-42.5175.5-530000111.6S758 D759 L760 N766S758-T762 WeakPolarHBondContact O-CB 3.29Å; S758-T762 PolarHBondContact O-N 3.35Å; S758-T762 PolarHBondContact O-OG1 2.65Å; D759-T762 PolarHBondContact O-N 3.35Å; L760-T762 VanDerWaalsContact C-N 3.28Å; L760-T762 PolarHBondContact O-N 2.89Å; T762-N766 WeakPolarHBondContact O-CB 3.43Å; T762-N766 VanDerWaalsContact O-CG 3.24Å; T762-N766 PolarHBondContact O-N 2.97Å; T762-N766 PolarHBondContact O-ND2 2.94Å; T762-N766 VanDerWaalsContact O-ND2 3.15Å
763K90.8Very high88.2Confident130 Ų13099.1 Ų99.157%0.56550%0.497SS*.Hα-helixtrans-64.4-43.9174.7-74.2171.2-177171.90111.7D759 L760 N766 T767D759-K763 WeakPolarHBondContact O-CG 3.42Å; D759-K763 PolarHBondContact O-N 3.14Å; L760-K763 PolarHBondContact O-N 2.95Å; K763-N766 WeakPolarHBondContact O-CB 3.49Å; K763-N766 PolarHBondContact O-N 2.95Å; K763-T767 WeakPolarHBondContact O-CG2 3.45Å; K763-T767 PolarHBondContact O-N 3.39Å; K763-T767 PolarHBondContact O-OG1 3.44Å
764L88.3Confident88Confident88 Ų8898.6 Ų98.646%0.46150%0.497SS..Hα-helixtrans-62.3-47-179.9-161151.2000110.2L760 N761 N766 T767 E768L760-L764 VanDerWaalsContact O-CB 3.26Å; L760-L764 WeakPolarHBondContact O-CB 3.44Å; L760-L764 PolarHBondContact O-N 3.46Å; N761-L764 PolarHBondContact O-N 3.49Å; L764-N766 VanDerWaalsContact C-N 3.33Å; L764-N766 PolarHBondContact O-N 3.3Å; L764-T767 VanDerWaalsContact CA-OG1 3.3Å; L764-T767 WeakPolarHBondContact CA-OG1 3.41Å; L764-T767 PolarHBondContact O-N 2.88Å; L764-T767 VanDerWaalsContact O-N 3.14Å; L764-T767 PolarHBondContact O-OG1 3.36Å; L764-E768 VanDerWaalsContact CD2-CD 3.43Å; L764-E768 HydrophobicContact CD2-CG 3.99Å; L764-E768 WeakPolarHBondContact CD2-OE1 3.49Å; L764-E768 WeakPolarHBondContact O-CG 3.37Å; L764-E768 PolarHBondContact O-N 3.4Å
765Y90.1Very high87.8Confident91 Ų9199.9 Ų99.936%0.35750%0.498SS..Hα-helixtrans-56-44.4171.9179.7-101.2000112.5N761 E768 K769 L827N761-Y765 WeakPolarHBondContact O-CB 3.43Å; N761-Y765 PolarHBondContact O-N 3.41Å; Y765-E768 PolarHBondContact O-N 3.48Å; Y765-K769 WeakPolarHBondContact O-CB 3.34Å; Y765-K769 PolarHBondContact O-N 2.96Å; Y765-L827 WeakPolarHBondContact OH-CD2 3.41Å
766N87.9Confident87.6Confident82 Ų8298.2 Ų98.244%0.43949%0.489SS..Hα-helixtrans-67-35.8177.3-72.8-30.3000112.9T762 K763 L764 R770T762-N766 WeakPolarHBondContact O-CB 3.43Å; T762-N766 VanDerWaalsContact O-CG 3.24Å; T762-N766 PolarHBondContact O-N 2.97Å; T762-N766 PolarHBondContact O-ND2 2.94Å; T762-N766 VanDerWaalsContact O-ND2 3.15Å; K763-N766 WeakPolarHBondContact O-CB 3.49Å; K763-N766 PolarHBondContact O-N 2.95Å; L764-N766 VanDerWaalsContact C-N 3.33Å; L764-N766 PolarHBondContact O-N 3.3Å; N766-R770 PolarHBondContact O-N 2.93Å
767T86Confident87.3Confident83 Ų83100 Ų10051%0.50950%0.497SS..Hα-helixtrans-71.6-39.7175.749.40000112.1K763 L764 K769 R770 L771K763-T767 WeakPolarHBondContact O-CG2 3.45Å; K763-T767 PolarHBondContact O-N 3.39Å; K763-T767 PolarHBondContact O-OG1 3.44Å; L764-T767 VanDerWaalsContact CA-OG1 3.3Å; L764-T767 WeakPolarHBondContact CA-OG1 3.41Å; L764-T767 PolarHBondContact O-N 2.88Å; L764-T767 VanDerWaalsContact O-N 3.14Å; L764-T767 PolarHBondContact O-OG1 3.36Å; T767-K769 VanDerWaalsContact C-N 3.33Å; T767-R770 PolarHBondContact O-N 3.5Å; T767-L771 WeakPolarHBondContact O-CB 3.49Å; T767-L771 PolarHBondContact O-N 2.78Å
768E87.8Confident87.1Confident113 Ų113102.7 Ų102.753%0.52851%0.505SS..Hα-helixtrans-61.8-43.1173.4-74.6177.1159.100110.6L764 Y765 R770 L771 H772L764-E768 VanDerWaalsContact CD2-CD 3.43Å; L764-E768 HydrophobicContact CD2-CG 3.99Å; L764-E768 WeakPolarHBondContact CD2-OE1 3.49Å; L764-E768 WeakPolarHBondContact O-CG 3.37Å; L764-E768 PolarHBondContact O-N 3.4Å; Y765-E768 PolarHBondContact O-N 3.48Å; E768-R770 PolarHBondContact O-N 3.19Å; E768-L771 PolarHBondContact O-N 3.42Å; E768-H772 WeakPolarHBondContact O-CB 3.48Å; E768-H772 PolarHBondContact O-N 3.28Å
769K88.2Confident86.9Confident108 Ų108106.3 Ų106.347%0.4751%0.51SS..Hα-helixtrans-59.3-47.3174.1-175.5178.8176.3-177.30111.9Y765 T767 H772 E773Y765-K769 WeakPolarHBondContact O-CB 3.34Å; Y765-K769 PolarHBondContact O-N 2.96Å; T767-K769 VanDerWaalsContact C-N 3.33Å; K769-H772 PolarHBondContact O-N 3.21Å; K769-E773 VanDerWaalsContact CE-OE1 3.25Å; K769-E773 WeakPolarHBondContact CE-OE1 3.47Å; K769-E773 WeakPolarHBondContact O-CG 3.47Å; K769-E773 PolarHBondContact O-N 2.98Å
770R86Confident86.6Confident181 Ų181106.3 Ų106.368%0.68351%0.509SS*.Hα-helixtrans-64.1-40.7176.5-84.9-177.6163.4172.2-3.3112.6N766 T767 E768 H772 E773 T774N766-R770 PolarHBondContact O-N 2.93Å; T767-R770 PolarHBondContact O-N 3.5Å; E768-R770 PolarHBondContact O-N 3.19Å; R770-H772 VanDerWaalsContact C-N 3.33Å; R770-E773 PolarHBondContact O-N 2.82Å; R770-T774 WeakPolarHBondContact O-CG2 3.46Å; R770-T774 PolarHBondContact O-N 3.42Å; R770-T774 PolarHBondContact O-OG1 3.45Å
771L86.6Confident86.2Confident101 Ų101103.8 Ų103.853%0.52950%0.504SS..Hα-helixtrans-59.4-48.5176.6-170.282.6000109.7T767 E768 E773 T774 E775T767-L771 WeakPolarHBondContact O-CB 3.49Å; T767-L771 PolarHBondContact O-N 2.78Å; E768-L771 PolarHBondContact O-N 3.42Å; L771-E773 VanDerWaalsContact C-N 3.34Å; L771-E773 PolarHBondContact O-N 3.46Å; L771-T774 WeakPolarHBondContact CA-OG1 3.33Å; L771-T774 CarbonylContact O-C 3.56Å; L771-T774 PolarHBondContact O-N 3.08Å; L771-T774 VanDerWaalsContact O-N 3.1Å; L771-T774 PolarHBondContact O-OG1 3.47Å; L771-E775 WeakPolarHBondContact O-CG 3.49Å; L771-E775 PolarHBondContact O-N 3.46Å
772H86.1Confident85.9Confident101 Ų101104.7 Ų104.747%0.46851%0.505SS..Hα-helixtrans-61.7-40177.3-16860000112.5E768 K769 R770 N776E768-H772 WeakPolarHBondContact O-CB 3.48Å; E768-H772 PolarHBondContact O-N 3.28Å; K769-H772 PolarHBondContact O-N 3.21Å; R770-H772 VanDerWaalsContact C-N 3.33Å; H772-N776 PolarHBondContact NE2-ND2 2.75Å; H772-N776 WeakPolarHBondContact O-CB 3.33Å; H772-N776 VanDerWaalsContact O-CG 3.29Å; H772-N776 PolarHBondContact O-N 3.06Å; H772-N776 PolarHBondContact O-ND2 2.93Å; H772-N776 VanDerWaalsContact O-ND2 3.17Å
773E85.1Confident85.7Confident93 Ų93105.6 Ų105.644%0.43550%0.504SS..Hα-helixtrans-61.9-42.2172.3-73.1167.4-176.600111.9K769 R770 L771 Q777K769-E773 VanDerWaalsContact CE-OE1 3.25Å; K769-E773 WeakPolarHBondContact CE-OE1 3.47Å; K769-E773 WeakPolarHBondContact O-CG 3.47Å; K769-E773 PolarHBondContact O-N 2.98Å; R770-E773 PolarHBondContact O-N 2.82Å; L771-E773 VanDerWaalsContact C-N 3.34Å; L771-E773 PolarHBondContact O-N 3.46Å; E773-Q777 WeakPolarHBondContact O-CG 3.39Å; E773-Q777 PolarHBondContact O-N 3.42Å
774T83.4Confident85.2Confident79 Ų79107.1 Ų107.149%0.48551%0.511SS..Hα-helixtrans-70.3-39.1177.652.80000113.1R770 L771 N776 Q777 F778R770-T774 WeakPolarHBondContact O-CG2 3.46Å; R770-T774 PolarHBondContact O-N 3.42Å; R770-T774 PolarHBondContact O-OG1 3.45Å; L771-T774 WeakPolarHBondContact CA-OG1 3.33Å; L771-T774 CarbonylContact O-C 3.56Å; L771-T774 PolarHBondContact O-N 3.08Å; L771-T774 VanDerWaalsContact O-N 3.1Å; L771-T774 PolarHBondContact O-OG1 3.47Å; T774-N776 VanDerWaalsContact C-N 3.34Å; T774-Q777 PolarHBondContact O-N 2.98Å; T774-F778 WeakPolarHBondContact O-CB 3.42Å; T774-F778 PolarHBondContact O-N 3.49Å
775E85.7Confident84.7Confident106 Ų106105.8 Ų105.850%0.49551%0.513SS..Hα-helixtrans-60.8-44.6173.6-77.1176.3167.400110.5L771 Q777 F778 Y779L771-E775 WeakPolarHBondContact O-CG 3.49Å; L771-E775 PolarHBondContact O-N 3.46Å; E775-Q777 VanDerWaalsContact C-N 3.34Å; E775-Q777 PolarHBondContact O-N 3.4Å; E775-F778 PolarHBondContact O-N 2.95Å; E775-Y779 WeakPolarHBondContact O-CB 3.26Å; E775-Y779 PolarHBondContact O-N 3.4Å
776N84.2Confident84.2Confident68 Ų68107 Ų10736%0.36452%0.522SS..Hα-helixtrans-62.3-39.7175.2-76-30.8000112.1H772 T774 L780H772-N776 PolarHBondContact NE2-ND2 2.75Å; H772-N776 WeakPolarHBondContact O-CB 3.33Å; H772-N776 VanDerWaalsContact O-CG 3.29Å; H772-N776 PolarHBondContact O-N 3.06Å; H772-N776 PolarHBondContact O-ND2 2.93Å; H772-N776 VanDerWaalsContact O-ND2 3.17Å; T774-N776 VanDerWaalsContact C-N 3.34Å; N776-L780 WeakPolarHBondContact O-CB 3.32Å; N776-L780 WeakPolarHBondContact O-CG 3.49Å; N776-L780 PolarHBondContact O-N 3.45Å; N776-L780 VanDerWaalsContact O-N 3.09Å
777Q84.8Confident83.8Confident140 Ų140108.8 Ų108.865%0.65453%0.53SS*.Hα-helixtrans-66.4-39.1173.7-74.4-168.81800112.5E773 T774 E775 L780 A781E773-Q777 WeakPolarHBondContact O-CG 3.39Å; E773-Q777 PolarHBondContact O-N 3.42Å; T774-Q777 PolarHBondContact O-N 2.98Å; E775-Q777 VanDerWaalsContact C-N 3.34Å; E775-Q777 PolarHBondContact O-N 3.4Å; Q777-L780 PolarHBondContact O-N 3.14Å; Q777-A781 WeakPolarHBondContact O-CB 3.38Å; Q777-A781 PolarHBondContact O-N 3.23Å
778F82.5Confident83.3Confident153 Ų153107.6 Ų107.667%0.67153%0.529SS*.Hα-helixtrans-66.2-45.1178.5-144.6-82000110.8T774 E775 L780 A781 E782T774-F778 WeakPolarHBondContact O-CB 3.42Å; T774-F778 PolarHBondContact O-N 3.49Å; E775-F778 PolarHBondContact O-N 2.95Å; F778-L780 VanDerWaalsContact C-N 3.33Å; F778-L780 PolarHBondContact O-N 2.87Å; F778-A781 CarbonylContact O-C 3.59Å; F778-A781 PolarHBondContact O-N 2.72Å; F778-A781 VanDerWaalsContact O-N 3.11Å; F778-E782 WeakPolarHBondContact O-CB 3.36Å; F778-E782 PolarHBondContact O-N 3.28Å
779Y85Confident82.7Confident142 Ų142105.9 Ų105.956%0.55753%0.529SS*.Hα-helixtrans-58.5-43.1174.8-176.2-100.5000112.1E775 E782 Q783E775-Y779 WeakPolarHBondContact O-CB 3.26Å; E775-Y779 PolarHBondContact O-N 3.4Å; Y779-E782 PolarHBondContact O-N 2.97Å; Y779-Q783 HydrophobicContact CE1-CG 4.38Å; Y779-Q783 PolarHBondContact O-N 3.41Å; Y779-Q783 PolarHBondContact OH-NE2 3.11Å
780L83.8Confident82.2Confident96 Ų96106.2 Ų106.250%0.50353%0.532SS..Hα-helixtrans-65.9-37.4174.3-77.1166.4000112.9N776 Q777 F778 K784N776-L780 WeakPolarHBondContact O-CB 3.32Å; N776-L780 WeakPolarHBondContact O-CG 3.49Å; N776-L780 PolarHBondContact O-N 3.45Å; N776-L780 VanDerWaalsContact O-N 3.09Å; Q777-L780 PolarHBondContact O-N 3.14Å; F778-L780 VanDerWaalsContact C-N 3.33Å; F778-L780 PolarHBondContact O-N 2.87Å; L780-K784 WeakPolarHBondContact O-CG 3.28Å; L780-K784 PolarHBondContact O-N 3.27Å; L780-K784 VanDerWaalsContact O-N 3.17Å
781A80.4Confident81.7Confident54 Ų54104.6 Ų104.645%0.44653%0.53SS..Hα-helixtrans-70.2-38.9176.800000111.7Q777 F778 K784 A785Q777-A781 WeakPolarHBondContact O-CB 3.38Å; Q777-A781 PolarHBondContact O-N 3.23Å; F778-A781 CarbonylContact O-C 3.59Å; F778-A781 PolarHBondContact O-N 2.72Å; F778-A781 VanDerWaalsContact O-N 3.11Å; A781-K784 PolarHBondContact O-N 3.48Å; A781-A785 WeakPolarHBondContact O-CB 3.49Å; A781-A785 PolarHBondContact O-N 3.37Å
782E83.9Confident80.9Confident116 Ų116102.2 Ų102.254%0.54253%0.525SS..Hα-helixtrans-65.1-46.5176.4-172.3167.3-152.100110.9F778 Y779 K784 A785 E786F778-E782 WeakPolarHBondContact O-CB 3.36Å; F778-E782 PolarHBondContact O-N 3.28Å; Y779-E782 PolarHBondContact O-N 2.97Å; E782-K784 VanDerWaalsContact C-N 3.29Å; E782-K784 PolarHBondContact O-N 3.37Å; E782-A785 PolarHBondContact O-N 3.11Å; E782-A785 VanDerWaalsContact O-N 3.14Å; E782-E786 WeakPolarHBondContact O-CB 3.28Å; E782-E786 PolarHBondContact O-N 3.43Å
783Q82.6Confident80.4Confident93 Ų93104.3 Ų104.344%0.43553%0.532SS..Hα-helixtrans-55.9-43.4171.6-82.4-167.34.800112Y779 E786 L787Y779-Q783 HydrophobicContact CE1-CG 4.38Å; Y779-Q783 PolarHBondContact O-N 3.41Å; Y779-Q783 PolarHBondContact OH-NE2 3.11Å; Q783-E786 PolarHBondContact O-N 3.02Å; Q783-L787 WeakPolarHBondContact O-CB 3.45Å; Q783-L787 PolarHBondContact O-N 3.42Å
784K80Confident79.6Confident161 Ų161105.8 Ų105.870%0.754%0.539SS*.Hα-helixtrans-65.3-41.1177-77.8179.3-178.4177.70112.5L780 A781 E782 L787 A788L780-K784 WeakPolarHBondContact O-CG 3.28Å; L780-K784 PolarHBondContact O-N 3.27Å; L780-K784 VanDerWaalsContact O-N 3.17Å; A781-K784 PolarHBondContact O-N 3.48Å; E782-K784 VanDerWaalsContact C-N 3.29Å; E782-K784 PolarHBondContact O-N 3.37Å; K784-L787 PolarHBondContact O-N 3.12Å; K784-A788 WeakPolarHBondContact O-CB 3.46Å; K784-A788 PolarHBondContact O-N 3.33Å
785A78.1Confident78.9Confident60 Ų60107.1 Ų107.150%0.49654%0.543SS..Hα-helixtrans-66.9-41178.600000111.3A781 E782 A788 C789A781-A785 WeakPolarHBondContact O-CB 3.49Å; A781-A785 PolarHBondContact O-N 3.37Å; E782-A785 PolarHBondContact O-N 3.11Å; E782-A785 VanDerWaalsContact O-N 3.14Å; A785-A788 PolarHBondContact O-N 2.87Å; A785-C789 WeakPolarHBondContact O-CB 3.46Å; A785-C789 PolarHBondContact O-N 3.31Å
786E80.7Confident78Confident117 Ų117106.6 Ų106.655%0.54755%0.547SS..Hα-helixtrans-64.3-43.1176.3-168.8163.9-158.200111.3E782 Q783 A788 C789 Q790E782-E786 WeakPolarHBondContact O-CB 3.28Å; E782-E786 PolarHBondContact O-N 3.43Å; Q783-E786 PolarHBondContact O-N 3.02Å; E786-A788 VanDerWaalsContact C-N 3.33Å; E786-A788 PolarHBondContact O-N 2.9Å; E786-C789 WeakPolarHBondContact O-CB 3.46Å; E786-C789 PolarHBondContact O-N 2.84Å; E786-Q790 WeakPolarHBondContact O-CG 3.39Å; E786-Q790 PolarHBondContact O-N 3.22Å
787L79.2Confident77.1Confident119 Ų119109.2 Ų109.262%0.62356%0.56SS**Hα-helixtrans-62-40.1174-139.2122.4000111.8Q783 K784 K791Q783-L787 WeakPolarHBondContact O-CB 3.45Å; Q783-L787 PolarHBondContact O-N 3.42Å; K784-L787 PolarHBondContact O-N 3.12Å; L787-K791 WeakPolarHBondContact O-CB 3.47Å; L787-K791 PolarHBondContact O-N 3.45Å
788A74.4Confident75.9Confident59 Ų59107.7 Ų107.749%0.48855%0.553SS.*Hα-helixtrans-66.3-39.1174.700000112.2K784 A785 E786 K791 A792K784-A788 WeakPolarHBondContact O-CB 3.46Å; K784-A788 PolarHBondContact O-N 3.33Å; A785-A788 PolarHBondContact O-N 2.87Å; E786-A788 VanDerWaalsContact C-N 3.33Å; E786-A788 PolarHBondContact O-N 2.9Å; A788-K791 PolarHBondContact O-N 3.38Å; A788-A792 WeakPolarHBondContact O-CB 3.35Å; A788-A792 PolarHBondContact O-N 3.42Å
789C75.6Confident74.6Confident77 Ų77103.6 Ų103.652%0.5255%0.547SS..Hα-helixtrans-66.1-41.9176.6-121.30000111.7A785 E786 K791 A792 K793A785-C789 WeakPolarHBondContact O-CB 3.46Å; A785-C789 PolarHBondContact O-N 3.31Å; E786-C789 WeakPolarHBondContact O-CB 3.46Å; E786-C789 PolarHBondContact O-N 2.84Å; C789-K791 VanDerWaalsContact C-N 3.35Å; C789-A792 PolarHBondContact O-N 3.33Å; C789-K793 WeakPolarHBondContact O-CG 3.06Å; C789-K793 PolarHBondContact O-N 3.03Å
790Q78Confident73.3Confident114 Ų11499.8 Ų99.853%0.53355%0.545SS..Hα-helixtrans-61.2-44.5172.8-72178.68.600110.9E786 A792 K793 Q794E786-Q790 WeakPolarHBondContact O-CG 3.39Å; E786-Q790 PolarHBondContact O-N 3.22Å; Q790-A792 VanDerWaalsContact C-N 3.35Å; Q790-A792 PolarHBondContact O-N 3.44Å; Q790-K793 PolarHBondContact O-N 2.8Å; Q790-Q794 PolarHBondContact O-N 3.15Å
791K75.4Confident71.9Confident148 Ų14898.2 Ų98.264%0.64355%0.546SS*.Hα-helixtrans-62.8-39176.8-143.8170.8-170.2175.50112.5L787 A788 C789 Q794 L795L787-K791 WeakPolarHBondContact O-CB 3.47Å; L787-K791 PolarHBondContact O-N 3.45Å; A788-K791 PolarHBondContact O-N 3.38Å; C789-K791 VanDerWaalsContact C-N 3.35Å; K791-Q794 WeakPolarHBondContact O-CB 3.48Å; K791-Q794 PolarHBondContact O-N 3.34Å; K791-L795 WeakPolarHBondContact O-CG 3.26Å; K791-L795 PolarHBondContact O-N 3.09Å; K791-L795 VanDerWaalsContact O-N 3.08Å
792A70.7Confident70.5Confident50 Ų50101.7 Ų101.741%0.41356%0.561SS.*Hα-helixtrans-67.4-41.8174.700000112.3A788 C789 Q790 Q794 L795 T796A788-A792 WeakPolarHBondContact O-CB 3.35Å; A788-A792 PolarHBondContact O-N 3.42Å; C789-A792 PolarHBondContact O-N 3.33Å; Q790-A792 VanDerWaalsContact C-N 3.35Å; Q790-A792 PolarHBondContact O-N 3.44Å; A792-Q794 VanDerWaalsContact C-N 3.33Å; A792-Q794 PolarHBondContact O-N 3.04Å; A792-L795 PolarHBondContact O-N 3.02Å; A792-T796 WeakPolarHBondContact O-CB 3.47Å; A792-T796 PolarHBondContact O-N 3.42Å; A792-T796 PolarHBondContact O-OG1 3.15Å
793K74.6Confident68.8Low145 Ų145105 Ų10563%0.6357%0.574SS**Hα-helixtrans-60.6-43.3173.5-77.5179.3-179.71770111.2C789 Q790 L795 T796 I797C789-K793 WeakPolarHBondContact O-CG 3.06Å; C789-K793 PolarHBondContact O-N 3.03Å; Q790-K793 PolarHBondContact O-N 2.8Å; K793-L795 PolarHBondContact O-N 3.13Å; K793-T796 PolarHBondContact O-N 3.09Å; K793-T796 VanDerWaalsContact O-N 3.16Å; K793-I797 WeakPolarHBondContact O-CG1 3.29Å; K793-I797 PolarHBondContact O-N 3.25Å
794Q68.9Low66.7Low125 Ų125106.8 Ų106.858%0.58459%0.586SS**Hα-helixtrans-56.7-50.4176.1-156.4951700111Q790 K791 A792 T796 I797 E798Q790-Q794 PolarHBondContact O-N 3.15Å; K791-Q794 WeakPolarHBondContact O-CB 3.48Å; K791-Q794 PolarHBondContact O-N 3.34Å; A792-Q794 VanDerWaalsContact C-N 3.33Å; A792-Q794 PolarHBondContact O-N 3.04Å; Q794-T796 VanDerWaalsContact C-N 3.28Å; Q794-T796 PolarHBondContact O-N 3.3Å; Q794-I797 PolarHBondContact O-N 3.29Å; Q794-E798 WeakPolarHBondContact O-CG 3.4Å; Q794-E798 PolarHBondContact O-N 3.34Å
795L68.3Low64.4Low107 Ų107106.5 Ų106.556%0.5659%0.592SS**Hα-helixtrans-63.5-32.2177.4-74.2168.8000113K791 A792 K793 A799K791-L795 WeakPolarHBondContact O-CG 3.26Å; K791-L795 PolarHBondContact O-N 3.09Å; K791-L795 VanDerWaalsContact O-N 3.08Å; A792-L795 PolarHBondContact O-N 3.02Å; K793-L795 PolarHBondContact O-N 3.13Å; L795-A799 VanDerWaalsContact O-CB 3.31Å; L795-A799 WeakPolarHBondContact O-CB 3.49Å; L795-A799 PolarHBondContact O-N 3.31Å
796T67Low62.3Low94 Ų94108.7 Ų108.758%0.57760%0.601SS**Hα-helixtrans-71.9-38.2177.9-47.20000111.3A792 K793 Q794 A799 A800A792-T796 WeakPolarHBondContact O-CB 3.47Å; A792-T796 PolarHBondContact O-N 3.42Å; A792-T796 PolarHBondContact O-OG1 3.15Å; K793-T796 PolarHBondContact O-N 3.09Å; K793-T796 VanDerWaalsContact O-N 3.16Å; Q794-T796 VanDerWaalsContact C-N 3.28Å; Q794-T796 PolarHBondContact O-N 3.3Å; T796-A799 PolarHBondContact O-N 3.08Å; T796-A800 WeakPolarHBondContact O-CB 3.27Å; T796-A800 PolarHBondContact O-N 2.88Å
797I65.6Low59.9Low123 Ų123111.4 Ų111.463%0.63161%0.613SS**Hα-helixtrans-66.3-42.8173.5-66.2166.8000109.9K793 Q794 A800 A801K793-I797 WeakPolarHBondContact O-CG1 3.29Å; K793-I797 PolarHBondContact O-N 3.25Å; Q794-I797 PolarHBondContact O-N 3.29Å; I797-A800 PolarHBondContact O-N 3.39Å; I797-A801 WeakPolarHBondContact O-CB 3.37Å; I797-A801 PolarHBondContact O-N 3.5Å
798E58.7Low57.6Low108 Ų108114.1 Ų114.151%0.50563%0.627SS.*Hα-helixtrans-62.1-42.6174.9-73.1173.4-174.500111.8Q794 A800 A801 V802Q794-E798 WeakPolarHBondContact O-CG 3.4Å; Q794-E798 PolarHBondContact O-N 3.34Å; E798-A800 PolarHBondContact O-N 2.74Å; E798-A801 PolarHBondContact O-N 3.3Å; E798-V802 VanDerWaalsContact O-CG2 3.29Å; E798-V802 WeakPolarHBondContact O-CG2 3.25Å; E798-V802 PolarHBondContact O-N 2.84Å; E798-V802 VanDerWaalsContact O-N 3.12Å
799A56.3Low55.2Low68 Ų68116.7 Ų116.756%0.56264%0.637SS**Hα-helixtrans-65.7-36.5175.600000113L795 T796L795-A799 VanDerWaalsContact O-CB 3.31Å; L795-A799 WeakPolarHBondContact O-CB 3.49Å; L795-A799 PolarHBondContact O-N 3.31Å; T796-A799 PolarHBondContact O-N 3.08Å
800A56.2Low53Low62 Ų62119.9 Ų119.951%0.51265%0.649SS.*Hα-helixtrans-70.4-36.9176.100000112.2T796 I797 E798 K803T796-A800 WeakPolarHBondContact O-CB 3.27Å; T796-A800 PolarHBondContact O-N 2.88Å; I797-A800 PolarHBondContact O-N 3.39Å; E798-A800 PolarHBondContact O-N 2.74Å; A800-K803 PolarHBondContact O-N 3.38Å
801A55.2Low50.8Low63 Ų63125 Ų12552%0.52167%0.665SS.*Hα-helixtrans-66.9-36.8176.600000112.2I797 E798 K803 N804I797-A801 WeakPolarHBondContact O-CB 3.37Å; I797-A801 PolarHBondContact O-N 3.5Å; E798-A801 PolarHBondContact O-N 3.3Å; A801-K803 PolarHBondContact O-N 3.44Å; A801-N804 CarbonylContact O-C 3.57Å; A801-N804 PolarHBondContact O-N 2.82Å
802V51.7Low48.4Very low127 Ų127122.6 Ų122.677%0.7767%0.667SS**Hα-helixtrans-65.1-21.3179.2171.80000112.9E798E798-V802 VanDerWaalsContact O-CG2 3.29Å; E798-V802 WeakPolarHBondContact O-CG2 3.25Å; E798-V802 PolarHBondContact O-N 2.84Å; E798-V802 VanDerWaalsContact O-N 3.12Å
803K46.8Very low46.4Very low185 Ų185125.6 Ų125.680%0.80468%0.68SS**THydrogen-bonded Turntrans-80.1-15.3178.6-136.7176.5-174.5-179.80114.1A800 A801A800-K803 PolarHBondContact O-N 3.38Å; A801-K803 PolarHBondContact O-N 3.44Å
804N39.9Very low44.4Very low130 Ų130126.8 Ų126.870%0.69569%0.687SS**SBendtrans-13972.5-175.7-70.4-38.2000111.1A801A801-N804 CarbonylContact O-C 3.57Å; A801-N804 PolarHBondContact O-N 2.82Å
805L30.3Very low42.5Very low155 Ų155124.8 Ų124.881%0.81269%0.692SS**  trans173.6121144.7-11871.4000110.5
806P35.1Very low40.8Very low106 Ų106127.6 Ų127.669%0.68871%0.708SS**  trans-87.3138.2164.333-26.7000110.7
807H30Very low38.9Very low175 Ų175131 Ų13181%0.8172%0.717SS**  trans77.6100.4169.2-52.4-62.8000117.3
808L30.2Very low37.1Very low175 Ų175132.6 Ų132.692%0.91672%0.721SS**  -173.1143.7110.4-93.2156.9000111.3
809T25.6Very low35.8Very low114 Ų114134.2 Ų134.270%0.69973%0.734SS**  trans-88.6150.9-17236.20000113.9
810N28.9Very low34.6Very low143 Ų143134.1 Ų134.177%0.76574%0.739SS**  trans82.9146.7150.9-70.6-10.8000121.4
811Y30.8Very low33.5Very low223 Ų223139 Ų13988%0.87576%0.755SS**  trans95112.1175.4-65.4-84.2000115.2
812S25.6Very low32.4Very low97 Ų97142.4 Ų142.468%0.67877%0.769SS**  cis100102.736.3-179.50000113.3
813V29.4Very low31.4Very low112 Ų112141.3 Ų141.368%0.67976%0.762SS**  trans90.6146.2135.3-177.30000120.5
814H31.1Very low30.6Very low171 Ų171139.1 Ų139.179%0.79276%0.759SS**  trans92.1107.4171-60.8-59.1000115.6
815A29.9Very low30.3Very low83 Ų83136.4 Ų136.469%0.68675%0.751SS**  cis63.911043.500000113.8
816D31.8Very low30.4Very low166 Ų166137 Ų13789%0.88875%0.749SS**  trans172.9101.6155.5-84.5-18.1000105.4
817E27.4Very low30.2Very low166 Ų166137.3 Ų137.378%0.77674%0.744SS**  56.3132.163.8-84.4-171.517700116.6
818H28.2Very low30.3Very low155 Ų155137.9 Ų137.972%0.71875%0.747SS**  trans78.2137163.3-70.6-54000118
819N32.2Very low30.3Very low143 Ų143135.3 Ų135.377%0.76573%0.73SS**  cis-157.1157.717.2-82.8-38.1000107.2
820G30Very low30.6Very low65 Ų65136.4 Ų136.467%0.6773%0.731SS**  cis96.372.225.100000112.9
821I33.8Very low30.9Very low164 Ų164137.3 Ų137.384%0.84174%0.736SS**  trans-152.492.1162.8-54.3-179.2000106.8
822V30.9Very low30.9Very low136 Ų136130.4 Ų130.482%0.82473%0.733SS**  62.6109.378.9-175.40000114.4
823V31.6Very low31.2Very low103 Ų103133.5 Ų133.562%0.62474%0.741SS**  trans-52.9140.2164173.10000111.3
824D31Very low31.3Very low140 Ų140136.8 Ų136.875%0.74975%0.748SS**  trans-140.3127.8149.2-128.5-17.5000112.4H826D824-H826 IonicContact OD1-CE1 3.93Å
825S31.9Very low31.5Very low73 Ų73133.5 Ų133.551%0.5174%0.74SS.*  trans-114.9120.5-175-49.20000107.6
826H32.5Very low31.6Very low168 Ų168136 Ų13678%0.77875%0.746SS**  trans-126.691.9170.1-72.3-27.7000111.4D824D824-H826 IonicContact OD1-CE1 3.93Å
827L30.6Very low31.6Very low111 Ų111133.9 Ų133.958%0.58174%0.735SS**  trans-67.7136.2151.5-88.3136.5000110.3Y765Y765-L827 WeakPolarHBondContact OH-CD2 3.41Å
828H33.9Very low31.8Very low187 Ų187132.2 Ų132.287%0.86673%0.732SS**  trans-159.596.2151-96.375.2000105.5
829H28.9Very low32Very low122 Ų122133.7 Ų133.757%0.56574%0.739SS**  39101.778.7-83.282.7000115.3
830N32.9Very low32.1Very low137 Ų137136.1 Ų136.173%0.73374%0.743SS**  162.5122.9107.4-90-25.3000114.8
831N33.6Very low32.3Very low162 Ų162140.5 Ų140.587%0.86675%0.751SS**  trans21.7129.3132.7-64.4-18.7000121
832G32Very low32.3Very low78 Ų78143.9 Ų143.980%0.80475%0.753SS**  trans-157.167.2164.400000112.3H834G832-H834 PolarHBondContact O-N 3.32Å
833L30.9Very low32.3Very low162 Ų162142.5 Ų142.585%0.84875%0.75SS**  trans-67113.7172.1-171.275.3000109.8V835L833-V835 HydrophobicContact CD2-CG2 3.98Å; L833-V835 HydrophobicContact CG-CG2 4.14Å; L833-V835 PolarHBondContact O-N 2.9Å
834H31.2Very low32.4Very low180 Ų180146.9 Ų146.983%0.83376%0.76SS**  trans-89.189.7175.4-133.4-62.6000109.3G832 V836G832-H834 PolarHBondContact O-N 3.32Å; H834-V836 PolarHBondContact O-N 3.47Å
835V35.4Very low32.5Very low102 Ų102145.7 Ų145.762%0.61876%0.763SS**  trans-78.6114.4167.6176.10000107.7L833 D837L833-V835 HydrophobicContact CD2-CG2 3.98Å; L833-V835 HydrophobicContact CG-CG2 4.14Å; L833-V835 PolarHBondContact O-N 2.9Å; V835-D837 PolarHBondContact O-N 3.4Å
836V33.3Very low32.7Very low135 Ų135148.6 Ų148.682%0.81877%0.771SS**  trans-79.2101.8176174.30000108.2H834H834-V836 PolarHBondContact O-N 3.47Å
837D31.2Very low32.6Very low123 Ų123145.7 Ų145.766%0.65877%0.769SS**  trans-87.5127.7175.6-116-35.5000111.5V835V835-D837 PolarHBondContact O-N 3.4Å
838N31.7Very low32.8Very low131 Ų131148.4 Ų148.470%0.70178%0.779SS**  trans55.593.5140.8-79.4-50.5000120
839Q33.6Very low32.7Very low185 Ų185148.1 Ų148.186%0.86478%0.778SS**  trans-102.595.9144.7-81-169-6.900111.2N841Q839-N841 PolarHBondContact O-N 3.48Å
840K33.4Very low32.8Very low194 Ų194150.2 Ų150.284%0.84379%0.793SS**  trans-50.4110.6154.9-82.1169.8170.6166.80109.7
841N33.9Very low33Very low157 Ų157149.6 Ų149.684%0.8480%0.796SS**  trans-106.2111158.8-96.2-26.5000110.3Q839Q839-N841 PolarHBondContact O-N 3.48Å
842R33.7Very low33Very low235 Ų235147.6 Ų147.689%0.88779%0.794SS**  trans-54.9133.4-177.8-84.3172.4162.3178.3-5.2112.9K844R842-K844 PolarHBondContact O-N 3.42Å
843S30.3Very low33.2Very low108 Ų108155.4 Ų155.476%0.75580%0.8SS**  trans-22.8116147.8-400000114.5
844K34.7Very low33.2Very low195 Ų195155.2 Ų155.285%0.84880%0.8SS**  trans-11083.8155.4-78.7-178.4178176.60107.9R842 I846R842-K844 PolarHBondContact O-N 3.42Å; K844-I846 PolarHBondContact O-N 3.39Å
845S34Very low34Very low114 Ų114151.7 Ų151.780%0.79779%0.793SS**  trans-75.797.4166.7-59.10000108S847S845-S847 PolarHBondContact O-N 3.2Å
846I34.2Very low34Very low135 Ų135152.5 Ų152.569%0.69280%0.803SS**  trans-77.897.8170-64.4173.7000106.8K844 H848K844-I846 PolarHBondContact O-N 3.39Å; I846-H848 WeakPolarHBondContact CG2-CD2 3.47Å
847S30.5Very low34Very low106 Ų106151.7 Ų151.774%0.74180%0.798SS**  trans-83.1103.2167.9-170.30000107.8S845S845-S847 PolarHBondContact O-N 3.2Å
848H34.6Very low34.2Very low168 Ų168152.2 Ų152.278%0.77881%0.806SS**  trans-99.4107.1162.2-82.6-59.1000108.6I846 L850I846-H848 WeakPolarHBondContact CG2-CD2 3.47Å; H848-L850 PolarHBondContact O-N 2.9Å
849Q33Very low34.3Very low182 Ų182154.4 Ų154.485%0.8581%0.809SS**  trans-51.5118.6172.6-72.1167.3-2700110.7
850L30.8Very low34.3Very low166 Ų166153.4 Ų153.487%0.86981%0.809SS**  trans-71.6125.2158.4-81.8151.5000108H848 S852H848-L850 PolarHBondContact O-N 2.9Å; L850-S852 PolarHBondContact O-N 3.4Å; L850-S852 VanDerWaalsContact O-N 3.16Å
851P38Very low34.3Very low124 Ų124150.4 Ų150.481%0.80580%0.8SS**  trans-76.2108.4-178.729.5-31.2000109.8R853P851-R853 PolarHBondContact O-N 3.44Å
852S33.6Very low34.2Very low119 Ų119150.5 Ų150.583%0.83280%0.8SS**  trans-66.5110.3164.959.80000109.6L850L850-S852 PolarHBondContact O-N 3.4Å; L850-S852 VanDerWaalsContact O-N 3.16Å
853R34.3Very low34.2Very low243 Ų243146.6 Ų146.692%0.91779%0.792SS**  trans-118.996.5163.3-157.6176.3-172.5-176.72108.5P851P851-R853 PolarHBondContact O-N 3.44Å
854N31.9Very low34.4Very low158 Ų158148.4 Ų148.485%0.84579%0.793SS**  trans-81.7167.7169-108.8-4.2000110.6
855P48.6Very low34.3Very low106 Ų106145.3 Ų145.369%0.68879%0.786SS**  trans-100.8149.1-130.737-35.6000114.2
856S33.9Very low34.2Very low119 Ų119145.8 Ų145.883%0.83278%0.784SS**  trans-99106.6160.1-80.30000109.7V858S856-V858 PolarHBondContact O-N 3.46Å
857T33.3Very low34.1Very low118 Ų118148 Ų14872%0.72479%0.789SS**  trans-36.2107.7159.1-49.20000112.2K859T857-K859 HydrophobicContact CG2-CG 4.26Å
858V35.2Very low34.5Very low133 Ų133148.2 Ų148.281%0.80679%0.788SS**  trans-90.899.2160.5178.40000106.5S856 L860S856-V858 PolarHBondContact O-N 3.46Å; V858-L860 PolarHBondContact O-N 2.91Å
859K34Very low34.4Very low177 Ų177148.3 Ų148.377%0.7779%0.794SS**  trans-59.6114.3168.1-84177.4171.8178.60108.1T857 I861T857-K859 HydrophobicContact CG2-CG 4.26Å; K859-I861 VanDerWaalsContact C-N 3.35Å; K859-I861 PolarHBondContact O-N 3.26Å
860L33.8Very low34.4Very low164 Ų164144.7 Ų144.786%0.85979%0.789SS**  trans-65.797.9160.8-78.9161.6000107.4V858 L862V858-L860 PolarHBondContact O-N 2.91Å; L860-L862 PolarHBondContact O-N 2.83Å
861I33.3Very low34.5Very low131 Ų131140.1 Ų140.167%0.67278%0.782SS**  trans-71.7108.5164.5-63.8173.7000105.3K859 E863K859-I861 VanDerWaalsContact C-N 3.35Å; K859-I861 PolarHBondContact O-N 3.26Å; I861-E863 VanDerWaalsContact C-N 3.35Å; I861-E863 HydrophobicContact CG2-CB 4.47Å; I861-E863 HydrophobicContact CG2-CG 3.88Å; I861-E863 PolarHBondContact O-N 2.88Å; I861-E863 VanDerWaalsContact O-N 3.12Å
862L33Very low34.3Very low159 Ų159143.1 Ų143.183%0.83279%0.791SS**  trans-66.199.6159.3-89.888.8000106.5L860L860-L862 PolarHBondContact O-N 2.83Å
863E33.8Very low34.2Very low154 Ų154141.8 Ų141.872%0.7278%0.781SS**  trans-97.6118.5162.4-99.8173.8-174.500108.4I861 N865I861-E863 VanDerWaalsContact C-N 3.35Å; I861-E863 HydrophobicContact CG2-CB 4.47Å; I861-E863 HydrophobicContact CG2-CG 3.88Å; I861-E863 PolarHBondContact O-N 2.88Å; I861-E863 VanDerWaalsContact O-N 3.12Å; E863-N865 PolarHBondContact O-N 2.8Å
864D32.9Very low34.2Very low145 Ų145136.4 Ų136.478%0.77577%0.771SS**  trans-57.491.6175-75.4-41.8000110.8T866D864-T866 PolarHBondContact O-N 3.33Å
865N33.2Very low34.4Very low130 Ų130139.7 Ų139.770%0.69577%0.773SS**  trans-73.678.6168.5-79-33.4000110E863 F867E863-N865 PolarHBondContact O-N 2.8Å; N865-F867 VanDerWaalsContact C-N 3.33Å; N865-F867 HydrophobicContact CB-CD2 4.41Å; N865-F867 HydrophobicContact CB-CE2 4.1Å; N865-F867 WeakPolarHBondContact O-CD2 3.19Å; N865-F867 PolarHBondContact O-N 3.1Å; N865-F867 VanDerWaalsContact O-N 3.07Å
866T33.2Very low33.7Very low125 Ų125143.5 Ų143.577%0.76778%0.778SS**  trans-71.891.7162.2-39.80000107D864 P868D864-T866 PolarHBondContact O-N 3.33Å; T866-P868 VanDerWaalsContact O-CD 3.28Å; T866-P868 WeakPolarHBondContact O-CD 3.47Å
867F32Very low33.7Very low180 Ų180145.4 Ų145.479%0.78978%0.779SS**  trans-60.6117.1179-80.1-88.9000110.6N865 N869N865-F867 VanDerWaalsContact C-N 3.33Å; N865-F867 HydrophobicContact CB-CD2 4.41Å; N865-F867 HydrophobicContact CB-CE2 4.1Å; N865-F867 WeakPolarHBondContact O-CD2 3.19Å; N865-F867 PolarHBondContact O-N 3.1Å; N865-F867 VanDerWaalsContact O-N 3.07Å; F867-N869 PolarHBondContact O-N 3.4Å
868P38.3Very low33.7Very low111 Ų111145.4 Ų145.472%0.72178%0.783SS**  trans-78.9114.2173.330.4-26.8000108.6T866 S870T866-P868 VanDerWaalsContact O-CD 3.28Å; T866-P868 WeakPolarHBondContact O-CD 3.47Å; P868-S870 PolarHBondContact O-N 2.79Å; P868-S870 VanDerWaalsContact O-N 3.08Å
869N32Very low33.6Very low171 Ų171145.7 Ų145.791%0.91479%0.786SS**  trans-74.492.1175.2-16310.4000109.1F867F867-N869 PolarHBondContact O-N 3.4Å
870S34.1Very low33.7Very low106 Ų106142.5 Ų142.574%0.74179%0.786SS**  trans-145.3111170.861.50000112.3P868P868-S870 PolarHBondContact O-N 2.79Å; P868-S870 VanDerWaalsContact O-N 3.08Å
871G31.8Very low33.8Very low70 Ų70141.7 Ų141.772%0.72278%0.782SS**  trans88.356.9137.700000118.2S873G871-S873 PolarHBondContact O-N 3.44Å; G871-S873 VanDerWaalsContact O-N 3.08Å
872L33.3Very low33.8Very low187 Ų187147.6 Ų147.698%0.97980%0.796SS**  trans-77.979.5153.7-74.3171.4000109.2
873S32.8Very low34.1Very low91 Ų91145 Ų14564%0.63679%0.791SS**  trans-105.9127.5165.6101.70000109.5G871G871-S873 PolarHBondContact O-N 3.44Å; G871-S873 VanDerWaalsContact O-N 3.08Å
874N34.3Very low34Very low130 Ų130142.7 Ų142.770%0.69579%0.792SS**  trans72.670.9151.6-56.7-30.7000118.6
875Y35.8Very low34.2Very low226 Ų226143.8 Ų143.889%0.88680%0.795SS**  trans-8987.2138.3-80.8-82.3000108.8L877Y875-L877 PolarHBondContact O-N 2.84Å
876K33.5Very low34.2Very low186 Ų186144.8 Ų144.881%0.80980%0.8SS**  trans-68.8103.6163.6-87.2179.9173.91770107.7S878K876-S878 PolarHBondContact O-N 2.86Å
877L33.9Very low34.1Very low160 Ų160148.8 Ų148.884%0.83881%0.807SS**  trans-66.5117.5159.7-95.993.2000108.2Y875 T879Y875-L877 PolarHBondContact O-N 2.84Å; L877-T879 PolarHBondContact O-N 2.95Å; L877-T879 VanDerWaalsContact O-N 3.09Å
878S33.3Very low34.2Very low118 Ų118144.7 Ų144.783%0.82581%0.806SS**  trans-53.9107.9175.7-63.30000111.6K876 S880K876-S878 PolarHBondContact O-N 2.86Å; S878-S880 VanDerWaalsContact C-N 3.34Å; S878-S880 PolarHBondContact O-N 3.11Å
879T33.3Very low34Very low139 Ų139145 Ų14585%0.85381%0.808SS**  trans-71.888.416440.30000108.9L877 N881L877-T879 PolarHBondContact O-N 2.95Å; L877-T879 VanDerWaalsContact O-N 3.09Å; T879-N881 PolarHBondContact O-N 3.34Å; T879-N881 VanDerWaalsContact O-N 3.13Å
880S35.6Very low33.9Very low110 Ų110142.4 Ų142.477%0.76980%0.804SS**  trans-73.1101.8173.3-172.70000110.3S878S878-S880 VanDerWaalsContact C-N 3.34Å; S878-S880 PolarHBondContact O-N 3.11Å
881N36.9Very low33.8Very low147 Ų147142.6 Ų142.679%0.78681%0.805SS**  trans27.391.8151.1-67.8-21.8000117.2T879 S883T879-N881 PolarHBondContact O-N 3.34Å; T879-N881 VanDerWaalsContact O-N 3.13Å; N881-S883 PolarHBondContact O-N 3.23Å
882R33.4Very low33.8Very low254 Ų254147.1 Ų147.196%0.95881%0.812SS**  trans-61.698.3151-93-175.8169-149.8-0.1108.2S884R882-S884 PolarHBondContact O-N 3.38Å
883S37.9Very low33.7Very low105 Ų105145.2 Ų145.273%0.73480%0.801SS**  trans-66.2115.5162.454.80000108.6N881 M885N881-S883 PolarHBondContact O-N 3.23Å; S883-M885 PolarHBondContact O-N 2.77Å; S883-M885 VanDerWaalsContact O-N 3.12Å
884S33.1Very low33.7Very low105 Ų105147.5 Ų147.573%0.73481%0.806SS**  trans-62.4106.7171.557.70000109.9R882 N886R882-S884 PolarHBondContact O-N 3.38Å; S884-N886 PolarHBondContact O-N 3.02Å
885M36.6Very low33.7Very low169 Ų169148.5 Ų148.583%0.83381%0.811SS**  trans-82.3109.1165.2-87.8-174.4164.900108.6S883 F887S883-M885 PolarHBondContact O-N 2.77Å; S883-M885 VanDerWaalsContact O-N 3.12Å; M885-F887 PolarHBondContact O-N 2.76Å
886N33.8Very low33.6Very low151 Ų151146.3 Ų146.381%0.80781%0.814SS**  trans-66.4118.6170-73.6-9.7000109S884 A888S884-N886 PolarHBondContact O-N 3.02Å; N886-A888 PolarHBondContact O-N 3.33Å
887F29.9Very low33.5Very low209 Ų209140.6 Ų140.692%0.91781%0.808SS**  trans-72.1109.5169.2-78.7-92.7000109.3M885M885-F887 PolarHBondContact O-N 2.76Å
888A34.2Very low33.4Very low93 Ų93140.5 Ų140.577%0.76981%0.808SS**  trans-111.4128.9158.100000107.9N886N886-A888 PolarHBondContact O-N 3.33Å
889P35.4Very low33.4Very low117 Ų117140.5 Ų140.576%0.7680%0.803SS**  trans-92.6147.3-164.835.9-33.7000113.3
890S28.3Very low33.4Very low118 Ų118145.4 Ų145.483%0.82581%0.806SS**  trans77.1107.6147.4-54.40000119.6
891S33Very low33.2Very low110 Ų110150.5 Ų150.577%0.76981%0.808SS**  -159.4121.8126.750.60000111.9
892L31.6Very low33.1Very low164 Ų164148.5 Ų148.586%0.85981%0.806SS**  trans55.595.1143.3-76.3138.7000119.7D894L892-D894 PolarHBondContact O-N 2.84Å
893I31.3Very low33.1Very low148 Ų148144.2 Ų144.276%0.75980%0.799SS**  -3.5111.1121.2-57.7168.2000113.6
894D32.9Very low33Very low138 Ų138146.7 Ų146.774%0.73880%0.799SS**  172.9144.7123.5-90.2-33.4000109.8L892L892-D894 PolarHBondContact O-N 2.84Å
895N34.1Very low33.4Very low151 Ų151149.1 Ų149.181%0.80780%0.803SS**  trans94.773.2174.8-51.8-45.5000117.5
896L33.4Very low33.6Very low180 Ų180145.4 Ų145.494%0.94279%0.794SS**  trans-132.589.5139.5-78.2177.5000109.4
897G32Very low34.4Very low66 Ų66142.3 Ų142.368%0.6878%0.784SS**  trans-66142.1160.700000111.1
898N32.3Very low36Very low158 Ų158137 Ų13785%0.84577%0.766SS**  trans40.492.9150.2-91.3-1.8000117.9
899V33.4Very low37.7Very low119 Ų119137.2 Ų137.272%0.72176%0.759SS**  trans-123.896143.2-177.50000108.1R901V899-R901 HydrophobicContact CG1-CG 4.16Å; V899-R901 PolarHBondContact O-N 2.83Å
900R31.8Very low39.6Very low241 Ų241134.4 Ų134.491%0.90975%0.745SS**  trans-52.3103.5158.6-80.6178.9175.8-174.2-2.2107.7
901R32.3Very low42Very low218 Ų218129.9 Ų129.982%0.82372%0.718SS**  trans-93.5118.6161.2-78-169-169-141.22.5108.1V899 M903V899-R901 HydrophobicContact CG1-CG 4.16Å; V899-R901 PolarHBondContact O-N 2.83Å; R901-M903 PolarHBondContact O-N 3.44Å; R901-M903 VanDerWaalsContact O-N 3.09Å
902S33.7Very low44.5Very low105 Ų105129.1 Ų129.173%0.73471%0.705SS**  trans-55.6104.6168.8-145.10000108.6E904S902-E904 VanDerWaalsContact C-N 3.34Å
903M34.5Very low46.9Very low164 Ų164126.3 Ų126.381%0.80869%0.69SS**  trans-96.772.5165-77.1-84.4-76.300106.4R901R901-M903 PolarHBondContact O-N 3.44Å; R901-M903 VanDerWaalsContact O-N 3.09Å
904E36.1Very low49.6Very low156 Ų156126.1 Ų126.173%0.72969%0.686SS**  trans-86.4127.2160.1-82.5178.9166.100107.3S902S902-E904 VanDerWaalsContact C-N 3.34Å
905N41.2Very low52.2Low156 Ų156123.3 Ų123.383%0.83467%0.674SS**  trans77.953.9161.2-46.2-19.6000116.5
906S41.2Very low54.8Low91 Ų91121 Ų12164%0.63666%0.661SS**  trans-94.9104138.3730000107.2D908S906-D908 PolarHBondContact O-N 2.87Å
907S49.5Very low57.6Low86 Ų86117 Ų11760%0.60164%0.64SS**  trans-47.8105.7165.1163.80000107P909 D912S907-P909 WeakPolarHBondContact O-CD 3Å; S907-D912 PolarHBondContact OG-OD2 3.42Å
908D64.5Low60.3Low99 Ų99122.8 Ų122.853%0.52964%0.641SS.*  trans-77.7103.8169.9178.56.1000105.7S906 A910 G911 D912S906-D908 PolarHBondContact O-N 2.87Å; D908-A910 PolarHBondContact O-N 3.26Å; D908-A910 VanDerWaalsContact O-N 3.07Å; D908-A910 WeakPolarHBondContact OD1-CB 3.35Å; D908-A910 PolarHBondContact OD1-N 2.7Å; D908-A910 VanDerWaalsContact OD1-N 3.11Å; D908-G911 PolarHBondContact O-N 2.93Å; D908-D912 PolarHBondContact O-N 3.42Å; D908-D912 VanDerWaalsContact O-N 3.14Å
909P69Low63.1Low96 Ų96120.7 Ų120.762%0.62363%0.626SS**Hα-helixtrans-61.1-23.2-175.9-17.332.5000111.3S907 L913S907-P909 WeakPolarHBondContact O-CD 3Å; P909-L913 VanDerWaalsContact O-CB 3.3Å; P909-L913 WeakPolarHBondContact O-CB 3.37Å; P909-L913 PolarHBondContact O-N 3.45Å
910A75Confident65.8Low58 Ų58118.7 Ų118.748%0.47961%0.614SS.*Hα-helixtrans-70.1-42.5176.300000111.5D908 L913 E914D908-A910 PolarHBondContact O-N 3.26Å; D908-A910 VanDerWaalsContact O-N 3.07Å; D908-A910 WeakPolarHBondContact OD1-CB 3.35Å; D908-A910 PolarHBondContact OD1-N 2.7Å; D908-A910 VanDerWaalsContact OD1-N 3.11Å; A910-L913 PolarHBondContact O-N 3.43Å; A910-E914 PolarHBondContact O-N 2.67Å
911G80.1Confident68.6Low24 Ų24110.3 Ų110.325%0.24759%0.59CS.*Hα-helixtrans-66.6-38.8175.700000112.8D908 L913 E914 T915D908-G911 PolarHBondContact O-N 2.93Å; G911-L913 VanDerWaalsContact C-N 3.33Å; G911-E914 PolarHBondContact O-N 3.2Å; G911-T915 WeakPolarHBondContact O-CB 3.12Å; G911-T915 PolarHBondContact O-N 3.08Å; G911-T915 PolarHBondContact O-OG1 2.7Å
912D84.3Confident71.3Confident93 Ų93104.2 Ų104.250%0.49757%0.573SS.*Hα-helixtrans-64.3-40.4174.2-72.1-28000110.9S907 D908 T915 L916S907-D912 PolarHBondContact OG-OD2 3.42Å; D908-D912 PolarHBondContact O-N 3.42Å; D908-D912 VanDerWaalsContact O-N 3.14Å; D912-T915 PolarHBondContact O-N 3.13Å; D912-L916 WeakPolarHBondContact O-CB 3.17Å; D912-L916 PolarHBondContact O-N 3.01Å
913L82.5Confident73.7Confident106 Ų106106 Ų10656%0.55557%0.568SS**Hα-helixtrans-66.9-44.4175.8-160.781.2000112.1P909 A910 G911 T915 L916 I917P909-L913 VanDerWaalsContact O-CB 3.3Å; P909-L913 WeakPolarHBondContact O-CB 3.37Å; P909-L913 PolarHBondContact O-N 3.45Å; A910-L913 PolarHBondContact O-N 3.43Å; G911-L913 VanDerWaalsContact C-N 3.33Å; L913-T915 VanDerWaalsContact C-N 3.29Å; L913-T915 PolarHBondContact O-N 2.81Å; L913-L916 PolarHBondContact O-N 3.43Å; L913-I917 HydrophobicContact CD2-CD1 4.33Å; L913-I917 HydrophobicContact CG-CD1 4.14Å; L913-I917 WeakPolarHBondContact O-CB 3.14Å; L913-I917 VanDerWaalsContact O-CG1 3.25Å; L913-I917 WeakPolarHBondContact O-CG1 3.32Å; L913-I917 PolarHBondContact O-N 3.33Å
914E87.2Confident76.1Confident144 Ų144102.9 Ų102.967%0.67355%0.554SS**Hα-helixtrans-59.9-41.5175.2-101.2-173.5164.800111.5A910 G911 I917 R918A910-E914 PolarHBondContact O-N 2.67Å; G911-E914 PolarHBondContact O-N 3.2Å; E914-I917 PolarHBondContact O-N 3.43Å; E914-R918 VanDerWaalsContact O-CB 3.29Å; E914-R918 WeakPolarHBondContact O-CB 3.16Å; E914-R918 PolarHBondContact O-N 2.59Å
915T88.3Confident78.5Confident79 Ų7999 Ų9949%0.48554%0.538SS..Hα-helixtrans-65.4-42.1177.8-550000111.2G911 D912 L913 R918 Q919G911-T915 WeakPolarHBondContact O-CB 3.12Å; G911-T915 PolarHBondContact O-N 3.08Å; G911-T915 PolarHBondContact O-OG1 2.7Å; D912-T915 PolarHBondContact O-N 3.13Å; L913-T915 VanDerWaalsContact C-N 3.29Å; L913-T915 PolarHBondContact O-N 2.81Å; T915-R918 PolarHBondContact O-N 3.25Å; T915-Q919 WeakPolarHBondContact O-CG 3.28Å; T915-Q919 PolarHBondContact O-N 2.72Å
916L89.5Confident80Confident102 Ų10297.7 Ų97.753%0.53453%0.527SS..Hα-helixtrans-65-46.1177.2-162.480.4000111.5D912 L913 R918 Q919 V920D912-L916 WeakPolarHBondContact O-CB 3.17Å; D912-L916 PolarHBondContact O-N 3.01Å; L913-L916 PolarHBondContact O-N 3.43Å; L916-R918 VanDerWaalsContact C-N 3.29Å; L916-R918 PolarHBondContact O-N 3.31Å; L916-Q919 PolarHBondContact O-N 2.63Å; L916-V920 WeakPolarHBondContact O-CG2 2.9Å; L916-V920 PolarHBondContact O-N 3.45Å
917I90.6Very high81.5Confident95 Ų9599.8 Ų99.849%0.48753%0.527SS..Hα-helixtrans-56.7-48.3175.9-71166.2000109.3L913 E914 Q919 V920 T921L913-I917 HydrophobicContact CD2-CD1 4.33Å; L913-I917 HydrophobicContact CG-CD1 4.14Å; L913-I917 WeakPolarHBondContact O-CB 3.14Å; L913-I917 VanDerWaalsContact O-CG1 3.25Å; L913-I917 WeakPolarHBondContact O-CG1 3.32Å; L913-I917 PolarHBondContact O-N 3.33Å; E914-I917 PolarHBondContact O-N 3.43Å; I917-Q919 VanDerWaalsContact C-N 3.34Å; I917-Q919 PolarHBondContact O-N 3.07Å; I917-V920 PolarHBondContact O-N 3.46Å; I917-T921 PolarHBondContact O-N 2.63Å; I917-T921 PolarHBondContact O-OG1 3.25Å
918R89.8Confident82.2Confident189 Ų189103.6 Ų103.671%0.71354%0.535SS*.Hα-helixtrans-65-35.6-178.8-157.3173.8171.6-161.4-3.4112.8E914 T915 L916 N922E914-R918 VanDerWaalsContact O-CB 3.29Å; E914-R918 WeakPolarHBondContact O-CB 3.16Å; E914-R918 PolarHBondContact O-N 2.59Å; T915-R918 PolarHBondContact O-N 3.25Å; L916-R918 VanDerWaalsContact C-N 3.29Å; L916-R918 PolarHBondContact O-N 3.31Å; R918-N922 WeakPolarHBondContact O-CB 3.49Å; R918-N922 PolarHBondContact O-N 3.35Å; R918-N922 PolarHBondContact O-ND2 2.85Å
919Q90.4Very high82Confident113 Ų113109.6 Ų109.653%0.52855%0.55SS.*Hα-helixtrans-67.1-41.2173-78.1-176.25.500112.5T915 L916 I917 K923T915-Q919 WeakPolarHBondContact O-CG 3.28Å; T915-Q919 PolarHBondContact O-N 2.72Å; L916-Q919 PolarHBondContact O-N 2.63Å; I917-Q919 VanDerWaalsContact C-N 3.34Å; I917-Q919 PolarHBondContact O-N 3.07Å; Q919-K923 PolarHBondContact O-N 3.46Å; Q919-K923 VanDerWaalsContact O-N 3.1Å
920V89.9Confident81Confident77 Ų77114.2 Ų114.247%0.46757%0.568SS.*Hα-helixtrans-67.1-45178.4172.50000110.5L916 I917 N922 K923 L924L916-V920 WeakPolarHBondContact O-CG2 2.9Å; L916-V920 PolarHBondContact O-N 3.45Å; I917-V920 PolarHBondContact O-N 3.46Å; V920-N922 PolarHBondContact O-N 3.3Å; V920-K923 PolarHBondContact O-N 3.41Å; V920-L924 HydrophobicContact CG1-CD1 4.01Å; V920-L924 PolarHBondContact O-N 3.32Å
921T91.4Very high81.3Confident65 Ų65117.1 Ų117.140%0.39957%0.572SS.*Hα-helixtrans-60.3-46176.2-51.80000111.4I917 K923 L924 D925I917-T921 PolarHBondContact O-N 2.63Å; I917-T921 PolarHBondContact O-OG1 3.25Å; T921-K923 VanDerWaalsContact C-N 3.28Å; T921-K923 PolarHBondContact O-N 2.61Å; T921-L924 PolarHBondContact O-N 2.86Å; T921-L924 VanDerWaalsContact O-N 3.17Å; T921-D925 PolarHBondContact O-N 3.05Å
922N87.8Confident81.4Confident90 Ų90121.9 Ų121.948%0.48159%0.59SS.*Hα-helixtrans-61.9-34.3177.1-80.8-18.1000113.1R918 V920 Q926R918-N922 WeakPolarHBondContact O-CB 3.49Å; R918-N922 PolarHBondContact O-N 3.35Å; R918-N922 PolarHBondContact O-ND2 2.85Å; V920-N922 PolarHBondContact O-N 3.3Å; N922-Q926 WeakPolarHBondContact O-CB 3.15Å; N922-Q926 WeakPolarHBondContact O-CG 3.08Å; N922-Q926 PolarHBondContact O-N 3.24Å
923K85.5Confident81.2Confident144 Ų144123.6 Ų123.663%0.62660%0.595SS**Hα-helixtrans-70.2-39.4175.5-81.7-173.9177.1-178.80112.1Q919 V920 T921 Q926 Q927Q919-K923 PolarHBondContact O-N 3.46Å; Q919-K923 VanDerWaalsContact O-N 3.1Å; V920-K923 PolarHBondContact O-N 3.41Å; T921-K923 VanDerWaalsContact C-N 3.28Å; T921-K923 PolarHBondContact O-N 2.61Å; K923-Q926 PolarHBondContact O-N 3.14Å; K923-Q927 WeakPolarHBondContact O-CG 3.46Å; K923-Q927 PolarHBondContact O-N 3.28Å
924L85.1Confident81.2Confident97 Ų97124.6 Ų124.651%0.50860%0.597SS.*Hα-helixtrans-64.6-45.7174.8-82.3159.8000111.1V920 T921 Q926 Q927 E928V920-L924 HydrophobicContact CG1-CD1 4.01Å; V920-L924 PolarHBondContact O-N 3.32Å; T921-L924 PolarHBondContact O-N 2.86Å; T921-L924 VanDerWaalsContact O-N 3.17Å; L924-Q926 VanDerWaalsContact C-N 3.27Å; L924-Q926 PolarHBondContact O-N 2.81Å; L924-Q927 WeakPolarHBondContact O-CA 3.4Å; L924-Q927 WeakPolarHBondContact O-CB 3.19Å; L924-Q927 PolarHBondContact O-N 3.26Å; L924-E928 PolarHBondContact O-N 3.41Å
925D85.1Confident80.8Confident74 Ų74123.4 Ų123.440%0.39659%0.592SS.*Hα-helixtrans-62.2-34.2176.7-73.4-4.5000112.3T921 R929T921-D925 PolarHBondContact O-N 3.05Å; D925-R929 WeakPolarHBondContact O-CG 3.43Å; D925-R929 PolarHBondContact O-N 3.26Å
926Q74.3Confident80.3Confident129 Ų129126.3 Ų126.360%0.60360%0.599SS**Hα-helixtrans-69.1-38172.7-81.6-178.3-4.100112.1N922 K923 L924 R929 I930N922-Q926 WeakPolarHBondContact O-CB 3.15Å; N922-Q926 WeakPolarHBondContact O-CG 3.08Å; N922-Q926 PolarHBondContact O-N 3.24Å; K923-Q926 PolarHBondContact O-N 3.14Å; L924-Q926 VanDerWaalsContact C-N 3.27Å; L924-Q926 PolarHBondContact O-N 2.81Å; Q926-R929 PolarHBondContact O-N 3.16Å; Q926-I930 WeakPolarHBondContact O-CG1 3.27Å; Q926-I930 PolarHBondContact O-N 2.98Å
927Q72.1Confident79.6Confident135 Ų135128.1 Ų128.163%0.63160%0.604SS**Hα-helixtrans-69.2-32.2176.5-78.7-177.7-28.300112.7K923 L924 R929 I930K923-Q927 WeakPolarHBondContact O-CG 3.46Å; K923-Q927 PolarHBondContact O-N 3.28Å; L924-Q927 WeakPolarHBondContact O-CA 3.4Å; L924-Q927 WeakPolarHBondContact O-CB 3.19Å; L924-Q927 PolarHBondContact O-N 3.26Å; Q927-R929 VanDerWaalsContact C-N 3.33Å; Q927-I930 VanDerWaalsContact O-OXT 3.09Å
928E64.4Low78.8Confident166 Ų166130.6 Ų130.678%0.77661%0.613SS**Hα-helixtrans-74.9-21.2174.1-79.7-169.4157.300113.6L924L924-E928 PolarHBondContact O-N 3.41Å
929R59.7Low77.8Confident225 Ų225125.8 Ų125.885%0.84961%0.605SS**Hα-helixtrans-85-15.7175.1-74.1-173.9-165.6-153.44.9114D925 Q926 Q927D925-R929 WeakPolarHBondContact O-CG 3.43Å; D925-R929 PolarHBondContact O-N 3.26Å; Q926-R929 PolarHBondContact O-N 3.16Å; Q927-R929 VanDerWaalsContact C-N 3.33Å
930I48.7Very low76.7Confident194 Ų194126.9 Ų126.9100%0.99561%0.612SS**  trans-89.90173.2-64.8168.3000107.8Q926 Q927Q926-I930 WeakPolarHBondContact O-CG1 3.27Å; Q926-I930 PolarHBondContact O-N 2.98Å; Q927-I930 VanDerWaalsContact O-OXT 3.09Å

Retrieved 930 of 930 residues in 295.5 ms (Link to these results)