A0A077Z0P8_TRITR Loading...

FYVE zinc finger family protein

AlphaFold DB , UniProt , Accession A0A077Z0P8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 426 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.4Very low39.5Very low236 Ų236150.9 Ų150.9100%1.16385%0.846SS**  087.90-72176155.300106.6
2S39.3Very low39.5Very low110 Ų110152.3 Ų152.377%0.76985%0.849SS**  68.4122.1102.6-710000112
3L40.1Very low39.5Very low133 Ų133148.8 Ų148.870%0.69684%0.84SS**  cis-165.7135.111.9-91.1149.8000108.4
4R41Very low39.2Very low221 Ų221147 Ų14783%0.83484%0.84SS**  55.9116.4127.3-64.4-178.3-165.7-158.10.9121.7
5R35.8Very low39.2Very low253 Ų253144 Ų14496%0.95583%0.832SS**  trans-61.6140.7142.1-68.7176.8173.1-157.4-3.5110.5
6S43.3Very low39.2Very low119 Ų119142.4 Ų142.483%0.83283%0.828SS**  trans-122.2120.417035.50000110.1
7S36.6Very low38.9Very low123 Ų123145.4 Ų145.486%0.8683%0.832SS**  trans-76.7142.9163.4-270000109.1
8S41.6Very low38.7Very low124 Ų124143.1 Ų143.187%0.86783%0.833SS**  trans-142.5130.5159.9-173.50000110.8
9C35.9Very low38.6Very low125 Ų125140.8 Ų140.885%0.84583%0.833SS**  trans-76.3167.4175.6-650000112.5
10G39.6Very low38.4Very low66 Ų66137.4 Ų137.468%0.6883%0.828SS**  trans159.888156.400000111
11N41.2Very low38.2Very low150 Ų150139.9 Ų139.980%0.80283%0.832SS**  81.8139.785.3-93-4.9000115.2
12L40.1Very low38.1Very low168 Ų168137.9 Ų137.988%0.8882%0.819SS**  trans87.9126.9162.6-54.2133.9000114.3
13S39.5Very low38Very low106 Ų106137.2 Ų137.274%0.74182%0.82SS**  cis-167.4133.824.741.70000109.2
14C35.2Very low37.8Very low124 Ų124140.7 Ų140.784%0.83883%0.83SS**  47.6130.7104.9-85.20000115.3
15S38.8Very low37.7Very low102 Ų102135.3 Ų135.371%0.71383%0.826SS**  cis-170.4-162.511.5-710000107.4
16P39.5Very low38.3Very low119 Ų119128.9 Ų128.977%0.77382%0.817SS**  -118.9178-90.636.9-18.4000114.2
17Q34.3Very low38.2Very low193 Ų193128.7 Ų128.790%0.90282%0.816SS**  trans-36.2134.4168.3-67.6155.1-32.100115.2
18A35.6Very low38.9Very low103 Ų103128.4 Ų128.485%0.85181%0.811SS**  trans-12495.9156.300000108.6
19A35.3Very low39.2Very low100 Ų100133.2 Ų133.283%0.82681%0.81SS**  trans-74.6119.9160.400000107.7
20G34.9Very low39.5Very low72 Ų72134.9 Ų134.974%0.74281%0.811SS**  trans-119.984172.700000109.2Q22G20-Q22 PolarHBondContact O-N 3.11Å; G20-Q22 VanDerWaalsContact O-N 3.16Å
21E34.9Very low39.9Very low191 Ų191140 Ų14089%0.89382%0.815SS**  trans-62.7106.5165.4-76.6172.9133.900108.8A23E21-A23 PolarHBondContact O-N 2.82Å
22Q37.4Very low40Very low194 Ų194139.2 Ų139.291%0.90782%0.815SS**  trans-79.596.8162.3-77.5-174.60.200108.4G20G20-Q22 PolarHBondContact O-N 3.11Å; G20-Q22 VanDerWaalsContact O-N 3.16Å
23A37.9Very low40.3Very low95 Ų95139.6 Ų139.679%0.78581%0.81SS**PPolyproline II helixtrans-60130168.800000110.6E21 S25E21-A23 PolarHBondContact O-N 2.82Å; A23-S25 PolarHBondContact O-N 3.41Å
24K35Very low40.6Very low206 Ų206141.4 Ų141.490%0.89681%0.811SS**PPolyproline II helixtrans-57.9119.8172.6-68.1171.6176.5177.40110.6
25S40.2Very low41Very low109 Ų109147.4 Ų147.476%0.76282%0.816SS**PPolyproline II helixtrans-80.6125.615751.90000109.2A23A23-S25 PolarHBondContact O-N 3.41Å
26P47.1Very low41.2Very low118 Ų118149.6 Ų149.677%0.76682%0.819SS**PPolyproline II helixtrans-75.8132.9176.230-30000110.2
27S41.9Very low41.4Very low114 Ų114148.8 Ų148.880%0.79782%0.816SS**PPolyproline II helixtrans-52.9135.4169.3-83.60000110.8R29S27-R29 PolarHBondContact O-N 3.32Å
28P50.8Low41.9Very low118 Ų118145.1 Ų145.177%0.76681%0.812SS**PPolyproline II helixtrans-69.1132.8174.2-3.619.1000109.5N30P28-N30 PolarHBondContact O-N 3.15Å
29R48.7Very low42.5Very low224 Ų224145.3 Ų145.385%0.84581%0.807SS**PPolyproline II helixtrans-54.6124.8167.9-73.9175170.6178.9-3.9109.4S27 F31S27-R29 PolarHBondContact O-N 3.32Å; R29-F31 PolarHBondContact O-N 2.97Å
30N42.7Very low43.6Very low161 Ų161148.5 Ų148.586%0.86181%0.809SS**  trans-58.795.8167-80.8-29.2000109.6P28 V32P28-N30 PolarHBondContact O-N 3.15Å; N30-V32 PolarHBondContact O-N 3.4Å
31F46.5Very low44.7Very low173 Ų173152.3 Ų152.376%0.75981%0.813SS**  trans-78.4105.6160.2-101.6-90.9000107.3R29 F33R29-F31 PolarHBondContact O-N 2.97Å; F31-F33 VanDerWaalsContact C-N 3.32Å; F31-F33 PolarHBondContact O-N 3.23Å
32V44.6Very low46.6Very low134 Ų134146.2 Ų146.281%0.81279%0.791SS**  trans-68.693.5168.8178.90000107.3N30 N34N30-V32 PolarHBondContact O-N 3.4Å; V32-N34 PolarHBondContact O-N 3.34Å
33F46.3Very low48.4Very low175 Ų175143 Ų14377%0.76878%0.78SS**  trans-77.3118.6166-113.7-87.8000108.3F31 R35F31-F33 VanDerWaalsContact C-N 3.32Å; F31-F33 PolarHBondContact O-N 3.23Å; F33-R35 PolarHBondContact O-N 3.07Å
34N45.8Very low50.4Low144 Ų144143 Ų14377%0.7776%0.764SS**  trans-46.2130.8170-106.3-18.3000110.2V32 L36V32-N34 PolarHBondContact O-N 3.34Å; N34-L36 PolarHBondContact O-N 2.94Å
35R42.5Very low52.5Low250 Ų250136.8 Ų136.894%0.94375%0.746SS**  trans-53.9108174.8-67.6-179.8-169.1-157.51.5109.4F33F33-R35 PolarHBondContact O-N 3.07Å
36L43.9Very low54.5Low149 Ų149134.9 Ų134.978%0.7873%0.73SS**  trans-72.4136.7157.6-92.593.7000108.6N34 S38N34-L36 PolarHBondContact O-N 2.94Å; L36-S38 PolarHBondContact O-N 3.45Å
37S43.6Very low56.3Low102 Ų102133.3 Ų133.371%0.71372%0.715SS**  trans-37.1124.8165.447.60000113.2S39S37-S39 PolarHBondContact O-N 3.32Å
38S43.9Very low58.5Low115 Ų115134.7 Ų134.780%0.80470%0.704SS**SBendtrans-48117.3162.643.80000112.4L36L36-S38 PolarHBondContact O-N 3.45Å
39S49.8Very low60.2Low107 Ų107134.5 Ų134.575%0.74869%0.692SS**  trans170.65.9147.347.80000117.1S37S37-S39 PolarHBondContact O-N 3.32Å
40L57Low62Low168 Ų168126.1 Ų126.188%0.8867%0.669SS**  trans-109.679.2171.1-81.697.9000112.7
41N58.2Low64.3Low151 Ų151125.2 Ų125.281%0.80765%0.653SS**  trans-84.8110.1160.7-79.18.2000108.1D43N41-D43 PolarHBondContact O-N 2.94Å
42C74.2Confident66.4Low64 Ų64121.6 Ų121.643%0.43264%0.641SS.*  trans-78.4112.9172.7175.80000109.4M44 C45 V46C42-M44 PolarHBondContact O-N 2.99Å; C42-M44 VanDerWaalsContact O-N 3.1Å; C42-C45 HydrophobicContact CB-CB 3.93Å; C42-C45 WeakPolarHBondContact O-CA 3.17Å; C42-C45 WeakPolarHBondContact O-CB 3.36Å; C42-C45 PolarHBondContact O-N 3.26Å; C42-C45 VanDerWaalsContact SG-SG 3.63Å; C42-V46 PolarHBondContact O-N 3.07Å
43D76.9Confident68.5Low127 Ų127120.3 Ų120.368%0.67963%0.626SS**Hα-helixtrans-53.1-31.7176.9-101.3-10.4000112.7N41 N47N41-D43 PolarHBondContact O-N 2.94Å; D43-N47 WeakPolarHBondContact O-CB 3.39Å; D43-N47 PolarHBondContact O-N 3.35Å; D43-N47 PolarHBondContact O-ND2 2.93Å
44M78.5Confident70.7Confident93 Ų93117.7 Ų117.746%0.45862%0.616SS.*Hα-helixtrans-70.7-41.2175.4-75.8-88.544.600112.3C42 N47 Y48C42-M44 PolarHBondContact O-N 2.99Å; C42-M44 VanDerWaalsContact O-N 3.1Å; M44-N47 HydrophobicContact CE-CB 3.98Å; M44-N47 PolarHBondContact O-N 2.93Å; M44-Y48 HydrophobicContact CB-CD2 4.47Å; M44-Y48 HydrophobicContact CB-CE2 4.32Å; M44-Y48 HydrophobicContact CE-CD2 4.3Å; M44-Y48 HydrophobicContact CE-CE2 3.88Å; M44-Y48 WeakPolarHBondContact O-CD2 3.37Å; M44-Y48 PolarHBondContact O-N 3.17Å; M44-Y48 HydrophobicContact SD-CE2 4.44Å
45C80.5Confident72.9Confident77 Ų77118.6 Ų118.652%0.5261%0.61SS.*Hα-helixtrans-63-42.3175.3-64.10000111.4C42 N47 Y48 E49C42-C45 HydrophobicContact CB-CB 3.93Å; C42-C45 WeakPolarHBondContact O-CA 3.17Å; C42-C45 WeakPolarHBondContact O-CB 3.36Å; C42-C45 PolarHBondContact O-N 3.26Å; C42-C45 VanDerWaalsContact SG-SG 3.63Å; C45-N47 VanDerWaalsContact C-N 3.33Å; C45-N47 PolarHBondContact O-N 3.35Å; C45-Y48 PolarHBondContact O-N 3.4Å; C45-E49 VanDerWaalsContact O-CB 3.27Å; C45-E49 WeakPolarHBondContact O-CB 3.46Å; C45-E49 PolarHBondContact O-N 3.36Å
46V82.1Confident75.3Confident69 Ų69111.8 Ų111.842%0.41859%0.589SS.*Hα-helixtrans-61.4-41.8176.3178.10000111.2C42 E49 S50C42-V46 PolarHBondContact O-N 3.07Å; V46-E49 PolarHBondContact O-N 3.35Å; V46-S50 WeakPolarHBondContact O-CB 3.43Å; V46-S50 PolarHBondContact O-N 3.37Å
47N85.2Confident77.6Confident84 Ų84109.6 Ų109.645%0.44958%0.575SS.*Hα-helixtrans-67.3-40.5175.9-80-50.5000113.2D43 M44 C45 R51D43-N47 WeakPolarHBondContact O-CB 3.39Å; D43-N47 PolarHBondContact O-N 3.35Å; D43-N47 PolarHBondContact O-ND2 2.93Å; M44-N47 HydrophobicContact CE-CB 3.98Å; M44-N47 PolarHBondContact O-N 2.93Å; C45-N47 VanDerWaalsContact C-N 3.33Å; C45-N47 PolarHBondContact O-N 3.35Å; N47-R51 WeakPolarHBondContact O-CG 3.32Å; N47-R51 PolarHBondContact O-N 3.44Å
48Y86.3Confident80Confident144 Ų144107.2 Ų107.257%0.56556%0.558SS**Hα-helixtrans-66.6-39.9174.7-76.6-62.7000111.8M44 C45 R51 L52M44-Y48 HydrophobicContact CB-CD2 4.47Å; M44-Y48 HydrophobicContact CB-CE2 4.32Å; M44-Y48 HydrophobicContact CE-CD2 4.3Å; M44-Y48 HydrophobicContact CE-CE2 3.88Å; M44-Y48 WeakPolarHBondContact O-CD2 3.37Å; M44-Y48 PolarHBondContact O-N 3.17Å; M44-Y48 HydrophobicContact SD-CE2 4.44Å; C45-Y48 PolarHBondContact O-N 3.4Å; Y48-R51 PolarHBondContact O-N 3.35Å; Y48-L52 VanDerWaalsContact O-CB 3.27Å; Y48-L52 WeakPolarHBondContact O-CB 3.38Å; Y48-L52 PolarHBondContact O-N 2.88Å
49E86.8Confident82.4Confident113 Ų113106 Ų10653%0.52854%0.54SS..Hα-helixtrans-64.4-43.6175.4-171.1172.7-168.900111.1C45 V46 L52 Q53C45-E49 VanDerWaalsContact O-CB 3.27Å; C45-E49 WeakPolarHBondContact O-CB 3.46Å; C45-E49 PolarHBondContact O-N 3.36Å; V46-E49 PolarHBondContact O-N 3.35Å; E49-L52 PolarHBondContact O-N 3.16Å; E49-Q53 WeakPolarHBondContact O-CB 3.44Å; E49-Q53 VanDerWaalsContact O-CG 3.29Å; E49-Q53 WeakPolarHBondContact O-CG 3.39Å; E49-Q53 PolarHBondContact O-N 2.94Å
50S87.4Confident84.5Confident49 Ų49109.4 Ų109.434%0.34354%0.536SS..Hα-helixtrans-62.1-45.2174.5-1760000112.5V46 L52 Q53 Q54V46-S50 WeakPolarHBondContact O-CB 3.43Å; V46-S50 PolarHBondContact O-N 3.37Å; S50-L52 PolarHBondContact O-N 2.94Å; S50-Q53 PolarHBondContact O-N 2.97Å; S50-Q54 WeakPolarHBondContact O-CG 3.45Å; S50-Q54 PolarHBondContact O-N 2.74Å
51R91.1Very high86.3Confident142 Ų142108.4 Ų108.454%0.53652%0.521SS..Hα-helixtrans-63.1-40.8174.3-77.7179.1-177167.31.9112N47 Y48 Q54 Y55N47-R51 WeakPolarHBondContact O-CG 3.32Å; N47-R51 PolarHBondContact O-N 3.44Å; Y48-R51 PolarHBondContact O-N 3.35Å; R51-Q54 WeakPolarHBondContact O-CB 3.33Å; R51-Q54 PolarHBondContact O-N 3.35Å; R51-Y55 HydrophobicContact CB-CE2 4.44Å; R51-Y55 WeakPolarHBondContact O-CD2 3.44Å; R51-Y55 PolarHBondContact O-N 3.23Å
52L89.6Confident88Confident97 Ų97106.5 Ų106.551%0.50851%0.51SS..Hα-helixtrans-63.2-43.5177.1-176.666.2000111.2Y48 E49 S50 Y55 Q56Y48-L52 VanDerWaalsContact O-CB 3.27Å; Y48-L52 WeakPolarHBondContact O-CB 3.38Å; Y48-L52 PolarHBondContact O-N 2.88Å; E49-L52 PolarHBondContact O-N 3.16Å; S50-L52 PolarHBondContact O-N 2.94Å; L52-Y55 PolarHBondContact O-N 3.05Å; L52-Q56 WeakPolarHBondContact O-CB 3.36Å; L52-Q56 VanDerWaalsContact O-CG 3.29Å; L52-Q56 WeakPolarHBondContact O-CG 3.47Å; L52-Q56 PolarHBondContact O-N 2.96Å
53Q90.2Very high89Confident106 Ų106111 Ų11150%0.49552%0.518SS..Hα-helixtrans-60.9-44174.1-73.7174.1200111.4E49 S50 Y55 Q56 E57E49-Q53 WeakPolarHBondContact O-CB 3.44Å; E49-Q53 VanDerWaalsContact O-CG 3.29Å; E49-Q53 WeakPolarHBondContact O-CG 3.39Å; E49-Q53 PolarHBondContact O-N 2.94Å; S50-Q53 PolarHBondContact O-N 2.97Å; Q53-Y55 PolarHBondContact O-N 3.46Å; Q53-Q56 PolarHBondContact O-N 3.47Å; Q53-E57 WeakPolarHBondContact O-CB 3.5Å; Q53-E57 PolarHBondContact O-N 3.33Å
54Q91.8Very high89.9Confident121 Ų121110 Ų11057%0.56551%0.509SS*.Hα-helixtrans-59.8-43.4174.3-72.8173.72.800112.2S50 R51 E57 S58S50-Q54 WeakPolarHBondContact O-CG 3.45Å; S50-Q54 PolarHBondContact O-N 2.74Å; R51-Q54 WeakPolarHBondContact O-CB 3.33Å; R51-Q54 PolarHBondContact O-N 3.35Å; Q54-E57 PolarHBondContact O-N 3.34Å; Q54-S58 WeakPolarHBondContact O-CB 3.37Å; Q54-S58 PolarHBondContact O-N 2.95Å
55Y92Very high90.7Very high163 Ų163111 Ų11164%0.63951%0.513SS*.Hα-helixtrans-64.8-44.9175.8-76.1-57.9000112R51 L52 Q53 E57 S58 E59R51-Y55 HydrophobicContact CB-CE2 4.44Å; R51-Y55 WeakPolarHBondContact O-CD2 3.44Å; R51-Y55 PolarHBondContact O-N 3.23Å; L52-Y55 PolarHBondContact O-N 3.05Å; Q53-Y55 PolarHBondContact O-N 3.46Å; Y55-E57 VanDerWaalsContact C-N 3.31Å; Y55-E57 PolarHBondContact O-N 3.49Å; Y55-S58 WeakPolarHBondContact CA-OG 3.37Å; Y55-S58 PolarHBondContact O-N 2.93Å; Y55-S58 PolarHBondContact O-OG 3.34Å; Y55-E59 WeakPolarHBondContact O-CB 3.34Å; Y55-E59 PolarHBondContact O-N 2.89Å
56Q92.3Very high91.4Very high106 Ų106112.1 Ų112.150%0.49551%0.513SS..Hα-helixtrans-61.5-38.9176.4-74174.6-1500112L52 Q53 E59 R60L52-Q56 WeakPolarHBondContact O-CB 3.36Å; L52-Q56 VanDerWaalsContact O-CG 3.29Å; L52-Q56 WeakPolarHBondContact O-CG 3.47Å; L52-Q56 PolarHBondContact O-N 2.96Å; Q53-Q56 PolarHBondContact O-N 3.47Å; Q56-E59 PolarHBondContact O-N 3.17Å; Q56-R60 WeakPolarHBondContact O-CB 3.47Å; Q56-R60 PolarHBondContact O-N 2.86Å
57E92.6Very high92.1Very high104 Ų104112 Ų11249%0.48651%0.513SS..Hα-helixtrans-69.6-40.1176.4-156.2-179.4155.300111.5Q53 Q54 Y55 R60 R61Q53-E57 WeakPolarHBondContact O-CB 3.5Å; Q53-E57 PolarHBondContact O-N 3.33Å; Q54-E57 PolarHBondContact O-N 3.34Å; Y55-E57 VanDerWaalsContact C-N 3.31Å; Y55-E57 PolarHBondContact O-N 3.49Å; E57-R60 PolarHBondContact O-N 3.13Å; E57-R61 WeakPolarHBondContact O-CG 3.37Å; E57-R61 PolarHBondContact O-N 2.9Å; E57-R61 IonicContact OE1-CZ 3.25Å; E57-R61 IonicContact OE1-NE 2.67Å; E57-R61 IonicContact OE1-NH2 3.07Å; E57-R61 PolarHBondContact OE1-NH2 3.47Å
58S93.7Very high92.6Very high52 Ų52112.1 Ų112.136%0.36452%0.516SS..Hα-helixtrans-63.5-40.4173.3780000112.4Q54 Y55 R61 L62Q54-S58 WeakPolarHBondContact O-CB 3.37Å; Q54-S58 PolarHBondContact O-N 2.95Å; Y55-S58 WeakPolarHBondContact CA-OG 3.37Å; Y55-S58 PolarHBondContact O-N 2.93Å; Y55-S58 PolarHBondContact O-OG 3.34Å; S58-R61 PolarHBondContact O-N 3.09Å; S58-L62 WeakPolarHBondContact O-CG 3.44Å; S58-L62 PolarHBondContact O-N 3.03Å
59E93.7Very high93.1Very high90 Ų90110.5 Ų110.542%0.42152%0.517SS..Hα-helixtrans-65.4-42.7176.2-170.4-169.9171.200110.6Y55 Q56 R61 L62 R63Y55-E59 WeakPolarHBondContact O-CB 3.34Å; Y55-E59 PolarHBondContact O-N 2.89Å; Q56-E59 PolarHBondContact O-N 3.17Å; E59-R61 VanDerWaalsContact C-N 3.35Å; E59-R61 PolarHBondContact O-N 2.88Å; E59-L62 PolarHBondContact O-N 3.48Å; E59-R63 WeakPolarHBondContact O-CB 3.48Å; E59-R63 VanDerWaalsContact O-CG 3.27Å; E59-R63 WeakPolarHBondContact O-CG 3.46Å; E59-R63 PolarHBondContact O-N 3.1Å; E59-R63 IonicContact OE1-CZ 3.49Å; E59-R63 IonicContact OE1-NE 3.51Å; E59-R63 PolarHBondContact OE1-NE 3.35Å; E59-R63 IonicContact OE1-NH2 2.91Å; E59-R63 PolarHBondContact OE1-NH2 3.39Å
60R93.6Very high93.5Very high177 Ų177110.1 Ų110.167%0.66852%0.515SS*.Hα-helixtrans-62-41.9175.6-167.4177.1-175.51721.6111.6Q56 E57 R63 Q64Q56-R60 WeakPolarHBondContact O-CB 3.47Å; Q56-R60 PolarHBondContact O-N 2.86Å; E57-R60 PolarHBondContact O-N 3.13Å; R60-R63 PolarHBondContact O-N 3.48Å; R60-Q64 WeakPolarHBondContact O-CG 3.46Å; R60-Q64 PolarHBondContact O-N 3.21Å
61R94.8Very high93.9Very high147 Ų147112.7 Ų112.756%0.55553%0.525SS*.Hα-helixtrans-63.9-45.7175.3-72.2176.5-168-167.35.6111.8E57 S58 E59 Q64 Q65E57-R61 WeakPolarHBondContact O-CG 3.37Å; E57-R61 PolarHBondContact O-N 2.9Å; E57-R61 IonicContact OE1-CZ 3.25Å; E57-R61 IonicContact OE1-NE 2.67Å; E57-R61 IonicContact OE1-NH2 3.07Å; E57-R61 PolarHBondContact OE1-NH2 3.47Å; S58-R61 PolarHBondContact O-N 3.09Å; E59-R61 VanDerWaalsContact C-N 3.35Å; E59-R61 PolarHBondContact O-N 2.88Å; R61-Q64 PolarHBondContact O-N 3.09Å; R61-Q65 WeakPolarHBondContact O-CG 3.24Å; R61-Q65 PolarHBondContact O-N 2.91Å
62L95Very high94.2Very high111 Ų111109 Ų10958%0.58152%0.516SS*.Hα-helixtrans-64.4-40176.8-74.6170.2000112.1S58 E59 Q65 L66S58-L62 WeakPolarHBondContact O-CG 3.44Å; S58-L62 PolarHBondContact O-N 3.03Å; E59-L62 PolarHBondContact O-N 3.48Å; L62-Q65 PolarHBondContact O-N 2.92Å; L62-L66 WeakPolarHBondContact O-CB 3.41Å; L62-L66 PolarHBondContact O-N 3.44Å
63R95Very high94.5Very high158 Ų158108.5 Ų108.560%0.59651%0.513SS*.Hα-helixtrans-62.2-43.4173.7-75.1175.5180-134.65.9111.3E59 R60 L66 T67E59-R63 WeakPolarHBondContact O-CB 3.48Å; E59-R63 VanDerWaalsContact O-CG 3.27Å; E59-R63 WeakPolarHBondContact O-CG 3.46Å; E59-R63 PolarHBondContact O-N 3.1Å; E59-R63 IonicContact OE1-CZ 3.49Å; E59-R63 IonicContact OE1-NE 3.51Å; E59-R63 PolarHBondContact OE1-NE 3.35Å; E59-R63 IonicContact OE1-NH2 2.91Å; E59-R63 PolarHBondContact OE1-NH2 3.39Å; R60-R63 PolarHBondContact O-N 3.48Å; R63-L66 PolarHBondContact O-N 2.93Å; R63-T67 WeakPolarHBondContact O-CG2 3.5Å; R63-T67 PolarHBondContact O-N 2.95Å; R63-T67 PolarHBondContact O-OG1 3.01Å
64Q95.3Very high94.7Very high107 Ų107108.3 Ų108.350%0.551%0.513SS..Hα-helixtrans-61.2-47.9173.9-75.9173.6-15.700111.4R60 R61 L66 T67 T68R60-Q64 WeakPolarHBondContact O-CG 3.46Å; R60-Q64 PolarHBondContact O-N 3.21Å; R61-Q64 PolarHBondContact O-N 3.09Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 3.49Å; Q64-T67 WeakPolarHBondContact CA-OG1 3.37Å; Q64-T67 PolarHBondContact O-N 3.41Å; Q64-T67 PolarHBondContact O-OG1 3.23Å; Q64-T68 WeakPolarHBondContact O-CG2 3.39Å; Q64-T68 PolarHBondContact O-N 3Å; Q64-T68 PolarHBondContact O-OG1 2.89Å
65Q96.1Very high94.9Very high114 Ų114107.6 Ų107.653%0.53351%0.509SS..Hα-helixtrans-58.8-43.9176.1-74.2177.7-17.700112.2R61 L62 T67 T68 L69R61-Q65 WeakPolarHBondContact O-CG 3.24Å; R61-Q65 PolarHBondContact O-N 2.91Å; L62-Q65 PolarHBondContact O-N 2.92Å; Q65-T67 PolarHBondContact O-N 2.88Å; Q65-T68 WeakPolarHBondContact CA-OG1 3.24Å; Q65-T68 PolarHBondContact O-N 2.94Å; Q65-T68 PolarHBondContact O-OG1 3.43Å; Q65-L69 WeakPolarHBondContact O-CG 3.46Å; Q65-L69 PolarHBondContact O-N 3.44Å
66L95.9Very high95.1Very high100 Ų100106.5 Ų106.552%0.52451%0.505SS..Hα-helixtrans-60.1-46.3176.1-175.468000111.3L62 R63 Q64 T68 L69 Q70L62-L66 WeakPolarHBondContact O-CB 3.41Å; L62-L66 PolarHBondContact O-N 3.44Å; R63-L66 PolarHBondContact O-N 2.93Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 3.49Å; L66-T68 VanDerWaalsContact C-N 3.34Å; L66-T68 PolarHBondContact O-N 3.44Å; L66-L69 PolarHBondContact O-N 2.93Å; L66-Q70 WeakPolarHBondContact O-CB 3.44Å; L66-Q70 VanDerWaalsContact O-CG 3.28Å; L66-Q70 WeakPolarHBondContact O-CG 3.42Å; L66-Q70 PolarHBondContact O-N 3.41Å
67T95.7Very high95.3Very high68 Ų68106.5 Ų106.542%0.41750%0.503SS..Hα-helixtrans-63-38.8176.954.70000112.3R63 Q64 Q65 Q70 N71R63-T67 WeakPolarHBondContact O-CG2 3.5Å; R63-T67 PolarHBondContact O-N 2.95Å; R63-T67 PolarHBondContact O-OG1 3.01Å; Q64-T67 WeakPolarHBondContact CA-OG1 3.37Å; Q64-T67 PolarHBondContact O-N 3.41Å; Q64-T67 PolarHBondContact O-OG1 3.23Å; Q65-T67 PolarHBondContact O-N 2.88Å; T67-Q70 PolarHBondContact O-N 2.99Å; T67-N71 WeakPolarHBondContact O-CB 3.36Å; T67-N71 PolarHBondContact O-N 3.28Å; T67-N71 PolarHBondContact O-ND2 3.47Å
68T95.9Very high95.5Very high85 Ų85105.6 Ų105.652%0.52151%0.505SS..Hα-helixtrans-66-41.1175.855.80000112.4Q64 Q65 L66 N71 L72Q64-T68 WeakPolarHBondContact O-CG2 3.39Å; Q64-T68 PolarHBondContact O-N 3Å; Q64-T68 PolarHBondContact O-OG1 2.89Å; Q65-T68 WeakPolarHBondContact CA-OG1 3.24Å; Q65-T68 PolarHBondContact O-N 2.94Å; Q65-T68 PolarHBondContact O-OG1 3.43Å; L66-T68 VanDerWaalsContact C-N 3.34Å; L66-T68 PolarHBondContact O-N 3.44Å; T68-N71 PolarHBondContact O-N 3.45Å; T68-L72 WeakPolarHBondContact O-CB 3.44Å; T68-L72 PolarHBondContact O-N 2.95Å
69L95.9Very high95.6Very high111 Ų111108.5 Ų108.558%0.58151%0.513SS*.Hα-helixtrans-68.7-37176.9-72.4173.7000112Q65 L66 L72 N73Q65-L69 WeakPolarHBondContact O-CG 3.46Å; Q65-L69 PolarHBondContact O-N 3.44Å; L66-L69 PolarHBondContact O-N 2.93Å; L69-L72 PolarHBondContact O-N 3.49Å; L69-N73 VanDerWaalsContact O-CB 3.31Å; L69-N73 WeakPolarHBondContact O-CB 3.43Å; L69-N73 PolarHBondContact O-N 3.07Å
70Q96.4Very high95.7Very high105 Ų105108.5 Ų108.549%0.49152%0.515SS..Hα-helixtrans-62.6-46.4173.7-76.8173.9-29.900111.2L66 T67 L72 N73 E74L66-Q70 WeakPolarHBondContact O-CB 3.44Å; L66-Q70 VanDerWaalsContact O-CG 3.28Å; L66-Q70 WeakPolarHBondContact O-CG 3.42Å; L66-Q70 PolarHBondContact O-N 3.41Å; T67-Q70 PolarHBondContact O-N 2.99Å; Q70-L72 PolarHBondContact O-N 3Å; Q70-N73 PolarHBondContact O-N 3.32Å; Q70-E74 PolarHBondContact O-N 2.93Å
71N95.7Very high95.9Very high102 Ų102103.4 Ų103.455%0.54551%0.507SS..Hα-helixtrans-62.2-42.7176.8-68.9-15.1000111.8T67 T68 N73 E74 Q75T67-N71 WeakPolarHBondContact O-CB 3.36Å; T67-N71 PolarHBondContact O-N 3.28Å; T67-N71 PolarHBondContact O-ND2 3.47Å; T68-N71 PolarHBondContact O-N 3.45Å; N71-N73 VanDerWaalsContact C-N 3.35Å; N71-E74 PolarHBondContact O-N 3.04Å; N71-Q75 WeakPolarHBondContact O-CG 3.27Å; N71-Q75 PolarHBondContact O-N 2.93Å
72L96.3Very high95.9Very high66 Ų6698.7 Ų98.735%0.34650%0.499SS..Hα-helixtrans-64.7-38.6176.4-171.271.5000111.9T68 L69 Q70 Q75 Y76T68-L72 WeakPolarHBondContact O-CB 3.44Å; T68-L72 PolarHBondContact O-N 2.95Å; L69-L72 PolarHBondContact O-N 3.49Å; Q70-L72 PolarHBondContact O-N 3Å; L72-Q75 PolarHBondContact O-N 3.41Å; L72-Y76 HydrophobicContact CD1-CE2 3.91Å; L72-Y76 HydrophobicContact CD2-CE2 3.76Å; L72-Y76 HydrophobicContact CG-CD2 3.96Å; L72-Y76 HydrophobicContact CG-CE2 3.51Å; L72-Y76 WeakPolarHBondContact O-CD2 3.24Å; L72-Y76 PolarHBondContact O-N 3.2Å
73N96Very high96Very high85 Ų8598.5 Ų98.546%0.45550%0.495SS..Hα-helixtrans-65.4-42.7176.9-166.5-85.7000111.8L69 Q70 N71 Y76 K77L69-N73 VanDerWaalsContact O-CB 3.31Å; L69-N73 WeakPolarHBondContact O-CB 3.43Å; L69-N73 PolarHBondContact O-N 3.07Å; Q70-N73 PolarHBondContact O-N 3.32Å; N71-N73 VanDerWaalsContact C-N 3.35Å; N73-Y76 PolarHBondContact O-N 3.45Å; N73-K77 WeakPolarHBondContact O-CG 3.29Å; N73-K77 PolarHBondContact O-N 3.2Å; N73-K77 WeakPolarHBondContact OD1-CE 3.45Å; N73-K77 PolarHBondContact OD1-NZ 3.44Å
74E95.6Very high96Very high103 Ų10399 Ų9948%0.48150%0.497SS..Hα-helixtrans-65-40.1174.2-71.1-54.6133.400111.7Q70 N71 K77 T78Q70-E74 PolarHBondContact O-N 2.93Å; N71-E74 PolarHBondContact O-N 3.04Å; E74-K77 PolarHBondContact O-N 3.4Å; E74-K77 IonicContact OE1-NZ 3.13Å; E74-K77 PolarHBondContact OE1-NZ 2.87Å; E74-T78 WeakPolarHBondContact O-CG2 3.42Å; E74-T78 PolarHBondContact O-N 3.44Å; E74-T78 PolarHBondContact O-OG1 2.88Å
75Q95.3Very high96.1Very high106 Ų10698.8 Ų98.850%0.49550%0.499SS..Hα-helixtrans-57.4-52.5171.8-74.8174.2-3.600111.5N71 L72 K77 T78 E79N71-Q75 WeakPolarHBondContact O-CG 3.27Å; N71-Q75 PolarHBondContact O-N 2.93Å; L72-Q75 PolarHBondContact O-N 3.41Å; Q75-K77 VanDerWaalsContact C-N 3.3Å; Q75-K77 PolarHBondContact O-N 3.46Å; Q75-T78 PolarHBondContact O-N 2.94Å; Q75-T78 PolarHBondContact O-OG1 3.46Å; Q75-E79 PolarHBondContact O-N 3.16Å
76Y96.2Very high96.1Very high139 Ų13999 Ų9955%0.54550%0.5SS..Hα-helixtrans-62.6-33.1178.2-72.1-41.6000113.8L72 N73 L80L72-Y76 HydrophobicContact CD1-CE2 3.91Å; L72-Y76 HydrophobicContact CD2-CE2 3.76Å; L72-Y76 HydrophobicContact CG-CD2 3.96Å; L72-Y76 HydrophobicContact CG-CE2 3.51Å; L72-Y76 WeakPolarHBondContact O-CD2 3.24Å; L72-Y76 PolarHBondContact O-N 3.2Å; N73-Y76 PolarHBondContact O-N 3.45Å; Y76-L80 WeakPolarHBondContact O-CB 3.38Å; Y76-L80 PolarHBondContact O-N 3.01Å
77K96.8Very high96.1Very high107 Ų107101.4 Ų101.447%0.46550%0.502SS..Hα-helixtrans-63.4-44.3172.1-77.5174.1-1771630111.4N73 E74 Q75 S81N73-K77 WeakPolarHBondContact O-CG 3.29Å; N73-K77 PolarHBondContact O-N 3.2Å; N73-K77 WeakPolarHBondContact OD1-CE 3.45Å; N73-K77 PolarHBondContact OD1-NZ 3.44Å; E74-K77 PolarHBondContact O-N 3.4Å; E74-K77 IonicContact OE1-NZ 3.13Å; E74-K77 PolarHBondContact OE1-NZ 2.87Å; Q75-K77 VanDerWaalsContact C-N 3.3Å; Q75-K77 PolarHBondContact O-N 3.46Å; K77-S81 WeakPolarHBondContact O-CB 3.44Å; K77-S81 PolarHBondContact O-N 2.86Å
78T96.3Very high96.1Very high84 Ų84105 Ų10552%0.51551%0.512SS..Hα-helixtrans-64.8-45.7178.258.40000111.7E74 Q75 L80 S81 A82E74-T78 WeakPolarHBondContact O-CG2 3.42Å; E74-T78 PolarHBondContact O-N 3.44Å; E74-T78 PolarHBondContact O-OG1 2.88Å; Q75-T78 PolarHBondContact O-N 2.94Å; Q75-T78 PolarHBondContact O-OG1 3.46Å; T78-L80 PolarHBondContact O-N 3.45Å; T78-S81 PolarHBondContact O-N 3.21Å; T78-S81 PolarHBondContact O-OG 2.97Å; T78-A82 PolarHBondContact O-N 3.35Å
79E96.4Very high96.2Very high113 Ų113105 Ų10553%0.52851%0.509SS..Hα-helixtrans-60.9-45.9176.1-70.4176.6-177.800111.9Q75 S81 A82 E83Q75-E79 PolarHBondContact O-N 3.16Å; E79-S81 VanDerWaalsContact C-N 3.28Å; E79-S81 PolarHBondContact O-N 3.42Å; E79-A82 PolarHBondContact O-N 2.93Å; E79-E83 WeakPolarHBondContact O-CB 3.46Å; E79-E83 PolarHBondContact O-N 3.48Å
80L96.5Very high96.2Very high90 Ų90103.5 Ų103.547%0.47150%0.504SS..Hα-helixtrans-62.6-36.1176.9-177.164.3000112.1Y76 T78 R84Y76-L80 WeakPolarHBondContact O-CB 3.38Å; Y76-L80 PolarHBondContact O-N 3.01Å; T78-L80 PolarHBondContact O-N 3.45Å; L80-R84 WeakPolarHBondContact O-CB 3.44Å; L80-R84 VanDerWaalsContact O-CG 3.24Å; L80-R84 WeakPolarHBondContact O-CG 3.43Å; L80-R84 PolarHBondContact O-N 2.9Å
81S96.1Very high96.2Very high71 Ų71103.9 Ų103.950%0.49751%0.506SS..Hα-helixtrans-68.2-39.3175.876.90000112.1K77 T78 E79 L85K77-S81 WeakPolarHBondContact O-CB 3.44Å; K77-S81 PolarHBondContact O-N 2.86Å; T78-S81 PolarHBondContact O-N 3.21Å; T78-S81 PolarHBondContact O-OG 2.97Å; E79-S81 VanDerWaalsContact C-N 3.28Å; E79-S81 PolarHBondContact O-N 3.42Å; S81-L85 PolarHBondContact O-N 3.21Å; S81-L85 VanDerWaalsContact O-N 3.13Å
82A96.2Very high96.2Very high48 Ų48102.4 Ų102.440%0.39750%0.504SS..Hα-helixtrans-66.6-44.9176.100000111.3T78 E79 R84 L85 Q86T78-A82 PolarHBondContact O-N 3.35Å; E79-A82 PolarHBondContact O-N 2.93Å; A82-R84 VanDerWaalsContact C-N 3.35Å; A82-R84 PolarHBondContact O-N 3.27Å; A82-L85 PolarHBondContact O-N 2.9Å; A82-Q86 WeakPolarHBondContact O-CG 3.38Å; A82-Q86 PolarHBondContact O-N 2.95Å
83E96.1Very high96.2Very high106 Ų106101.8 Ų101.850%0.49551%0.508SS..Hα-helixtrans-61.9-41.1177.3-172.864.5-156.500111.7E79 L85 Q86 R87E79-E83 WeakPolarHBondContact O-CB 3.46Å; E79-E83 PolarHBondContact O-N 3.48Å; E83-L85 VanDerWaalsContact C-N 3.33Å; E83-L85 PolarHBondContact O-N 3.39Å; E83-Q86 PolarHBondContact O-N 3.43Å; E83-R87 WeakPolarHBondContact O-CB 3.46Å; E83-R87 PolarHBondContact O-N 3.28Å
84R96.5Very high96.3Very high170 Ų170103.2 Ų103.264%0.64252%0.515SS*.Hα-helixtrans-62.3-39.9175.1-77.4172.8179.4-178.30.9112.4L80 A82 K88L80-R84 WeakPolarHBondContact O-CB 3.44Å; L80-R84 VanDerWaalsContact O-CG 3.24Å; L80-R84 WeakPolarHBondContact O-CG 3.43Å; L80-R84 PolarHBondContact O-N 2.9Å; A82-R84 VanDerWaalsContact C-N 3.35Å; A82-R84 PolarHBondContact O-N 3.27Å; R84-K88 WeakPolarHBondContact O-CB 3.43Å; R84-K88 PolarHBondContact O-N 2.88Å; R84-K88 VanDerWaalsContact O-N 3.08Å
85L96.2Very high96.3Very high102 Ų102102.2 Ų102.253%0.53451%0.51SS..Hα-helixtrans-66.9-48.3177.2-175.262.4000110.6S81 A82 E83 R87 K88 D89S81-L85 PolarHBondContact O-N 3.21Å; S81-L85 VanDerWaalsContact O-N 3.13Å; A82-L85 PolarHBondContact O-N 2.9Å; E83-L85 VanDerWaalsContact C-N 3.33Å; E83-L85 PolarHBondContact O-N 3.39Å; L85-R87 VanDerWaalsContact C-N 3.31Å; L85-R87 PolarHBondContact O-N 3.49Å; L85-K88 WeakPolarHBondContact O-CB 3.29Å; L85-K88 PolarHBondContact O-N 3.5Å; L85-D89 VanDerWaalsContact O-CG 3.32Å; L85-D89 PolarHBondContact O-N 3.27Å
86Q95.8Very high96.3Very high117 Ų117100.5 Ų100.555%0.54751%0.51SS..Hα-helixtrans-57.1-43.9175.5-73.4-173.6-8.300111.9A82 E83 K88 D89 T90A82-Q86 WeakPolarHBondContact O-CG 3.38Å; A82-Q86 PolarHBondContact O-N 2.95Å; E83-Q86 PolarHBondContact O-N 3.43Å; Q86-K88 PolarHBondContact O-N 3.36Å; Q86-D89 PolarHBondContact O-N 2.94Å; Q86-T90 WeakPolarHBondContact O-CG2 3.34Å; Q86-T90 PolarHBondContact O-N 2.86Å; Q86-T90 PolarHBondContact O-OG1 3.35Å
87R96.5Very high96.4Very high152 Ų15298.8 Ų98.857%0.57451%0.51SS*.Hα-helixtrans-60.9-46177.9-158-178.4-167.9105.2-0.5111.7E83 L85 D89 T90 E91E83-R87 WeakPolarHBondContact O-CB 3.46Å; E83-R87 PolarHBondContact O-N 3.28Å; L85-R87 VanDerWaalsContact C-N 3.31Å; L85-R87 PolarHBondContact O-N 3.49Å; R87-D89 VanDerWaalsContact C-N 3.32Å; R87-D89 PolarHBondContact O-N 3.32Å; R87-T90 WeakPolarHBondContact CA-OG1 3.47Å; R87-T90 PolarHBondContact O-N 2.92Å; R87-T90 PolarHBondContact O-OG1 2.83Å; R87-E91 IonicContact NE-OE1 3.81Å; R87-E91 WeakPolarHBondContact O-CB 3.38Å; R87-E91 WeakPolarHBondContact O-CG 3.43Å; R87-E91 PolarHBondContact O-N 2.8Å
88K96.7Very high96.4Very high142 Ų142100 Ų10062%0.61751%0.511SS*.Hα-helixtrans-59.9-42.3175.5-174.4-176.5177.1-173.30111.9R84 L85 Q86 E91 S92R84-K88 WeakPolarHBondContact O-CB 3.43Å; R84-K88 PolarHBondContact O-N 2.88Å; R84-K88 VanDerWaalsContact O-N 3.08Å; L85-K88 WeakPolarHBondContact O-CB 3.29Å; L85-K88 PolarHBondContact O-N 3.5Å; Q86-K88 PolarHBondContact O-N 3.36Å; K88-E91 PolarHBondContact O-N 2.93Å; K88-S92 WeakPolarHBondContact O-CB 3.35Å; K88-S92 PolarHBondContact O-N 3.16Å
89D96.3Very high96.4Very high86 Ų86101.1 Ų101.146%0.4651%0.511SS..Hα-helixtrans-64.7-44.5177.8-67.4-15.8000110.7L85 Q86 R87 S92 A93L85-D89 VanDerWaalsContact O-CG 3.32Å; L85-D89 PolarHBondContact O-N 3.27Å; Q86-D89 PolarHBondContact O-N 2.94Å; R87-D89 VanDerWaalsContact C-N 3.32Å; R87-D89 PolarHBondContact O-N 3.32Å; D89-S92 PolarHBondContact O-N 3.12Å; D89-S92 PolarHBondContact O-OG 2.97Å; D89-A93 WeakPolarHBondContact O-CB 3.39Å; D89-A93 PolarHBondContact O-N 2.96Å
90T95.9Very high96.4Very high79 Ų7998.4 Ų98.449%0.48550%0.504SS..Hα-helixtrans-64.3-40.4176.161.10000113Q86 R87 S92 A93 L94Q86-T90 WeakPolarHBondContact O-CG2 3.34Å; Q86-T90 PolarHBondContact O-N 2.86Å; Q86-T90 PolarHBondContact O-OG1 3.35Å; R87-T90 WeakPolarHBondContact CA-OG1 3.47Å; R87-T90 PolarHBondContact O-N 2.92Å; R87-T90 PolarHBondContact O-OG1 2.83Å; T90-S92 VanDerWaalsContact C-N 3.34Å; T90-A93 PolarHBondContact O-N 3.38Å; T90-L94 WeakPolarHBondContact O-CB 3.33Å; T90-L94 VanDerWaalsContact O-CG 3.31Å; T90-L94 WeakPolarHBondContact O-CG 3.45Å; T90-L94 PolarHBondContact O-N 3.44Å
91E97.3Very high96.4Very high114 Ų11497.7 Ų97.753%0.53350%0.504SS..Hα-helixtrans-63-42175.3-75.6172.9-17400111.1R87 K88 L94 Q95R87-E91 IonicContact NE-OE1 3.81Å; R87-E91 WeakPolarHBondContact O-CB 3.38Å; R87-E91 WeakPolarHBondContact O-CG 3.43Å; R87-E91 PolarHBondContact O-N 2.8Å; K88-E91 PolarHBondContact O-N 2.93Å; E91-L94 PolarHBondContact O-N 3.34Å; E91-Q95 WeakPolarHBondContact O-CB 3.39Å; E91-Q95 PolarHBondContact O-N 2.89Å
92S96.1Very high96.4Very high71 Ų7198.7 Ų98.750%0.49750%0.5SS..Hα-helixtrans-65-39.3175.777.20000112.5K88 D89 T90 Q95 S96K88-S92 WeakPolarHBondContact O-CB 3.35Å; K88-S92 PolarHBondContact O-N 3.16Å; D89-S92 PolarHBondContact O-N 3.12Å; D89-S92 PolarHBondContact O-OG 2.97Å; T90-S92 VanDerWaalsContact C-N 3.34Å; S92-Q95 PolarHBondContact O-N 2.86Å; S92-S96 PolarHBondContact O-N 3.46Å
93A96.6Very high96.4Very high53 Ų53102.5 Ų102.544%0.43851%0.508SS..Hα-helixtrans-65.8-45.1176.600000111.4D89 T90 Q95 S96 L97D89-A93 WeakPolarHBondContact O-CB 3.39Å; D89-A93 PolarHBondContact O-N 2.96Å; T90-A93 PolarHBondContact O-N 3.38Å; A93-Q95 PolarHBondContact O-N 3Å; A93-S96 PolarHBondContact O-N 2.9Å; A93-S96 PolarHBondContact O-OG 3.46Å; A93-L97 WeakPolarHBondContact O-CB 3.21Å; A93-L97 PolarHBondContact O-N 3.41Å
94L96.4Very high96.4Very high114 Ų114102.7 Ų102.760%0.59751%0.509SS*.Hα-helixtrans-62.1-41.1176.1-73.3174.2000112.2T90 E91 L97 R98T90-L94 WeakPolarHBondContact O-CB 3.33Å; T90-L94 VanDerWaalsContact O-CG 3.31Å; T90-L94 WeakPolarHBondContact O-CG 3.45Å; T90-L94 PolarHBondContact O-N 3.44Å; E91-L94 PolarHBondContact O-N 3.34Å; L94-L97 PolarHBondContact O-N 2.88Å; L94-R98 WeakPolarHBondContact O-CB 3.44Å; L94-R98 PolarHBondContact O-N 3.13Å
95Q96.5Very high96.4Very high83 Ų83100.6 Ų100.639%0.38851%0.51SS..Hα-helixtrans-62.6-43.7175.8-178.159.427.100111.3E91 S92 A93 L97 R98 E99E91-Q95 WeakPolarHBondContact O-CB 3.39Å; E91-Q95 PolarHBondContact O-N 2.89Å; S92-Q95 PolarHBondContact O-N 2.86Å; A93-Q95 PolarHBondContact O-N 3Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 3.32Å; Q95-R98 PolarHBondContact O-N 2.96Å; Q95-E99 PolarHBondContact NE2-OE1 3.41Å; Q95-E99 WeakPolarHBondContact O-CG 3.44Å; Q95-E99 PolarHBondContact O-N 3.23Å
96S96.2Very high96.4Very high70 Ų70102 Ų10249%0.4951%0.514SS..Hα-helixtrans-63.8-38.8176.880.10000112.7S92 A93 E99 S100S92-S96 PolarHBondContact O-N 3.46Å; A93-S96 PolarHBondContact O-N 2.9Å; A93-S96 PolarHBondContact O-OG 3.46Å; S96-E99 PolarHBondContact O-N 2.98Å; S96-S100 PolarHBondContact O-N 3.32Å
97L96.3Very high96.4Very high102 Ų102101.3 Ų101.353%0.53451%0.51SS..Hα-helixtrans-67.4-43.2176.9-179.161.4000111A93 L94 Q95 E99 S100 V101A93-L97 WeakPolarHBondContact O-CB 3.21Å; A93-L97 PolarHBondContact O-N 3.41Å; L94-L97 PolarHBondContact O-N 2.88Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 3.32Å; L97-E99 PolarHBondContact O-N 3.02Å; L97-S100 PolarHBondContact O-N 2.89Å; L97-V101 HydrophobicContact CD1-CG2 4.27Å; L97-V101 HydrophobicContact CG-CG2 4.49Å; L97-V101 WeakPolarHBondContact O-CG2 3.42Å; L97-V101 PolarHBondContact O-N 3.48Å
98R97.3Very high96.3Very high132 Ų13298.1 Ų98.150%0.49851%0.508SS..Hα-helixtrans-57.5-48.9175.6177.8179.8168.8-114.5-11.5111.2L94 Q95 S100 V101 E102L94-R98 WeakPolarHBondContact O-CB 3.44Å; L94-R98 PolarHBondContact O-N 3.13Å; Q95-R98 PolarHBondContact O-N 2.96Å; R98-S100 VanDerWaalsContact C-N 3.33Å; R98-S100 PolarHBondContact O-N 2.94Å; R98-V101 PolarHBondContact O-N 3.11Å; R98-E102 HydrophobicContact CG-CG 4.48Å; R98-E102 IonicContact CZ-OE1 2.98Å; R98-E102 IonicContact CZ-OE2 3.66Å; R98-E102 IonicContact NE-OE1 3.93Å; R98-E102 PolarHBondContact NE-OE1 2.97Å; R98-E102 IonicContact NH2-OE1 2.66Å; R98-E102 PolarHBondContact NH2-OE1 3.45Å; R98-E102 IonicContact NH2-OE2 3.08Å; R98-E102 WeakPolarHBondContact O-CB 3.31Å; R98-E102 WeakPolarHBondContact O-CG 3.45Å; R98-E102 PolarHBondContact O-N 3.01Å
99E96.7Very high96.3Very high108 Ų10892.7 Ų92.751%0.50549%0.493SS..Hα-helixtrans-61-40.9178.2-72.1171.4-166.900112Q95 S96 L97 K103Q95-E99 PolarHBondContact NE2-OE1 3.41Å; Q95-E99 WeakPolarHBondContact O-CG 3.44Å; Q95-E99 PolarHBondContact O-N 3.23Å; S96-E99 PolarHBondContact O-N 2.98Å; L97-E99 PolarHBondContact O-N 3.02Å; E99-K103 WeakPolarHBondContact O-CB 3.3Å; E99-K103 PolarHBondContact O-N 2.93Å
100S96.7Very high96.2Very high57 Ų5792.3 Ų92.340%0.39949%0.49SS..Hα-helixtrans-63.2-43.1174.7-176.60000112.5S96 L97 R98 K103 Q104S96-S100 PolarHBondContact O-N 3.32Å; L97-S100 PolarHBondContact O-N 2.89Å; R98-S100 VanDerWaalsContact C-N 3.33Å; R98-S100 PolarHBondContact O-N 2.94Å; S100-K103 PolarHBondContact O-N 3.37Å; S100-Q104 WeakPolarHBondContact O-CG 3.38Å; S100-Q104 PolarHBondContact O-N 3.47Å
101V96.1Very high96.2Very high75 Ų7592.6 Ų92.646%0.45549%0.492SS..Hα-helixtrans-69.3-41179.5171.30000111.2L97 R98 K103 Q104 L105L97-V101 HydrophobicContact CD1-CG2 4.27Å; L97-V101 HydrophobicContact CG-CG2 4.49Å; L97-V101 WeakPolarHBondContact O-CG2 3.42Å; L97-V101 PolarHBondContact O-N 3.48Å; R98-V101 PolarHBondContact O-N 3.11Å; V101-K103 VanDerWaalsContact C-N 3.32Å; V101-K103 PolarHBondContact O-N 2.93Å; V101-Q104 PolarHBondContact O-N 3.32Å; V101-L105 WeakPolarHBondContact O-CB 3.38Å; V101-L105 PolarHBondContact O-N 3.3Å
102E96.7Very high96.1Very high91 Ų9193.7 Ų93.743%0.42550%0.495SS..Hα-helixtrans-60.4-42.6174.5-77.1178.3177.700111.4R98 L105 Q106R98-E102 HydrophobicContact CG-CG 4.48Å; R98-E102 IonicContact CZ-OE1 2.98Å; R98-E102 IonicContact CZ-OE2 3.66Å; R98-E102 IonicContact NE-OE1 3.93Å; R98-E102 PolarHBondContact NE-OE1 2.97Å; R98-E102 IonicContact NH2-OE1 2.66Å; R98-E102 PolarHBondContact NH2-OE1 3.45Å; R98-E102 IonicContact NH2-OE2 3.08Å; R98-E102 WeakPolarHBondContact O-CB 3.31Å; R98-E102 WeakPolarHBondContact O-CG 3.45Å; R98-E102 PolarHBondContact O-N 3.01Å; E102-L105 PolarHBondContact O-N 3.41Å; E102-Q106 PolarHBondContact O-N 3.38Å
103K96.4Very high96.1Very high128 Ų12896.1 Ų96.156%0.55750%0.497SS*.Hα-helixtrans-62.1-46.4174.2-176.6178174.2-178.10112.1E99 S100 V101 L105 Q106 E107E99-K103 WeakPolarHBondContact O-CB 3.3Å; E99-K103 PolarHBondContact O-N 2.93Å; S100-K103 PolarHBondContact O-N 3.37Å; V101-K103 VanDerWaalsContact C-N 3.32Å; V101-K103 PolarHBondContact O-N 2.93Å; K103-L105 VanDerWaalsContact C-N 3.32Å; K103-L105 PolarHBondContact O-N 3.34Å; K103-Q106 PolarHBondContact O-N 3.13Å; K103-E107 WeakPolarHBondContact CE-OE1 3.44Å; K103-E107 WeakPolarHBondContact O-CG 3.47Å; K103-E107 PolarHBondContact O-N 3Å
104Q96.2Very high96.1Very high111 Ų11196 Ų9652%0.51950%0.496SS..Hα-helixtrans-63-38176.8-75.5179-15.100112.2S100 V101 E107 T108S100-Q104 WeakPolarHBondContact O-CG 3.38Å; S100-Q104 PolarHBondContact O-N 3.47Å; V101-Q104 PolarHBondContact O-N 3.32Å; Q104-E107 PolarHBondContact O-N 3.04Å; Q104-T108 WeakPolarHBondContact O-CB 3.47Å; Q104-T108 VanDerWaalsContact O-CG2 3.3Å; Q104-T108 WeakPolarHBondContact O-CG2 3.39Å; Q104-T108 PolarHBondContact O-N 2.9Å; Q104-T108 PolarHBondContact O-OG1 3.41Å
105L96.2Very high96Very high125 Ų12595.5 Ų95.565%0.65449%0.493SS*.Hα-helixtrans-66.2-38.8176.5-170.468.1000111.5V101 E102 K103 T108 G109V101-L105 WeakPolarHBondContact O-CB 3.38Å; V101-L105 PolarHBondContact O-N 3.3Å; E102-L105 PolarHBondContact O-N 3.41Å; K103-L105 VanDerWaalsContact C-N 3.32Å; K103-L105 PolarHBondContact O-N 3.34Å; L105-T108 WeakPolarHBondContact CA-OG1 3.48Å; L105-T108 PolarHBondContact O-OG1 2.94Å; L105-G109 PolarHBondContact O-N 3.47Å
106Q96Very high96Very high132 Ų13296 Ų9662%0.61750%0.495SS*.Hα-helixtrans-65.4-48.4174.5-173.4175.7-2.700111.5E102 K103 T108 G109 D110E102-Q106 PolarHBondContact O-N 3.38Å; K103-Q106 PolarHBondContact O-N 3.13Å; Q106-T108 PolarHBondContact O-N 3.22Å; Q106-G109 PolarHBondContact O-N 3.4Å; Q106-D110 PolarHBondContact O-N 3.43Å
107E95.2Very high96Very high103 Ų10397.9 Ų97.948%0.48150%0.499SS..Hα-helixtrans-59.4-44.3178-72.7174.6-176.500111.8K103 Q104 D110 V111K103-E107 WeakPolarHBondContact CE-OE1 3.44Å; K103-E107 WeakPolarHBondContact O-CG 3.47Å; K103-E107 PolarHBondContact O-N 3Å; Q104-E107 PolarHBondContact O-N 3.04Å; E107-D110 PolarHBondContact O-N 2.98Å; E107-V111 WeakPolarHBondContact O-CG2 3.48Å; E107-V111 PolarHBondContact O-N 3.41Å
108T94.8Very high95.9Very high84 Ų8499.8 Ų99.852%0.51550%0.503SS..Hα-helixtrans-67.6-37.9176.5510000112.4Q104 L105 Q106 D110 V111 F112Q104-T108 WeakPolarHBondContact O-CB 3.47Å; Q104-T108 VanDerWaalsContact O-CG2 3.3Å; Q104-T108 WeakPolarHBondContact O-CG2 3.39Å; Q104-T108 PolarHBondContact O-N 2.9Å; Q104-T108 PolarHBondContact O-OG1 3.41Å; L105-T108 WeakPolarHBondContact CA-OG1 3.48Å; L105-T108 PolarHBondContact O-OG1 2.94Å; Q106-T108 PolarHBondContact O-N 3.22Å; T108-D110 VanDerWaalsContact C-N 3.35Å; T108-V111 PolarHBondContact O-N 3.2Å; T108-F112 WeakPolarHBondContact O-CB 3.48Å; T108-F112 PolarHBondContact O-N 3.4Å
109G96.2Very high95.8Very high29 Ų2998.7 Ų98.730%0.29950%0.504SS..Hα-helixtrans-62.3-39.5173.800000113L105 Q106 F112 K113L105-G109 PolarHBondContact O-N 3.47Å; Q106-G109 PolarHBondContact O-N 3.4Å; G109-F112 PolarHBondContact O-N 3.19Å; G109-K113 WeakPolarHBondContact O-CG 3.33Å; G109-K113 PolarHBondContact O-N 2.97Å
110D95.6Very high95.7Very high77 Ų7797.3 Ų97.341%0.41250%0.5SS..Hα-helixtrans-71.9-37.8177.7-69.3-21.2000112Q106 E107 T108 K113 A114Q106-D110 PolarHBondContact O-N 3.43Å; E107-D110 PolarHBondContact O-N 2.98Å; T108-D110 VanDerWaalsContact C-N 3.35Å; D110-K113 PolarHBondContact O-N 3.19Å; D110-K113 IonicContact OD1-NZ 2.78Å; D110-K113 PolarHBondContact OD1-NZ 3.02Å; D110-K113 VanDerWaalsContact OD1-NZ 3.13Å; D110-A114 WeakPolarHBondContact O-CB 3.31Å; D110-A114 PolarHBondContact O-N 2.87Å
111V95.7Very high95.6Very high85 Ų8598.3 Ų98.352%0.51550%0.5SS..Hα-helixtrans-62-43.6170.81720000111.2E107 T108 K113 A114 I115E107-V111 WeakPolarHBondContact O-CG2 3.48Å; E107-V111 PolarHBondContact O-N 3.41Å; T108-V111 PolarHBondContact O-N 3.2Å; V111-K113 PolarHBondContact O-N 2.96Å; V111-A114 PolarHBondContact O-N 2.86Å; V111-I115 HydrophobicContact CG1-CD1 3.84Å; V111-I115 HydrophobicContact CG1-CG1 4.42Å; V111-I115 WeakPolarHBondContact O-CG1 3.47Å; V111-I115 PolarHBondContact O-N 3.26Å
112F95.3Very high95.5Very high137 Ų13797.5 Ų97.560%0.60150%0.502SS*.Hα-helixtrans-61.6-44.8178-175.9-94000112T108 G109 A114 I115 Q116T108-F112 WeakPolarHBondContact O-CB 3.48Å; T108-F112 PolarHBondContact O-N 3.4Å; G109-F112 PolarHBondContact O-N 3.19Å; F112-A114 VanDerWaalsContact C-N 3.33Å; F112-A114 PolarHBondContact O-N 2.98Å; F112-I115 PolarHBondContact O-N 2.78Å; F112-Q116 WeakPolarHBondContact O-CB 3.34Å; F112-Q116 PolarHBondContact O-N 2.89Å
113K96.3Very high95.5Very high122 Ų12298.5 Ų98.553%0.5351%0.506SS..Hα-helixtrans-59.3-42.7174.2-70.3169.5-164.8158.30111.9G109 D110 V111 Q116 L117G109-K113 WeakPolarHBondContact O-CG 3.33Å; G109-K113 PolarHBondContact O-N 2.97Å; D110-K113 PolarHBondContact O-N 3.19Å; D110-K113 IonicContact OD1-NZ 2.78Å; D110-K113 PolarHBondContact OD1-NZ 3.02Å; D110-K113 VanDerWaalsContact OD1-NZ 3.13Å; V111-K113 PolarHBondContact O-N 2.96Å; K113-Q116 PolarHBondContact O-N 2.94Å; K113-L117 WeakPolarHBondContact O-CG 3.26Å; K113-L117 PolarHBondContact O-N 3.02Å
114A95.4Very high95.4Very high52 Ų5298.9 Ų98.943%0.4351%0.51SS..Hα-helixtrans-64-41.6178.100000112.1D110 V111 F112 L117 K118D110-A114 WeakPolarHBondContact O-CB 3.31Å; D110-A114 PolarHBondContact O-N 2.87Å; V111-A114 PolarHBondContact O-N 2.86Å; F112-A114 VanDerWaalsContact C-N 3.33Å; F112-A114 PolarHBondContact O-N 2.98Å; A114-L117 PolarHBondContact O-N 3.31Å; A114-K118 WeakPolarHBondContact O-CG 3.28Å; A114-K118 PolarHBondContact O-N 3.46Å; A114-K118 VanDerWaalsContact O-N 3.08Å
115I94.5Very high95.3Very high102 Ų10298.7 Ų98.752%0.52351%0.512SS..Hα-helixtrans-63.8-44.1174.8-69.1169.8000110.7V111 F112 L117 K118 Q119V111-I115 HydrophobicContact CG1-CD1 3.84Å; V111-I115 HydrophobicContact CG1-CG1 4.42Å; V111-I115 WeakPolarHBondContact O-CG1 3.47Å; V111-I115 PolarHBondContact O-N 3.26Å; F112-I115 PolarHBondContact O-N 2.78Å; I115-L117 PolarHBondContact O-N 3.04Å; I115-K118 PolarHBondContact O-N 3.3Å; I115-Q119 WeakPolarHBondContact O-CB 3.48Å; I115-Q119 PolarHBondContact O-N 2.91Å
116Q96.2Very high95.3Very high93 Ų9397.8 Ų97.844%0.43551%0.508SS..Hα-helixtrans-62.8-41.3179.3-170.8176.26.400112.1F112 K113 Q119 N120F112-Q116 WeakPolarHBondContact O-CB 3.34Å; F112-Q116 PolarHBondContact O-N 2.89Å; K113-Q116 PolarHBondContact O-N 2.94Å; Q116-Q119 PolarHBondContact O-N 3.36Å; Q116-N120 VanDerWaalsContact O-CG 3.29Å; Q116-N120 PolarHBondContact O-N 3.48Å
117L95.5Very high95.3Very high110 Ų11093.1 Ų93.158%0.57649%0.492SS*.Hα-helixtrans-60.2-46.9172.7-74.2168.9000111.3K113 A114 I115 Q119 N120 D121K113-L117 WeakPolarHBondContact O-CG 3.26Å; K113-L117 PolarHBondContact O-N 3.02Å; A114-L117 PolarHBondContact O-N 3.31Å; I115-L117 PolarHBondContact O-N 3.04Å; L117-Q119 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.49Å; L117-N120 PolarHBondContact O-N 3.38Å; L117-D121 PolarHBondContact O-N 3.39Å
118K95.1Very high95.3Very high143 Ų14396.3 Ų96.362%0.62250%0.499SS*.Hα-helixtrans-65-34.3178.4-71.3-69.9162.4-147.50113.4A114 I115 D121 A122A114-K118 WeakPolarHBondContact O-CG 3.28Å; A114-K118 PolarHBondContact O-N 3.46Å; A114-K118 VanDerWaalsContact O-N 3.08Å; I115-K118 PolarHBondContact O-N 3.3Å; K118-D121 IonicContact NZ-OD2 3.2Å; K118-D121 PolarHBondContact NZ-OD2 3.5Å; K118-A122 WeakPolarHBondContact O-CB 3.32Å; K118-A122 PolarHBondContact O-N 3.11Å
119Q94.8Very high95.3Very high109 Ų10996.3 Ų96.351%0.50949%0.493SS..Hα-helixtrans-64.2-43.5173.4-177.5-179.51.100111.2I115 Q116 L117 A122 Q123I115-Q119 WeakPolarHBondContact O-CB 3.48Å; I115-Q119 PolarHBondContact O-N 2.91Å; Q116-Q119 PolarHBondContact O-N 3.36Å; L117-Q119 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.49Å; Q119-A122 PolarHBondContact O-N 3.43Å; Q119-Q123 WeakPolarHBondContact O-CG 3.44Å; Q119-Q123 PolarHBondContact O-N 3.38Å
120N95.1Very high95.2Very high79 Ų7999.3 Ų99.342%0.42250%0.502SS..Hα-helixtrans-64.5-45.6176.7-68.2-15.9000111.4Q116 L117 A122 Q123 E124Q116-N120 VanDerWaalsContact O-CG 3.29Å; Q116-N120 PolarHBondContact O-N 3.48Å; L117-N120 PolarHBondContact O-N 3.38Å; N120-A122 VanDerWaalsContact C-N 3.29Å; N120-A122 PolarHBondContact O-N 2.93Å; N120-Q123 PolarHBondContact O-N 2.92Å; N120-E124 PolarHBondContact O-N 2.93Å
121D95.3Very high95.3Very high77 Ų77102.4 Ų102.441%0.41251%0.508SS..Hα-helixtrans-54.9-45.7174.9-66.7-12.7000110.9L117 K118 E124 L125L117-D121 PolarHBondContact O-N 3.39Å; K118-D121 IonicContact NZ-OD2 3.2Å; K118-D121 PolarHBondContact NZ-OD2 3.5Å; D121-E124 PolarHBondContact O-N 2.93Å; D121-L125 WeakPolarHBondContact O-CB 3.36Å; D121-L125 PolarHBondContact O-N 2.96Å
122A93.4Very high95.3Very high59 Ų59103.9 Ų103.949%0.48851%0.508SS..Hα-helixtrans-67.2-38.5179.700000112.7K118 Q119 N120 L126K118-A122 WeakPolarHBondContact O-CB 3.32Å; K118-A122 PolarHBondContact O-N 3.11Å; Q119-A122 PolarHBondContact O-N 3.43Å; N120-A122 VanDerWaalsContact C-N 3.29Å; N120-A122 PolarHBondContact O-N 2.93Å; A122-L126 WeakPolarHBondContact O-CB 3.49Å; A122-L126 PolarHBondContact O-N 2.97Å
123Q95.8Very high95.2Very high111 Ų111101.8 Ų101.852%0.51950%0.502SS..Hα-helixtrans-64.9-40.8174.6-76.2179-1400111.7Q119 N120 L126 A127Q119-Q123 WeakPolarHBondContact O-CG 3.44Å; Q119-Q123 PolarHBondContact O-N 3.38Å; N120-Q123 PolarHBondContact O-N 2.92Å; Q123-L126 PolarHBondContact O-N 3.38Å; Q123-A127 WeakPolarHBondContact O-CB 3.49Å; Q123-A127 PolarHBondContact O-N 3.47Å
124E95.3Very high95.2Very high137 Ų137104.7 Ų104.764%0.6451%0.509SS*.Hα-helixtrans-66.1-43.3177-171.5174.4178.900111.7N120 D121 A127 R128N120-E124 PolarHBondContact O-N 2.93Å; D121-E124 PolarHBondContact O-N 2.93Å; E124-A127 PolarHBondContact O-N 2.92Å; E124-R128 WeakPolarHBondContact O-CB 3.44Å; E124-R128 PolarHBondContact O-N 2.96Å
125L94.4Very high95.2Very high106 Ų106104.8 Ų104.856%0.55551%0.51SS*.Hα-helixtrans-60.2-48.7175.2-175.865.1000111.2D121 A127 R128 E129D121-L125 WeakPolarHBondContact O-CB 3.36Å; D121-L125 PolarHBondContact O-N 2.96Å; L125-A127 VanDerWaalsContact C-N 3.31Å; L125-A127 PolarHBondContact O-N 3.5Å; L125-R128 WeakPolarHBondContact O-CB 3.39Å; L125-R128 PolarHBondContact O-N 3.02Å; L125-R128 VanDerWaalsContact O-N 3.11Å; L125-E129 WeakPolarHBondContact O-CG 3.34Å; L125-E129 PolarHBondContact O-N 3.01Å
126L94.6Very high95.2Very high107 Ų107104.2 Ų104.256%0.5650%0.504SS*.Hα-helixtrans-59.6-42.9177.1179.262.2000111.7A122 Q123 R128 E129 L130A122-L126 WeakPolarHBondContact O-CB 3.49Å; A122-L126 PolarHBondContact O-N 2.97Å; Q123-L126 PolarHBondContact O-N 3.38Å; L126-R128 VanDerWaalsContact C-N 3.29Å; L126-R128 PolarHBondContact O-N 3.38Å; L126-E129 PolarHBondContact O-N 3.38Å; L126-L130 HydrophobicContact CD1-CD1 4.23Å; L126-L130 HydrophobicContact CD1-CG 4.21Å; L126-L130 HydrophobicContact CG-CD1 4.09Å; L126-L130 HydrophobicContact CG-CG 4.49Å; L126-L130 WeakPolarHBondContact O-CB 3.28Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.36Å; L126-L130 PolarHBondContact O-N 3.37Å
127A96.3Very high95.1Very high34 Ų34103.5 Ų103.528%0.28151%0.505SS..Hα-helixtrans-63.5-36.517700000112Q123 E124 L125 R131Q123-A127 WeakPolarHBondContact O-CB 3.49Å; Q123-A127 PolarHBondContact O-N 3.47Å; E124-A127 PolarHBondContact O-N 2.92Å; L125-A127 VanDerWaalsContact C-N 3.31Å; L125-A127 PolarHBondContact O-N 3.5Å; A127-R131 WeakPolarHBondContact O-CG 3.42Å; A127-R131 PolarHBondContact O-N 3.03Å; A127-R131 VanDerWaalsContact O-N 3.13Å
128R95.7Very high95.1Very high169 Ų16999.7 Ų99.764%0.63849%0.493SS*.Hα-helixtrans-66-48.3175.1-176.9178.2177.8158.3-1.8111.6E124 L125 L126 L130 R131 F132E124-R128 WeakPolarHBondContact O-CB 3.44Å; E124-R128 PolarHBondContact O-N 2.96Å; L125-R128 WeakPolarHBondContact O-CB 3.39Å; L125-R128 PolarHBondContact O-N 3.02Å; L125-R128 VanDerWaalsContact O-N 3.11Å; L126-R128 VanDerWaalsContact C-N 3.29Å; L126-R128 PolarHBondContact O-N 3.38Å; R128-L130 PolarHBondContact O-N 3.41Å; R128-R131 WeakPolarHBondContact O-CB 3.31Å; R128-R131 PolarHBondContact O-N 2.93Å; R128-F132 PolarHBondContact O-N 3.18Å
129E94.2Very high95Very high85 Ų8597.9 Ų97.940%0.39749%0.487SS..Hα-helixtrans-63.4-42.1178.7-68.1-49.5128.100112.1L125 L126 R131 F132 I133L125-E129 WeakPolarHBondContact O-CG 3.34Å; L125-E129 PolarHBondContact O-N 3.01Å; L126-E129 PolarHBondContact O-N 3.38Å; E129-R131 VanDerWaalsContact C-N 3.32Å; E129-R131 PolarHBondContact O-N 3.35Å; E129-F132 PolarHBondContact O-N 3.4Å; E129-I133 WeakPolarHBondContact O-CG1 3.38Å; E129-I133 PolarHBondContact O-N 2.88Å
130L95.6Very high94.9Very high91 Ų9197.5 Ų97.548%0.47649%0.491SS..Hα-helixtrans-62.8-37.8175.3-72.9174.4000112.5L126 R128 R134L126-L130 HydrophobicContact CD1-CD1 4.23Å; L126-L130 HydrophobicContact CD1-CG 4.21Å; L126-L130 HydrophobicContact CG-CD1 4.09Å; L126-L130 HydrophobicContact CG-CG 4.49Å; L126-L130 WeakPolarHBondContact O-CB 3.28Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.36Å; L126-L130 PolarHBondContact O-N 3.37Å; R128-L130 PolarHBondContact O-N 3.41Å; L130-R134 VanDerWaalsContact O-CB 3.26Å; L130-R134 WeakPolarHBondContact O-CB 3.32Å; L130-R134 PolarHBondContact O-N 3.47Å
131R96.4Very high94.9Very high142 Ų14298 Ų9854%0.53649%0.493SS..Hα-helixtrans-64.5-43.6173.4-77.3-172.7-61.9-95.43.9111.4A127 R128 E129 R134 A135A127-R131 WeakPolarHBondContact O-CG 3.42Å; A127-R131 PolarHBondContact O-N 3.03Å; A127-R131 VanDerWaalsContact O-N 3.13Å; R128-R131 WeakPolarHBondContact O-CB 3.31Å; R128-R131 PolarHBondContact O-N 2.93Å; E129-R131 VanDerWaalsContact C-N 3.32Å; E129-R131 PolarHBondContact O-N 3.35Å; R131-R134 PolarHBondContact O-N 3.19Å; R131-A135 PolarHBondContact O-N 2.89Å
132F95.4Very high94.9Very high117 Ų11797.3 Ų97.351%0.51350%0.495SS..Hα-helixtrans-62.2-49.9178.4178.5-100.3000111.9R128 E129 R134 A135 K136R128-F132 PolarHBondContact O-N 3.18Å; E129-F132 PolarHBondContact O-N 3.4Å; F132-R134 VanDerWaalsContact C-N 3.33Å; F132-R134 PolarHBondContact O-N 2.96Å; F132-A135 WeakPolarHBondContact O-CB 3.46Å; F132-A135 PolarHBondContact O-N 3.19Å; F132-K136 HydrophobicContact CD1-CG 4.45Å; F132-K136 HydrophobicContact CE1-CG 4.03Å; F132-K136 HydrophobicContact CE2-CG 4.31Å; F132-K136 HydrophobicContact CZ-CD 4.38Å; F132-K136 HydrophobicContact CZ-CG 3.96Å; F132-K136 PolarHBondContact O-N 2.85Å
133I93.5Very high94.8Very high92 Ų9297.9 Ų97.947%0.47250%0.495SS..Hα-helixtrans-59.9-44.3177.5-66.8167.5000110.5E129 A135 K136 V137E129-I133 WeakPolarHBondContact O-CG1 3.38Å; E129-I133 PolarHBondContact O-N 2.88Å; I133-A135 VanDerWaalsContact C-N 3.32Å; I133-A135 PolarHBondContact O-N 3.17Å; I133-K136 PolarHBondContact O-N 3.08Å; I133-V137 HydrophobicContact CG2-CG2 4.22Å; I133-V137 WeakPolarHBondContact O-CB 3.4Å; I133-V137 VanDerWaalsContact O-CG2 3.32Å; I133-V137 WeakPolarHBondContact O-CG2 3.48Å; I133-V137 PolarHBondContact O-N 3.13Å
134R96.6Very high94.7Very high184 Ų184100.1 Ų100.169%0.69450%0.499SS*.Hα-helixtrans-61.1-41.1178.2-173.3179.7-67147.70.1112L130 R131 F132 G138L130-R134 VanDerWaalsContact O-CB 3.26Å; L130-R134 WeakPolarHBondContact O-CB 3.32Å; L130-R134 PolarHBondContact O-N 3.47Å; R131-R134 PolarHBondContact O-N 3.19Å; F132-R134 VanDerWaalsContact C-N 3.33Å; F132-R134 PolarHBondContact O-N 2.96Å; R134-G138 PolarHBondContact O-N 3.01Å
135A95.5Very high94.7Very high54 Ų5498.5 Ų98.545%0.44649%0.494SS..Hα-helixtrans-62.7-48.1175.600000111.2R131 F132 I133 V137 G138 E139R131-A135 PolarHBondContact O-N 2.89Å; F132-A135 WeakPolarHBondContact O-CB 3.46Å; F132-A135 PolarHBondContact O-N 3.19Å; I133-A135 VanDerWaalsContact C-N 3.32Å; I133-A135 PolarHBondContact O-N 3.17Å; A135-V137 PolarHBondContact O-N 3.15Å; A135-G138 WeakPolarHBondContact O-CA 3.4Å; A135-G138 PolarHBondContact O-N 3.37Å; A135-G138 VanDerWaalsContact O-N 3.11Å; A135-E139 PolarHBondContact O-N 3.02Å
136K94.1Very high94.6Very high90 Ų9099.9 Ų99.939%0.39150%0.496SS..Hα-helixtrans-62.2-42.7178.5-71.7-72.4158.1-154.10113F132 I133 G138 E139 V140F132-K136 HydrophobicContact CD1-CG 4.45Å; F132-K136 HydrophobicContact CE1-CG 4.03Å; F132-K136 HydrophobicContact CE2-CG 4.31Å; F132-K136 HydrophobicContact CZ-CD 4.38Å; F132-K136 HydrophobicContact CZ-CG 3.96Å; F132-K136 PolarHBondContact O-N 2.85Å; I133-K136 PolarHBondContact O-N 3.08Å; K136-G138 VanDerWaalsContact C-N 3.3Å; K136-G138 PolarHBondContact O-N 3.43Å; K136-E139 IonicContact NZ-OE1 2.81Å; K136-E139 IonicContact NZ-OE2 3.69Å; K136-E139 PolarHBondContact NZ-OE2 3.08Å; K136-E139 PolarHBondContact O-N 3.43Å; K136-V140 WeakPolarHBondContact O-CG2 3.47Å; K136-V140 PolarHBondContact O-N 3.2Å
137V94.1Very high94.3Very high77 Ų7797.9 Ų97.947%0.46749%0.491SS..Hα-helixtrans-62.2-40.2173.7171.40000110.8I133 A135 V140 L141I133-V137 HydrophobicContact CG2-CG2 4.22Å; I133-V137 WeakPolarHBondContact O-CB 3.4Å; I133-V137 VanDerWaalsContact O-CG2 3.32Å; I133-V137 WeakPolarHBondContact O-CG2 3.48Å; I133-V137 PolarHBondContact O-N 3.13Å; A135-V137 PolarHBondContact O-N 3.15Å; V137-V140 PolarHBondContact O-N 3.42Å; V137-L141 HydrophobicContact CG1-CD1 3.94Å; V137-L141 HydrophobicContact CG1-CG 4.3Å; V137-L141 WeakPolarHBondContact O-CB 3.4Å; V137-L141 VanDerWaalsContact O-CG 3.31Å; V137-L141 WeakPolarHBondContact O-CG 3.35Å; V137-L141 PolarHBondContact O-N 3.04Å
138G95.4Very high94.1Very high30 Ų30100.1 Ų100.131%0.30950%0.495SS..Hα-helixtrans-61.6-42.1174.900000113.5R134 A135 K136 S142R134-G138 PolarHBondContact O-N 3.01Å; A135-G138 WeakPolarHBondContact O-CA 3.4Å; A135-G138 PolarHBondContact O-N 3.37Å; A135-G138 VanDerWaalsContact O-N 3.11Å; K136-G138 VanDerWaalsContact C-N 3.3Å; K136-G138 PolarHBondContact O-N 3.43Å; G138-S142 WeakPolarHBondContact O-CB 3.4Å; G138-S142 PolarHBondContact O-N 3.23Å; G138-S142 PolarHBondContact O-OG 3.25Å
139E93.7Very high94Very high106 Ų10698.2 Ų98.250%0.49549%0.494SS..Hα-helixtrans-60.8-48174.2-72.2170.9-170.700111.4A135 K136 S142 S143A135-E139 PolarHBondContact O-N 3.02Å; K136-E139 IonicContact NZ-OE1 2.81Å; K136-E139 IonicContact NZ-OE2 3.69Å; K136-E139 PolarHBondContact NZ-OE2 3.08Å; K136-E139 PolarHBondContact O-N 3.43Å; E139-S142 PolarHBondContact O-N 3.5Å; E139-S143 WeakPolarHBondContact O-CB 3.35Å; E139-S143 PolarHBondContact O-N 3.4Å
140V92.5Very high93.9Very high100 Ų100101.6 Ų101.661%0.60651%0.507SS*.Hα-helixtrans-62.9-45.6179.4172.10000111.5K136 V137 S142 S143 R144K136-V140 WeakPolarHBondContact O-CG2 3.47Å; K136-V140 PolarHBondContact O-N 3.2Å; V137-V140 PolarHBondContact O-N 3.42Å; V140-S142 VanDerWaalsContact C-N 3.33Å; V140-S142 PolarHBondContact O-N 3.47Å; V140-S143 PolarHBondContact O-N 2.89Å; V140-R144 WeakPolarHBondContact O-CB 3.33Å; V140-R144 PolarHBondContact O-N 3.4Å
141L95.3Very high93.7Very high89 Ų89104.4 Ų104.447%0.46652%0.516SS..Hα-helixtrans-62.2-41.5177.5-72.8174.9000111.6V137 R144 L145V137-L141 HydrophobicContact CG1-CD1 3.94Å; V137-L141 HydrophobicContact CG1-CG 4.3Å; V137-L141 WeakPolarHBondContact O-CB 3.4Å; V137-L141 VanDerWaalsContact O-CG 3.31Å; V137-L141 WeakPolarHBondContact O-CG 3.35Å; V137-L141 PolarHBondContact O-N 3.04Å; L141-R144 PolarHBondContact O-N 3.49Å; L141-L145 WeakPolarHBondContact O-CG 3.45Å; L141-L145 PolarHBondContact O-N 2.97Å
142S94.5Very high93.5Very high63 Ų63102.4 Ų102.444%0.44151%0.512SS..Hα-helixtrans-64.9-42177.3-59.10000112.1G138 E139 V140 K146G138-S142 WeakPolarHBondContact O-CB 3.4Å; G138-S142 PolarHBondContact O-N 3.23Å; G138-S142 PolarHBondContact O-OG 3.25Å; E139-S142 PolarHBondContact O-N 3.5Å; V140-S142 VanDerWaalsContact C-N 3.33Å; V140-S142 PolarHBondContact O-N 3.47Å; S142-K146 WeakPolarHBondContact O-CG 3.5Å; S142-K146 PolarHBondContact O-N 3.34Å; S142-K146 VanDerWaalsContact O-N 3.16Å
143S92.7Very high93.4Very high71 Ų7199.4 Ų99.450%0.49751%0.506SS..Hα-helixtrans-65-41.5175.7-174.40000112E139 V140 K146 S147E139-S143 WeakPolarHBondContact O-CB 3.35Å; E139-S143 PolarHBondContact O-N 3.4Å; V140-S143 PolarHBondContact O-N 2.89Å; S143-K146 PolarHBondContact O-N 3.42Å; S143-S147 WeakPolarHBondContact O-CB 3.33Å; S143-S147 PolarHBondContact O-N 2.98Å; S143-S147 PolarHBondContact O-OG 3.28Å
144R93Very high93.2Very high159 Ų159100.7 Ų100.760%0.651%0.513SS*.Hα-helixtrans-60.1-48.9175.2179.5-173.3163.2-164.4-5111.5V140 L141 K146 S147 E148V140-R144 WeakPolarHBondContact O-CB 3.33Å; V140-R144 PolarHBondContact O-N 3.4Å; L141-R144 PolarHBondContact O-N 3.49Å; R144-K146 PolarHBondContact O-N 2.9Å; R144-S147 WeakPolarHBondContact O-CB 3.39Å; R144-S147 PolarHBondContact O-N 3.36Å; R144-S147 VanDerWaalsContact O-N 3.13Å; R144-E148 WeakPolarHBondContact O-CB 3.43Å; R144-E148 PolarHBondContact O-N 3.03Å
145L94.7Very high92.9Very high103 Ų10394.3 Ų94.354%0.53950%0.497SS..Hα-helixtrans-59.2-45.9179.2-74.8170.3000111.7L141 S147 E148 E149L141-L145 WeakPolarHBondContact O-CG 3.45Å; L141-L145 PolarHBondContact O-N 2.97Å; L145-S147 VanDerWaalsContact C-N 3.28Å; L145-S147 PolarHBondContact O-N 3.46Å; L145-E148 PolarHBondContact O-N 2.98Å; L145-E149 WeakPolarHBondContact O-CG 3.44Å; L145-E149 PolarHBondContact O-N 3.24Å
146K93Very high92.8Very high135 Ų13598.9 Ų98.959%0.58751%0.507SS*.Hα-helixtrans-59.9-38.5175-71.5175.5-178.6-179.70112.6S142 S143 R144 K150S142-K146 WeakPolarHBondContact O-CG 3.5Å; S142-K146 PolarHBondContact O-N 3.34Å; S142-K146 VanDerWaalsContact O-N 3.16Å; S143-K146 PolarHBondContact O-N 3.42Å; R144-K146 PolarHBondContact O-N 2.9Å; K146-K150 WeakPolarHBondContact O-CG 3.38Å; K146-K150 PolarHBondContact O-N 3.28Å; K146-K150 VanDerWaalsContact O-N 3.12Å
147S88.7Confident92.6Very high65 Ų65101.1 Ų101.146%0.45552%0.516SS..Hα-helixtrans-69.6-38.6178.2-57.80000111.6S143 R144 L145 K150 F151S143-S147 WeakPolarHBondContact O-CB 3.33Å; S143-S147 PolarHBondContact O-N 2.98Å; S143-S147 PolarHBondContact O-OG 3.28Å; R144-S147 WeakPolarHBondContact O-CB 3.39Å; R144-S147 PolarHBondContact O-N 3.36Å; R144-S147 VanDerWaalsContact O-N 3.13Å; L145-S147 VanDerWaalsContact C-N 3.28Å; L145-S147 PolarHBondContact O-N 3.46Å; S147-K150 PolarHBondContact O-N 2.72Å; S147-F151 WeakPolarHBondContact O-CB 3.47Å; S147-F151 PolarHBondContact O-N 2.67Å
148E92.6Very high92.4Very high80 Ų80104 Ų10437%0.37452%0.52SS..Hα-helixtrans-65.4-42.9175.4-170.9169.717800111.8R144 L145 K150 F151 Q152R144-E148 WeakPolarHBondContact O-CB 3.43Å; R144-E148 PolarHBondContact O-N 3.03Å; L145-E148 PolarHBondContact O-N 2.98Å; E148-K150 PolarHBondContact O-N 2.98Å; E148-F151 PolarHBondContact O-N 2.91Å; E148-Q152 WeakPolarHBondContact O-CG 3.47Å; E148-Q152 PolarHBondContact O-N 2.94Å
149E92.4Very high92.2Very high130 Ų130107 Ų10761%0.60753%0.529SS*.Hα-helixtrans-59.6-44.3173-73.8175.217000112.2L145 Q152 S153L145-E149 WeakPolarHBondContact O-CG 3.44Å; L145-E149 PolarHBondContact O-N 3.24Å; E149-Q152 PolarHBondContact O-N 2.98Å; E149-S153 WeakPolarHBondContact O-CB 3.04Å; E149-S153 PolarHBondContact O-N 3.39Å
150K92.4Very high92.1Very high156 Ų156104.3 Ų104.368%0.67853%0.525SS*.Hα-helixtrans-61.6-44.7175.4-74.9176.3-178.9-176.10111.5K146 S147 E148 S153 L154K146-K150 WeakPolarHBondContact O-CG 3.38Å; K146-K150 PolarHBondContact O-N 3.28Å; K146-K150 VanDerWaalsContact O-N 3.12Å; S147-K150 PolarHBondContact O-N 2.72Å; E148-K150 PolarHBondContact O-N 2.98Å; K150-S153 PolarHBondContact O-N 3.22Å; K150-L154 WeakPolarHBondContact O-CB 3.46Å; K150-L154 PolarHBondContact O-N 2.88Å
151F91.3Very high92Very high150 Ų150104.4 Ų104.466%0.65852%0.521SS*.Hα-helixtrans-62.2-45.5178-176.9-95.9000111.7S147 E148 S153 L154 S155S147-F151 WeakPolarHBondContact O-CB 3.47Å; S147-F151 PolarHBondContact O-N 2.67Å; E148-F151 PolarHBondContact O-N 2.91Å; F151-S153 VanDerWaalsContact C-N 3.35Å; F151-S153 PolarHBondContact O-N 3.43Å; F151-L154 PolarHBondContact O-N 2.97Å; F151-S155 WeakPolarHBondContact O-CB 3.42Å; F151-S155 PolarHBondContact O-N 3.46Å
152Q92.8Very high91.6Very high99 Ų99104.3 Ų104.346%0.46352%0.521SS..Hα-helixtrans-62.2-41.2175.8-71.5178.714.300112.2E148 E149 S155 K156E148-Q152 WeakPolarHBondContact O-CG 3.47Å; E148-Q152 PolarHBondContact O-N 2.94Å; E149-Q152 PolarHBondContact O-N 2.98Å; Q152-S155 PolarHBondContact O-N 2.91Å; Q152-K156 WeakPolarHBondContact O-CG 3.29Å; Q152-K156 PolarHBondContact O-N 2.93Å
153S92.7Very high91.4Very high55 Ų55103.1 Ų103.139%0.38552%0.518SS..Hα-helixtrans-62.1-44175.1-176.30000111.8E149 K150 F151 K156 K157E149-S153 WeakPolarHBondContact O-CB 3.04Å; E149-S153 PolarHBondContact O-N 3.39Å; K150-S153 PolarHBondContact O-N 3.22Å; F151-S153 VanDerWaalsContact C-N 3.35Å; F151-S153 PolarHBondContact O-N 3.43Å; S153-K156 PolarHBondContact O-N 3.18Å; S153-K157 WeakPolarHBondContact O-CG 3.34Å; S153-K157 PolarHBondContact O-N 3.44Å
154L89.5Confident91.2Very high118 Ų118107.2 Ų107.262%0.61852%0.523SS*.Hα-helixtrans-65-42.9177.3-17265.7000111.8K150 F151 K156 K157 Y158K150-L154 WeakPolarHBondContact O-CB 3.46Å; K150-L154 PolarHBondContact O-N 2.88Å; F151-L154 PolarHBondContact O-N 2.97Å; L154-K156 PolarHBondContact O-N 3.11Å; L154-K157 PolarHBondContact O-N 2.84Å; L154-Y158 WeakPolarHBondContact O-CB 3.4Å; L154-Y158 PolarHBondContact O-N 2.91Å
155S91Very high90.9Very high51 Ų51106.3 Ų106.336%0.35753%0.525SS..Hα-helixtrans-57.6-47.2175.2-168.40000111.4F151 Q152 K157 Y158 D159F151-S155 WeakPolarHBondContact O-CB 3.42Å; F151-S155 PolarHBondContact O-N 3.46Å; Q152-S155 PolarHBondContact O-N 2.91Å; S155-K157 VanDerWaalsContact C-N 3.34Å; S155-K157 PolarHBondContact O-N 2.95Å; S155-Y158 WeakPolarHBondContact O-CB 3.43Å; S155-Y158 PolarHBondContact O-N 3.01Å; S155-D159 PolarHBondContact O-N 3.34Å
156K91.9Very high90.6Very high150 Ų150109.9 Ų109.965%0.65253%0.531SS*.Hα-helixtrans-60.1-41.9176.1-73.3176.3-178.7177.30112.4Q152 S153 L154 Y158 A160Q152-K156 WeakPolarHBondContact O-CG 3.29Å; Q152-K156 PolarHBondContact O-N 2.93Å; S153-K156 PolarHBondContact O-N 3.18Å; L154-K156 PolarHBondContact O-N 3.11Å; K156-Y158 VanDerWaalsContact C-N 3.35Å; K156-A160 WeakPolarHBondContact O-CB 3.38Å; K156-A160 PolarHBondContact O-N 3.27Å
157K91.5Very high90.5Very high136 Ų136108.7 Ų108.759%0.59153%0.528SS*.Hα-helixtrans-64.9-39.8176.8-72176.1-176.3-177.70111.6S153 L154 S155 A160 L161S153-K157 WeakPolarHBondContact O-CG 3.34Å; S153-K157 PolarHBondContact O-N 3.44Å; L154-K157 PolarHBondContact O-N 2.84Å; S155-K157 VanDerWaalsContact C-N 3.34Å; S155-K157 PolarHBondContact O-N 2.95Å; K157-A160 PolarHBondContact O-N 3.26Å; K157-L161 WeakPolarHBondContact O-CB 3.26Å; K157-L161 PolarHBondContact O-N 2.93Å
158Y89.6Confident90.4Very high139 Ų139112.2 Ų112.255%0.54553%0.531SS..Hα-helixtrans-64-47.6177-179.9-101000111.7L154 S155 K156 A160 L161 L162L154-Y158 WeakPolarHBondContact O-CB 3.4Å; L154-Y158 PolarHBondContact O-N 2.91Å; S155-Y158 WeakPolarHBondContact O-CB 3.43Å; S155-Y158 PolarHBondContact O-N 3.01Å; K156-Y158 VanDerWaalsContact C-N 3.35Å; Y158-A160 VanDerWaalsContact C-N 3.31Å; Y158-A160 PolarHBondContact O-N 3.45Å; Y158-L161 WeakPolarHBondContact O-CB 3.47Å; Y158-L161 PolarHBondContact O-N 3.46Å; Y158-L161 VanDerWaalsContact O-N 3.1Å; Y158-L162 HydrophobicContact CD1-CD1 3.91Å; Y158-L162 HydrophobicContact CD1-CG 4.44Å; Y158-L162 HydrophobicContact CE1-CD1 3.3Å; Y158-L162 HydrophobicContact CE1-CG 4.03Å; Y158-L162 HydrophobicContact CE2-CG 4.49Å; Y158-L162 PolarHBondContact O-N 3.04Å
159D91.3Very high90.1Very high93 Ų93110.7 Ų110.750%0.49753%0.529SS..Hα-helixtrans-60.8-41.2176.1-66.8-29.5000111.7S155 L161 L162 G163S155-D159 PolarHBondContact O-N 3.34Å; D159-L161 VanDerWaalsContact C-N 3.34Å; D159-L161 PolarHBondContact O-N 3.41Å; D159-L162 PolarHBondContact O-N 2.94Å; D159-G163 PolarHBondContact O-N 2.89Å
160A90.9Very high89.9Confident49 Ų49109.5 Ų109.541%0.40552%0.524SS..Hα-helixtrans-65.3-35175.200000112.7K156 K157 Y158 R164K156-A160 WeakPolarHBondContact O-CB 3.38Å; K156-A160 PolarHBondContact O-N 3.27Å; K157-A160 PolarHBondContact O-N 3.26Å; Y158-A160 VanDerWaalsContact C-N 3.31Å; Y158-A160 PolarHBondContact O-N 3.45Å; A160-R164 WeakPolarHBondContact O-CB 3.44Å; A160-R164 WeakPolarHBondContact O-CG 3.36Å; A160-R164 PolarHBondContact O-N 2.82Å; A160-R164 PolarHBondContact O-NE 3.02Å
161L89.7Confident89.7Confident102 Ų102105.8 Ų105.853%0.53451%0.509SS..Hα-helixtrans-68.3-47.5175.6-174.967.7000111K157 Y158 D159 G163 R164 H165K157-L161 WeakPolarHBondContact O-CB 3.26Å; K157-L161 PolarHBondContact O-N 2.93Å; Y158-L161 WeakPolarHBondContact O-CB 3.47Å; Y158-L161 PolarHBondContact O-N 3.46Å; Y158-L161 VanDerWaalsContact O-N 3.1Å; D159-L161 VanDerWaalsContact C-N 3.34Å; D159-L161 PolarHBondContact O-N 3.41Å; L161-G163 VanDerWaalsContact C-N 3.31Å; L161-G163 PolarHBondContact O-N 2.99Å; L161-R164 PolarHBondContact O-N 3.42Å; L161-H165 WeakPolarHBondContact O-CB 3.44Å; L161-H165 PolarHBondContact O-N 3.47Å
162L87.7Confident89.3Confident86 Ų86103.6 Ų103.645%0.4550%0.503SS..Hα-helixtrans-59.2-42.4174.8-74.2179.8000111.8Y158 D159 H165 R166Y158-L162 HydrophobicContact CD1-CD1 3.91Å; Y158-L162 HydrophobicContact CD1-CG 4.44Å; Y158-L162 HydrophobicContact CE1-CD1 3.3Å; Y158-L162 HydrophobicContact CE1-CG 4.03Å; Y158-L162 HydrophobicContact CE2-CG 4.49Å; Y158-L162 PolarHBondContact O-N 3.04Å; D159-L162 PolarHBondContact O-N 2.94Å; L162-H165 PolarHBondContact O-N 3.17Å; L162-R166 WeakPolarHBondContact O-CB 3.37Å; L162-R166 PolarHBondContact O-N 2.81Å
163G89.9Confident88.8Confident38 Ų38106.4 Ų106.439%0.39252%0.517SS..Hα-helixtrans-60-48.6175.500000112.5D159 L161 R166 Q167D159-G163 PolarHBondContact O-N 2.89Å; L161-G163 VanDerWaalsContact C-N 3.31Å; L161-G163 PolarHBondContact O-N 2.99Å; G163-R166 PolarHBondContact O-N 3.26Å; G163-Q167 WeakPolarHBondContact O-CB 3.49Å; G163-Q167 PolarHBondContact O-N 2.89Å
164R89.2Confident88.4Confident158 Ų158107.6 Ų107.660%0.59653%0.53SS*.Hα-helixtrans-62.3-43.1176.2-77.6-174.1-72.6174.8-1.2112.4A160 L161 R166 Q167 R168A160-R164 WeakPolarHBondContact O-CB 3.44Å; A160-R164 WeakPolarHBondContact O-CG 3.36Å; A160-R164 PolarHBondContact O-N 2.82Å; A160-R164 PolarHBondContact O-NE 3.02Å; L161-R164 PolarHBondContact O-N 3.42Å; R164-R166 PolarHBondContact O-N 3.34Å; R164-Q167 PolarHBondContact O-N 3.48Å; R164-R168 WeakPolarHBondContact O-CB 3.44Å; R164-R168 PolarHBondContact O-N 3.5Å
165H86.6Confident88.1Confident139 Ų139107 Ų10764%0.64452%0.524SS*.Hα-helixtrans-60.1-46.1176.7-176.7-80.9000111.3L161 L162 R168 S169L161-H165 WeakPolarHBondContact O-CB 3.44Å; L161-H165 PolarHBondContact O-N 3.47Å; L162-H165 PolarHBondContact O-N 3.17Å; H165-R168 PolarHBondContact O-N 3.04Å; H165-S169 VanDerWaalsContact O-CB 3.27Å; H165-S169 WeakPolarHBondContact O-CB 3.43Å; H165-S169 PolarHBondContact O-N 2.9Å
166R88.8Confident87.5Confident178 Ų178110 Ų11067%0.67254%0.54SS*.Hα-helixtrans-61.6-45.1176.4-173.7177.2-177.5165.62112L162 G163 R164 S169 Q170L162-R166 WeakPolarHBondContact O-CB 3.37Å; L162-R166 PolarHBondContact O-N 2.81Å; G163-R166 PolarHBondContact O-N 3.26Å; R164-R166 PolarHBondContact O-N 3.34Å; R166-S169 PolarHBondContact O-N 3.27Å; R166-Q170 WeakPolarHBondContact O-CG 3.5Å; R166-Q170 PolarHBondContact O-N 3.03Å
167Q89.3Confident86.6Confident111 Ų111110 Ų11052%0.51955%0.545SS..Hα-helixtrans-63-47.7178.1-175.5-178.71400111.7G163 R164 S169 Q170 Q171G163-Q167 WeakPolarHBondContact O-CB 3.49Å; G163-Q167 PolarHBondContact O-N 2.89Å; R164-Q167 PolarHBondContact O-N 3.48Å; Q167-S169 VanDerWaalsContact C-N 3.33Å; Q167-S169 PolarHBondContact O-N 3.46Å; Q167-Q170 PolarHBondContact O-N 2.88Å; Q167-Q171 WeakPolarHBondContact O-CG 3.45Å; Q167-Q171 PolarHBondContact O-N 3.43Å
168R87.1Confident85.8Confident139 Ų139110 Ų11053%0.52555%0.552SS.*Hα-helixtrans-64.3-39.2179.6-169.661.3172.6170.82.3111.6R164 H165 Q171 L172R164-R168 WeakPolarHBondContact O-CB 3.44Å; R164-R168 PolarHBondContact O-N 3.5Å; H165-R168 PolarHBondContact O-N 3.04Å; R168-Q171 PolarHBondContact O-N 3.04Å; R168-L172 HydrophobicContact CG-CD1 4.15Å; R168-L172 WeakPolarHBondContact O-CB 3.37Å; R168-L172 WeakPolarHBondContact O-CD1 3.3Å; R168-L172 WeakPolarHBondContact O-CG 3.35Å; R168-L172 PolarHBondContact O-N 3.33Å
169S86.6Confident85.1Confident47 Ų47109.8 Ų109.833%0.32956%0.559SS.*Hα-helixtrans-61.6-41.5173.8177.70000112.6H165 R166 Q167 Q173H165-S169 VanDerWaalsContact O-CB 3.27Å; H165-S169 WeakPolarHBondContact O-CB 3.43Å; H165-S169 PolarHBondContact O-N 2.9Å; R166-S169 PolarHBondContact O-N 3.27Å; Q167-S169 VanDerWaalsContact C-N 3.33Å; Q167-S169 PolarHBondContact O-N 3.46Å; S169-Q173 WeakPolarHBondContact O-CG 3.34Å; S169-Q173 PolarHBondContact O-N 3.44Å; S169-Q173 VanDerWaalsContact O-N 3.13Å
170Q88.2Confident84.6Confident106 Ų106107.4 Ų107.450%0.49555%0.549SS..Hα-helixtrans-67.7-39.3175.4-73.7175.6-17.700112.6R166 Q167 Q173 A174R166-Q170 WeakPolarHBondContact O-CG 3.5Å; R166-Q170 PolarHBondContact O-N 3.03Å; Q167-Q170 PolarHBondContact O-N 2.88Å; Q170-Q173 PolarHBondContact O-N 3.23Å; Q170-A174 WeakPolarHBondContact O-CB 3.32Å; Q170-A174 PolarHBondContact O-N 2.98Å; Q170-A174 VanDerWaalsContact O-N 3.07Å
171Q87.3Confident84Confident78 Ų78113.7 Ų113.736%0.36457%0.57SS.*Hα-helixtrans-60.5-49.8174.6-73.7172.5-12.600111.1Q167 R168 Q173 A174 E175Q167-Q171 WeakPolarHBondContact O-CG 3.45Å; Q167-Q171 PolarHBondContact O-N 3.43Å; R168-Q171 PolarHBondContact O-N 3.04Å; Q171-Q173 PolarHBondContact O-N 2.91Å; Q171-A174 PolarHBondContact O-N 3.44Å; Q171-E175 WeakPolarHBondContact O-CG 3.25Å; Q171-E175 PolarHBondContact O-N 3.47Å
172L83.3Confident83.9Confident103 Ų103112 Ų11254%0.53956%0.564SS.*Hα-helixtrans-57.2-35.4176.3-82.2155.9000112.8R168R168-L172 HydrophobicContact CG-CD1 4.15Å; R168-L172 WeakPolarHBondContact O-CB 3.37Å; R168-L172 WeakPolarHBondContact O-CD1 3.3Å; R168-L172 WeakPolarHBondContact O-CG 3.35Å; R168-L172 PolarHBondContact O-N 3.33Å
173Q82.5Confident83.8Confident159 Ų159112.7 Ų112.774%0.74357%0.571SS**Hα-helixtrans-73.8-27.9175.6-74.2175.4-1.800113.5S169 Q170 Q171S169-Q173 WeakPolarHBondContact O-CG 3.34Å; S169-Q173 PolarHBondContact O-N 3.44Å; S169-Q173 VanDerWaalsContact O-N 3.13Å; Q170-Q173 PolarHBondContact O-N 3.23Å; Q171-Q173 PolarHBondContact O-N 2.91Å
174A85.3Confident83.6Confident79 Ų79116.6 Ų116.665%0.65358%0.583SS**Hα-helixtrans-91.8-16.5-177.900000113.5Q170 Q171 V176Q170-A174 WeakPolarHBondContact O-CB 3.32Å; Q170-A174 PolarHBondContact O-N 2.98Å; Q170-A174 VanDerWaalsContact O-N 3.07Å; Q171-A174 PolarHBondContact O-N 3.44Å; A174-V176 PolarHBondContact O-N 3.31Å
175E81.9Confident83.5Confident107 Ų107113.2 Ų113.250%0.557%0.574SS.*SBendtrans-61.7124.3177.4-84.7171.7-17500111Q171 I177Q171-E175 WeakPolarHBondContact O-CG 3.25Å; Q171-E175 PolarHBondContact O-N 3.47Å; E175-I177 PolarHBondContact O-N 2.91Å
176V78.7Confident83.5Confident114 Ų114110.6 Ų110.669%0.69156%0.564SS**  trans-73120.7176.2179.40000108.4A174 N178A174-V176 PolarHBondContact O-N 3.31Å; V176-N178 PolarHBondContact O-N 2.93Å
177I74.4Confident83.5Confident149 Ų149107.5 Ų107.576%0.76456%0.558SS**  trans-69.296.2178.2-55.2173.8000108.7E175 L179E175-I177 PolarHBondContact O-N 2.91Å; I177-L179 HydrophobicContact CG2-CD1 3.65Å; I177-L179 PolarHBondContact O-N 3.07Å
178N72.7Confident83.5Confident137 Ų137106.8 Ų106.873%0.73356%0.556SS**  trans-85.6105.1173.1-68.9-52.3000109.3V176V176-N178 PolarHBondContact O-N 2.93Å
179L75.5Confident83.6Confident134 Ų134103.1 Ų103.170%0.70255%0.547SS*.  trans-76.2129.5174.4-109.672.4000110.2I177 Q181I177-L179 HydrophobicContact CG2-CD1 3.65Å; I177-L179 PolarHBondContact O-N 3.07Å; L179-Q181 PolarHBondContact O-N 3.04Å
180P81.1Confident83.7Confident43 Ų43103.5 Ų103.528%0.27955%0.549SS..  trans-54.8131.8173.9-25.634.6000111.8E185 L186 L189P180-E185 HydrophobicContact CB-CB 3.84Å; P180-L186 HydrophobicContact CB-CB 3.91Å; P180-L186 HydrophobicContact CB-CD1 4.4Å; P180-L186 HydrophobicContact CG-CB 4.24Å; P180-L186 HydrophobicContact CG-CD1 3.92Å; P180-L189 HydrophobicContact CG-CB 4.47Å; P180-L189 HydrophobicContact CG-CD2 3.66Å
181Q79.3Confident83.9Confident181 Ų181104 Ų10485%0.84655%0.554SS**SBendtrans-91.9-21.2-179.6-63.4-1767.400112.2L179 E185L179-Q181 PolarHBondContact O-N 3.04Å; Q181-E185 PolarHBondContact N-OE2 3.45Å
182T85.7Confident84Confident66 Ų66105 Ų10541%0.40556%0.559SS.*SBendtrans-120154.6178.463.60000111.6D184 E185 L186T182-D184 PolarHBondContact O-N 3.27Å; T182-E185 PolarHBondContact O-N 3.08Å; T182-E185 WeakPolarHBondContact OG1-CB 3.45Å; T182-E185 WeakPolarHBondContact OG1-CG 3.49Å; T182-E185 PolarHBondContact OG1-N 3.19Å; T182-E185 VanDerWaalsContact OG1-N 3.15Å; T182-E185 PolarHBondContact OG1-OE1 3.47Å; T182-E185 VanDerWaalsContact OG1-OE1 3.11Å; T182-L186 PolarHBondContact O-N 2.89Å; T182-L186 VanDerWaalsContact O-N 3.07Å
183V86.6Confident84.3Confident100 Ų100104.8 Ų104.861%0.60656%0.558SS**Hα-helixtrans-60-35.2174174.70000110.3L186 H187V183-L186 PolarHBondContact O-N 3.31Å; V183-H187 WeakPolarHBondContact CG1-CE1 3.38Å; V183-H187 WeakPolarHBondContact CG1-ND1 3.34Å; V183-H187 PolarHBondContact O-N 2.95Å; V183-H187 PolarHBondContact O-ND1 2.97Å
184D86.6Confident84.8Confident120 Ų120103.6 Ų103.664%0.64255%0.55SS*.Hα-helixtrans-67.5-43.7178.1-64.3-24.9000112.1T182 L186 H187 I188T182-D184 PolarHBondContact O-N 3.27Å; D184-L186 VanDerWaalsContact C-N 3.3Å; D184-L186 PolarHBondContact O-N 3.2Å; D184-H187 PolarHBondContact O-N 3.01Å; D184-I188 WeakPolarHBondContact O-CG1 3.41Å; D184-I188 PolarHBondContact O-N 2.9Å
185E86.7Confident85.2Confident87 Ų87105.6 Ų105.641%0.40755%0.546SS..Hα-helixtrans-59.6-40.3172.7-76.3161.1-143.200111.9P180 Q181 T182 I188 L189P180-E185 HydrophobicContact CB-CB 3.84Å; Q181-E185 PolarHBondContact N-OE2 3.45Å; T182-E185 PolarHBondContact O-N 3.08Å; T182-E185 WeakPolarHBondContact OG1-CB 3.45Å; T182-E185 WeakPolarHBondContact OG1-CG 3.49Å; T182-E185 PolarHBondContact OG1-N 3.19Å; T182-E185 VanDerWaalsContact OG1-N 3.15Å; T182-E185 PolarHBondContact OG1-OE1 3.47Å; T182-E185 VanDerWaalsContact OG1-OE1 3.11Å; E185-I188 PolarHBondContact O-N 3.3Å; E185-L189 WeakPolarHBondContact O-CB 3.5Å; E185-L189 PolarHBondContact O-N 2.95Å
186L86.7Confident85.7Confident84 Ų84106.1 Ų106.144%0.4455%0.548SS..Hα-helixtrans-65-41.4176.9-177.865.8000111.6P180 T182 V183 D184 L189 C190P180-L186 HydrophobicContact CB-CB 3.91Å; P180-L186 HydrophobicContact CB-CD1 4.4Å; P180-L186 HydrophobicContact CG-CB 4.24Å; P180-L186 HydrophobicContact CG-CD1 3.92Å; T182-L186 PolarHBondContact O-N 2.89Å; T182-L186 VanDerWaalsContact O-N 3.07Å; V183-L186 PolarHBondContact O-N 3.31Å; D184-L186 VanDerWaalsContact C-N 3.3Å; D184-L186 PolarHBondContact O-N 3.2Å; L186-L189 PolarHBondContact O-N 3.28Å; L186-C190 WeakPolarHBondContact O-CB 3.42Å; L186-C190 PolarHBondContact O-N 3.33Å; L186-C190 PolarHBondContact O-SG 3.44Å
187H89Confident86.4Confident114 Ų114104.8 Ų104.853%0.52854%0.537SS..Hα-helixtrans-63-43.2175.8-79.192.9000111.3V183 D184 C190 L191V183-H187 WeakPolarHBondContact CG1-CE1 3.38Å; V183-H187 WeakPolarHBondContact CG1-ND1 3.34Å; V183-H187 PolarHBondContact O-N 2.95Å; V183-H187 PolarHBondContact O-ND1 2.97Å; D184-H187 PolarHBondContact O-N 3.01Å; H187-C190 PolarHBondContact O-N 3.49Å; H187-L191 WeakPolarHBondContact O-CG 3.3Å; H187-L191 PolarHBondContact O-N 3.02Å
188I89Confident87.3Confident96 Ų96102.7 Ų102.749%0.49253%0.526SS..Hα-helixtrans-61.1-49.2176.5-67.5167000110.3D184 E185 C190 L191 Q192D184-I188 WeakPolarHBondContact O-CG1 3.41Å; D184-I188 PolarHBondContact O-N 2.9Å; E185-I188 PolarHBondContact O-N 3.3Å; I188-C190 VanDerWaalsContact C-N 3.32Å; I188-C190 PolarHBondContact O-N 3.44Å; I188-L191 PolarHBondContact O-N 3.46Å; I188-Q192 HydrophobicContact CG2-CG 4.48Å; I188-Q192 WeakPolarHBondContact O-CG 3.45Å; I188-Q192 PolarHBondContact O-N 3.24Å
189L88.4Confident88.2Confident62 Ų62102.1 Ų102.133%0.32552%0.519SS..Hα-helixtrans-60.6-41.7178.1-179.163.5000111.8P180 E185 L186 L191 Q192 L193P180-L189 HydrophobicContact CG-CB 4.47Å; P180-L189 HydrophobicContact CG-CD2 3.66Å; E185-L189 WeakPolarHBondContact O-CB 3.5Å; E185-L189 PolarHBondContact O-N 2.95Å; L186-L189 PolarHBondContact O-N 3.28Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-L191 PolarHBondContact O-N 2.96Å; L189-Q192 PolarHBondContact O-N 3.41Å; L189-L193 HydrophobicContact CD1-CD1 4.39Å; L189-L193 HydrophobicContact CD1-CG 4.35Å; L189-L193 HydrophobicContact CG-CD1 4.15Å; L189-L193 WeakPolarHBondContact O-CB 3.38Å; L189-L193 WeakPolarHBondContact O-CG 3.06Å; L189-L193 PolarHBondContact O-N 3.24Å
190C89.6Confident88.9Confident55 Ų5599.1 Ų99.137%0.37251%0.51SS..Hα-helixtrans-65.7-35.2177.3-72.30000112.5L186 H187 I188 K194L186-C190 WeakPolarHBondContact O-CB 3.42Å; L186-C190 PolarHBondContact O-N 3.33Å; L186-C190 PolarHBondContact O-SG 3.44Å; H187-C190 PolarHBondContact O-N 3.49Å; I188-C190 VanDerWaalsContact C-N 3.32Å; I188-C190 PolarHBondContact O-N 3.44Å; C190-K194 WeakPolarHBondContact O-CB 3.31Å; C190-K194 VanDerWaalsContact O-CG 3.24Å; C190-K194 WeakPolarHBondContact O-CG 3.44Å; C190-K194 PolarHBondContact O-N 2.87Å; C190-K194 VanDerWaalsContact O-N 3.09Å
191L91.1Very high89.5Confident116 Ų116103.4 Ų103.461%0.60752%0.521SS*.Hα-helixtrans-68.1-44.8174-73171.7000111H187 I188 L189 K194 E195H187-L191 WeakPolarHBondContact O-CG 3.3Å; H187-L191 PolarHBondContact O-N 3.02Å; I188-L191 PolarHBondContact O-N 3.46Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-L191 PolarHBondContact O-N 2.96Å; L191-K194 PolarHBondContact O-N 3.35Å; L191-E195 WeakPolarHBondContact O-CB 3.46Å; L191-E195 PolarHBondContact O-N 3.4Å
192Q90.1Very high90.1Very high100 Ų100100 Ų10047%0.46751%0.507SS..Hα-helixtrans-58.5-49.1175.6-72.7174.1-25.300111.7I188 L189 K194 E195 E196I188-Q192 HydrophobicContact CG2-CG 4.48Å; I188-Q192 WeakPolarHBondContact O-CG 3.45Å; I188-Q192 PolarHBondContact O-N 3.24Å; L189-Q192 PolarHBondContact O-N 3.41Å; Q192-K194 VanDerWaalsContact C-N 3.3Å; Q192-K194 PolarHBondContact O-N 3.04Å; Q192-E195 WeakPolarHBondContact O-CB 3.5Å; Q192-E195 PolarHBondContact O-N 3.46Å; Q192-E196 WeakPolarHBondContact O-CG 3.42Å; Q192-E196 PolarHBondContact O-N 2.87Å
193L90.3Very high90.4Very high97 Ų9799.7 Ų99.751%0.50851%0.511SS..Hα-helixtrans-63.8-33.3177.3-70.6173.2000112.9L189 L197L189-L193 HydrophobicContact CD1-CD1 4.39Å; L189-L193 HydrophobicContact CD1-CG 4.35Å; L189-L193 HydrophobicContact CG-CD1 4.15Å; L189-L193 WeakPolarHBondContact O-CB 3.38Å; L189-L193 WeakPolarHBondContact O-CG 3.06Å; L189-L193 PolarHBondContact O-N 3.24Å; L193-L197 VanDerWaalsContact O-CB 3.24Å; L193-L197 WeakPolarHBondContact O-CB 3.49Å; L193-L197 PolarHBondContact O-N 2.93Å
194K93Very high90.7Very high134 Ų134100 Ų10058%0.58351%0.506SS*.Hα-helixtrans-69.9-39.1174.1-79.7176-179.6-179.60111.8C190 L191 Q192 L197 L198C190-K194 WeakPolarHBondContact O-CB 3.31Å; C190-K194 VanDerWaalsContact O-CG 3.24Å; C190-K194 WeakPolarHBondContact O-CG 3.44Å; C190-K194 PolarHBondContact O-N 2.87Å; C190-K194 VanDerWaalsContact O-N 3.09Å; L191-K194 PolarHBondContact O-N 3.35Å; Q192-K194 VanDerWaalsContact C-N 3.3Å; Q192-K194 PolarHBondContact O-N 3.04Å; K194-L197 PolarHBondContact O-N 3.43Å; K194-L198 WeakPolarHBondContact O-CB 3.41Å; K194-L198 VanDerWaalsContact O-CG 3.24Å; K194-L198 WeakPolarHBondContact O-CG 3.36Å; K194-L198 PolarHBondContact O-N 3.22Å
195E92.4Very high91Very high121 Ų121100.7 Ų100.757%0.56551%0.505SS*.Hα-helixtrans-64.1-49.5175.3-172.2167.9-155.400110.7L191 Q192 L197 L198 E199L191-E195 WeakPolarHBondContact O-CB 3.46Å; L191-E195 PolarHBondContact O-N 3.4Å; Q192-E195 WeakPolarHBondContact O-CB 3.5Å; Q192-E195 PolarHBondContact O-N 3.46Å; E195-L197 VanDerWaalsContact C-N 3.32Å; E195-L197 PolarHBondContact O-N 2.76Å; E195-L198 WeakPolarHBondContact O-CB 3.27Å; E195-L198 PolarHBondContact O-N 3.34Å; E195-L198 VanDerWaalsContact O-N 3.09Å; E195-E199 WeakPolarHBondContact O-CG 3.5Å; E195-E199 PolarHBondContact O-N 3.27Å
196E92.3Very high91.2Very high118 Ų118102.9 Ų102.955%0.55152%0.515SS*.Hα-helixtrans-59.2-40.1174.9-70.7179.6-177.600112.5Q192 E199 S200Q192-E196 WeakPolarHBondContact O-CG 3.42Å; Q192-E196 PolarHBondContact O-N 2.87Å; E196-E199 PolarHBondContact O-N 2.74Å; E196-S200 WeakPolarHBondContact O-CB 3.44Å; E196-S200 PolarHBondContact O-N 3.02Å
197L93Very high91.5Very high87 Ų87103.8 Ų103.846%0.45552%0.52SS..Hα-helixtrans-65.7-39175.6-176.769.1000111.9L193 K194 E195 R201L193-L197 VanDerWaalsContact O-CB 3.24Å; L193-L197 WeakPolarHBondContact O-CB 3.49Å; L193-L197 PolarHBondContact O-N 2.93Å; K194-L197 PolarHBondContact O-N 3.43Å; E195-L197 VanDerWaalsContact C-N 3.32Å; E195-L197 PolarHBondContact O-N 2.76Å; L197-R201 WeakPolarHBondContact O-CB 3.37Å; L197-R201 VanDerWaalsContact O-CG 3.29Å; L197-R201 WeakPolarHBondContact O-CG 3.49Å; L197-R201 PolarHBondContact O-N 3.29Å
198L93.5Very high91.7Very high104 Ų104102.5 Ų102.555%0.54551%0.514SS..Hα-helixtrans-65.2-46.5175.3-76.3166.9000110.8K194 E195 S200 R201 I202K194-L198 WeakPolarHBondContact O-CB 3.41Å; K194-L198 VanDerWaalsContact O-CG 3.24Å; K194-L198 WeakPolarHBondContact O-CG 3.36Å; K194-L198 PolarHBondContact O-N 3.22Å; E195-L198 WeakPolarHBondContact O-CB 3.27Å; E195-L198 PolarHBondContact O-N 3.34Å; E195-L198 VanDerWaalsContact O-N 3.09Å; L198-S200 VanDerWaalsContact C-N 3.34Å; L198-S200 PolarHBondContact O-N 3.33Å; L198-R201 PolarHBondContact O-N 2.95Å; L198-I202 VanDerWaalsContact O-CG1 3.29Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 2.9Å
199E92.3Very high91.8Very high125 Ų125104.8 Ų104.858%0.58452%0.523SS*.Hα-helixtrans-58.4-45.1175.6-71.2-176.2168.700111.9E195 E196 R201 I202 A203E195-E199 WeakPolarHBondContact O-CG 3.5Å; E195-E199 PolarHBondContact O-N 3.27Å; E196-E199 PolarHBondContact O-N 2.74Å; E199-R201 PolarHBondContact O-N 2.96Å; E199-I202 PolarHBondContact O-N 3.3Å; E199-A203 WeakPolarHBondContact O-CB 3.47Å; E199-A203 PolarHBondContact O-N 3.18Å
200S89.9Confident92.1Very high72 Ų72104.2 Ų104.250%0.50352%0.524SS..Hα-helixtrans-63.2-39.6177.1-174.10000112.5E196 L198 A203 E204E196-S200 WeakPolarHBondContact O-CB 3.44Å; E196-S200 PolarHBondContact O-N 3.02Å; L198-S200 VanDerWaalsContact C-N 3.34Å; L198-S200 PolarHBondContact O-N 3.33Å; S200-A203 PolarHBondContact O-N 2.92Å; S200-E204 WeakPolarHBondContact O-CB 3.43Å; S200-E204 PolarHBondContact O-N 3.36Å
201R93.7Very high92.3Very high133 Ų133106 Ų10650%0.50253%0.529SS..Hα-helixtrans-68.2-42.3177.4-77.4176.7-178.2-174.80.6112.1L197 L198 E199 A203 E204 E205L197-R201 WeakPolarHBondContact O-CB 3.37Å; L197-R201 VanDerWaalsContact O-CG 3.29Å; L197-R201 WeakPolarHBondContact O-CG 3.49Å; L197-R201 PolarHBondContact O-N 3.29Å; L198-R201 PolarHBondContact O-N 2.95Å; E199-R201 PolarHBondContact O-N 2.96Å; R201-A203 VanDerWaalsContact C-N 3.28Å; R201-A203 PolarHBondContact O-N 3.45Å; R201-E204 PolarHBondContact O-N 3.01Å; R201-E205 WeakPolarHBondContact O-CG 3.46Å; R201-E205 PolarHBondContact O-N 3.4Å
202I93Very high92.5Very high109 Ų109107.9 Ų107.956%0.55953%0.528SS*.Hα-helixtrans-61.1-41.4175.2-67.6165.8000110.1L198 E199 H206L198-I202 VanDerWaalsContact O-CG1 3.29Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 2.9Å; E199-I202 PolarHBondContact O-N 3.3Å; I202-H206 WeakPolarHBondContact O-CB 3.34Å; I202-H206 PolarHBondContact O-N 2.72Å
203A92.1Very high92.6Very high59 Ų59106.8 Ų106.849%0.48853%0.531SS..Hα-helixtrans-65.7-38.9175.800000112.8E199 S200 R201 L207E199-A203 WeakPolarHBondContact O-CB 3.47Å; E199-A203 PolarHBondContact O-N 3.18Å; S200-A203 PolarHBondContact O-N 2.92Å; R201-A203 VanDerWaalsContact C-N 3.28Å; R201-A203 PolarHBondContact O-N 3.45Å; A203-L207 WeakPolarHBondContact O-CB 3.49Å; A203-L207 PolarHBondContact O-N 2.94Å
204E92.1Very high92.8Very high108 Ų108106.3 Ų106.351%0.50553%0.53SS..Hα-helixtrans-64.2-47.9174.5-176.8177.1-17100111.6S200 R201 H206 L207 E208S200-E204 WeakPolarHBondContact O-CB 3.43Å; S200-E204 PolarHBondContact O-N 3.36Å; R201-E204 PolarHBondContact O-N 3.01Å; E204-H206 PolarHBondContact O-N 3.29Å; E204-L207 PolarHBondContact O-N 3.3Å; E204-L207 VanDerWaalsContact O-N 3.16Å; E204-E208 PolarHBondContact O-N 2.97Å
205E92.2Very high92.8Very high133 Ų133105 Ų10562%0.62153%0.528SS*.Hα-helixtrans-59-45.6176.6-73.9176.5176.300111.6R201 L207 E208 E209R201-E205 WeakPolarHBondContact O-CG 3.46Å; R201-E205 PolarHBondContact O-N 3.4Å; E205-L207 VanDerWaalsContact C-N 3.34Å; E205-L207 PolarHBondContact O-N 3.2Å; E205-E208 PolarHBondContact O-N 3.35Å; E205-E209 WeakPolarHBondContact O-CB 3.45Å; E205-E209 PolarHBondContact O-N 3.49Å
206H91.9Very high92.9Very high134 Ų134104.9 Ų104.962%0.6253%0.53SS*.Hα-helixtrans-63.6-38.7175.7-177.6-67.7000112.1I202 E204 S210I202-H206 WeakPolarHBondContact O-CB 3.34Å; I202-H206 PolarHBondContact O-N 2.72Å; E204-H206 PolarHBondContact O-N 3.29Å; H206-S210 WeakPolarHBondContact O-CB 3.49Å; H206-S210 PolarHBondContact O-N 3.06Å
207L92.9Very high93Very high103 Ų103105.8 Ų105.854%0.53953%0.533SS..Hα-helixtrans-67.4-43176.8-176.965.5000111.3A203 E204 E205 S210 L211A203-L207 WeakPolarHBondContact O-CB 3.49Å; A203-L207 PolarHBondContact O-N 2.94Å; E204-L207 PolarHBondContact O-N 3.3Å; E204-L207 VanDerWaalsContact O-N 3.16Å; E205-L207 VanDerWaalsContact C-N 3.34Å; E205-L207 PolarHBondContact O-N 3.2Å; L207-S210 PolarHBondContact O-N 3.44Å; L207-L211 HydrophobicContact CD1-CG 4.48Å; L207-L211 HydrophobicContact CG-CD1 4.13Å; L207-L211 WeakPolarHBondContact O-CB 3.31Å; L207-L211 VanDerWaalsContact O-CG 3.3Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 3.13Å
208E92.3Very high93Very high86 Ų86105.6 Ų105.640%0.40254%0.535SS..Hα-helixtrans-60.1-44.9174.2-78.1-160.3-176.800111.7E204 E205 L211 R212E204-E208 PolarHBondContact O-N 2.97Å; E205-E208 PolarHBondContact O-N 3.35Å; E208-L211 PolarHBondContact O-N 2.91Å; E208-R212 WeakPolarHBondContact O-CB 3.44Å; E208-R212 WeakPolarHBondContact O-CG 3.24Å; E208-R212 PolarHBondContact O-N 2.92Å; E208-R212 IonicContact OE2-CZ 3.85Å; E208-R212 IonicContact OE2-NE 3.96Å; E208-R212 IonicContact OE2-NH2 2.94Å; E208-R212 PolarHBondContact OE2-NH2 3.4Å
209E92.7Very high93.1Very high144 Ų144106.9 Ų106.967%0.67354%0.536SS*.Hα-helixtrans-62.5-43.7177.8-170.6172.5-163.600111.3E205 L211 R212 S213E205-E209 WeakPolarHBondContact O-CB 3.45Å; E205-E209 PolarHBondContact O-N 3.49Å; E209-L211 PolarHBondContact O-N 2.92Å; E209-R212 PolarHBondContact O-N 3.18Å; E209-S213 PolarHBondContact O-N 2.95Å
210S93.6Very high93.2Very high50 Ų50104.3 Ų104.335%0.3553%0.532SS..Hα-helixtrans-60.3-45.9174.1-171.60000112H206 L207 R212 S213 D214H206-S210 WeakPolarHBondContact O-CB 3.49Å; H206-S210 PolarHBondContact O-N 3.06Å; L207-S210 PolarHBondContact O-N 3.44Å; S210-R212 PolarHBondContact O-N 2.88Å; S210-S213 WeakPolarHBondContact O-CB 3.46Å; S210-S213 PolarHBondContact O-N 3.18Å; S210-D214 PolarHBondContact O-N 2.95Å
211L93.7Very high93.3Very high92 Ų92105.7 Ų105.748%0.48253%0.53SS..Hα-helixtrans-66.7-35.5178.7-73.1172.6000112.3L207 E208 E209 D214 L215L207-L211 HydrophobicContact CD1-CG 4.48Å; L207-L211 HydrophobicContact CG-CD1 4.13Å; L207-L211 WeakPolarHBondContact O-CB 3.31Å; L207-L211 VanDerWaalsContact O-CG 3.3Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 3.13Å; E208-L211 PolarHBondContact O-N 2.91Å; E209-L211 PolarHBondContact O-N 2.92Å; L211-D214 PolarHBondContact O-N 3.34Å; L211-L215 WeakPolarHBondContact O-CB 3.46Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.3Å; L211-L215 PolarHBondContact O-N 2.93Å
212R95.1Very high93.3Very high157 Ų157104.4 Ų104.459%0.59253%0.533SS*.Hα-helixtrans-63.9-43.2173.4-73.7171.7-165.5-145.89.7110.9E208 E209 S210 L215 I216E208-R212 WeakPolarHBondContact O-CB 3.44Å; E208-R212 WeakPolarHBondContact O-CG 3.24Å; E208-R212 PolarHBondContact O-N 2.92Å; E208-R212 IonicContact OE2-CZ 3.85Å; E208-R212 IonicContact OE2-NE 3.96Å; E208-R212 IonicContact OE2-NH2 2.94Å; E208-R212 PolarHBondContact OE2-NH2 3.4Å; E209-R212 PolarHBondContact O-N 3.18Å; S210-R212 PolarHBondContact O-N 2.88Å; R212-L215 PolarHBondContact O-N 3.37Å; R212-I216 VanDerWaalsContact O-CG1 3.31Å; R212-I216 WeakPolarHBondContact O-CG1 3.48Å; R212-I216 PolarHBondContact O-N 2.9Å
213S93.2Very high93.4Very high76 Ų76105 Ų10553%0.53153%0.533SS..Hα-helixtrans-60.8-48.4174.9-1730000111.7E209 S210 L215 I216 F217E209-S213 PolarHBondContact O-N 2.95Å; S210-S213 WeakPolarHBondContact O-CB 3.46Å; S210-S213 PolarHBondContact O-N 3.18Å; S213-L215 VanDerWaalsContact C-N 3.34Å; S213-L215 PolarHBondContact O-N 2.93Å; S213-I216 PolarHBondContact O-N 3.49Å; S213-F217 PolarHBondContact O-N 2.98Å
214D93.9Very high93.4Very high88 Ų88105.6 Ų105.647%0.47153%0.534SS..Hα-helixtrans-61.5-41177.4-72.5-16.5000111.9S210 L211 F217 V218S210-D214 PolarHBondContact O-N 2.95Å; L211-D214 PolarHBondContact O-N 3.34Å; D214-F217 PolarHBondContact O-N 3.36Å; D214-V218 WeakPolarHBondContact O-CG2 3.2Å; D214-V218 PolarHBondContact O-N 2.96Å
215L93.4Very high93.5Very high105 Ų105106 Ų10655%0.5554%0.536SS..Hα-helixtrans-63.4-41.5176.2-80.4171.8000112.4L211 R212 S213 F217 K219L211-L215 WeakPolarHBondContact O-CB 3.46Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.3Å; L211-L215 PolarHBondContact O-N 2.93Å; R212-L215 PolarHBondContact O-N 3.37Å; S213-L215 VanDerWaalsContact C-N 3.34Å; S213-L215 PolarHBondContact O-N 2.93Å; L215-F217 VanDerWaalsContact C-N 3.35Å; L215-K219 WeakPolarHBondContact O-CB 3.49Å; L215-K219 VanDerWaalsContact O-CG 3.28Å; L215-K219 WeakPolarHBondContact O-CG 3.4Å; L215-K219 PolarHBondContact O-N 3.32Å
216I94.9Very high93.6Very high120 Ų120103.8 Ų103.862%0.61553%0.528SS*.Hα-helixtrans-63.7-44.4175.7-69.1166000109.8R212 S213 K219 S220R212-I216 VanDerWaalsContact O-CG1 3.31Å; R212-I216 WeakPolarHBondContact O-CG1 3.48Å; R212-I216 PolarHBondContact O-N 2.9Å; S213-I216 PolarHBondContact O-N 3.49Å; I216-K219 PolarHBondContact O-N 3Å; I216-S220 WeakPolarHBondContact O-CB 3.42Å; I216-S220 PolarHBondContact O-N 2.97Å
217F92.7Very high93.7Very high136 Ų136103 Ų10360%0.59652%0.524SS*.Hα-helixtrans-60.5-48.8177.7-179.6-97.1000112.1S213 D214 L215 K219 S220 Q221S213-F217 PolarHBondContact O-N 2.98Å; D214-F217 PolarHBondContact O-N 3.36Å; L215-F217 VanDerWaalsContact C-N 3.35Å; F217-K219 PolarHBondContact O-N 3Å; F217-S220 PolarHBondContact O-N 3.39Å; F217-Q221 WeakPolarHBondContact O-CB 3.43Å; F217-Q221 PolarHBondContact O-N 3.24Å
218V93.3Very high93.8Very high83 Ų83101.3 Ų101.350%0.50352%0.521SS..Hα-helixtrans-64.9-38.9179172.20000111.7D214 Q221 L222D214-V218 WeakPolarHBondContact O-CG2 3.2Å; D214-V218 PolarHBondContact O-N 2.96Å; V218-Q221 PolarHBondContact O-N 2.96Å; V218-L222 WeakPolarHBondContact O-CB 3.33Å; V218-L222 PolarHBondContact O-N 3.35Å
219K95.5Very high93.8Very high132 Ų132102.9 Ų102.957%0.57453%0.527SS*.Hα-helixtrans-62.4-47.9174.7-79179.5177.6-176.30111.8L215 I216 F217 Q221 L222 E223L215-K219 WeakPolarHBondContact O-CB 3.49Å; L215-K219 VanDerWaalsContact O-CG 3.28Å; L215-K219 WeakPolarHBondContact O-CG 3.4Å; L215-K219 PolarHBondContact O-N 3.32Å; I216-K219 PolarHBondContact O-N 3Å; F217-K219 PolarHBondContact O-N 3Å; K219-Q221 VanDerWaalsContact C-N 3.3Å; K219-Q221 PolarHBondContact O-N 3.14Å; K219-L222 PolarHBondContact O-N 3.39Å; K219-E223 WeakPolarHBondContact O-CG 3.49Å; K219-E223 PolarHBondContact O-N 2.98Å
220S94.6Very high93.9Very high70 Ų70101.7 Ų101.749%0.4952%0.521SS..Hα-helixtrans-61.1-40.4177.1178.60000111.8I216 F217 E223 S224I216-S220 WeakPolarHBondContact O-CB 3.42Å; I216-S220 PolarHBondContact O-N 2.97Å; F217-S220 PolarHBondContact O-N 3.39Å; S220-E223 PolarHBondContact O-N 3.44Å; S220-S224 PolarHBondContact O-N 3.41Å
221Q93.4Very high94Very high102 Ų102105.9 Ų105.948%0.47754%0.535SS..Hα-helixtrans-63.1-44.8174.6-173.1171.63300111.7F217 V218 K219 E223 S224 E225F217-Q221 WeakPolarHBondContact O-CB 3.43Å; F217-Q221 PolarHBondContact O-N 3.24Å; V218-Q221 PolarHBondContact O-N 2.96Å; K219-Q221 VanDerWaalsContact C-N 3.3Å; K219-Q221 PolarHBondContact O-N 3.14Å; Q221-E223 PolarHBondContact O-N 2.72Å; Q221-S224 PolarHBondContact O-N 2.67Å; Q221-E225 VanDerWaalsContact O-CG 3.32Å; Q221-E225 WeakPolarHBondContact O-CG 3.34Å; Q221-E225 PolarHBondContact O-N 3.47Å
222L93Very high94.1Very high106 Ų106106.5 Ų106.556%0.55554%0.538SS*.Hα-helixtrans-62.6-42.1177.9-179.563.5000112.1V218 K219 E225 L226V218-L222 WeakPolarHBondContact O-CB 3.33Å; V218-L222 PolarHBondContact O-N 3.35Å; K219-L222 PolarHBondContact O-N 3.39Å; L222-E225 PolarHBondContact O-N 2.71Å; L222-L226 HydrophobicContact CD1-CG 4.48Å; L222-L226 HydrophobicContact CG-CD1 4.26Å; L222-L226 WeakPolarHBondContact O-CB 3.5Å; L222-L226 WeakPolarHBondContact O-CG 3.49Å; L222-L226 PolarHBondContact O-N 3.47Å
223E94.8Very high94Very high120 Ų120103.5 Ų103.556%0.56153%0.531SS*.Hα-helixtrans-61.7-43.4175.9-73.8171-178.800111.6K219 S220 Q221 L226 Q227K219-E223 WeakPolarHBondContact O-CG 3.49Å; K219-E223 PolarHBondContact O-N 2.98Å; S220-E223 PolarHBondContact O-N 3.44Å; Q221-E223 PolarHBondContact O-N 2.72Å; E223-L226 PolarHBondContact O-N 3.4Å; E223-Q227 WeakPolarHBondContact O-CG 3.42Å; E223-Q227 PolarHBondContact O-N 2.98Å
224S93.1Very high94.1Very high72 Ų72103.9 Ų103.950%0.50353%0.53SS..Hα-helixtrans-63-42.3175.7-175.50000112.5S220 Q221 Q227 S228S220-S224 PolarHBondContact O-N 3.41Å; Q221-S224 PolarHBondContact O-N 2.67Å; S224-Q227 PolarHBondContact O-N 3.06Å; S224-S228 PolarHBondContact O-N 2.82Å
225E92.4Very high94.2Very high118 Ų118102.2 Ų102.255%0.55153%0.525SS*.Hα-helixtrans-66.8-39177.6-70.1-69.8155.100111.6Q221 L222 S228 K229Q221-E225 VanDerWaalsContact O-CG 3.32Å; Q221-E225 WeakPolarHBondContact O-CG 3.34Å; Q221-E225 PolarHBondContact O-N 3.47Å; L222-E225 PolarHBondContact O-N 2.71Å; E225-S228 PolarHBondContact O-N 2.83Å; E225-K229 WeakPolarHBondContact O-CB 3.39Å; E225-K229 PolarHBondContact O-N 2.84Å
226L94.7Very high94.3Very high85 Ų85101.7 Ų101.745%0.44552%0.522SS..Hα-helixtrans-63.4-44.8175-76.3172.6000111.8L222 E223 S228 K229 E230L222-L226 HydrophobicContact CD1-CG 4.48Å; L222-L226 HydrophobicContact CG-CD1 4.26Å; L222-L226 WeakPolarHBondContact O-CB 3.5Å; L222-L226 WeakPolarHBondContact O-CG 3.49Å; L222-L226 PolarHBondContact O-N 3.47Å; E223-L226 PolarHBondContact O-N 3.4Å; L226-S228 PolarHBondContact O-N 3.38Å; L226-K229 WeakPolarHBondContact O-CB 3.31Å; L226-K229 PolarHBondContact O-N 3.34Å; L226-K229 VanDerWaalsContact O-N 3.17Å; L226-E230 WeakPolarHBondContact O-CG 3.07Å; L226-E230 PolarHBondContact O-N 2.92Å
227Q95.1Very high94.3Very high117 Ų11799.7 Ų99.755%0.54752%0.516SS..Hα-helixtrans-61.7-42.9175.4-73176.82.300111.9E223 S224 K229 E230 Q231E223-Q227 WeakPolarHBondContact O-CG 3.42Å; E223-Q227 PolarHBondContact O-N 2.98Å; S224-Q227 PolarHBondContact O-N 3.06Å; Q227-K229 VanDerWaalsContact C-N 3.27Å; Q227-K229 PolarHBondContact O-N 2.91Å; Q227-E230 PolarHBondContact O-N 3.35Å; Q227-Q231 WeakPolarHBondContact O-CG 3.28Å; Q227-Q231 PolarHBondContact O-N 3.34Å
228S93.8Very high94.4Very high68 Ų6899.1 Ų99.148%0.47652%0.515SS..Hα-helixtrans-62.1-37.2175.4-175.60000111.9S224 E225 L226 L232S224-S228 PolarHBondContact O-N 2.82Å; E225-S228 PolarHBondContact O-N 2.83Å; L226-S228 PolarHBondContact O-N 3.38Å; S228-L232 PolarHBondContact O-N 3.41Å; S228-L232 VanDerWaalsContact O-N 3.15Å
229K93.5Very high94.5Very high119 Ų11999.2 Ų99.252%0.51751%0.513SS..Hα-helixtrans-69-44.8177.3-173.6-170.6173.4-139.70111.7E225 L226 Q227 Q231 L232 E233E225-K229 WeakPolarHBondContact O-CB 3.39Å; E225-K229 PolarHBondContact O-N 2.84Å; L226-K229 WeakPolarHBondContact O-CB 3.31Å; L226-K229 PolarHBondContact O-N 3.34Å; L226-K229 VanDerWaalsContact O-N 3.17Å; Q227-K229 VanDerWaalsContact C-N 3.27Å; Q227-K229 PolarHBondContact O-N 2.91Å; K229-Q231 VanDerWaalsContact C-N 3.33Å; K229-Q231 PolarHBondContact O-N 3.43Å; K229-L232 WeakPolarHBondContact O-CB 3.4Å; K229-L232 PolarHBondContact O-N 2.87Å; K229-E233 WeakPolarHBondContact CE-OE1 3.37Å; K229-E233 IonicContact NZ-OE1 3.77Å; K229-E233 PolarHBondContact NZ-OE1 2.99Å; K229-E233 VanDerWaalsContact NZ-OE1 3.08Å; K229-E233 WeakPolarHBondContact O-CG 3.36Å; K229-E233 PolarHBondContact O-N 3.3Å
230E95.1Very high94.5Very high119 Ų11996.1 Ų96.156%0.55651%0.505SS*.Hα-helixtrans-60.2-43.1176.6-75176179.300111.4L226 Q227 L232 E233 V234L226-E230 WeakPolarHBondContact O-CG 3.07Å; L226-E230 PolarHBondContact O-N 2.92Å; Q227-E230 PolarHBondContact O-N 3.35Å; E230-L232 VanDerWaalsContact C-N 3.32Å; E230-L232 PolarHBondContact O-N 3.44Å; E230-E233 PolarHBondContact O-N 3.25Å; E230-V234 WeakPolarHBondContact O-CG2 3.41Å; E230-V234 PolarHBondContact O-N 3.48Å
231Q95.1Very high94.5Very high139 Ų13996.6 Ų96.665%0.6550%0.502SS*.Hα-helixtrans-60.1-41.9174.5-72.9175.13.900112.2Q227 K229 V234 S235Q227-Q231 WeakPolarHBondContact O-CG 3.28Å; Q227-Q231 PolarHBondContact O-N 3.34Å; K229-Q231 VanDerWaalsContact C-N 3.33Å; K229-Q231 PolarHBondContact O-N 3.43Å; Q231-V234 PolarHBondContact O-N 2.96Å; Q231-S235 PolarHBondContact O-N 2.7Å
232L94.6Very high94.7Very high104 Ų10494.6 Ų94.655%0.54550%0.499SS..Hα-helixtrans-66.3-40.4176.3-174.866.2000111.9S228 K229 E230 S235 L236S228-L232 PolarHBondContact O-N 3.41Å; S228-L232 VanDerWaalsContact O-N 3.15Å; K229-L232 WeakPolarHBondContact O-CB 3.4Å; K229-L232 PolarHBondContact O-N 2.87Å; E230-L232 VanDerWaalsContact C-N 3.32Å; E230-L232 PolarHBondContact O-N 3.44Å; L232-S235 PolarHBondContact O-N 3.25Å; L232-L236 HydrophobicContact CD1-CD1 4.5Å; L232-L236 HydrophobicContact CD1-CG 4.43Å; L232-L236 HydrophobicContact CG-CD1 4.07Å; L232-L236 HydrophobicContact CG-CG 4.42Å; L232-L236 WeakPolarHBondContact O-CB 3.05Å; L232-L236 VanDerWaalsContact O-CG 3.29Å; L232-L236 WeakPolarHBondContact O-CG 3.48Å; L232-L236 PolarHBondContact O-N 2.97Å
233E93.4Very high94.7Very high94 Ų9494.7 Ų94.744%0.43950%0.5SS..Hα-helixtrans-63-41176.5-75.3179.9-177.800111.8K229 E230 T237K229-E233 WeakPolarHBondContact CE-OE1 3.37Å; K229-E233 IonicContact NZ-OE1 3.77Å; K229-E233 PolarHBondContact NZ-OE1 2.99Å; K229-E233 VanDerWaalsContact NZ-OE1 3.08Å; K229-E233 WeakPolarHBondContact O-CG 3.36Å; K229-E233 PolarHBondContact O-N 3.3Å; E230-E233 PolarHBondContact O-N 3.25Å; E233-T237 WeakPolarHBondContact O-CB 3.41Å; E233-T237 PolarHBondContact O-N 2.92Å; E233-T237 PolarHBondContact O-OG1 3.39Å
234V96.4Very high94.8Very high85 Ų8596.9 Ų96.952%0.51550%0.503SS..Hα-helixtrans-62.2-50174.1173.30000110.5E230 Q231 L236 T237 E238E230-V234 WeakPolarHBondContact O-CG2 3.41Å; E230-V234 PolarHBondContact O-N 3.48Å; Q231-V234 PolarHBondContact O-N 2.96Å; V234-L236 PolarHBondContact O-N 2.94Å; V234-T237 WeakPolarHBondContact O-CB 3.35Å; V234-T237 PolarHBondContact O-N 3.21Å; V234-T237 VanDerWaalsContact O-N 3.11Å; V234-E238 WeakPolarHBondContact O-CG 3.46Å; V234-E238 PolarHBondContact O-N 3.25Å
235S95.3Very high94.9Very high52 Ų5298 Ų9836%0.36451%0.507SS..Hα-helixtrans-58-45.7178.1-178.50000112.3Q231 L232 T237 E238 D239Q231-S235 PolarHBondContact O-N 2.7Å; L232-S235 PolarHBondContact O-N 3.25Å; S235-T237 VanDerWaalsContact C-N 3.28Å; S235-T237 PolarHBondContact O-N 2.89Å; S235-E238 PolarHBondContact O-N 3.47Å; S235-D239 PolarHBondContact O-N 3.45Å
236L95.4Very high95.1Very high94 Ų9497.9 Ų97.949%0.49251%0.506SS..Hα-helixtrans-65.7-32.8178.1-71.7173.2000112.1L232 V234 V240L232-L236 HydrophobicContact CD1-CD1 4.5Å; L232-L236 HydrophobicContact CD1-CG 4.43Å; L232-L236 HydrophobicContact CG-CD1 4.07Å; L232-L236 HydrophobicContact CG-CG 4.42Å; L232-L236 WeakPolarHBondContact O-CB 3.05Å; L232-L236 VanDerWaalsContact O-CG 3.29Å; L232-L236 WeakPolarHBondContact O-CG 3.48Å; L232-L236 PolarHBondContact O-N 2.97Å; V234-L236 PolarHBondContact O-N 2.94Å; L236-V240 WeakPolarHBondContact O-CB 3.49Å; L236-V240 VanDerWaalsContact O-CG2 3.26Å; L236-V240 WeakPolarHBondContact O-CG2 3.33Å; L236-V240 PolarHBondContact O-N 3.43Å
237T95.6Very high95.1Very high79 Ų7998.5 Ų98.549%0.48551%0.51SS..Hα-helixtrans-68.9-40.1176.1-580000111.2E233 V234 S235 V240 N241E233-T237 WeakPolarHBondContact O-CB 3.41Å; E233-T237 PolarHBondContact O-N 2.92Å; E233-T237 PolarHBondContact O-OG1 3.39Å; V234-T237 WeakPolarHBondContact O-CB 3.35Å; V234-T237 PolarHBondContact O-N 3.21Å; V234-T237 VanDerWaalsContact O-N 3.11Å; S235-T237 VanDerWaalsContact C-N 3.28Å; S235-T237 PolarHBondContact O-N 2.89Å; T237-V240 PolarHBondContact O-N 2.76Å; T237-N241 WeakPolarHBondContact O-CB 3.42Å; T237-N241 VanDerWaalsContact O-CG 3.25Å; T237-N241 PolarHBondContact O-N 2.93Å; T237-N241 PolarHBondContact O-ND2 2.68Å; T237-N241 VanDerWaalsContact O-ND2 3.17Å
238E95.3Very high95.1Very high123 Ų12395.6 Ų95.658%0.57551%0.505SS*.Hα-helixtrans-61.8-46.9173.1-70.8176.2173.800111.4V234 S235 V240 N241 S242V234-E238 WeakPolarHBondContact O-CG 3.46Å; V234-E238 PolarHBondContact O-N 3.25Å; S235-E238 PolarHBondContact O-N 3.47Å; E238-V240 PolarHBondContact O-N 3.09Å; E238-N241 PolarHBondContact O-N 3.13Å; E238-S242 PolarHBondContact O-N 3.44Å
239D95.4Very high95.2Very high86 Ų8696 Ų9646%0.4651%0.505SS..Hα-helixtrans-59.5-45.1176.6-71.8-19.7000111.8S235 N241 S242 L243S235-D239 PolarHBondContact O-N 3.45Å; D239-N241 VanDerWaalsContact C-N 3.32Å; D239-N241 PolarHBondContact O-N 3.24Å; D239-S242 PolarHBondContact O-N 3.04Å; D239-L243 WeakPolarHBondContact O-CB 3.28Å; D239-L243 WeakPolarHBondContact O-CG 3.43Å; D239-L243 PolarHBondContact O-N 2.9Å
240V94.6Very high95.3Very high66 Ų6692.7 Ų92.740%0.450%0.5SS..Hα-helixtrans-61.3-40.8176.6166.60000111.4L236 T237 E238 R244L236-V240 WeakPolarHBondContact O-CB 3.49Å; L236-V240 VanDerWaalsContact O-CG2 3.26Å; L236-V240 WeakPolarHBondContact O-CG2 3.33Å; L236-V240 PolarHBondContact O-N 3.43Å; T237-V240 PolarHBondContact O-N 2.76Å; E238-V240 PolarHBondContact O-N 3.09Å; V240-R244 WeakPolarHBondContact O-CB 3.49Å; V240-R244 VanDerWaalsContact O-CG 3.25Å; V240-R244 WeakPolarHBondContact O-CG 3.36Å; V240-R244 PolarHBondContact O-N 3Å
241N95.4Very high95.3Very high80 Ų8092.6 Ų92.643%0.42850%0.499SS..Hα-helixtrans-66.8-42.3176.9-71.8-29.3000111.3T237 E238 D239 R244 T245T237-N241 WeakPolarHBondContact O-CB 3.42Å; T237-N241 VanDerWaalsContact O-CG 3.25Å; T237-N241 PolarHBondContact O-N 2.93Å; T237-N241 PolarHBondContact O-ND2 2.68Å; T237-N241 VanDerWaalsContact O-ND2 3.17Å; E238-N241 PolarHBondContact O-N 3.13Å; D239-N241 VanDerWaalsContact C-N 3.32Å; D239-N241 PolarHBondContact O-N 3.24Å; N241-R244 WeakPolarHBondContact O-CB 3.34Å; N241-R244 PolarHBondContact O-N 3.27Å; N241-T245 PolarHBondContact O-N 2.91Å; N241-T245 PolarHBondContact O-OG1 3.48Å
242S95.8Very high95.3Very high61 Ų6189.2 Ų89.243%0.42749%0.491SS..Hα-helixtrans-59-50.2174.8-168.50000111.6E238 D239 R244 T245 E246E238-S242 PolarHBondContact O-N 3.44Å; D239-S242 PolarHBondContact O-N 3.04Å; S242-R244 VanDerWaalsContact C-N 3.28Å; S242-R244 PolarHBondContact O-N 2.88Å; S242-T245 WeakPolarHBondContact O-CB 3.39Å; S242-T245 PolarHBondContact O-N 3.43Å; S242-T245 VanDerWaalsContact O-N 3.07Å; S242-E246 PolarHBondContact O-N 3.36Å
243L94.8Very high95.3Very high108 Ų10890.1 Ų90.157%0.56549%0.493SS*.Hα-helixtrans-61.4-35.1178.4-71.8172.7000112.4D239 L247D239-L243 WeakPolarHBondContact O-CB 3.28Å; D239-L243 WeakPolarHBondContact O-CG 3.43Å; D239-L243 PolarHBondContact O-N 2.9Å; L243-L247 VanDerWaalsContact O-CB 3.3Å; L243-L247 WeakPolarHBondContact O-CB 3.4Å; L243-L247 PolarHBondContact O-N 3.35Å
244R96.6Very high95.4Very high166 Ų16690.4 Ų90.463%0.62650%0.496SS*.Hα-helixtrans-65.4-41.2173.6-78171.8175.2177.4-0.6112V240 N241 S242 L247 A248V240-R244 WeakPolarHBondContact O-CB 3.49Å; V240-R244 VanDerWaalsContact O-CG 3.25Å; V240-R244 WeakPolarHBondContact O-CG 3.36Å; V240-R244 PolarHBondContact O-N 3Å; N241-R244 WeakPolarHBondContact O-CB 3.34Å; N241-R244 PolarHBondContact O-N 3.27Å; S242-R244 VanDerWaalsContact C-N 3.28Å; S242-R244 PolarHBondContact O-N 2.88Å; R244-L247 PolarHBondContact O-N 3.09Å; R244-A248 PolarHBondContact O-N 2.94Å
245T95.4Very high95.3Very high94 Ų9488.4 Ų88.458%0.57749%0.489SS*.Hα-helixtrans-64.6-45.3175.3-57.90000111.3N241 S242 L247 A248 V249N241-T245 PolarHBondContact O-N 2.91Å; N241-T245 PolarHBondContact O-OG1 3.48Å; S242-T245 WeakPolarHBondContact O-CB 3.39Å; S242-T245 PolarHBondContact O-N 3.43Å; S242-T245 VanDerWaalsContact O-N 3.07Å; T245-L247 VanDerWaalsContact C-N 3.33Å; T245-L247 PolarHBondContact O-N 2.99Å; T245-A248 PolarHBondContact O-N 2.91Å; T245-V249 WeakPolarHBondContact O-CG2 3.41Å; T245-V249 PolarHBondContact O-N 2.94Å
246E96.2Very high95.3Very high116 Ų11690.2 Ų90.254%0.54250%0.495SS..Hα-helixtrans-60-43175.5-71176.8-155.700111.9S242 A248 V249 A250S242-E246 PolarHBondContact O-N 3.36Å; E246-A248 PolarHBondContact O-N 2.96Å; E246-V249 PolarHBondContact O-N 3.29Å; E246-A250 WeakPolarHBondContact O-CB 3.5Å; E246-A250 PolarHBondContact O-N 2.89Å
247L94.7Very high95.2Very high99 Ų9993.8 Ų93.852%0.51850%0.501SS..Hα-helixtrans-61.6-42.6176.2-177.864.9000112L243 R244 T245 A250 Q251L243-L247 VanDerWaalsContact O-CB 3.3Å; L243-L247 WeakPolarHBondContact O-CB 3.4Å; L243-L247 PolarHBondContact O-N 3.35Å; R244-L247 PolarHBondContact O-N 3.09Å; T245-L247 VanDerWaalsContact C-N 3.33Å; T245-L247 PolarHBondContact O-N 2.99Å; L247-A250 PolarHBondContact O-N 3.24Å; L247-Q251 HydrophobicContact CD1-CG 4.48Å; L247-Q251 WeakPolarHBondContact O-CB 3.49Å; L247-Q251 VanDerWaalsContact O-CG 3.27Å; L247-Q251 WeakPolarHBondContact O-CG 3.33Å; L247-Q251 PolarHBondContact O-N 3.25Å
248A95.7Very high95.2Very high55 Ų5595.2 Ų95.246%0.45550%0.503SS..Hα-helixtrans-63.2-41.7177.500000111.8R244 T245 E246 Q251 S252R244-A248 PolarHBondContact O-N 2.94Å; T245-A248 PolarHBondContact O-N 2.91Å; E246-A248 PolarHBondContact O-N 2.96Å; A248-Q251 PolarHBondContact O-N 3.48Å; A248-S252 PolarHBondContact O-N 3.23Å
249V95.3Very high95.2Very high76 Ų7695.4 Ų95.446%0.46151%0.505SS..Hα-helixtrans-63.2-46.3174.7173.30000110.7T245 E246 Q251 S252 Q253T245-V249 WeakPolarHBondContact O-CG2 3.41Å; T245-V249 PolarHBondContact O-N 2.94Å; E246-V249 PolarHBondContact O-N 3.29Å; V249-Q251 VanDerWaalsContact C-N 3.32Å; V249-Q251 PolarHBondContact O-N 2.81Å; V249-S252 WeakPolarHBondContact O-CB 3.33Å; V249-S252 PolarHBondContact O-N 2.98Å; V249-Q253 HydrophobicContact CG1-CG 4.49Å; V249-Q253 WeakPolarHBondContact O-CG 3.48Å; V249-Q253 PolarHBondContact O-N 3.42Å
250A94.2Very high95.2Very high50 Ų5096.8 Ų96.841%0.41351%0.512SS..Hα-helixtrans-62-38.4178.200000112.4E246 L247 Q253 L254E246-A250 WeakPolarHBondContact O-CB 3.5Å; E246-A250 PolarHBondContact O-N 2.89Å; L247-A250 PolarHBondContact O-N 3.24Å; A250-Q253 PolarHBondContact O-N 2.71Å; A250-L254 WeakPolarHBondContact O-CB 3.39Å; A250-L254 PolarHBondContact O-N 3.29Å
251Q96.1Very high95.2Very high118 Ų11898.4 Ų98.455%0.55152%0.518SS*.Hα-helixtrans-65.7-42174.9-75.3174.2-11.100112.2L247 A248 V249 L254 A255L247-Q251 HydrophobicContact CD1-CG 4.48Å; L247-Q251 WeakPolarHBondContact O-CB 3.49Å; L247-Q251 VanDerWaalsContact O-CG 3.27Å; L247-Q251 WeakPolarHBondContact O-CG 3.33Å; L247-Q251 PolarHBondContact O-N 3.25Å; A248-Q251 PolarHBondContact O-N 3.48Å; V249-Q251 VanDerWaalsContact C-N 3.32Å; V249-Q251 PolarHBondContact O-N 2.81Å; Q251-L254 PolarHBondContact O-N 3.1Å; Q251-A255 PolarHBondContact O-N 2.91Å
252S94.9Very high95.2Very high68 Ų68100.7 Ų100.748%0.47653%0.526SS..Hα-helixtrans-60.6-46.8173.9-170.50000111.3A248 V249 L254 A255 D256A248-S252 PolarHBondContact O-N 3.23Å; V249-S252 WeakPolarHBondContact O-CB 3.33Å; V249-S252 PolarHBondContact O-N 2.98Å; S252-L254 VanDerWaalsContact C-N 3.28Å; S252-L254 PolarHBondContact O-N 3.07Å; S252-A255 WeakPolarHBondContact O-CB 3.43Å; S252-A255 PolarHBondContact O-N 3.29Å; S252-D256 PolarHBondContact O-N 2.96Å
253Q95.3Very high95.1Very high123 Ų123105.9 Ų105.958%0.57554%0.536SS*.Hα-helixtrans-62.6-35.4177.6-70.61760.700112.4V249 A250 R257V249-Q253 HydrophobicContact CG1-CG 4.49Å; V249-Q253 WeakPolarHBondContact O-CG 3.48Å; V249-Q253 PolarHBondContact O-N 3.42Å; A250-Q253 PolarHBondContact O-N 2.71Å; Q253-R257 VanDerWaalsContact O-CB 3.31Å; Q253-R257 WeakPolarHBondContact O-CB 3.27Å; Q253-R257 PolarHBondContact O-N 2.97Å
254L95.2Very high95.2Very high99 Ų99107.4 Ų107.452%0.51854%0.538SS..Hα-helixtrans-65.8-42.6174.9-175.168.1000111.4A250 Q251 S252 R257 Q258A250-L254 WeakPolarHBondContact O-CB 3.39Å; A250-L254 PolarHBondContact O-N 3.29Å; Q251-L254 PolarHBondContact O-N 3.1Å; S252-L254 VanDerWaalsContact C-N 3.28Å; S252-L254 PolarHBondContact O-N 3.07Å; L254-R257 PolarHBondContact O-N 3.47Å; L254-Q258 WeakPolarHBondContact O-CG 3Å; L254-Q258 PolarHBondContact O-N 2.83Å
255A94.8Very high95.1Very high44 Ų44102.3 Ų102.336%0.36453%0.531SS..Hα-helixtrans-62.8-46.617600000111.5Q251 S252 R257 Q258 M259Q251-A255 PolarHBondContact O-N 2.91Å; S252-A255 WeakPolarHBondContact O-CB 3.43Å; S252-A255 PolarHBondContact O-N 3.29Å; A255-R257 VanDerWaalsContact C-N 3.29Å; A255-R257 PolarHBondContact O-N 3.44Å; A255-Q258 WeakPolarHBondContact O-CB 3.27Å; A255-Q258 PolarHBondContact O-N 3.5Å; A255-Q258 VanDerWaalsContact O-N 3.14Å; A255-M259 PolarHBondContact O-N 3.28Å
256D93.6Very high95.1Very high90 Ų90102.6 Ų102.648%0.48153%0.53SS..Hα-helixtrans-58.5-42.5175.1-69-21.6000111.4S252 M259 L260S252-D256 PolarHBondContact O-N 2.96Å; D256-M259 PolarHBondContact O-N 3.31Å; D256-L260 WeakPolarHBondContact O-CG 3.42Å; D256-L260 PolarHBondContact O-N 2.85Å
257R94.2Very high95Very high168 Ų16899.3 Ų99.363%0.63452%0.517SS*.Hα-helixtrans-65.1-38.8177-172.9174.4179.597.9-2112.2Q253 L254 A255 L260 L261Q253-R257 VanDerWaalsContact O-CB 3.31Å; Q253-R257 WeakPolarHBondContact O-CB 3.27Å; Q253-R257 PolarHBondContact O-N 2.97Å; L254-R257 PolarHBondContact O-N 3.47Å; A255-R257 VanDerWaalsContact C-N 3.29Å; A255-R257 PolarHBondContact O-N 3.44Å; R257-L260 PolarHBondContact O-N 3.44Å; R257-L261 WeakPolarHBondContact O-CG 3.39Å; R257-L261 PolarHBondContact O-N 2.88Å
258Q95.6Very high95Very high110 Ų110101.8 Ų101.851%0.51452%0.524SS..Hα-helixtrans-64.5-42.8175.1-75.3174.6-9.400111.4L254 A255 L260 L261 Q262L254-Q258 WeakPolarHBondContact O-CG 3Å; L254-Q258 PolarHBondContact O-N 2.83Å; A255-Q258 WeakPolarHBondContact O-CB 3.27Å; A255-Q258 PolarHBondContact O-N 3.5Å; A255-Q258 VanDerWaalsContact O-N 3.14Å; Q258-L260 PolarHBondContact O-N 2.94Å; Q258-L261 PolarHBondContact O-N 2.87Å; Q258-Q262 WeakPolarHBondContact O-CG 3.37Å; Q258-Q262 PolarHBondContact O-N 3.45Å
259M95.1Very high95Very high127 Ų127102.1 Ų102.163%0.62652%0.523SS*.Hα-helixtrans-60.6-43.8173.9-71.3-175.866.400112A255 D256 L261 Q262 W263A255-M259 PolarHBondContact O-N 3.28Å; D256-M259 PolarHBondContact O-N 3.31Å; M259-L261 VanDerWaalsContact C-N 3.33Å; M259-L261 PolarHBondContact O-N 3.31Å; M259-Q262 PolarHBondContact O-N 3.26Å; M259-W263 WeakPolarHBondContact O-CB 3.39Å; M259-W263 PolarHBondContact O-N 2.91Å
260L94.8Very high95Very high114 Ų114105.9 Ų105.960%0.59753%0.529SS*.Hα-helixtrans-62.7-38.2176.1-75.9170.4000112.6D256 R257 Q258 K264D256-L260 WeakPolarHBondContact O-CG 3.42Å; D256-L260 PolarHBondContact O-N 2.85Å; R257-L260 PolarHBondContact O-N 3.44Å; Q258-L260 PolarHBondContact O-N 2.94Å; L260-K264 VanDerWaalsContact O-CB 3.3Å; L260-K264 WeakPolarHBondContact O-CB 3.39Å; L260-K264 PolarHBondContact O-N 3.37Å
261L94.7Very high95Very high100 Ų100109 Ų10952%0.52454%0.538SS..Hα-helixtrans-67.2-41.3176.3-74.3173000112R257 Q258 M259 K264 A265R257-L261 WeakPolarHBondContact O-CG 3.39Å; R257-L261 PolarHBondContact O-N 2.88Å; Q258-L261 PolarHBondContact O-N 2.87Å; M259-L261 VanDerWaalsContact C-N 3.33Å; M259-L261 PolarHBondContact O-N 3.31Å; L261-K264 PolarHBondContact O-N 2.85Å; L261-A265 PolarHBondContact O-N 2.86Å
262Q95.5Very high94.9Very high129 Ų129106.7 Ų106.760%0.60353%0.532SS*.Hα-helixtrans-62.3-49.6173.2-73.9177.7-15.900111Q258 M259 K264 A265 D266Q258-Q262 WeakPolarHBondContact O-CG 3.37Å; Q258-Q262 PolarHBondContact O-N 3.45Å; M259-Q262 PolarHBondContact O-N 3.26Å; Q262-K264 VanDerWaalsContact C-N 3.27Å; Q262-K264 PolarHBondContact O-N 3.3Å; Q262-A265 WeakPolarHBondContact O-CA 3.45Å; Q262-A265 WeakPolarHBondContact O-CB 3.43Å; Q262-A265 PolarHBondContact O-N 2.92Å; Q262-D266 PolarHBondContact O-N 2.96Å
263W95.4Very high94.9Very high169 Ų169108.5 Ų108.564%0.6453%0.533SS*.Hα-helixtrans-57.5-39.9176.4-179.282.9000112.4M259 D266 T267M259-W263 WeakPolarHBondContact O-CB 3.39Å; M259-W263 PolarHBondContact O-N 2.91Å; W263-D266 PolarHBondContact O-N 3.32Å; W263-T267 HydrophobicContact CD2-CG2 4Å; W263-T267 HydrophobicContact CE3-CG2 4.43Å; W263-T267 HydrophobicContact CG-CG2 4.5Å; W263-T267 HydrophobicContact CH2-CG2 4.24Å; W263-T267 HydrophobicContact CZ2-CG2 3.77Å; W263-T267 WeakPolarHBondContact O-CB 3.29Å; W263-T267 VanDerWaalsContact O-CG2 3.28Å; W263-T267 WeakPolarHBondContact O-CG2 3.37Å; W263-T267 PolarHBondContact O-N 3.13Å; W263-T267 PolarHBondContact O-OG1 3.01Å
264K95.5Very high94.8Very high141 Ų141108 Ų10861%0.61353%0.53SS*.Hα-helixtrans-64.7-38.2174.7-174.7178.8178.7-179.40112.4L260 L261 Q262 T267 K268L260-K264 VanDerWaalsContact O-CB 3.3Å; L260-K264 WeakPolarHBondContact O-CB 3.39Å; L260-K264 PolarHBondContact O-N 3.37Å; L261-K264 PolarHBondContact O-N 2.85Å; Q262-K264 VanDerWaalsContact C-N 3.27Å; Q262-K264 PolarHBondContact O-N 3.3Å; K264-T267 WeakPolarHBondContact CA-OG1 3.46Å; K264-T267 PolarHBondContact O-OG1 3.41Å; K264-K268 WeakPolarHBondContact O-CB 3.39Å; K264-K268 PolarHBondContact O-N 3.41Å; K264-K268 VanDerWaalsContact O-N 3.13Å
265A94.8Very high94.8Very high58 Ų58106 Ų10648%0.47953%0.525SS..Hα-helixtrans-67.6-46.2176.300000111.3L261 Q262 K268 S269L261-A265 PolarHBondContact O-N 2.86Å; Q262-A265 WeakPolarHBondContact O-CA 3.45Å; Q262-A265 WeakPolarHBondContact O-CB 3.43Å; Q262-A265 PolarHBondContact O-N 2.92Å; A265-K268 WeakPolarHBondContact O-CB 3.44Å; A265-K268 PolarHBondContact O-N 2.93Å; A265-S269 PolarHBondContact O-N 2.83Å
266D95.3Very high94.8Very high101 Ų101109.1 Ų109.154%0.5453%0.532SS..Hα-helixtrans-63.7-44.5179.5-67.2-11.7000111.8Q262 W263 K268 S269 R270Q262-D266 PolarHBondContact O-N 2.96Å; W263-D266 PolarHBondContact O-N 3.32Å; D266-K268 VanDerWaalsContact C-N 3.31Å; D266-K268 PolarHBondContact O-N 3.05Å; D266-S269 PolarHBondContact O-N 2.95Å; D266-R270 WeakPolarHBondContact O-CG 3.35Å; D266-R270 PolarHBondContact O-N 2.93Å
267T94Very high94.9Very high46 Ų46108.5 Ų108.528%0.28253%0.531SS..Hα-helixtrans-63.5-37.4176.148.10000112.1W263 K264 L271W263-T267 HydrophobicContact CD2-CG2 4Å; W263-T267 HydrophobicContact CE3-CG2 4.43Å; W263-T267 HydrophobicContact CG-CG2 4.5Å; W263-T267 HydrophobicContact CH2-CG2 4.24Å; W263-T267 HydrophobicContact CZ2-CG2 3.77Å; W263-T267 WeakPolarHBondContact O-CB 3.29Å; W263-T267 VanDerWaalsContact O-CG2 3.28Å; W263-T267 WeakPolarHBondContact O-CG2 3.37Å; W263-T267 PolarHBondContact O-N 3.13Å; W263-T267 PolarHBondContact O-OG1 3.01Å; K264-T267 WeakPolarHBondContact CA-OG1 3.46Å; K264-T267 PolarHBondContact O-OG1 3.41Å; T267-L271 WeakPolarHBondContact O-CB 3.34Å; T267-L271 PolarHBondContact O-N 3.36Å
268K95.6Very high94.9Very high151 Ų151104.9 Ų104.966%0.65752%0.524SS*.Hα-helixtrans-64.6-43.9173.4-173.4-179178.4-174.30111.5K264 A265 D266 L271 V272K264-K268 WeakPolarHBondContact O-CB 3.39Å; K264-K268 PolarHBondContact O-N 3.41Å; K264-K268 VanDerWaalsContact O-N 3.13Å; A265-K268 WeakPolarHBondContact O-CB 3.44Å; A265-K268 PolarHBondContact O-N 2.93Å; D266-K268 VanDerWaalsContact C-N 3.31Å; D266-K268 PolarHBondContact O-N 3.05Å; K268-L271 PolarHBondContact O-N 3.33Å; K268-V272 WeakPolarHBondContact O-CG2 3.37Å; K268-V272 PolarHBondContact O-N 2.94Å; K268-V272 VanDerWaalsContact O-N 3.09Å
269S94.4Very high94.9Very high63 Ų63103.6 Ų103.644%0.44152%0.52SS..Hα-helixtrans-59.3-48.7176.1-164.50000111.2A265 D266 L271 V272 E273A265-S269 PolarHBondContact O-N 2.83Å; D266-S269 PolarHBondContact O-N 2.95Å; S269-L271 VanDerWaalsContact C-N 3.27Å; S269-L271 PolarHBondContact O-N 2.92Å; S269-V272 WeakPolarHBondContact O-CB 3.47Å; S269-V272 PolarHBondContact O-N 2.97Å; S269-V272 VanDerWaalsContact O-N 3.09Å; S269-E273 PolarHBondContact O-N 2.66Å
270R95.8Very high94.9Very high154 Ų154102.6 Ų102.658%0.58151%0.514SS*.Hα-helixtrans-59.1-37.1176.6-73175.961.6-174.1-0.9112.9D266 Q274D266-R270 WeakPolarHBondContact O-CG 3.35Å; D266-R270 PolarHBondContact O-N 2.93Å; R270-Q274 WeakPolarHBondContact O-CB 3.49Å; R270-Q274 VanDerWaalsContact O-CG 3.24Å; R270-Q274 WeakPolarHBondContact O-CG 3.29Å; R270-Q274 PolarHBondContact O-N 3.05Å
271L94.1Very high94.9Very high116 Ų116101.8 Ų101.861%0.60751%0.51SS*.Hα-helixtrans-68.3-36.6177.7-172.3128.4000111.8T267 K268 S269 S275T267-L271 WeakPolarHBondContact O-CB 3.34Å; T267-L271 PolarHBondContact O-N 3.36Å; K268-L271 PolarHBondContact O-N 3.33Å; S269-L271 VanDerWaalsContact C-N 3.27Å; S269-L271 PolarHBondContact O-N 2.92Å; L271-S275 WeakPolarHBondContact O-CB 3.32Å; L271-S275 PolarHBondContact O-N 3.04Å
272V94.5Very high95Very high69 Ų69101.9 Ų101.942%0.41851%0.508SS..Hα-helixtrans-64.9-49.9173.2174.40000110.5K268 S269 Q274 S275 E276K268-V272 WeakPolarHBondContact O-CG2 3.37Å; K268-V272 PolarHBondContact O-N 2.94Å; K268-V272 VanDerWaalsContact O-N 3.09Å; S269-V272 WeakPolarHBondContact O-CB 3.47Å; S269-V272 PolarHBondContact O-N 2.97Å; S269-V272 VanDerWaalsContact O-N 3.09Å; V272-Q274 VanDerWaalsContact C-N 3.3Å; V272-Q274 PolarHBondContact O-N 3.22Å; V272-S275 WeakPolarHBondContact O-CB 3.23Å; V272-S275 PolarHBondContact O-N 2.9Å; V272-E276 WeakPolarHBondContact O-CG 3.48Å; V272-E276 PolarHBondContact O-N 3Å
273E94.6Very high95Very high106 Ų106102.3 Ų102.350%0.49551%0.51SS..Hα-helixtrans-57.4-42176.9-70.6167.5-161.100112.3S269 E276 T277S269-E273 PolarHBondContact O-N 2.66Å; E273-E276 PolarHBondContact O-N 3.45Å; E273-T277 WeakPolarHBondContact O-CB 3.49Å; E273-T277 PolarHBondContact O-N 3.4Å; E273-T277 PolarHBondContact O-OG1 3.38Å
274Q94Very high95Very high112 Ų11299.6 Ų99.652%0.52350%0.502SS..Hα-helixtrans-65.4-39.6175.5-76.8-179.9-18.300112R270 V272 T277 I278R270-Q274 WeakPolarHBondContact O-CB 3.49Å; R270-Q274 VanDerWaalsContact O-CG 3.24Å; R270-Q274 WeakPolarHBondContact O-CG 3.29Å; R270-Q274 PolarHBondContact O-N 3.05Å; V272-Q274 VanDerWaalsContact C-N 3.3Å; V272-Q274 PolarHBondContact O-N 3.22Å; Q274-T277 PolarHBondContact O-N 3.49Å; Q274-I278 WeakPolarHBondContact O-CB 3.49Å; Q274-I278 VanDerWaalsContact O-CG1 3.23Å; Q274-I278 WeakPolarHBondContact O-CG1 3.27Å; Q274-I278 PolarHBondContact O-N 2.99Å
275S94.9Very high94.9Very high57 Ų5798.4 Ų98.440%0.39950%0.5SS..Hα-helixtrans-64.2-40.9176.1-170.40000111.8L271 V272 I278 N279L271-S275 WeakPolarHBondContact O-CB 3.32Å; L271-S275 PolarHBondContact O-N 3.04Å; V272-S275 WeakPolarHBondContact O-CB 3.23Å; V272-S275 PolarHBondContact O-N 2.9Å; S275-I278 PolarHBondContact O-N 3.43Å; S275-N279 PolarHBondContact O-N 3.3Å; S275-N279 PolarHBondContact O-ND2 3.29Å
276E95.2Very high95Very high111 Ų111102.1 Ų102.152%0.51951%0.506SS..Hα-helixtrans-63.7-46.3175.3-70.9173.3173.600111V272 E273 I278 N279 E280V272-E276 WeakPolarHBondContact O-CG 3.48Å; V272-E276 PolarHBondContact O-N 3Å; E273-E276 PolarHBondContact O-N 3.45Å; E276-I278 VanDerWaalsContact C-N 3.31Å; E276-I278 PolarHBondContact O-N 2.93Å; E276-N279 WeakPolarHBondContact O-CB 3.43Å; E276-N279 PolarHBondContact O-N 3.41Å; E276-N279 VanDerWaalsContact O-N 3.13Å; E276-E280 PolarHBondContact O-N 3.41Å
277T95.4Very high95Very high76 Ų76101 Ų10147%0.46650%0.502SS..Hα-helixtrans-59.6-41.3176.1-540000111.9E273 Q274 E280 L281E273-T277 WeakPolarHBondContact O-CB 3.49Å; E273-T277 PolarHBondContact O-N 3.4Å; E273-T277 PolarHBondContact O-OG1 3.38Å; Q274-T277 PolarHBondContact O-N 3.49Å; T277-E280 PolarHBondContact O-N 3.1Å; T277-L281 HydrophobicContact CG2-CD1 4.24Å; T277-L281 WeakPolarHBondContact O-CB 3.24Å; T277-L281 VanDerWaalsContact O-CG 3.3Å; T277-L281 WeakPolarHBondContact O-CG 3.43Å; T277-L281 PolarHBondContact O-N 3.41Å
278I94.4Very high95.1Very high92 Ų92103.9 Ų103.947%0.47252%0.516SS..Hα-helixtrans-63.3-44176.2-72.7165.7000110.5Q274 S275 E276 L281 Q282Q274-I278 WeakPolarHBondContact O-CB 3.49Å; Q274-I278 VanDerWaalsContact O-CG1 3.23Å; Q274-I278 WeakPolarHBondContact O-CG1 3.27Å; Q274-I278 PolarHBondContact O-N 2.99Å; S275-I278 PolarHBondContact O-N 3.43Å; E276-I278 VanDerWaalsContact C-N 3.31Å; E276-I278 PolarHBondContact O-N 2.93Å; I278-L281 PolarHBondContact O-N 3.13Å; I278-Q282 HydrophobicContact CG2-CG 4.41Å; I278-Q282 WeakPolarHBondContact O-CB 3.3Å; I278-Q282 WeakPolarHBondContact O-CG 3.48Å; I278-Q282 PolarHBondContact O-N 3.36Å
279N95Very high95.1Very high83 Ų83101.5 Ų101.544%0.44451%0.507SS..Hα-helixtrans-61.9-45.1178-69.9-21.4000111.3S275 E276 L281 Q282 E283S275-N279 PolarHBondContact O-N 3.3Å; S275-N279 PolarHBondContact O-ND2 3.29Å; E276-N279 WeakPolarHBondContact O-CB 3.43Å; E276-N279 PolarHBondContact O-N 3.41Å; E276-N279 VanDerWaalsContact O-N 3.13Å; N279-L281 VanDerWaalsContact C-N 3.34Å; N279-L281 PolarHBondContact O-N 3Å; N279-Q282 PolarHBondContact O-N 3.45Å; N279-E283 PolarHBondContact O-N 3.39Å
280E95.9Very high95.1Very high107 Ų107102.6 Ų102.650%0.551%0.511SS..Hα-helixtrans-60.2-42.2175.4-72.1-175.1-171.400112.6E276 T277 E283 K284E276-E280 PolarHBondContact O-N 3.41Å; T277-E280 PolarHBondContact O-N 3.1Å; E280-E283 PolarHBondContact O-N 3.07Å; E280-K284 WeakPolarHBondContact O-CG 3.5Å; E280-K284 PolarHBondContact O-N 3.18Å; E280-K284 IonicContact OE2-NZ 2.67Å
281L94.8Very high95.1Very high96 Ų96100.9 Ų100.950%0.50351%0.509SS..Hα-helixtrans-66.2-38.2177-72.9173.4000111.6T277 I278 N279 K284 M285T277-L281 HydrophobicContact CG2-CD1 4.24Å; T277-L281 WeakPolarHBondContact O-CB 3.24Å; T277-L281 VanDerWaalsContact O-CG 3.3Å; T277-L281 WeakPolarHBondContact O-CG 3.43Å; T277-L281 PolarHBondContact O-N 3.41Å; I278-L281 PolarHBondContact O-N 3.13Å; N279-L281 VanDerWaalsContact C-N 3.34Å; N279-L281 PolarHBondContact O-N 3Å; L281-K284 PolarHBondContact O-N 2.94Å; L281-M285 WeakPolarHBondContact O-CG 3.33Å; L281-M285 PolarHBondContact O-N 3.36Å
282Q95.7Very high95.2Very high102 Ų102101.5 Ų101.548%0.47751%0.507SS..Hα-helixtrans-64.8-39.6175.1-75.6178.9-12.200112.2I278 N279 M285 K286I278-Q282 HydrophobicContact CG2-CG 4.41Å; I278-Q282 WeakPolarHBondContact O-CB 3.3Å; I278-Q282 WeakPolarHBondContact O-CG 3.48Å; I278-Q282 PolarHBondContact O-N 3.36Å; N279-Q282 PolarHBondContact O-N 3.45Å; Q282-M285 PolarHBondContact O-N 2.87Å; Q282-K286 WeakPolarHBondContact O-CG 3.35Å; Q282-K286 PolarHBondContact O-N 3.34Å
283E94.8Very high95.2Very high138 Ų138104.8 Ų104.865%0.64551%0.512SS*.Hα-helixtrans-64.4-46.1173.7-72.1-162.6147.500111.6N279 E280 M285 K286 T287N279-E283 PolarHBondContact O-N 3.39Å; E280-E283 PolarHBondContact O-N 3.07Å; E283-M285 VanDerWaalsContact C-N 3.27Å; E283-M285 PolarHBondContact O-N 3.2Å; E283-K286 PolarHBondContact O-N 3.44Å; E283-K286 VanDerWaalsContact O-N 3.13Å; E283-T287 PolarHBondContact O-N 2.9Å; E283-T287 PolarHBondContact O-OG1 2.98Å
284K96Very high95.3Very high112 Ų112105.9 Ų105.949%0.48752%0.515SS..Hα-helixtrans-59.8-36.4174.6-72.9168.9-177.2159.80112.4E280 L281 T287 L288E280-K284 WeakPolarHBondContact O-CG 3.5Å; E280-K284 PolarHBondContact O-N 3.18Å; E280-K284 IonicContact OE2-NZ 2.67Å; L281-K284 PolarHBondContact O-N 2.94Å; K284-T287 WeakPolarHBondContact CA-OG1 3.46Å; K284-T287 PolarHBondContact O-OG1 3.3Å; K284-L288 WeakPolarHBondContact O-CB 3.29Å; K284-L288 VanDerWaalsContact O-CG 3.29Å; K284-L288 WeakPolarHBondContact O-CG 3.37Å; K284-L288 PolarHBondContact O-N 3.35Å; K284-L288 VanDerWaalsContact O-N 3.07Å
285M94.7Very high95.4Very high116 Ų116104.8 Ų104.857%0.57152%0.516SS*.Hα-helixtrans-64.7-45.2174.1-78.1-173.67100111.6L281 Q282 E283 T287 L288 E289L281-M285 WeakPolarHBondContact O-CG 3.33Å; L281-M285 PolarHBondContact O-N 3.36Å; Q282-M285 PolarHBondContact O-N 2.87Å; E283-M285 VanDerWaalsContact C-N 3.27Å; E283-M285 PolarHBondContact O-N 3.2Å; M285-T287 VanDerWaalsContact C-N 3.35Å; M285-T287 PolarHBondContact O-N 3.16Å; M285-L288 PolarHBondContact O-N 2.94Å; M285-E289 WeakPolarHBondContact O-CG 3.4Å; M285-E289 PolarHBondContact O-N 3.24Å
286K95.8Very high95.4Very high136 Ų136106.9 Ų106.959%0.59152%0.519SS*.Hα-helixtrans-61.8-41177.6-72.3174.4-177.5174.20112.2Q282 E283 E289 V290Q282-K286 WeakPolarHBondContact O-CG 3.35Å; Q282-K286 PolarHBondContact O-N 3.34Å; E283-K286 PolarHBondContact O-N 3.44Å; E283-K286 VanDerWaalsContact O-N 3.13Å; K286-E289 PolarHBondContact O-N 3.24Å; K286-V290 WeakPolarHBondContact O-CG2 3.44Å; K286-V290 PolarHBondContact O-N 3.09Å
287T95.6Very high95.4Very high77 Ų77108 Ų10847%0.47253%0.525SS..Hα-helixtrans-65.7-45.7177.757.30000111.3E283 K284 M285 E289 V290 E291E283-T287 PolarHBondContact O-N 2.9Å; E283-T287 PolarHBondContact O-OG1 2.98Å; K284-T287 WeakPolarHBondContact CA-OG1 3.46Å; K284-T287 PolarHBondContact O-OG1 3.3Å; M285-T287 VanDerWaalsContact C-N 3.35Å; M285-T287 PolarHBondContact O-N 3.16Å; T287-E289 VanDerWaalsContact C-N 3.29Å; T287-E289 PolarHBondContact O-N 3.23Å; T287-V290 PolarHBondContact O-N 3.48Å; T287-V290 VanDerWaalsContact O-N 3.1Å; T287-E291 PolarHBondContact O-N 3.44Å
288L95.5Very high95.4Very high107 Ų107109.4 Ų109.456%0.5653%0.526SS*.Hα-helixtrans-61.5-35.1176-73.9171.6000112.6K284 M285 V290 E291 K292K284-L288 WeakPolarHBondContact O-CB 3.29Å; K284-L288 VanDerWaalsContact O-CG 3.29Å; K284-L288 WeakPolarHBondContact O-CG 3.37Å; K284-L288 PolarHBondContact O-N 3.35Å; K284-L288 VanDerWaalsContact O-N 3.07Å; M285-L288 PolarHBondContact O-N 2.94Å; L288-V290 VanDerWaalsContact C-N 3.35Å; L288-E291 PolarHBondContact O-N 2.85Å; L288-K292 VanDerWaalsContact O-CB 3.23Å; L288-K292 WeakPolarHBondContact O-CB 3.23Å; L288-K292 PolarHBondContact O-N 3.45Å
289E95.2Very high95.5Very high102 Ų102109.5 Ų109.548%0.47753%0.527SS..Hα-helixtrans-66.2-33.9174.3-77.2175.9174.300113.2M285 K286 T287 R293M285-E289 WeakPolarHBondContact O-CG 3.4Å; M285-E289 PolarHBondContact O-N 3.24Å; K286-E289 PolarHBondContact O-N 3.24Å; T287-E289 VanDerWaalsContact C-N 3.29Å; T287-E289 PolarHBondContact O-N 3.23Å; E289-R293 WeakPolarHBondContact O-CG 3.42Å; E289-R293 PolarHBondContact O-N 3.41Å; E289-R293 PolarHBondContact O-NE 3.37Å
290V95.8Very high95.5Very high85 Ų85110.4 Ų110.452%0.51553%0.528SS..Hα-helixtrans-71.4-45.6174173.30000110.5K286 T287 L288 K292 R293 K294K286-V290 WeakPolarHBondContact O-CG2 3.44Å; K286-V290 PolarHBondContact O-N 3.09Å; T287-V290 PolarHBondContact O-N 3.48Å; T287-V290 VanDerWaalsContact O-N 3.1Å; L288-V290 VanDerWaalsContact C-N 3.35Å; V290-K292 PolarHBondContact O-N 3.39Å; V290-R293 PolarHBondContact O-N 2.97Å; V290-K294 PolarHBondContact O-N 2.91Å; V290-K294 VanDerWaalsContact O-N 3.09Å
291E95.2Very high95.5Very high119 Ų119109.9 Ų109.956%0.55653%0.526SS*.Hα-helixtrans-61.6-43.3177.1-70.8179.917300111.9T287 L288 R293 K294 V295T287-E291 PolarHBondContact O-N 3.44Å; L288-E291 PolarHBondContact O-N 2.85Å; E291-R293 PolarHBondContact O-N 2.91Å; E291-K294 PolarHBondContact O-N 3.41Å; E291-V295 WeakPolarHBondContact O-CG2 3.48Å; E291-V295 PolarHBondContact O-N 2.99Å
292K96.2Very high95.4Very high128 Ų128108.2 Ų108.256%0.55752%0.523SS*.Hα-helixtrans-56.3-48.6175179.1-176.5167.6-173.90111.5L288 V290 K294 V295 E296L288-K292 VanDerWaalsContact O-CB 3.23Å; L288-K292 WeakPolarHBondContact O-CB 3.23Å; L288-K292 PolarHBondContact O-N 3.45Å; V290-K292 PolarHBondContact O-N 3.39Å; K292-K294 VanDerWaalsContact C-N 3.33Å; K292-K294 PolarHBondContact O-N 3.35Å; K292-V295 PolarHBondContact O-N 3.5Å; K292-E296 WeakPolarHBondContact CE-OE1 3.36Å; K292-E296 HydrophobicContact CG-CG 4.46Å; K292-E296 IonicContact NZ-OE1 3.34Å; K292-E296 WeakPolarHBondContact O-CG 3.49Å; K292-E296 PolarHBondContact O-N 3.06Å
293R95.4Very high95.4Very high139 Ų139108.3 Ų108.353%0.52552%0.521SS..Hα-helixtrans-58.6-44.3177.7-81.8-177.1-79.7177.4-6.8112E289 V290 E291 V295 E296 E297E289-R293 WeakPolarHBondContact O-CG 3.42Å; E289-R293 PolarHBondContact O-N 3.41Å; E289-R293 PolarHBondContact O-NE 3.37Å; V290-R293 PolarHBondContact O-N 2.97Å; E291-R293 PolarHBondContact O-N 2.91Å; R293-V295 VanDerWaalsContact C-N 3.35Å; R293-V295 PolarHBondContact O-N 3.23Å; R293-E296 PolarHBondContact O-N 3.42Å; R293-E297 WeakPolarHBondContact O-CG 3.34Å; R293-E297 PolarHBondContact O-N 2.99Å
294K96.1Very high95.5Very high129 Ų129105.8 Ų105.856%0.56151%0.512SS*.Hα-helixtrans-61.4-41.9177.6-173179.7179.8-178.40112.2V290 E291 K292 E297 Q298V290-K294 PolarHBondContact O-N 2.91Å; V290-K294 VanDerWaalsContact O-N 3.09Å; E291-K294 PolarHBondContact O-N 3.41Å; K292-K294 VanDerWaalsContact C-N 3.33Å; K292-K294 PolarHBondContact O-N 3.35Å; K294-E297 PolarHBondContact O-N 3.34Å; K294-Q298 WeakPolarHBondContact O-CG 3.43Å; K294-Q298 PolarHBondContact O-N 2.96Å
295V95.5Very high95.4Very high89 Ų89107.1 Ų107.154%0.53951%0.514SS..Hα-helixtrans-67.3-39.9176.5173.10000111.2E291 K292 R293 Q298 L299E291-V295 WeakPolarHBondContact O-CG2 3.48Å; E291-V295 PolarHBondContact O-N 2.99Å; K292-V295 PolarHBondContact O-N 3.5Å; R293-V295 VanDerWaalsContact C-N 3.35Å; R293-V295 PolarHBondContact O-N 3.23Å; V295-Q298 PolarHBondContact O-N 2.89Å; V295-L299 WeakPolarHBondContact O-CB 2.91Å; V295-L299 PolarHBondContact O-N 3.39Å
296E95.5Very high95.4Very high100 Ų100104.3 Ų104.347%0.46751%0.51SS..Hα-helixtrans-62.8-41.5176-74.4174.3161.500112K292 R293 L299 Q300K292-E296 WeakPolarHBondContact CE-OE1 3.36Å; K292-E296 HydrophobicContact CG-CG 4.46Å; K292-E296 IonicContact NZ-OE1 3.34Å; K292-E296 WeakPolarHBondContact O-CG 3.49Å; K292-E296 PolarHBondContact O-N 3.06Å; R293-E296 PolarHBondContact O-N 3.42Å; E296-L299 PolarHBondContact O-N 2.91Å; E296-Q300 WeakPolarHBondContact O-CB 3.37Å; E296-Q300 PolarHBondContact O-N 2.67Å
297E95.3Very high95.4Very high136 Ų136102.6 Ų102.664%0.63651%0.507SS*.Hα-helixtrans-62.5-47.4174.1-74171.4-178.900112R293 K294 L299 Q300 E301R293-E297 WeakPolarHBondContact O-CG 3.34Å; R293-E297 PolarHBondContact O-N 2.99Å; K294-E297 PolarHBondContact O-N 3.34Å; E297-L299 VanDerWaalsContact C-N 3.31Å; E297-L299 PolarHBondContact O-N 3.46Å; E297-Q300 PolarHBondContact O-N 3.23Å; E297-E301 PolarHBondContact O-N 3.4Å
298Q95.7Very high95.3Very high104 Ų104101.1 Ų101.149%0.48650%0.502SS..Hα-helixtrans-61.9-38.4176.9-74.2179.7-14.900112.5K294 V295 S302K294-Q298 WeakPolarHBondContact O-CG 3.43Å; K294-Q298 PolarHBondContact O-N 2.96Å; V295-Q298 PolarHBondContact O-N 2.89Å; Q298-S302 WeakPolarHBondContact O-CB 3.43Å; Q298-S302 PolarHBondContact O-N 3.43Å; Q298-S302 PolarHBondContact O-OG 3.42Å
299L95.8Very high95.3Very high95 Ų95101.2 Ų101.250%0.49750%0.503SS..Hα-helixtrans-64.8-42.8175.3179.563.4000111V295 E296 E297 S302 K303V295-L299 WeakPolarHBondContact O-CB 2.91Å; V295-L299 PolarHBondContact O-N 3.39Å; E296-L299 PolarHBondContact O-N 2.91Å; E297-L299 VanDerWaalsContact C-N 3.31Å; E297-L299 PolarHBondContact O-N 3.46Å; L299-S302 PolarHBondContact O-N 2.85Å; L299-K303 WeakPolarHBondContact O-CG 3.45Å; L299-K303 PolarHBondContact O-N 3.3Å
300Q94.7Very high95.3Very high101 Ų101101 Ų10147%0.47250%0.501SS..Hα-helixtrans-65.9-41.9178.2-17258.532.300111.7E296 E297 K303 N304E296-Q300 WeakPolarHBondContact O-CB 3.37Å; E296-Q300 PolarHBondContact O-N 2.67Å; E297-Q300 PolarHBondContact O-N 3.23Å; Q300-K303 PolarHBondContact O-N 3.47Å; Q300-N304 PolarHBondContact NE2-OD1 2.94Å; Q300-N304 VanDerWaalsContact O-CG 3.23Å; Q300-N304 PolarHBondContact O-N 3.35Å; Q300-N304 PolarHBondContact O-OD1 3.34Å
301E95.6Very high95.3Very high96 Ų96103.8 Ų103.845%0.44951%0.507SS..Hα-helixtrans-61.6-45.4175.3-167-174.717600111.5E297 K303 N304 R305E297-E301 PolarHBondContact O-N 3.4Å; E301-K303 VanDerWaalsContact C-N 3.34Å; E301-K303 PolarHBondContact O-N 2.96Å; E301-N304 WeakPolarHBondContact O-CB 3.35Å; E301-N304 PolarHBondContact O-N 3.19Å; E301-N304 VanDerWaalsContact O-N 3.17Å; E301-R305 WeakPolarHBondContact O-CG 3.49Å; E301-R305 PolarHBondContact O-N 3.49Å; E301-R305 IonicContact OE1-CZ 2.81Å; E301-R305 IonicContact OE1-NE 3.22Å; E301-R305 IonicContact OE1-NH2 2.76Å; E301-R305 PolarHBondContact OE1-NH2 2.93Å; E301-R305 IonicContact OE2-NH2 3.41Å; E301-R305 PolarHBondContact OE2-NH2 3.17Å
302S94Very high95.3Very high62 Ų62103.5 Ų103.543%0.43451%0.506SS..Hα-helixtrans-62.2-40.2177.6-60.30000112.2Q298 L299 R305 A306Q298-S302 WeakPolarHBondContact O-CB 3.43Å; Q298-S302 PolarHBondContact O-N 3.43Å; Q298-S302 PolarHBondContact O-OG 3.42Å; L299-S302 PolarHBondContact O-N 2.85Å; S302-R305 PolarHBondContact O-N 3.36Å; S302-A306 WeakPolarHBondContact O-CB 3.39Å; S302-A306 PolarHBondContact O-N 2.98Å
303K96Very high95.2Very high103 Ų103102 Ų10245%0.44850%0.503SS..Hα-helixtrans-62.2-43.3172.9-76.3175.3179.5176.20112L299 Q300 E301 A306 N307L299-K303 WeakPolarHBondContact O-CG 3.45Å; L299-K303 PolarHBondContact O-N 3.3Å; Q300-K303 PolarHBondContact O-N 3.47Å; E301-K303 VanDerWaalsContact C-N 3.34Å; E301-K303 PolarHBondContact O-N 2.96Å; K303-A306 PolarHBondContact O-N 2.97Å; K303-N307 WeakPolarHBondContact O-CB 3.43Å; K303-N307 VanDerWaalsContact O-CG 3.27Å; K303-N307 PolarHBondContact O-N 2.97Å; K303-N307 PolarHBondContact O-ND2 2.93Å
304N95.1Very high95.2Very high86 Ų8699.4 Ų99.446%0.4650%0.499SS..Hα-helixtrans-62.5-43.5177.7-69.4-14000111.3Q300 E301 N307 A308Q300-N304 PolarHBondContact NE2-OD1 2.94Å; Q300-N304 VanDerWaalsContact O-CG 3.23Å; Q300-N304 PolarHBondContact O-N 3.35Å; Q300-N304 PolarHBondContact O-OD1 3.34Å; E301-N304 WeakPolarHBondContact O-CB 3.35Å; E301-N304 PolarHBondContact O-N 3.19Å; E301-N304 VanDerWaalsContact O-N 3.17Å; N304-N307 PolarHBondContact O-N 3.49Å; N304-A308 PolarHBondContact O-N 2.95Å
305R95.6Very high95.1Very high140 Ų14097.9 Ų97.953%0.52850%0.498SS..Hα-helixtrans-62.6-45.1175-67.2-176.6-154.8159.41.9112.1E301 S302 N307 A308 L309E301-R305 WeakPolarHBondContact O-CG 3.49Å; E301-R305 PolarHBondContact O-N 3.49Å; E301-R305 IonicContact OE1-CZ 2.81Å; E301-R305 IonicContact OE1-NE 3.22Å; E301-R305 IonicContact OE1-NH2 2.76Å; E301-R305 PolarHBondContact OE1-NH2 2.93Å; E301-R305 IonicContact OE2-NH2 3.41Å; E301-R305 PolarHBondContact OE2-NH2 3.17Å; S302-R305 PolarHBondContact O-N 3.36Å; R305-N307 VanDerWaalsContact C-N 3.32Å; R305-N307 PolarHBondContact O-N 3.43Å; R305-A308 PolarHBondContact O-N 3.41Å; R305-L309 WeakPolarHBondContact O-CG 3.43Å; R305-L309 PolarHBondContact O-N 3.2Å
306A94.4Very high95Very high57 Ų5797.6 Ų97.647%0.47150%0.499SS..Hα-helixtrans-60.1-42.717700000111.9S302 K303 A308 L309 Q310S302-A306 WeakPolarHBondContact O-CB 3.39Å; S302-A306 PolarHBondContact O-N 2.98Å; K303-A306 PolarHBondContact O-N 2.97Å; A306-A308 PolarHBondContact O-N 3.4Å; A306-L309 PolarHBondContact O-N 3.16Å; A306-Q310 WeakPolarHBondContact O-CB 3.48Å; A306-Q310 PolarHBondContact O-N 3.36Å
307N95Very high94.9Very high100 Ų10095.1 Ų95.154%0.53549%0.49SS..Hα-helixtrans-65-37.1175.8-72.8-23.7000112.7K303 N304 R305 K311K303-N307 WeakPolarHBondContact O-CB 3.43Å; K303-N307 VanDerWaalsContact O-CG 3.27Å; K303-N307 PolarHBondContact O-N 2.97Å; K303-N307 PolarHBondContact O-ND2 2.93Å; N304-N307 PolarHBondContact O-N 3.49Å; R305-N307 VanDerWaalsContact C-N 3.32Å; R305-N307 PolarHBondContact O-N 3.43Å; N307-K311 WeakPolarHBondContact O-CG 3.38Å; N307-K311 PolarHBondContact O-N 3.38Å; N307-K311 VanDerWaalsContact O-N 3.16Å
308A94.8Very high94.8Very high45 Ų4593.9 Ų93.937%0.37248%0.484SS..Hα-helixtrans-65.4-49.6175.700000111.2N304 R305 A306 Q310 K311 E312N304-A308 PolarHBondContact O-N 2.95Å; R305-A308 PolarHBondContact O-N 3.41Å; A306-A308 PolarHBondContact O-N 3.4Å; A308-Q310 VanDerWaalsContact C-N 3.3Å; A308-Q310 PolarHBondContact O-N 3.1Å; A308-K311 WeakPolarHBondContact O-CB 3.38Å; A308-K311 PolarHBondContact O-N 2.99Å; A308-K311 VanDerWaalsContact O-N 3.13Å; A308-E312 PolarHBondContact O-N 3.13Å
309L95.2Very high94.7Very high109 Ų10993.7 Ų93.757%0.57149%0.49SS*.Hα-helixtrans-60.7-37.8176.6-70.6171.8000112.2R305 A306 E312 L313R305-L309 WeakPolarHBondContact O-CG 3.43Å; R305-L309 PolarHBondContact O-N 3.2Å; A306-L309 PolarHBondContact O-N 3.16Å; L309-E312 PolarHBondContact O-N 2.9Å; L309-L313 WeakPolarHBondContact O-CB 3.43Å; L309-L313 PolarHBondContact O-N 3.44Å
310Q95.4Very high94.5Very high97 Ų9795.4 Ų95.445%0.45350%0.496SS..Hα-helixtrans-62.3-43.1175.3-173.962.55700111.5A306 A308 L313 D314A306-Q310 WeakPolarHBondContact O-CB 3.48Å; A306-Q310 PolarHBondContact O-N 3.36Å; A308-Q310 VanDerWaalsContact C-N 3.3Å; A308-Q310 PolarHBondContact O-N 3.1Å; Q310-L313 PolarHBondContact O-N 3.36Å; Q310-D314 PolarHBondContact NE2-OD1 3.29Å; Q310-D314 WeakPolarHBondContact O-CB 3.5Å; Q310-D314 PolarHBondContact O-N 2.86Å
311K94.8Very high94.4Very high145 Ų14599.1 Ų99.163%0.6351%0.505SS*.Hα-helixtrans-64.3-41.9175.8-73.2177.3179.2-178.10112.3N307 A308 L313 D314 N315N307-K311 WeakPolarHBondContact O-CG 3.38Å; N307-K311 PolarHBondContact O-N 3.38Å; N307-K311 VanDerWaalsContact O-N 3.16Å; A308-K311 WeakPolarHBondContact O-CB 3.38Å; A308-K311 PolarHBondContact O-N 2.99Å; A308-K311 VanDerWaalsContact O-N 3.13Å; K311-L313 VanDerWaalsContact C-N 3.32Å; K311-D314 PolarHBondContact O-N 3.27Å; K311-N315 WeakPolarHBondContact O-CB 3.27Å; K311-N315 PolarHBondContact O-N 2.97Å; K311-N315 PolarHBondContact O-ND2 3.44Å
312E94.8Very high94.3Very high113 Ų11398.4 Ų98.453%0.52851%0.505SS..Hα-helixtrans-62.3-41.2175.7-72.7176.1-170.500111.6A308 L309 N315 C316A308-E312 PolarHBondContact O-N 3.13Å; L309-E312 PolarHBondContact O-N 2.9Å; E312-N315 PolarHBondContact O-N 2.94Å; E312-C316 WeakPolarHBondContact O-CB 3.48Å; E312-C316 PolarHBondContact O-N 3.39Å; E312-C316 PolarHBondContact O-SG 3.46Å
313L94.7Very high94.2Very high95 Ų95102.7 Ų102.750%0.49752%0.516SS..Hα-helixtrans-63.9-46.9175.3-179.162.5000111.4L309 Q310 K311 N315 C316 V317L309-L313 WeakPolarHBondContact O-CB 3.43Å; L309-L313 PolarHBondContact O-N 3.44Å; Q310-L313 PolarHBondContact O-N 3.36Å; K311-L313 VanDerWaalsContact C-N 3.32Å; L313-N315 VanDerWaalsContact C-N 3.29Å; L313-N315 PolarHBondContact O-N 3.19Å; L313-C316 PolarHBondContact O-N 2.97Å; L313-V317 HydrophobicContact CD1-CG2 4.2Å; L313-V317 HydrophobicContact CG-CG2 4.4Å; L313-V317 WeakPolarHBondContact O-CB 3.36Å; L313-V317 VanDerWaalsContact O-CG2 3.27Å; L313-V317 WeakPolarHBondContact O-CG2 3.45Å; L313-V317 PolarHBondContact O-N 2.91Å
314D94.5Very high94Very high85 Ų85100.9 Ų100.946%0.45551%0.513SS..Hα-helixtrans-59.6-42.2178.3-68.5-17.4000111Q310 K311 V317 Q318Q310-D314 PolarHBondContact NE2-OD1 3.29Å; Q310-D314 WeakPolarHBondContact O-CB 3.5Å; Q310-D314 PolarHBondContact O-N 2.86Å; K311-D314 PolarHBondContact O-N 3.27Å; D314-V317 PolarHBondContact O-N 3.14Å; D314-Q318 WeakPolarHBondContact O-CB 3.38Å; D314-Q318 PolarHBondContact O-N 2.86Å
315N94.1Very high93.8Very high98 Ų98102.7 Ų102.752%0.52452%0.518SS..Hα-helixtrans-62.1-48174.2-72.1-16.5000111.7K311 E312 L313 V317 Q318 V319K311-N315 WeakPolarHBondContact O-CB 3.27Å; K311-N315 PolarHBondContact O-N 2.97Å; K311-N315 PolarHBondContact O-ND2 3.44Å; E312-N315 PolarHBondContact O-N 2.94Å; L313-N315 VanDerWaalsContact C-N 3.29Å; L313-N315 PolarHBondContact O-N 3.19Å; N315-V317 VanDerWaalsContact C-N 3.34Å; N315-V317 PolarHBondContact O-N 2.92Å; N315-Q318 PolarHBondContact O-N 3.23Å; N315-V319 WeakPolarHBondContact O-CG2 3.45Å; N315-V319 PolarHBondContact O-N 3.44Å
316C93.1Very high93.5Very high83 Ų83101.7 Ų101.756%0.56152%0.523SS*.Hα-helixtrans-59.8-44177.8-69.20000111.9E312 L313 Q318 V319 Q320E312-C316 WeakPolarHBondContact O-CB 3.48Å; E312-C316 PolarHBondContact O-N 3.39Å; E312-C316 PolarHBondContact O-SG 3.46Å; L313-C316 PolarHBondContact O-N 2.97Å; C316-Q318 VanDerWaalsContact C-N 3.33Å; C316-Q318 PolarHBondContact O-N 3.34Å; C316-V319 PolarHBondContact O-N 3.1Å; C316-Q320 WeakPolarHBondContact O-CB 3.41Å; C316-Q320 PolarHBondContact O-N 2.9Å
317V94.8Very high93.2Very high47 Ų47100.8 Ų100.829%0.28551%0.513SS..Hα-helixtrans-63.6-40.6177.3170.10000110.8L313 D314 N315 Q320 R321L313-V317 HydrophobicContact CD1-CG2 4.2Å; L313-V317 HydrophobicContact CG-CG2 4.4Å; L313-V317 WeakPolarHBondContact O-CB 3.36Å; L313-V317 VanDerWaalsContact O-CG2 3.27Å; L313-V317 WeakPolarHBondContact O-CG2 3.45Å; L313-V317 PolarHBondContact O-N 2.91Å; D314-V317 PolarHBondContact O-N 3.14Å; N315-V317 VanDerWaalsContact C-N 3.34Å; N315-V317 PolarHBondContact O-N 2.92Å; V317-Q320 PolarHBondContact O-N 3.38Å; V317-R321 WeakPolarHBondContact O-CG 3.46Å; V317-R321 PolarHBondContact O-N 2.89Å
318Q92.8Very high92.9Very high110 Ų110101.1 Ų101.151%0.51451%0.512SS..Hα-helixtrans-63.7-48.6176.1-175.2178.4-21.900111.5D314 N315 C316 Q320 R321 D322D314-Q318 WeakPolarHBondContact O-CB 3.38Å; D314-Q318 PolarHBondContact O-N 2.86Å; N315-Q318 PolarHBondContact O-N 3.23Å; C316-Q318 VanDerWaalsContact C-N 3.33Å; C316-Q318 PolarHBondContact O-N 3.34Å; Q318-Q320 VanDerWaalsContact C-N 3.25Å; Q318-Q320 PolarHBondContact O-N 2.89Å; Q318-R321 WeakPolarHBondContact O-CB 3.39Å; Q318-R321 PolarHBondContact O-N 3.37Å; Q318-R321 VanDerWaalsContact O-N 3.1Å; Q318-D322 PolarHBondContact O-N 2.9Å
319V93.7Very high92.5Very high100 Ų100101.4 Ų101.461%0.60651%0.511SS*.Hα-helixtrans-57.5-40.8176.4171.30000111.1N315 C316 D322 F323N315-V319 WeakPolarHBondContact O-CG2 3.45Å; N315-V319 PolarHBondContact O-N 3.44Å; C316-V319 PolarHBondContact O-N 3.1Å; V319-D322 PolarHBondContact O-N 3.3Å; V319-F323 WeakPolarHBondContact O-CB 3.48Å; V319-F323 PolarHBondContact O-N 3.4Å
320Q91.9Very high92.2Very high132 Ų132100.9 Ų100.962%0.61751%0.508SS*.Hα-helixtrans-65.3-41.7176.8-168.217823.700112.2C316 V317 Q318 D322 F323 V324C316-Q320 WeakPolarHBondContact O-CB 3.41Å; C316-Q320 PolarHBondContact O-N 2.9Å; V317-Q320 PolarHBondContact O-N 3.38Å; Q318-Q320 VanDerWaalsContact C-N 3.25Å; Q318-Q320 PolarHBondContact O-N 2.89Å; Q320-D322 VanDerWaalsContact C-N 3.35Å; Q320-F323 PolarHBondContact O-N 2.96Å; Q320-V324 WeakPolarHBondContact O-CG2 3.5Å; Q320-V324 PolarHBondContact O-N 3.49Å
321R92.5Very high91.6Very high178 Ų178102.5 Ų102.567%0.67252%0.516SS*.Hα-helixtrans-61.6-44.2174.4-74177-173.4159.44.3111.4V317 Q318 F323 V324 H325V317-R321 WeakPolarHBondContact O-CG 3.46Å; V317-R321 PolarHBondContact O-N 2.89Å; Q318-R321 WeakPolarHBondContact O-CB 3.39Å; Q318-R321 PolarHBondContact O-N 3.37Å; Q318-R321 VanDerWaalsContact O-N 3.1Å; R321-F323 VanDerWaalsContact C-N 3.34Å; R321-F323 PolarHBondContact O-N 2.92Å; R321-V324 PolarHBondContact O-N 3.5Å; R321-H325 WeakPolarHBondContact O-CB 3.37Å; R321-H325 PolarHBondContact O-N 2.98Å
322D92.2Very high91.1Very high82 Ų8299.3 Ų99.344%0.43951%0.508SS..Hα-helixtrans-63.4-41.6178.2-69-17.9000110.9Q318 V319 Q320 H325 L326Q318-D322 PolarHBondContact O-N 2.9Å; V319-D322 PolarHBondContact O-N 3.3Å; Q320-D322 VanDerWaalsContact C-N 3.35Å; D322-H325 PolarHBondContact O-N 3.4Å; D322-L326 WeakPolarHBondContact O-CB 3.34Å; D322-L326 WeakPolarHBondContact O-CD1 3.34Å; D322-L326 PolarHBondContact O-N 3.44Å
323F92.3Very high90.4Very high151 Ų15199.2 Ų99.266%0.66251%0.508SS*.Hα-helixtrans-62.1-44.4174.8-176.3-95.4000112.5V319 Q320 R321 L326 S327V319-F323 WeakPolarHBondContact O-CB 3.48Å; V319-F323 PolarHBondContact O-N 3.4Å; Q320-F323 PolarHBondContact O-N 2.96Å; R321-F323 VanDerWaalsContact C-N 3.34Å; R321-F323 PolarHBondContact O-N 2.92Å; F323-L326 PolarHBondContact O-N 2.87Å; F323-S327 VanDerWaalsContact O-CB 3.29Å; F323-S327 WeakPolarHBondContact O-CB 3.29Å; F323-S327 PolarHBondContact O-N 2.83Å; F323-S327 PolarHBondContact O-OG 3.28Å
324V92.4Very high89.6Confident65 Ų6599 Ų9939%0.39451%0.507SS..Hα-helixtrans-61.9-45.1175.2172.40000110.5Q320 R321 S327 Q328Q320-V324 WeakPolarHBondContact O-CG2 3.5Å; Q320-V324 PolarHBondContact O-N 3.49Å; R321-V324 PolarHBondContact O-N 3.5Å; V324-S327 WeakPolarHBondContact CA-OG 3.45Å; V324-S327 PolarHBondContact O-N 3.37Å; V324-S327 PolarHBondContact O-OG 3.31Å; V324-Q328 WeakPolarHBondContact O-CB 3.41Å; V324-Q328 VanDerWaalsContact O-CG 3.29Å; V324-Q328 WeakPolarHBondContact O-CG 3.43Å; V324-Q328 PolarHBondContact O-N 2.82Å
325H90.1Very high88.9Confident124 Ų12499.2 Ų99.257%0.57451%0.505SS*.Hα-helixtrans-64.5-45178.8-176.7-92.7000112.5R321 D322 Q328 S329R321-H325 WeakPolarHBondContact O-CB 3.37Å; R321-H325 PolarHBondContact O-N 2.98Å; D322-H325 PolarHBondContact O-N 3.4Å; H325-Q328 PolarHBondContact O-N 2.89Å; H325-S329 WeakPolarHBondContact O-CB 3.46Å; H325-S329 PolarHBondContact O-N 3.3Å
326L90.5Very high88Confident119 Ų119101.1 Ų101.162%0.62351%0.509SS*.Hα-helixtrans-63.7-43.9176.3-100.374.9000111.6D322 F323 S329 L330D322-L326 WeakPolarHBondContact O-CB 3.34Å; D322-L326 WeakPolarHBondContact O-CD1 3.34Å; D322-L326 PolarHBondContact O-N 3.44Å; F323-L326 PolarHBondContact O-N 2.87Å; L326-S329 PolarHBondContact O-N 2.97Å; L326-L330 WeakPolarHBondContact O-CB 3.32Å; L326-L330 PolarHBondContact O-N 3.31Å
327S87.6Confident87Confident38 Ų38101.3 Ų101.327%0.26650%0.503SS..Hα-helixtrans-64.1-41.3179.462.50000111.9F323 V324 L330 Q331F323-S327 VanDerWaalsContact O-CB 3.29Å; F323-S327 WeakPolarHBondContact O-CB 3.29Å; F323-S327 PolarHBondContact O-N 2.83Å; F323-S327 PolarHBondContact O-OG 3.28Å; V324-S327 WeakPolarHBondContact CA-OG 3.45Å; V324-S327 PolarHBondContact O-N 3.37Å; V324-S327 PolarHBondContact O-OG 3.31Å; S327-L330 PolarHBondContact O-N 3.49Å; S327-Q331 VanDerWaalsContact O-CG 3.3Å; S327-Q331 WeakPolarHBondContact O-CG 3.42Å; S327-Q331 PolarHBondContact O-N 2.99Å
328Q88.4Confident85.8Confident107 Ų107107.4 Ų107.450%0.552%0.521SS..Hα-helixtrans-63.8-44.6172.4-72.5175.74.300111.8V324 H325 L330 Q331 V332V324-Q328 WeakPolarHBondContact O-CB 3.41Å; V324-Q328 VanDerWaalsContact O-CG 3.29Å; V324-Q328 WeakPolarHBondContact O-CG 3.43Å; V324-Q328 PolarHBondContact O-N 2.82Å; H325-Q328 PolarHBondContact O-N 2.89Å; Q328-L330 VanDerWaalsContact C-N 3.32Å; Q328-L330 PolarHBondContact O-N 2.88Å; Q328-Q331 PolarHBondContact O-N 3.49Å; Q328-V332 WeakPolarHBondContact O-CG2 3.29Å; Q328-V332 PolarHBondContact O-N 3.44Å
329S87.6Confident84.5Confident51 Ų51108.2 Ų108.236%0.35753%0.525SS..Hα-helixtrans-60.1-43.3177.1-166.80000111.6H325 L326 V332 Q333H325-S329 WeakPolarHBondContact O-CB 3.46Å; H325-S329 PolarHBondContact O-N 3.3Å; L326-S329 PolarHBondContact O-N 2.97Å; S329-V332 PolarHBondContact O-N 2.9Å; S329-Q333 WeakPolarHBondContact O-CG 3.44Å; S329-Q333 PolarHBondContact O-N 2.96Å
330L87.3Confident83.1Confident99 Ų99106.2 Ų106.252%0.51852%0.515SS..Hα-helixtrans-62.7-44175.2-175.968.1000111.5L326 S327 Q328 V332 Q333 L334L326-L330 WeakPolarHBondContact O-CB 3.32Å; L326-L330 PolarHBondContact O-N 3.31Å; S327-L330 PolarHBondContact O-N 3.49Å; Q328-L330 VanDerWaalsContact C-N 3.32Å; Q328-L330 PolarHBondContact O-N 2.88Å; L330-V332 VanDerWaalsContact C-N 3.34Å; L330-V332 PolarHBondContact O-N 2.81Å; L330-Q333 PolarHBondContact O-N 3.1Å; L330-L334 HydrophobicContact CD1-CG 4.48Å; L330-L334 HydrophobicContact CG-CD1 4.04Å; L330-L334 HydrophobicContact CG-CG 4.39Å; L330-L334 WeakPolarHBondContact O-CB 3.48Å; L330-L334 VanDerWaalsContact O-CG 3.28Å; L330-L334 WeakPolarHBondContact O-CG 3.16Å; L330-L334 PolarHBondContact O-N 2.84Å
331Q82.8Confident81.3Confident130 Ų130104.5 Ų104.561%0.60751%0.507SS*.Hα-helixtrans-59.6-44.1175.8-75.4173.2800111.7S327 Q328 Q333 L334 E335S327-Q331 VanDerWaalsContact O-CG 3.3Å; S327-Q331 WeakPolarHBondContact O-CG 3.42Å; S327-Q331 PolarHBondContact O-N 2.99Å; Q328-Q331 PolarHBondContact O-N 3.49Å; Q331-Q333 PolarHBondContact O-N 2.85Å; Q331-L334 PolarHBondContact O-N 3.05Å; Q331-E335 WeakPolarHBondContact O-CB 3.35Å; Q331-E335 PolarHBondContact O-N 2.92Å
332V85Confident79.6Confident79 Ų79104.6 Ų104.648%0.47952%0.515SS..Hα-helixtrans-63.1-41.9175.6172.30000111.3Q328 S329 L330 E335 K336Q328-V332 WeakPolarHBondContact O-CG2 3.29Å; Q328-V332 PolarHBondContact O-N 3.44Å; S329-V332 PolarHBondContact O-N 2.9Å; L330-V332 VanDerWaalsContact C-N 3.34Å; L330-V332 PolarHBondContact O-N 2.81Å; V332-E335 PolarHBondContact O-N 2.88Å; V332-K336 HydrophobicContact CG1-CD 4.45Å; V332-K336 WeakPolarHBondContact O-CG 3.38Å; V332-K336 PolarHBondContact O-N 3.29Å
333Q80.7Confident77.9Confident110 Ų110108.5 Ų108.551%0.51453%0.531SS..Hα-helixtrans-66.2-42.1177.3-74.2-178.52.500112.3S329 L330 Q331 E335 K336 I337S329-Q333 WeakPolarHBondContact O-CG 3.44Å; S329-Q333 PolarHBondContact O-N 2.96Å; L330-Q333 PolarHBondContact O-N 3.1Å; Q331-Q333 PolarHBondContact O-N 2.85Å; Q333-E335 VanDerWaalsContact C-N 3.34Å; Q333-K336 WeakPolarHBondContact O-CB 3.26Å; Q333-K336 PolarHBondContact O-N 3.09Å; Q333-I337 WeakPolarHBondContact O-CG1 3.34Å; Q333-I337 PolarHBondContact O-N 3.09Å
334L78.5Confident76.2Confident91 Ų91105.1 Ų105.148%0.47652%0.522SS..Hα-helixtrans-62.6-41.9175.9-73.5170.7000111.3L330 Q331 I337 R338L330-L334 HydrophobicContact CD1-CG 4.48Å; L330-L334 HydrophobicContact CG-CD1 4.04Å; L330-L334 HydrophobicContact CG-CG 4.39Å; L330-L334 WeakPolarHBondContact O-CB 3.48Å; L330-L334 VanDerWaalsContact O-CG 3.28Å; L330-L334 WeakPolarHBondContact O-CG 3.16Å; L330-L334 PolarHBondContact O-N 2.84Å; Q331-L334 PolarHBondContact O-N 3.05Å; L334-I337 PolarHBondContact O-N 2.97Å; L334-R338 WeakPolarHBondContact O-CG 3.4Å; L334-R338 PolarHBondContact O-N 3.49Å
335E77.8Confident75Confident90 Ų90110.2 Ų110.242%0.42154%0.535SS..Hα-helixtrans-65.5-40.1176.9-168.358-154.800111.7Q331 V332 Q333 I337 R338 Q339Q331-E335 WeakPolarHBondContact O-CB 3.35Å; Q331-E335 PolarHBondContact O-N 2.92Å; V332-E335 PolarHBondContact O-N 2.88Å; Q333-E335 VanDerWaalsContact C-N 3.34Å; E335-I337 VanDerWaalsContact C-N 3.32Å; E335-I337 PolarHBondContact O-N 3.33Å; E335-R338 PolarHBondContact O-N 3.22Å; E335-Q339 WeakPolarHBondContact O-CG 3.28Å; E335-Q339 PolarHBondContact O-N 3.33Å
336K76.4Confident74.7Confident137 Ų137109.8 Ų109.860%0.59653%0.528SS*.Hα-helixtrans-59.4-41.2171.3-76.1177.1-180-178.50112.3V332 Q333 S340V332-K336 HydrophobicContact CG1-CD 4.45Å; V332-K336 WeakPolarHBondContact O-CG 3.38Å; V332-K336 PolarHBondContact O-N 3.29Å; Q333-K336 WeakPolarHBondContact O-CB 3.26Å; Q333-K336 PolarHBondContact O-N 3.09Å; K336-S340 PolarHBondContact O-N 3.17Å
337I71.6Confident74.5Confident88 Ų88105.8 Ų105.845%0.45151%0.506SS..Hα-helixtrans-65.4-46.4177-68165.7000110.1Q333 L334 E335 Q339 S340 E341Q333-I337 WeakPolarHBondContact O-CG1 3.34Å; Q333-I337 PolarHBondContact O-N 3.09Å; L334-I337 PolarHBondContact O-N 2.97Å; E335-I337 VanDerWaalsContact C-N 3.32Å; E335-I337 PolarHBondContact O-N 3.33Å; I337-Q339 VanDerWaalsContact C-N 3.33Å; I337-Q339 PolarHBondContact O-N 3.23Å; I337-S340 CarbonylContact O-C 3.36Å; I337-S340 WeakPolarHBondContact O-CA 3.42Å; I337-S340 WeakPolarHBondContact O-CB 3.3Å; I337-S340 PolarHBondContact O-N 3.45Å; I337-S340 PolarHBondContact O-OG 3.43Å; I337-E341 PolarHBondContact O-N 2.92Å
338R69Low74.4Confident175 Ų175108.3 Ų108.366%0.6651%0.514SS*.Hα-helixtrans-60-41.2177.9-73.5-179.5115.4-173.33.6112.6L334 E335 S340 E341L334-R338 WeakPolarHBondContact O-CG 3.4Å; L334-R338 PolarHBondContact O-N 3.49Å; E335-R338 PolarHBondContact O-N 3.22Å; R338-S340 VanDerWaalsContact C-N 3.31Å; R338-S340 PolarHBondContact O-N 2.95Å; R338-E341 PolarHBondContact O-N 3.44Å
339Q67.1Low74.3Confident126 Ų126108.2 Ų108.259%0.58951%0.513SS*.Hα-helixtrans-64.6-36.8174.8-70.8174.47.700111.6E335 I337 E341 H342E335-Q339 WeakPolarHBondContact O-CG 3.28Å; E335-Q339 PolarHBondContact O-N 3.33Å; I337-Q339 VanDerWaalsContact C-N 3.33Å; I337-Q339 PolarHBondContact O-N 3.23Å; Q339-E341 VanDerWaalsContact C-N 3.35Å; Q339-E341 PolarHBondContact O-N 3.22Å; Q339-H342 PolarHBondContact O-N 3.28Å
340S63.2Low74.1Confident58 Ų58113.8 Ų113.841%0.40653%0.533SS..Hα-helixtrans-71.3-24.8176.178.50000114.2K336 I337 R338 H342 E343K336-S340 PolarHBondContact O-N 3.17Å; I337-S340 CarbonylContact O-C 3.36Å; I337-S340 WeakPolarHBondContact O-CA 3.42Å; I337-S340 WeakPolarHBondContact O-CB 3.3Å; I337-S340 PolarHBondContact O-N 3.45Å; I337-S340 PolarHBondContact O-OG 3.43Å; R338-S340 VanDerWaalsContact C-N 3.31Å; R338-S340 PolarHBondContact O-N 2.95Å; S340-H342 VanDerWaalsContact C-N 3.29Å; S340-E343 PolarHBondContact O-N 3.45Å
341E55.5Low74Confident96 Ų96114.5 Ų114.545%0.44954%0.538SS..Hα-helixtrans-74.7-18.5175.3-77.8-174155.400112.9I337 R338 Q339 E343 V344I337-E341 PolarHBondContact O-N 2.92Å; R338-E341 PolarHBondContact O-N 3.44Å; Q339-E341 VanDerWaalsContact C-N 3.35Å; Q339-E341 PolarHBondContact O-N 3.22Å; E341-E343 PolarHBondContact O-N 3.19Å; E341-V344 WeakPolarHBondContact O-CG2 3.44Å
342H56.1Low74.3Confident181 Ų181108.3 Ų108.384%0.83851%0.509SS*.THydrogen-bonded Turntrans-77.7-5.6175.8-136.1-63.6000113.3Q339 S340Q339-H342 PolarHBondContact O-N 3.28Å; S340-H342 VanDerWaalsContact C-N 3.29Å
343E55.6Low74.5Confident163 Ų163110.5 Ų110.576%0.76252%0.517SS*.THydrogen-bonded Turntrans-112.636.4-176.4-145.7175.1-147.500111.6S340 E341 R345S340-E343 PolarHBondContact O-N 3.45Å; E341-E343 PolarHBondContact O-N 3.19Å; E343-R345 PolarHBondContact O-N 3.43Å
344V57.8Low75Confident81 Ų81107.4 Ų107.449%0.49151%0.506SS..  trans-69.378.2172.91800000109.2E341E341-V344 WeakPolarHBondContact O-CG2 3.44Å
345R67.4Low75.6Confident172 Ų172103 Ų10365%0.64948%0.483SS*.  trans-79.5121.2164.1-172.6-179.1172.195.14.7107.2E343 E347 E348E343-R345 PolarHBondContact O-N 3.43Å; R345-E347 PolarHBondContact O-N 3.14Å; R345-E348 IonicContact CZ-OE1 3.86Å; R345-E348 IonicContact NH2-OE1 2.79Å; R345-E348 PolarHBondContact NH2-OE1 2.95Å
346W83.2Confident76.3Confident115 Ų115103 Ų10344%0.43648%0.479SS..  trans-56.7114.4168.1-168.7-90000108E348 H370W346-E348 PolarHBondContact O-N 3.39Å; W346-H370 AromaticContact CD1-CD2 3.94Å; W346-H370 AromaticContact CD1-NE2 3.84Å; W346-H370 AromaticContact CE2-CD2 3.36Å; W346-H370 AromaticContact CE2-CG 3.6Å; W346-H370 AromaticContact CE2-NE2 3.8Å; W346-H370 HydrophobicContact CH2-CB 3.43Å; W346-H370 VanDerWaalsContact CH2-CB 3.43Å; W346-H370 AromaticContact CH2-CG 3.92Å; W346-H370 HydrophobicContact CZ2-CB 3.32Å; W346-H370 AromaticContact CZ2-CD2 3.57Å; W346-H370 AromaticContact CZ2-CG 3.26Å; W346-H370 AromaticContact CZ2-ND1 3.79Å; W346-H370 HydrophobicContact CZ3-CB 4.28Å; W346-H370 AromaticContact NE1-CD2 3.33Å; W346-H370 PolarHBondContact NE1-CD2 2.97Å; W346-H370 VanDerWaalsContact NE1-CD2 3.33Å; W346-H370 AromaticContact NE1-CE1 3.75Å; W346-H370 AromaticContact NE1-CG 3.84Å; W346-H370 AromaticContact NE1-NE2 3.26Å; W346-H370 PolarHBondContact NE1-NE2 3.06Å
347E86.8Confident76.9Confident34 Ų3498.3 Ų98.316%0.15947%0.47CS..  trans-66.9130.1-177.1-75-173.7149.400108.9R345 V352 R356 H370 G375 R376 I377R345-E347 PolarHBondContact O-N 3.14Å; E347-V352 HydrophobicContact CB-CG2 3.96Å; E347-V352 HydrophobicContact CG-CG2 4.36Å; E347-R356 IonicContact OE1-CZ 3.99Å; E347-R356 IonicContact OE1-NE 2.72Å; E347-R356 PolarHBondContact OE1-NE 2.99Å; E347-R356 IonicContact OE1-NH2 3.66Å; E347-R356 PolarHBondContact OE1-NH2 3.27Å; E347-R356 IonicContact OE2-NE 3.96Å; E347-R356 PolarHBondContact OE2-NE 3.43Å; E347-H370 PolarHBondContact O-CD2 3.32Å; E347-H370 PolarHBondContact O-NE2 2.82Å; E347-G375 PolarHBondContact N-O 2.96Å; E347-R376 WeakPolarHBondContact OE2-CA 3.32Å; E347-I377 HydrophobicContact CB-CD1 4.12Å; E347-I377 HydrophobicContact CB-CG1 3.92Å; E347-I377 PolarHBondContact OE2-N 3.48Å
348E84.5Confident77.8Confident92 Ų9296.7 Ų96.743%0.4347%0.466SS..  trans-74.7138.7174.8-69.9171.1-139.700108.8R345 W346 E350 D351R345-E348 IonicContact CZ-OE1 3.86Å; R345-E348 IonicContact NH2-OE1 2.79Å; R345-E348 PolarHBondContact NH2-OE1 2.95Å; W346-E348 PolarHBondContact O-N 3.39Å; E348-E350 PolarHBondContact O-N 3.48Å; E348-E350 VanDerWaalsContact O-N 3.12Å; E348-D351 PolarHBondContact O-N 2.94Å
349E86.2Confident78.9Confident104 Ų10494.9 Ų94.949%0.48646%0.463SS..G310 helixtrans-59.9-28.8-174.9-68.6-170.3-178.200112D351 K368 H370 I377E349-D351 VanDerWaalsContact C-N 3.34Å; E349-D351 PolarHBondContact O-N 2.85Å; E349-K368 HydrophobicContact CB-CD 4.09Å; E349-K368 HydrophobicContact CG-CB 4.49Å; E349-K368 WeakPolarHBondContact O-CD 3.33Å; E349-K368 PolarHBondContact O-NZ 3.32Å; E349-H370 IonicContact OE1-CE1 3.68Å; E349-I377 HydrophobicContact CB-CD1 4.39Å; E349-I377 HydrophobicContact CG-CD1 4.09Å
350E83.4Confident80Confident168 Ų16894 Ų9479%0.78546%0.458SS*.G310 helixtrans-66.9-33.4-178-61.1-178.4-174.300112.4E348 V352E348-E350 PolarHBondContact O-N 3.48Å; E348-E350 VanDerWaalsContact O-N 3.12Å; E350-V352 PolarHBondContact O-N 3.19Å
351D86.6Confident81.2Confident114 Ų11495.7 Ų95.761%0.6147%0.466SS*.G310 helixtrans-84.6-9.8-173.4-65.8-30.7000114.2E348 E349E348-D351 PolarHBondContact O-N 2.94Å; E349-D351 VanDerWaalsContact C-N 3.34Å; E349-D351 PolarHBondContact O-N 2.85Å
352V87.4Confident82.9Confident0 Ų092.2 Ų92.20%045%0.449CS..  trans-109.5108.3-173.6-167.50000111.6E347 E350 V354 F362 K368 I377E347-V352 HydrophobicContact CB-CG2 3.96Å; E347-V352 HydrophobicContact CG-CG2 4.36Å; E350-V352 PolarHBondContact O-N 3.19Å; V352-V354 WeakPolarHBondContact CG1-O 3.43Å; V352-F362 HydrophobicContact CG1-CD2 4.35Å; V352-F362 HydrophobicContact CG1-CE2 3.8Å; V352-K368 WeakPolarHBondContact O-CE 3.38Å; V352-K368 PolarHBondContact O-NZ 2.98Å; V352-I377 HydrophobicContact CB-CB 4.25Å; V352-I377 HydrophobicContact CB-CD1 3.97Å; V352-I377 HydrophobicContact CB-CG1 4.5Å; V352-I377 HydrophobicContact CG1-CB 4.11Å; V352-I377 HydrophobicContact CG2-CB 4.23Å; V352-I377 HydrophobicContact CG2-CD1 3.67Å; V352-I377 HydrophobicContact CG2-CG1 4.1Å
353L90Very high84.3Confident125 Ų12587.6 Ų87.665%0.65443%0.431SS*.  trans-89.9-22178.1-59.2178.1000113.5V361 F362L353-V361 WeakPolarHBondContact O-CA 3.15Å; L353-F362 PolarHBondContact O-N 3.31Å
354V92Very high85.7Confident45 Ų4592 Ų9227%0.27344%0.441SS..BIsolated β-bridgetrans-132.3144.3-173.8-64.90000112V352 R356 Q360 V361 F362V352-V354 WeakPolarHBondContact CG1-O 3.43Å; V354-R356 PolarHBondContact O-N 3.36Å; V354-Q360 CarbonylContact C-O 3.59Å; V354-Q360 WeakPolarHBondContact CA-O 3.4Å; V354-V361 HydrophobicContact CG1-CG2 4.03Å; V354-F362 WeakPolarHBondContact O-CE2 3.32Å
355C91.2Very high87Confident0 Ų096.6 Ų96.60%046%0.457CS..  trans-59.6126.6173.5168.70000110.9G357 K359 Q360 F362 C379 C382C355-G357 PolarHBondContact O-N 2.99Å; C355-G357 VanDerWaalsContact O-N 3.17Å; C355-G357 PolarHBondContact SG-N 3.36Å; C355-G357 VanDerWaalsContact SG-N 3.45Å; C355-K359 WeakPolarHBondContact O-CA 3.48Å; C355-K359 PolarHBondContact O-N 2.89Å; C355-Q360 PolarHBondContact N-O 2.9Å; C355-F362 VanDerWaalsContact CA-CZ 3.46Å; C355-F362 HydrophobicContact CB-CE1 4.17Å; C355-F362 HydrophobicContact CB-CE2 4.43Å; C355-F362 HydrophobicContact CB-CZ 3.84Å; C355-C379 HydrophobicContact CB-CB 4.15Å; C355-C379 PolarHBondContact SG-N 3.26Å; C355-C382 VanDerWaalsContact SG-SG 3.64Å
356R91.1Very high88Confident88 Ų8892.4 Ų92.433%0.33244%0.441SS..THydrogen-bonded Turntrans-63.8-23.4-178.3-66.1-64.7-170-142.54.1114.1E347 V354 K359 R376 I377 F378E347-R356 IonicContact OE1-CZ 3.99Å; E347-R356 IonicContact OE1-NE 2.72Å; E347-R356 PolarHBondContact OE1-NE 2.99Å; E347-R356 IonicContact OE1-NH2 3.66Å; E347-R356 PolarHBondContact OE1-NH2 3.27Å; E347-R356 IonicContact OE2-NE 3.96Å; E347-R356 PolarHBondContact OE2-NE 3.43Å; V354-R356 PolarHBondContact O-N 3.36Å; R356-K359 PolarHBondContact O-NZ 2.89Å; R356-R376 HydrophobicContact CB-CB 4.48Å; R356-R376 HydrophobicContact CG-CB 4.15Å; R356-I377 WeakPolarHBondContact CB-O 3.35Å; R356-I377 VanDerWaalsContact CG-O 3.22Å; R356-I377 WeakPolarHBondContact CG-O 3.31Å; R356-I377 PolarHBondContact N-O 3.49Å; R356-F378 HydrophobicContact CB-CD1 4.15Å; R356-F378 HydrophobicContact CB-CE1 3.74Å; R356-F378 HydrophobicContact CB-CE2 4.31Å; R356-F378 HydrophobicContact CB-CZ 3.82Å
357G89.2Confident88.3Confident39 Ų3996.3 Ų96.340%0.40246%0.456SS..THydrogen-bonded Turntrans-78.9-84.9172.300000113C355 K359 F378C355-G357 PolarHBondContact O-N 2.99Å; C355-G357 VanDerWaalsContact O-N 3.17Å; C355-G357 PolarHBondContact SG-N 3.36Å; C355-G357 VanDerWaalsContact SG-N 3.45Å; G357-K359 VanDerWaalsContact C-N 3.29Å; G357-K359 PolarHBondContact O-N 2.86Å; G357-F378 VanDerWaalsContact N-CD1 3.26Å; G357-F378 VanDerWaalsContact N-CE1 3.34Å
358C90.5Very high88.5Confident55 Ų5597.5 Ų97.537%0.37246%0.46SS..THydrogen-bonded Turntrans-77.9-0.2-174.365.60000116.4Q360 C382C358-Q360 HydrophobicContact CB-CG 4.26Å; C358-Q360 PolarHBondContact O-N 3.27Å; C358-Q360 VanDerWaalsContact SG-CG 3.55Å; C358-C382 VanDerWaalsContact CB-SG 3.52Å; C358-C382 PolarHBondContact N-SG 2.95Å
359K92.1Very high88.8Confident137 Ų13795.1 Ų95.160%0.59645%0.45SS*.  trans60.710.6-178.4-48.9-55.8-173.8-167.40116C355 R356 G357C355-K359 WeakPolarHBondContact O-CA 3.48Å; C355-K359 PolarHBondContact O-N 2.89Å; R356-K359 PolarHBondContact O-NZ 2.89Å; G357-K359 VanDerWaalsContact C-N 3.29Å; G357-K359 PolarHBondContact O-N 2.86Å
360Q89.6Confident89.1Confident107 Ų10791.2 Ų91.250%0.543%0.432SS..PPolyproline II helixtrans-73.2141.6176.3-65.3-67.6-2600111.8V354 C355 C358V354-Q360 CarbonylContact C-O 3.59Å; V354-Q360 WeakPolarHBondContact CA-O 3.4Å; C355-Q360 PolarHBondContact N-O 2.9Å; C358-Q360 HydrophobicContact CB-CG 4.26Å; C358-Q360 PolarHBondContact O-N 3.27Å; C358-Q360 VanDerWaalsContact SG-CG 3.55Å
361V90.1Very high89.5Confident93 Ų9383.2 Ų83.256%0.56439%0.394SS*.BIsolated β-bridgetrans-67.3137.7-179.3-176.80000111.1L353 V354L353-V361 WeakPolarHBondContact O-CA 3.15Å; V354-V361 HydrophobicContact CG1-CG2 4.03Å
362F89.8Confident89.6Confident23 Ų2385.4 Ų85.410%0.10139%0.394CS..PPolyproline II helixtrans-75.2139.5174.5-70.6-62.9000111.3V352 L353 V354 C355 R366 K368 I377 C379V352-F362 HydrophobicContact CG1-CD2 4.35Å; V352-F362 HydrophobicContact CG1-CE2 3.8Å; L353-F362 PolarHBondContact O-N 3.31Å; V354-F362 WeakPolarHBondContact O-CE2 3.32Å; C355-F362 VanDerWaalsContact CA-CZ 3.46Å; C355-F362 HydrophobicContact CB-CE1 4.17Å; C355-F362 HydrophobicContact CB-CE2 4.43Å; C355-F362 HydrophobicContact CB-CZ 3.84Å; F362-R366 HydrophobicContact CD1-CG 4.08Å; F362-R366 WeakPolarHBondContact CD1-O 3.21Å; F362-R366 HydrophobicContact CE1-CG 4.46Å; F362-K368 HydrophobicContact CB-CG 4.11Å; F362-K368 HydrophobicContact CD1-CG 3.81Å; F362-K368 HydrophobicContact CD2-CD 4.22Å; F362-K368 HydrophobicContact CD2-CG 3.75Å; F362-K368 HydrophobicContact CE1-CG 4.09Å; F362-K368 HydrophobicContact CE2-CG 4.03Å; F362-K368 HydrophobicContact CG-CD 4.37Å; F362-K368 HydrophobicContact CG-CG 3.63Å; F362-K368 HydrophobicContact CZ-CG 4.2Å; F362-I377 HydrophobicContact CE1-CG2 4.45Å; F362-I377 HydrophobicContact CE2-CB 4.49Å; F362-I377 HydrophobicContact CE2-CG2 3.71Å; F362-I377 HydrophobicContact CZ-CG2 3.56Å; F362-C379 HydrophobicContact CE1-CB 4.01Å
363N86.3Confident89.5Confident85 Ų8589.2 Ų89.246%0.45541%0.412SS..  trans-146.8-179.1178.966.923.8000109.4Q365 R366N363-Q365 PolarHBondContact O-N 3.11Å; N363-Q365 WeakPolarHBondContact OD1-CA 3.28Å; N363-Q365 WeakPolarHBondContact OD1-CB 3.37Å; N363-Q365 PolarHBondContact OD1-N 2.95Å; N363-R366 PolarHBondContact N-O 2.79Å; N363-R366 CarbonylContact O-C 3.54Å; N363-R366 PolarHBondContact O-N 3.07Å; N363-R366 VanDerWaalsContact O-N 3.11Å; N363-R366 WeakPolarHBondContact OD1-CB 3.45Å; N363-R366 PolarHBondContact OD1-N 3.49Å
364R84.7Confident89.3Confident255 Ų25584.2 Ų84.296%0.96239%0.387SS*.SBendtrans-56.9-26.2-179.1-72.3-174.8176.7173.3-0.5114
365Q85.6Confident89.1Confident178 Ų17882.1 Ų82.183%0.83237%0.374SS*.SBendtrans-89.7-31.6178.8-65.7151.5-15.900112.2N363N363-Q365 PolarHBondContact O-N 3.11Å; N363-Q365 WeakPolarHBondContact OD1-CA 3.28Å; N363-Q365 WeakPolarHBondContact OD1-CB 3.37Å; N363-Q365 PolarHBondContact OD1-N 2.95Å
366R88.7Confident89.1Confident84 Ų8488.2 Ų88.232%0.31740%0.397SS..SBendtrans-100.590.2179.6-165.6-176.6-62.9-81.9-1.4109F362 N363 C379F362-R366 HydrophobicContact CD1-CG 4.08Å; F362-R366 WeakPolarHBondContact CD1-O 3.21Å; F362-R366 HydrophobicContact CE1-CG 4.46Å; N363-R366 PolarHBondContact N-O 2.79Å; N363-R366 CarbonylContact O-C 3.54Å; N363-R366 PolarHBondContact O-N 3.07Å; N363-R366 VanDerWaalsContact O-N 3.11Å; N363-R366 WeakPolarHBondContact OD1-CB 3.45Å; N363-R366 PolarHBondContact OD1-N 3.49Å; R366-C379 HydrophobicContact CG-CB 3.48Å; R366-C379 VanDerWaalsContact CG-CB 3.48Å
367R87.9Confident89.1Confident196 Ų19684 Ų8474%0.7438%0.382SS*.  trans-68.6148.9-178.7-57.2-178.181.91704.8111.6
368K91.9Very high89.3Confident60 Ų6082.8 Ų82.826%0.26137%0.365SS..  trans-80.4128174.2-68.1179.7-176.2-178.10109E349 V352 F362 I377E349-K368 HydrophobicContact CB-CD 4.09Å; E349-K368 HydrophobicContact CG-CB 4.49Å; E349-K368 WeakPolarHBondContact O-CD 3.33Å; E349-K368 PolarHBondContact O-NZ 3.32Å; V352-K368 WeakPolarHBondContact O-CE 3.38Å; V352-K368 PolarHBondContact O-NZ 2.98Å; F362-K368 HydrophobicContact CB-CG 4.11Å; F362-K368 HydrophobicContact CD1-CG 3.81Å; F362-K368 HydrophobicContact CD2-CD 4.22Å; F362-K368 HydrophobicContact CD2-CG 3.75Å; F362-K368 HydrophobicContact CE1-CG 4.09Å; F362-K368 HydrophobicContact CE2-CG 4.03Å; F362-K368 HydrophobicContact CG-CD 4.37Å; F362-K368 HydrophobicContact CG-CG 3.63Å; F362-K368 HydrophobicContact CZ-CG 4.2Å; K368-I377 HydrophobicContact CB-CG2 3.57Å; K368-I377 HydrophobicContact CG-CG2 3.95Å
369I91.6Very high89.4Confident42 Ų4280.2 Ų80.222%0.21535%0.348CS..EExtended strand (participates in β ladder)trans-136.9125-179.3-52.2175.6000109.1I377 F378 E380 L383I369-I377 WeakPolarHBondContact O-CA 3.48Å; I369-F378 PolarHBondContact N-O 2.9Å; I369-F378 PolarHBondContact O-N 3.29Å; I369-E380 HydrophobicContact CD1-CB 3.9Å; I369-E380 HydrophobicContact CD1-CG 4.34Å; I369-L383 HydrophobicContact CB-CD1 4.26Å; I369-L383 HydrophobicContact CG2-CD1 4Å; I369-L383 HydrophobicContact CG2-CD2 4.13Å; I369-L383 VanDerWaalsContact O-CD1 3.31Å; I369-L383 WeakPolarHBondContact O-CD1 3.43Å
370H92.3Very high89.3Confident21 Ų2179.8 Ų79.810%0.09735%0.348CS..EExtended strand (participates in β ladder)trans-77.6139.3177.4-59.275.4000112.8W346 E347 E349 R372 G375 R376 I377W346-H370 AromaticContact CD1-CD2 3.94Å; W346-H370 AromaticContact CD1-NE2 3.84Å; W346-H370 AromaticContact CE2-CD2 3.36Å; W346-H370 AromaticContact CE2-CG 3.6Å; W346-H370 AromaticContact CE2-NE2 3.8Å; W346-H370 HydrophobicContact CH2-CB 3.43Å; W346-H370 VanDerWaalsContact CH2-CB 3.43Å; W346-H370 AromaticContact CH2-CG 3.92Å; W346-H370 HydrophobicContact CZ2-CB 3.32Å; W346-H370 AromaticContact CZ2-CD2 3.57Å; W346-H370 AromaticContact CZ2-CG 3.26Å; W346-H370 AromaticContact CZ2-ND1 3.79Å; W346-H370 HydrophobicContact CZ3-CB 4.28Å; W346-H370 AromaticContact NE1-CD2 3.33Å; W346-H370 PolarHBondContact NE1-CD2 2.97Å; W346-H370 VanDerWaalsContact NE1-CD2 3.33Å; W346-H370 AromaticContact NE1-CE1 3.75Å; W346-H370 AromaticContact NE1-CG 3.84Å; W346-H370 AromaticContact NE1-NE2 3.26Å; W346-H370 PolarHBondContact NE1-NE2 3.06Å; E347-H370 PolarHBondContact O-CD2 3.32Å; E347-H370 PolarHBondContact O-NE2 2.82Å; E349-H370 IonicContact OE1-CE1 3.68Å; H370-R372 PolarHBondContact O-N 2.8Å; H370-G375 PolarHBondContact CD2-O 2.67Å; H370-R376 CarbonylContact C-O 3.56Å; H370-R376 WeakPolarHBondContact CA-O 3.16Å; H370-I377 WeakPolarHBondContact NE2-CD1 3.25Å; H370-I377 WeakPolarHBondContact NE2-CG1 3.34Å
371C90.7Very high89.3Confident0 Ų078.1 Ų78.10%035%0.353CS..  trans-68123.4162.4175.80000108.5H373 C374 G375 R376 F378 L383 V398 C399C371-H373 PolarHBondContact O-N 3.32Å; C371-H373 VanDerWaalsContact O-N 3.13Å; C371-C374 VanDerWaalsContact CB-SG 3.57Å; C371-C374 PolarHBondContact SG-SG 2.99Å; C371-G375 WeakPolarHBondContact O-CA 3.37Å; C371-G375 PolarHBondContact O-N 3.47Å; C371-R376 PolarHBondContact N-O 2.97Å; C371-F378 HydrophobicContact CB-CD2 4Å; C371-F378 HydrophobicContact CB-CE2 3.66Å; C371-L383 HydrophobicContact CB-CD1 4.32Å; C371-V398 VanDerWaalsContact SG-CA 3.59Å; C371-C399 HydrophobicContact CB-CB 4.34Å; C371-C399 PolarHBondContact SG-N 3.41Å
372R88.2Confident89.3Confident161 Ų16175 Ų7561%0.60834%0.335SS*.THydrogen-bonded Turntrans-70.3-5.8-179-67.8-63.4-179.9-174.2-1.5114.6H370 A396 K397H370-R372 PolarHBondContact O-N 2.8Å; R372-A396 HydrophobicContact CB-CB 3.85Å; R372-A396 HydrophobicContact CG-CB 4.23Å; R372-K397 WeakPolarHBondContact CB-O 3.48Å; R372-K397 PolarHBondContact N-O 2.85Å
373H85.3Confident89.4Confident80 Ų8074 Ų7437%0.3733%0.33SS..THydrogen-bonded Turntrans-99.4-58.2174.6-175.9-98000112.5C371 V398 C402 L406C371-H373 PolarHBondContact O-N 3.32Å; C371-H373 VanDerWaalsContact O-N 3.13Å; H373-V398 HydrophobicContact CB-CG1 3.88Å; H373-C402 HydrophobicContact CB-CB 3.91Å; H373-C402 PolarHBondContact ND1-SG 2.95Å; H373-L406 HydrophobicContact CB-CD1 3.89Å; H373-L406 VanDerWaalsContact CD2-CD1 3.43Å; H373-L406 WeakPolarHBondContact CD2-CD1 3.22Å
374C86.9Confident89.6Confident19 Ų1975.1 Ų75.113%0.12834%0.336CS..THydrogen-bonded Turntrans-96.60.9-174.765.60000114.9C371 R376 C402C371-C374 VanDerWaalsContact CB-SG 3.57Å; C371-C374 PolarHBondContact SG-SG 2.99Å; C374-R376 PolarHBondContact O-N 2.81Å; C374-C402 VanDerWaalsContact SG-SG 3.62Å
375G87.9Confident89.8Confident1 Ų165.4 Ų65.41%0.0130%0.301CS..  trans67.71.1177.400000115.7E347 H370 C371E347-G375 PolarHBondContact N-O 2.96Å; H370-G375 PolarHBondContact CD2-O 2.67Å; C371-G375 WeakPolarHBondContact O-CA 3.37Å; C371-G375 PolarHBondContact O-N 3.47Å
376R90Very high89.9Confident128 Ų12859.6 Ų59.648%0.48328%0.28SS..  trans-80.1154.4179.3-69.8178.5-173170.33.4112.6E347 R356 H370 C371 C374 F378E347-R376 WeakPolarHBondContact OE2-CA 3.32Å; R356-R376 HydrophobicContact CB-CB 4.48Å; R356-R376 HydrophobicContact CG-CB 4.15Å; H370-R376 CarbonylContact C-O 3.56Å; H370-R376 WeakPolarHBondContact CA-O 3.16Å; C371-R376 PolarHBondContact N-O 2.97Å; C374-R376 PolarHBondContact O-N 2.81Å; R376-F378 HydrophobicContact CB-CE2 3.63Å; R376-F378 HydrophobicContact CB-CZ 4.11Å; R376-F378 VanDerWaalsContact O-CD2 3.25Å; R376-F378 WeakPolarHBondContact O-CD2 3.43Å; R376-F378 WeakPolarHBondContact O-CE2 3.42Å
377I91.8Very high89.9Confident0 Ų056.1 Ų56.10%027%0.268CS..EExtended strand (participates in β ladder)trans-97.3129.9-175.5-55.9-176.7000112.6E347 E349 V352 R356 F362 K368 I369 H370E347-I377 HydrophobicContact CB-CD1 4.12Å; E347-I377 HydrophobicContact CB-CG1 3.92Å; E347-I377 PolarHBondContact OE2-N 3.48Å; E349-I377 HydrophobicContact CB-CD1 4.39Å; E349-I377 HydrophobicContact CG-CD1 4.09Å; V352-I377 HydrophobicContact CB-CB 4.25Å; V352-I377 HydrophobicContact CB-CD1 3.97Å; V352-I377 HydrophobicContact CB-CG1 4.5Å; V352-I377 HydrophobicContact CG1-CB 4.11Å; V352-I377 HydrophobicContact CG2-CB 4.23Å; V352-I377 HydrophobicContact CG2-CD1 3.67Å; V352-I377 HydrophobicContact CG2-CG1 4.1Å; R356-I377 WeakPolarHBondContact CB-O 3.35Å; R356-I377 VanDerWaalsContact CG-O 3.22Å; R356-I377 WeakPolarHBondContact CG-O 3.31Å; R356-I377 PolarHBondContact N-O 3.49Å; F362-I377 HydrophobicContact CE1-CG2 4.45Å; F362-I377 HydrophobicContact CE2-CB 4.49Å; F362-I377 HydrophobicContact CE2-CG2 3.71Å; F362-I377 HydrophobicContact CZ-CG2 3.56Å; K368-I377 HydrophobicContact CB-CG2 3.57Å; K368-I377 HydrophobicContact CG-CG2 3.95Å; I369-I377 WeakPolarHBondContact O-CA 3.48Å; H370-I377 WeakPolarHBondContact NE2-CD1 3.25Å; H370-I377 WeakPolarHBondContact NE2-CG1 3.34Å
378F93.9Very high89.8Confident14 Ų1451.2 Ų51.26%0.06126%0.262CS..EExtended strand (participates in β ladder)trans-129.2165.3178.7-57-102.8000110.8R356 G357 I369 C371 R376 C382 L383 C399R356-F378 HydrophobicContact CB-CD1 4.15Å; R356-F378 HydrophobicContact CB-CE1 3.74Å; R356-F378 HydrophobicContact CB-CE2 4.31Å; R356-F378 HydrophobicContact CB-CZ 3.82Å; G357-F378 VanDerWaalsContact N-CD1 3.26Å; G357-F378 VanDerWaalsContact N-CE1 3.34Å; I369-F378 PolarHBondContact N-O 2.9Å; I369-F378 PolarHBondContact O-N 3.29Å; C371-F378 HydrophobicContact CB-CD2 4Å; C371-F378 HydrophobicContact CB-CE2 3.66Å; R376-F378 HydrophobicContact CB-CE2 3.63Å; R376-F378 HydrophobicContact CB-CZ 4.11Å; R376-F378 VanDerWaalsContact O-CD2 3.25Å; R376-F378 WeakPolarHBondContact O-CD2 3.43Å; R376-F378 WeakPolarHBondContact O-CE2 3.42Å; F378-C382 HydrophobicContact CB-CB 4.08Å; F378-C382 HydrophobicContact CD1-CB 4.07Å; F378-L383 HydrophobicContact CB-CB 4.1Å; F378-L383 HydrophobicContact CB-CD1 3.63Å; F378-L383 HydrophobicContact CB-CG 4.32Å; F378-L383 HydrophobicContact CD2-CD1 3.71Å; F378-L383 HydrophobicContact CG-CD1 3.97Å; F378-C399 HydrophobicContact CD1-CB 3.96Å; F378-C399 HydrophobicContact CD2-CB 4.04Å; F378-C399 HydrophobicContact CE1-CB 3.45Å; F378-C399 VanDerWaalsContact CE1-CB 3.45Å; F378-C399 HydrophobicContact CE2-CB 3.54Å; F378-C399 HydrophobicContact CG-CB 4.26Å; F378-C399 HydrophobicContact CZ-CB 3.23Å
379C91.4Very high89.4Confident1 Ų151.2 Ų51.21%0.00727%0.269CS..  trans-83.9163.3166.872.90000110.9C355 F362 R366 A381 C382 L383C355-C379 HydrophobicContact CB-CB 4.15Å; C355-C379 PolarHBondContact SG-N 3.26Å; F362-C379 HydrophobicContact CE1-CB 4.01Å; R366-C379 HydrophobicContact CG-CB 3.48Å; R366-C379 VanDerWaalsContact CG-CB 3.48Å; C379-A381 PolarHBondContact O-N 3.21Å; C379-C382 PolarHBondContact O-N 3.05Å; C379-L383 PolarHBondContact O-N 3.4Å; C379-L383 VanDerWaalsContact O-N 3.14Å
380E90.7Very high88.7Confident127 Ų12752.3 Ų52.359%0.59329%0.291SS*.G310 helixtrans-55-37.1-179.1-171.5159.9-147.200113.8I369 C382 L383I369-E380 HydrophobicContact CD1-CB 3.9Å; I369-E380 HydrophobicContact CD1-CG 4.34Å; E380-C382 VanDerWaalsContact C-N 3.33Å; E380-C382 PolarHBondContact O-N 2.98Å; E380-L383 CarbonylContact O-C 3.5Å; E380-L383 PolarHBondContact O-N 3.42Å
381A89.2Confident88Confident73 Ų7356.8 Ų56.860%0.60333%0.325SS*.G310 helixtrans-66-32176.700000113.5C379C379-A381 PolarHBondContact O-N 3.21Å
382C91.3Very high87.5Confident28 Ų2863.7 Ų63.719%0.18936%0.357CS..G310 helixtrans-89.6-6.1178.4-69.40000113.5C355 C358 F378 C379 E380C355-C382 VanDerWaalsContact SG-SG 3.64Å; C358-C382 VanDerWaalsContact CB-SG 3.52Å; C358-C382 PolarHBondContact N-SG 2.95Å; F378-C382 HydrophobicContact CB-CB 4.08Å; F378-C382 HydrophobicContact CD1-CB 4.07Å; C379-C382 PolarHBondContact O-N 3.05Å; E380-C382 VanDerWaalsContact C-N 3.33Å; E380-C382 PolarHBondContact O-N 2.98Å
383L91.6Very high87.2Confident0 Ų059.7 Ų59.70%035%0.353CS..  trans-124.752-175.6-141151.8000109.3I369 C371 F378 C379 E380 K397I369-L383 HydrophobicContact CB-CD1 4.26Å; I369-L383 HydrophobicContact CG2-CD1 4Å; I369-L383 HydrophobicContact CG2-CD2 4.13Å; I369-L383 VanDerWaalsContact O-CD1 3.31Å; I369-L383 WeakPolarHBondContact O-CD1 3.43Å; C371-L383 HydrophobicContact CB-CD1 4.32Å; F378-L383 HydrophobicContact CB-CB 4.1Å; F378-L383 HydrophobicContact CB-CD1 3.63Å; F378-L383 HydrophobicContact CB-CG 4.32Å; F378-L383 HydrophobicContact CD2-CD1 3.71Å; F378-L383 HydrophobicContact CG-CD1 3.97Å; C379-L383 PolarHBondContact O-N 3.4Å; C379-L383 VanDerWaalsContact O-N 3.14Å; E380-L383 CarbonylContact O-C 3.5Å; E380-L383 PolarHBondContact O-N 3.42Å; L383-K397 VanDerWaalsContact CD2-C 3.45Å; L383-K397 HydrophobicContact CD2-CB 3.28Å; L383-K397 HydrophobicContact CD2-CD 3.79Å; L383-K397 HydrophobicContact CD2-CG 3.71Å; L383-K397 WeakPolarHBondContact O-CD 3.49Å; L383-K397 PolarHBondContact O-NZ 3.46Å
384N89.7Confident87.2Confident109 Ų10964.3 Ų64.358%0.58337%0.367SS*.  trans-99.7-7.7-176.164.8-12000113.4
385K88.9Confident87.2Confident51 Ų5168.6 Ų68.622%0.22240%0.395CS..EExtended strand (participates in β ladder)trans-100.2146.5176.3-50.6-171.2-170.71760110.3V398 E400 H403K385-V398 PolarHBondContact O-N 3.46Å; K385-E400 IonicContact NZ-OE1 2.81Å; K385-E400 PolarHBondContact NZ-OE1 3.37Å; K385-H403 HydrophobicContact CB-CB 4.03Å; K385-H403 VanDerWaalsContact CB-CD2 3.44Å; K385-H403 WeakPolarHBondContact CB-CD2 3.07Å; K385-H403 HydrophobicContact CD-CB 3.69Å; K385-H403 VanDerWaalsContact CD-CG 3.43Å; K385-H403 HydrophobicContact CG-CB 4.46Å
386S88.3Confident87.3Confident56 Ų5669.2 Ų69.239%0.39240%0.4SS..EExtended strand (participates in β ladder)trans-131.1145.4178.2-59.30000110.2A396S386-A396 CarbonylContact C-O 3.6Å; S386-A396 VanDerWaalsContact CA-O 3.28Å; S386-A396 WeakPolarHBondContact CA-O 3.03Å
387V87.5Confident87.4Confident12 Ų1266.9 Ų66.97%0.07339%0.393CS..EExtended strand (participates in β ladder)trans-123.9146176.3-65.60000109.9S389 A396 V398 L406 V407V387-S389 PolarHBondContact O-N 3.32Å; V387-A396 PolarHBondContact N-O 2.96Å; V387-A396 PolarHBondContact O-N 2.96Å; V387-V398 HydrophobicContact CB-CG2 4.35Å; V387-V398 HydrophobicContact CG1-CG2 3.68Å; V387-V398 HydrophobicContact CG2-CB 4.38Å; V387-V398 HydrophobicContact CG2-CG1 3.57Å; V387-V398 HydrophobicContact CG2-CG2 3.88Å; V387-L406 HydrophobicContact CG1-CB 4.12Å; V387-L406 HydrophobicContact CG1-CD1 4.39Å; V387-L406 HydrophobicContact CG2-CD1 3.83Å; V387-V407 HydrophobicContact CG1-CG2 3.68Å
388P86.8Confident87.4Confident92 Ų9266.9 Ų66.960%0.59739%0.394SS*.EExtended strand (participates in β ladder)trans-63.7126.4173.723.1-29.9000110.8S393P388-S393 WeakPolarHBondContact CB-OG 3.4Å
389S82.9Confident87.2Confident61 Ų6166.5 Ų66.543%0.42739%0.393SS..EExtended strand (participates in β ladder)trans-135.2144.8-177.5-172.90000112.3V387 R394 A396V387-S389 PolarHBondContact O-N 3.32Å; S389-R394 PolarHBondContact N-O 3.21Å; S389-R394 PolarHBondContact O-N 3.37Å; S389-A396 VanDerWaalsContact CB-CB 3.4Å
390G77.6Confident87Confident65 Ų6572.2 Ų72.267%0.6742%0.419SS*.THydrogen-bonded Turntrans76.3176.1-17900000114.4H392 S393G390-H392 PolarHBondContact O-N 3.05Å; G390-H392 VanDerWaalsContact O-N 3.16Å; G390-S393 PolarHBondContact O-N 2.8Å; G390-S393 VanDerWaalsContact O-N 3.13Å
391S77.4Confident86.7Confident115 Ų11570.9 Ų70.980%0.80442%0.42SS*.THydrogen-bonded Turntrans-59.3-26.6-176.754.30000114.4
392H80.5Confident86.5Confident144 Ų14467.7 Ų67.767%0.66739%0.393SS*.THydrogen-bonded Turntrans-100.712.8-178.7-61.6-68.5000113.8G390 R394G390-H392 PolarHBondContact O-N 3.05Å; G390-H392 VanDerWaalsContact O-N 3.16Å; H392-R394 HydrophobicContact CB-CG 4.17Å; H392-R394 PolarHBondContact O-N 2.88Å
393S82.5Confident86.3Confident77 Ų7768.1 Ų68.154%0.53839%0.392SS..THydrogen-bonded Turntrans54.139.9178.2-159.40000113.2P388 G390P388-S393 WeakPolarHBondContact CB-OG 3.4Å; G390-S393 PolarHBondContact O-N 2.8Å; G390-S393 VanDerWaalsContact O-N 3.13Å
394R83.8Confident85.9Confident177 Ų17770.6 Ų70.667%0.66841%0.407SS*.EExtended strand (participates in β ladder)trans-72136.8-177.2-67.8-177.2-180-129.91.8109.3S389 H392 A396S389-R394 PolarHBondContact N-O 3.21Å; S389-R394 PolarHBondContact O-N 3.37Å; H392-R394 HydrophobicContact CB-CG 4.17Å; H392-R394 PolarHBondContact O-N 2.88Å; R394-A396 PolarHBondContact O-N 2.61Å
395P88.1Confident85.5Confident110 Ų11070.5 Ų70.571%0.71441%0.406SS*.EExtended strand (participates in β ladder)trans-65.3110.8179.524.8-32.3000110.2
396A89.5Confident85.1Confident13 Ų1371.7 Ų71.711%0.10741%0.414CS..EExtended strand (participates in β ladder)trans-101.5121.5175.500000109.6R372 S386 V387 S389 R394 V398R372-A396 HydrophobicContact CB-CB 3.85Å; R372-A396 HydrophobicContact CG-CB 4.23Å; S386-A396 CarbonylContact C-O 3.6Å; S386-A396 VanDerWaalsContact CA-O 3.28Å; S386-A396 WeakPolarHBondContact CA-O 3.03Å; V387-A396 PolarHBondContact N-O 2.96Å; V387-A396 PolarHBondContact O-N 2.96Å; S389-A396 VanDerWaalsContact CB-CB 3.4Å; R394-A396 PolarHBondContact O-N 2.61Å; A396-V398 PolarHBondContact O-N 2.76Å
397K92Very high84.7Confident79 Ų7971 Ų7134%0.34341%0.408SS..EExtended strand (participates in β ladder)trans-69.9125.3-178.6-112.3-166.1-170.1-155.20110R372 L383R372-K397 WeakPolarHBondContact CB-O 3.48Å; R372-K397 PolarHBondContact N-O 2.85Å; L383-K397 VanDerWaalsContact CD2-C 3.45Å; L383-K397 HydrophobicContact CD2-CB 3.28Å; L383-K397 HydrophobicContact CD2-CD 3.79Å; L383-K397 HydrophobicContact CD2-CG 3.71Å; L383-K397 WeakPolarHBondContact O-CD 3.49Å; L383-K397 PolarHBondContact O-NZ 3.46Å
398V91.5Very high83.9Confident1 Ų182.1 Ų82.11%0.00645%0.448CS..EExtended strand (participates in β ladder)trans-133.7157.1-175.5-67.10000112.1C371 H373 K385 V387 A396 C402 H403 L406C371-V398 VanDerWaalsContact SG-CA 3.59Å; H373-V398 HydrophobicContact CB-CG1 3.88Å; K385-V398 PolarHBondContact O-N 3.46Å; V387-V398 HydrophobicContact CB-CG2 4.35Å; V387-V398 HydrophobicContact CG1-CG2 3.68Å; V387-V398 HydrophobicContact CG2-CB 4.38Å; V387-V398 HydrophobicContact CG2-CG1 3.57Å; V387-V398 HydrophobicContact CG2-CG2 3.88Å; A396-V398 PolarHBondContact O-N 2.76Å; V398-C402 HydrophobicContact CB-CB 4.11Å; V398-H403 HydrophobicContact CG2-CB 4.09Å; V398-L406 HydrophobicContact CG1-CD1 4.37Å
399C90.1Very high83.1Confident6 Ų685 Ų854%0.04146%0.459CS..  trans-73.7164.7173.871.50000111.8C371 F378 V401 C402 H403C371-C399 HydrophobicContact CB-CB 4.34Å; C371-C399 PolarHBondContact SG-N 3.41Å; F378-C399 HydrophobicContact CD1-CB 3.96Å; F378-C399 HydrophobicContact CD2-CB 4.04Å; F378-C399 HydrophobicContact CE1-CB 3.45Å; F378-C399 VanDerWaalsContact CE1-CB 3.45Å; F378-C399 HydrophobicContact CE2-CB 3.54Å; F378-C399 HydrophobicContact CG-CB 4.26Å; F378-C399 HydrophobicContact CZ-CB 3.23Å; C399-V401 VanDerWaalsContact C-N 3.33Å; C399-V401 PolarHBondContact O-N 3.42Å; C399-C402 PolarHBondContact O-N 2.81Å; C399-C402 PolarHBondContact SG-SG 3.33Å; C399-H403 PolarHBondContact O-N 2.82Å
400E86.7Confident82.2Confident120 Ų12084 Ų8456%0.56145%0.45SS*.Hα-helixtrans-55-44-179.4175.4152.6-124.400113.8K385 H403 T404K385-E400 IonicContact NZ-OE1 2.81Å; K385-E400 PolarHBondContact NZ-OE1 3.37Å; E400-H403 WeakPolarHBondContact O-CB 3.49Å; E400-H403 PolarHBondContact O-N 3.36Å; E400-T404 PolarHBondContact O-N 3.49Å; E400-T404 PolarHBondContact O-OG1 3.45Å; E400-T404 VanDerWaalsContact O-OG1 3.1Å
401V84.7Confident81.3Confident100 Ų10084.2 Ų84.261%0.60645%0.445SS*.Hα-helixtrans-61-48.8178179.70000110.8C399 H403 T404 L405C399-V401 VanDerWaalsContact C-N 3.33Å; C399-V401 PolarHBondContact O-N 3.42Å; V401-H403 VanDerWaalsContact C-N 3.31Å; V401-H403 PolarHBondContact O-N 3.33Å; V401-T404 PolarHBondContact O-N 3.29Å; V401-L405 HydrophobicContact CG1-CD1 4.05Å; V401-L405 WeakPolarHBondContact O-CG 3.49Å; V401-L405 PolarHBondContact O-N 3.48Å
402C86Confident80.4Confident6 Ų682.2 Ų82.24%0.04143%0.43CS..Hα-helixtrans-67.8-31.5178.8-65.70000112.4H373 C374 V398 C399 L405 L406H373-C402 HydrophobicContact CB-CB 3.91Å; H373-C402 PolarHBondContact ND1-SG 2.95Å; C374-C402 VanDerWaalsContact SG-SG 3.62Å; V398-C402 HydrophobicContact CB-CB 4.11Å; C399-C402 PolarHBondContact O-N 2.81Å; C399-C402 PolarHBondContact SG-SG 3.33Å; C402-L405 PolarHBondContact O-N 2.93Å; C402-L406 HydrophobicContact CB-CD1 4.36Å; C402-L406 WeakPolarHBondContact O-CB 3.49Å; C402-L406 WeakPolarHBondContact O-CD1 3.49Å; C402-L406 WeakPolarHBondContact O-CG 3.22Å; C402-L406 PolarHBondContact O-N 2.99Å
403H86.9Confident79.2Confident36 Ų3685.3 Ų85.317%0.16744%0.437CS..Hα-helixtrans-62.6-47.6172.1-177.5-82.5000111.1K385 V398 C399 E400 V401 L405 L406 V407K385-H403 HydrophobicContact CB-CB 4.03Å; K385-H403 VanDerWaalsContact CB-CD2 3.44Å; K385-H403 WeakPolarHBondContact CB-CD2 3.07Å; K385-H403 HydrophobicContact CD-CB 3.69Å; K385-H403 VanDerWaalsContact CD-CG 3.43Å; K385-H403 HydrophobicContact CG-CB 4.46Å; V398-H403 HydrophobicContact CG2-CB 4.09Å; C399-H403 PolarHBondContact O-N 2.82Å; E400-H403 WeakPolarHBondContact O-CB 3.49Å; E400-H403 PolarHBondContact O-N 3.36Å; V401-H403 VanDerWaalsContact C-N 3.31Å; V401-H403 PolarHBondContact O-N 3.33Å; H403-L405 VanDerWaalsContact C-N 3.25Å; H403-L405 PolarHBondContact O-N 3.13Å; H403-L406 PolarHBondContact O-N 3.13Å; H403-V407 WeakPolarHBondContact O-CB 3.37Å; H403-V407 PolarHBondContact O-N 3.16Å
404T83.7Confident77.9Confident52 Ų5290.8 Ų90.832%0.31945%0.452SS..Hα-helixtrans-62.5-33176.8-530000112.1E400 V401E400-T404 PolarHBondContact O-N 3.49Å; E400-T404 PolarHBondContact O-OG1 3.45Å; E400-T404 VanDerWaalsContact O-OG1 3.1Å; V401-T404 PolarHBondContact O-N 3.29Å
405L80.2Confident76.7Confident107 Ų10786.3 Ų86.356%0.5645%0.448SS*.Hα-helixtrans-75.1-34.3176-68.6170.9000113.6V401 C402 H403V401-L405 HydrophobicContact CG1-CD1 4.05Å; V401-L405 WeakPolarHBondContact O-CG 3.49Å; V401-L405 PolarHBondContact O-N 3.48Å; C402-L405 PolarHBondContact O-N 2.93Å; H403-L405 VanDerWaalsContact C-N 3.25Å; H403-L405 PolarHBondContact O-N 3.13Å
406L81Confident74.9Confident76 Ų7686.8 Ų86.840%0.39845%0.448SS..Hα-helixtrans-95.7-25.2-172.5-68.4168.9000114H373 V387 V398 C402 H403H373-L406 HydrophobicContact CB-CD1 3.89Å; H373-L406 VanDerWaalsContact CD2-CD1 3.43Å; H373-L406 WeakPolarHBondContact CD2-CD1 3.22Å; V387-L406 HydrophobicContact CG1-CB 4.12Å; V387-L406 HydrophobicContact CG1-CD1 4.39Å; V387-L406 HydrophobicContact CG2-CD1 3.83Å; V398-L406 HydrophobicContact CG1-CD1 4.37Å; C402-L406 HydrophobicContact CB-CD1 4.36Å; C402-L406 WeakPolarHBondContact O-CB 3.49Å; C402-L406 WeakPolarHBondContact O-CD1 3.49Å; C402-L406 WeakPolarHBondContact O-CG 3.22Å; C402-L406 PolarHBondContact O-N 2.99Å; H403-L406 PolarHBondContact O-N 3.13Å
407V80Confident73.2Confident42 Ų4294.9 Ų94.926%0.25548%0.484SS..  trans-99.8107.4179.7177.80000108.7V387 H403 D409 T410V387-V407 HydrophobicContact CG1-CG2 3.68Å; H403-V407 WeakPolarHBondContact O-CB 3.37Å; H403-V407 PolarHBondContact O-N 3.16Å; V407-D409 PolarHBondContact O-N 3.47Å; V407-D409 VanDerWaalsContact O-N 3.09Å; V407-T410 VanDerWaalsContact CB-OG1 3.26Å; V407-T410 WeakPolarHBondContact CB-OG1 3.38Å; V407-T410 WeakPolarHBondContact CG1-OG1 3.33Å; V407-T410 PolarHBondContact O-N 3.18Å; V407-T410 VanDerWaalsContact O-N 3.09Å; V407-T410 PolarHBondContact O-OG1 3.12Å
408R70.9Confident71.4Confident245 Ų24596.2 Ų96.293%0.92550%0.498SS*.THydrogen-bonded Turntrans-55.6-26.7-175.3-67.1-175.5178.2-167.8-1.1114.2
409D69.5Low69.5Low154 Ų154100.4 Ų100.482%0.82453%0.525SS*.THydrogen-bonded Turntrans-94.75.8-175.4-54-32.9000113.3V407 A411V407-D409 PolarHBondContact O-N 3.47Å; V407-D409 VanDerWaalsContact O-N 3.09Å; D409-A411 PolarHBondContact O-N 3.39Å
410T63.5Low67.9Low38 Ų38108.1 Ų108.123%0.23356%0.561CS.*  trans-85.9100.2174.7-22.20000109.2V407V407-T410 VanDerWaalsContact CB-OG1 3.26Å; V407-T410 WeakPolarHBondContact CB-OG1 3.38Å; V407-T410 WeakPolarHBondContact CG1-OG1 3.33Å; V407-T410 PolarHBondContact O-N 3.18Å; V407-T410 VanDerWaalsContact O-N 3.09Å; V407-T410 PolarHBondContact O-OG1 3.12Å
411A57.9Low66.7Low70 Ų70107.4 Ų107.458%0.57957%0.569SS**  trans-59.1129.7176.800000111D409D409-A411 PolarHBondContact O-N 3.39Å
412P58.8Low65.2Low74 Ų74110.1 Ų110.148%0.48158%0.575SS.*  trans-58.4150.2168.6-1829.4000110.1F414 S415P412-F414 PolarHBondContact O-N 2.73Å; P412-S415 WeakPolarHBondContact O-CB 3.32Å; P412-S415 PolarHBondContact O-N 3.44Å
413Y55.2Low63.8Low208 Ų208116.9 Ų116.982%0.81661%0.61SS**G310 helixtrans-50.1-23.5-179.3-177.7-102000114.7
414F56.9Low61.8Low192 Ų192122.5 Ų122.584%0.84264%0.641SS**G310 helixtrans-86.21.3179.3-69.6-80000115.4P412P412-F414 PolarHBondContact O-N 2.73Å
415S57Low59.9Low84 Ų84123.6 Ų123.659%0.58766%0.663SS**G310 helixtrans-97.39.4-179.9-59.10000113.9P412P412-S415 WeakPolarHBondContact O-CB 3.32Å; P412-S415 PolarHBondContact O-N 3.44Å
416V51.9Low57.9Low119 Ų119128 Ų12872%0.72170%0.703SS**SBendtrans-96.9129.1173-163.30000108.6
417E52.7Low56.7Low183 Ų183130.6 Ų130.686%0.85572%0.718SS**  trans-28.6137.3-170.4-65.3168171.100117.2
418V54.2Low55.5Low107 Ų107135.2 Ų135.265%0.64874%0.742SS**  trans-58.9129.4175.7-1770000109.7Q420V418-Q420 PolarHBondContact O-N 3.05Å
419P51.6Low54.6Low89 Ų89129.1 Ų129.158%0.57873%0.732SS**  trans-55127.8175.7-24.633.2000111.6S421 Q422P419-S421 PolarHBondContact O-N 2.79Å; P419-Q422 PolarHBondContact O-N 3.06Å
420Q57.1Low53.7Low169 Ų169127.6 Ų127.679%0.7973%0.727SS**G310 helixtrans-54.1-14.3-177.4-74.4175-22.100114.8V418 Q422 L423V418-Q420 PolarHBondContact O-N 3.05Å; Q420-Q422 PolarHBondContact O-N 2.74Å; Q420-Q422 VanDerWaalsContact O-N 3.1Å; Q420-L423 PolarHBondContact O-N 3.26Å
421S60.8Low53.1Low104 Ų104133.3 Ų133.373%0.72776%0.758SS**G310 helixtrans-67.6-3.1177.258.20000115.4P419P419-S421 PolarHBondContact O-N 2.79Å
422Q54.1Low52.8Low158 Ų158137.5 Ų137.574%0.73877%0.77SS**G310 helixtrans-106.53.1178.4-65.3-157.2-42.400114.8P419 Q420P419-Q422 PolarHBondContact O-N 3.06Å; Q420-Q422 PolarHBondContact O-N 2.74Å; Q420-Q422 VanDerWaalsContact O-N 3.1Å
423L56Low52.4Low147 Ų147142 Ų14277%0.7779%0.79SS**SBendtrans-101.8-10.9179.5-71.2169.1000114.4Q420Q420-L423 PolarHBondContact O-N 3.26Å
424D45.5Very low52.2Low154 Ų154136.9 Ų136.982%0.82479%0.788SS**  trans-108.485.8-179.7-66.7-22.7000110.8
425G43Very low51.8Low76 Ų76132.3 Ų132.378%0.78478%0.784SS**  trans-155.457177.300000111.7
426S37.4Very low51.3Low198 Ų198136.7 Ų136.7100%1.38580%0.802SS**  trans-95.90162.3-62.10000110.7

Retrieved 426 of 426 residues in 343.5 ms (Link to these results)