A0A087WPW5_MOUSE Loading...

Kinectin 1

AlphaFold DB , UniProt , Accession A0A087WPW5, Species MOUSE (Mus musculus, Mouse), Gene Ktn1, Length 1,252 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
1M41Very low48.9Very low239 Ų239152.7 Ų152.7100%1.17775%0.75SS**  065.50-172.7-177.1-120.400106.2
2E37.7Very low50.5Low171 Ų171148.7 Ų148.780%0.79973%0.732SS**  trans-138.319.2-158.3-69.7169.2141.200112.4
3L41.1Very low51.8Low158 Ų158144.7 Ų144.783%0.82771%0.714SS**SBendtrans-93.31.4-178.5-70.4173.9000113.9
4Y46Very low53.5Low238 Ų238138.8 Ų138.893%0.93369%0.692SS**SBendtrans-98.3-7.6-176.7-91.7-83.3000115.2
5E47.3Very low54.6Low178 Ų178133.7 Ų133.783%0.83268%0.675SS**  trans-101.23.6178.6-71.9-174.7134.300114.1T7E5-T7 PolarHBondContact O-N 3.4Å; E5-T7 VanDerWaalsContact O-N 3.07Å
6S43.9Very low56.2Low60 Ų60130.1 Ų130.142%0.4266%0.662SS.*  trans-72.6105.9179.2-169.60000111Y8 F9S6-Y8 PolarHBondContact O-N 3.28Å; S6-Y8 WeakPolarHBondContact OG-CD2 3.49Å; S6-F9 PolarHBondContact O-N 3.15Å
7T51.3Low57.7Low110 Ų110126.8 Ų126.868%0.67565%0.649SS**THydrogen-bonded Turntrans-53.5-20.7-177.8-31.80000113.6E5 F9 V10E5-T7 PolarHBondContact O-N 3.4Å; E5-T7 VanDerWaalsContact O-N 3.07Å; T7-F9 VanDerWaalsContact C-N 3.27Å; T7-F9 PolarHBondContact O-N 3.3Å; T7-V10 PolarHBondContact O-N 3.3Å
8Y54.3Low58.9Low184 Ų184124.8 Ų124.872%0.72264%0.639SS**Hα-helixtrans-58-32.7173.9-69.2-89.9000113.6S6 V10 V11 L12S6-Y8 PolarHBondContact O-N 3.28Å; S6-Y8 WeakPolarHBondContact OG-CD2 3.49Å; Y8-V10 VanDerWaalsContact C-N 3.31Å; Y8-V10 PolarHBondContact O-N 3.21Å; Y8-V11 PolarHBondContact O-N 2.91Å; Y8-L12 VanDerWaalsContact O-CB 3.26Å; Y8-L12 WeakPolarHBondContact O-CB 3.37Å; Y8-L12 PolarHBondContact O-N 3.39Å
9F54.6Low60.1Low127 Ų127122.1 Ų122.156%0.55763%0.629SS**Hα-helixtrans-66-33-179.2-116-85.8000113S6 T7 V11 I13S6-F9 PolarHBondContact O-N 3.15Å; T7-F9 VanDerWaalsContact C-N 3.27Å; T7-F9 PolarHBondContact O-N 3.3Å; F9-V11 VanDerWaalsContact C-N 3.27Å; F9-V11 PolarHBondContact O-N 3.46Å; F9-I13 HydrophobicContact CD1-CD1 3.71Å; F9-I13 HydrophobicContact CD1-CG1 4.04Å; F9-I13 HydrophobicContact CE1-CD1 4.13Å; F9-I13 HydrophobicContact CE1-CG1 4.38Å; F9-I13 PolarHBondContact O-N 3.23Å
10V57.6Low61.1Low112 Ų112120.3 Ų120.368%0.67962%0.623SS**Hα-helixtrans-69.1-24.8177.8-178.10000112.1T7 Y8 P14T7-V10 PolarHBondContact O-N 3.3Å; Y8-V10 VanDerWaalsContact C-N 3.31Å; Y8-V10 PolarHBondContact O-N 3.21Å; V10-P14 WeakPolarHBondContact O-CD 3.47Å; V10-P14 VanDerWaalsContact O-CG 3.25Å; V10-P14 WeakPolarHBondContact O-CG 3.48Å
11V62.7Low61.8Low103 Ų103118.3 Ų118.362%0.62461%0.613SS**Hα-helixtrans-95.9-35.8177.1-176.50000111.5Y8 F9 S15Y8-V11 PolarHBondContact O-N 2.91Å; F9-V11 VanDerWaalsContact C-N 3.27Å; F9-V11 PolarHBondContact O-N 3.46Å; V11-S15 WeakPolarHBondContact O-CB 3.49Å; V11-S15 PolarHBondContact O-N 3.42Å; V11-S15 VanDerWaalsContact O-N 3.14Å
12L68.1Low63.3Low104 Ų104113.9 Ų113.955%0.54559%0.587SS.*Hα-helixtrans-69.7-41.4-176.6-160.875.1000112Y8 S15 V16Y8-L12 VanDerWaalsContact O-CB 3.26Å; Y8-L12 WeakPolarHBondContact O-CB 3.37Å; Y8-L12 PolarHBondContact O-N 3.39Å; L12-S15 PolarHBondContact O-N 3.48Å; L12-V16 HydrophobicContact CG-CG2 4.37Å; L12-V16 WeakPolarHBondContact O-CB 3.3Å; L12-V16 VanDerWaalsContact O-CG2 3.31Å; L12-V16 WeakPolarHBondContact O-CG2 3.33Å; L12-V16 PolarHBondContact O-N 2.99Å
13I68.3Low65Low97 Ų97109.9 Ų109.950%0.49757%0.571SS.*Hα-helixtrans-61.1-52.9178.5-70.1173.6000111.3F9 S15 V16 V17F9-I13 HydrophobicContact CD1-CD1 3.71Å; F9-I13 HydrophobicContact CD1-CG1 4.04Å; F9-I13 HydrophobicContact CE1-CD1 4.13Å; F9-I13 HydrophobicContact CE1-CG1 4.38Å; F9-I13 PolarHBondContact O-N 3.23Å; I13-S15 VanDerWaalsContact C-N 3.3Å; I13-S15 PolarHBondContact O-N 3.14Å; I13-V16 PolarHBondContact O-N 3.02Å; I13-V17 HydrophobicContact CG2-CG2 4.34Å; I13-V17 WeakPolarHBondContact O-CB 3.15Å; I13-V17 VanDerWaalsContact O-CG2 3.32Å; I13-V17 WeakPolarHBondContact O-CG2 3.49Å; I13-V17 PolarHBondContact O-N 2.81Å
14P74.6Confident66.4Low62 Ų62109.2 Ų109.240%0.40356%0.562SS.*Hα-helixtrans-57.5-39.2173.8-27.636.3000113.3V10 V17 I18V10-P14 WeakPolarHBondContact O-CD 3.47Å; V10-P14 VanDerWaalsContact O-CG 3.25Å; V10-P14 WeakPolarHBondContact O-CG 3.48Å; P14-V17 PolarHBondContact O-N 3.5Å; P14-I18 VanDerWaalsContact O-CB 3.27Å; P14-I18 WeakPolarHBondContact O-CB 3.46Å; P14-I18 WeakPolarHBondContact O-CD1 3.45Å; P14-I18 WeakPolarHBondContact O-CG1 3.26Å; P14-I18 PolarHBondContact O-N 3.04Å
15S70.6Confident67.2Low63 Ų63104 Ų10444%0.44154%0.544SS..Hα-helixtrans-68.7-36.3179.9-161.70000113V11 L12 I13 T19V11-S15 WeakPolarHBondContact O-CB 3.49Å; V11-S15 PolarHBondContact O-N 3.42Å; V11-S15 VanDerWaalsContact O-N 3.14Å; L12-S15 PolarHBondContact O-N 3.48Å; I13-S15 VanDerWaalsContact C-N 3.3Å; I13-S15 PolarHBondContact O-N 3.14Å; S15-T19 PolarHBondContact O-N 3.48Å; S15-T19 PolarHBondContact O-OG1 2.89Å
16V80.5Confident67.8Low76 Ų76104 Ų10446%0.46154%0.537SS..Hα-helixtrans-69.1-43171.8171.60000110.9L12 I13 T19 V20L12-V16 HydrophobicContact CG-CG2 4.37Å; L12-V16 WeakPolarHBondContact O-CB 3.3Å; L12-V16 VanDerWaalsContact O-CG2 3.31Å; L12-V16 WeakPolarHBondContact O-CG2 3.33Å; L12-V16 PolarHBondContact O-N 2.99Å; I13-V16 PolarHBondContact O-N 3.02Å; V16-T19 WeakPolarHBondContact CA-OG1 3.41Å; V16-T19 PolarHBondContact O-N 2.8Å; V16-T19 PolarHBondContact O-OG1 2.74Å; V16-T19 VanDerWaalsContact O-OG1 3.07Å; V16-V20 HydrophobicContact CG1-CG2 4.46Å; V16-V20 WeakPolarHBondContact O-CB 3.34Å; V16-V20 VanDerWaalsContact O-CG2 3.3Å; V16-V20 WeakPolarHBondContact O-CG2 3.38Å; V16-V20 PolarHBondContact O-N 2.85Å
17V81.9Confident68.6Low74 Ų74107.7 Ų107.745%0.44855%0.551SS.*Hα-helixtrans-63.2-43.8175.5169.90000111I13 P14 V20 I21I13-V17 HydrophobicContact CG2-CG2 4.34Å; I13-V17 WeakPolarHBondContact O-CB 3.15Å; I13-V17 VanDerWaalsContact O-CG2 3.32Å; I13-V17 WeakPolarHBondContact O-CG2 3.49Å; I13-V17 PolarHBondContact O-N 2.81Å; P14-V17 PolarHBondContact O-N 3.5Å; V17-V20 PolarHBondContact O-N 3.38Å; V17-I21 HydrophobicContact CG1-CD1 3.67Å; V17-I21 HydrophobicContact CG1-CG1 4.4Å; V17-I21 WeakPolarHBondContact O-CB 3.48Å; V17-I21 WeakPolarHBondContact O-CG1 3.42Å; V17-I21 PolarHBondContact O-N 3.2Å
18I79.6Confident68.5Low91 Ų91108.6 Ų108.647%0.46755%0.546SS..Hα-helixtrans-62.4-42.9175.2-72163.8000110.9P14 I21 F22P14-I18 VanDerWaalsContact O-CB 3.27Å; P14-I18 WeakPolarHBondContact O-CB 3.46Å; P14-I18 WeakPolarHBondContact O-CD1 3.45Å; P14-I18 WeakPolarHBondContact O-CG1 3.26Å; P14-I18 PolarHBondContact O-N 3.04Å; I18-I21 PolarHBondContact O-N 3.45Å; I18-F22 HydrophobicContact CG2-CD2 3.76Å; I18-F22 HydrophobicContact CG2-CE2 4.03Å; I18-F22 WeakPolarHBondContact O-CB 3.24Å; I18-F22 WeakPolarHBondContact O-CD2 3.37Å; I18-F22 PolarHBondContact O-N 2.9Å
19T80.1Confident68.3Low72 Ų72106.1 Ų106.144%0.44254%0.543SS..Hα-helixtrans-70.1-34.6177.142.70000113S15 V16 F22 L23S15-T19 PolarHBondContact O-N 3.48Å; S15-T19 PolarHBondContact O-OG1 2.89Å; V16-T19 WeakPolarHBondContact CA-OG1 3.41Å; V16-T19 PolarHBondContact O-N 2.8Å; V16-T19 PolarHBondContact O-OG1 2.74Å; V16-T19 VanDerWaalsContact O-OG1 3.07Å; T19-F22 PolarHBondContact O-N 3.17Å; T19-L23 VanDerWaalsContact O-CB 3.32Å; T19-L23 WeakPolarHBondContact O-CB 3.48Å; T19-L23 WeakPolarHBondContact O-CD1 3.5Å; T19-L23 VanDerWaalsContact O-CG 3.3Å; T19-L23 WeakPolarHBondContact O-CG 3.42Å; T19-L23 PolarHBondContact O-N 3.47Å
20V80.4Confident68Low86 Ų86108 Ų10852%0.52155%0.551SS.*Hα-helixtrans-65.2-42.6170.5169.60000111V16 V17 L23 F24V16-V20 HydrophobicContact CG1-CG2 4.46Å; V16-V20 WeakPolarHBondContact O-CB 3.34Å; V16-V20 VanDerWaalsContact O-CG2 3.3Å; V16-V20 WeakPolarHBondContact O-CG2 3.38Å; V16-V20 PolarHBondContact O-N 2.85Å; V17-V20 PolarHBondContact O-N 3.38Å; V20-L23 PolarHBondContact O-N 2.83Å; V20-F24 WeakPolarHBondContact O-CB 3.23Å; V20-F24 PolarHBondContact O-N 3.34Å
21I76Confident67.5Low80 Ų80111.1 Ų111.141%0.4156%0.558SS.*Hα-helixtrans-63.3-44.1174.4-72.2167.7000110.8V17 I18 F24 F25V17-I21 HydrophobicContact CG1-CD1 3.67Å; V17-I21 HydrophobicContact CG1-CG1 4.4Å; V17-I21 WeakPolarHBondContact O-CB 3.48Å; V17-I21 WeakPolarHBondContact O-CG1 3.42Å; V17-I21 PolarHBondContact O-N 3.2Å; I18-I21 PolarHBondContact O-N 3.45Å; I21-F24 WeakPolarHBondContact O-CB 3.5Å; I21-F24 PolarHBondContact O-N 3.2Å; I21-F25 HydrophobicContact CG2-CD2 3.64Å; I21-F25 HydrophobicContact CG2-CE2 3.72Å; I21-F25 VanDerWaalsContact O-CD2 3.31Å; I21-F25 WeakPolarHBondContact O-CD2 3.46Å; I21-F25 PolarHBondContact O-N 3.33Å
22F72.4Confident66.8Low145 Ų145110.5 Ų110.564%0.63655%0.554SS**Hα-helixtrans-65.2-38.7175.3-98.1-81000112.5I18 T19 F24 F25 W26I18-F22 HydrophobicContact CG2-CD2 3.76Å; I18-F22 HydrophobicContact CG2-CE2 4.03Å; I18-F22 WeakPolarHBondContact O-CB 3.24Å; I18-F22 WeakPolarHBondContact O-CD2 3.37Å; I18-F22 PolarHBondContact O-N 2.9Å; T19-F22 PolarHBondContact O-N 3.17Å; F22-F24 VanDerWaalsContact C-N 3.34Å; F22-F25 PolarHBondContact O-N 2.82Å; F22-W26 WeakPolarHBondContact O-CB 3.36Å; F22-W26 PolarHBondContact O-N 2.9Å
23L73Confident65.7Low88 Ų88112 Ų11246%0.46156%0.562SS.*Hα-helixtrans-64.2-40.3172.7-80.6161.1000111.3T19 V20 W26 L27T19-L23 VanDerWaalsContact O-CB 3.32Å; T19-L23 WeakPolarHBondContact O-CB 3.48Å; T19-L23 WeakPolarHBondContact O-CD1 3.5Å; T19-L23 VanDerWaalsContact O-CG 3.3Å; T19-L23 WeakPolarHBondContact O-CG 3.42Å; T19-L23 PolarHBondContact O-N 3.47Å; V20-L23 PolarHBondContact O-N 2.83Å; L23-W26 HydrophobicContact CD2-CE3 4.12Å; L23-W26 HydrophobicContact CD2-CZ3 4.43Å; L23-W26 PolarHBondContact O-N 2.98Å; L23-L27 WeakPolarHBondContact O-CB 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.31Å; L23-L27 PolarHBondContact O-N 3.49Å
24F71.8Confident64.6Low143 Ų143116.7 Ų116.763%0.62758%0.575SS**Hα-helixtrans-63.8-49.4175.4-162.7-93.1000111.1V20 I21 F22 W26 L27 F28V20-F24 WeakPolarHBondContact O-CB 3.23Å; V20-F24 PolarHBondContact O-N 3.34Å; I21-F24 WeakPolarHBondContact O-CB 3.5Å; I21-F24 PolarHBondContact O-N 3.2Å; F22-F24 VanDerWaalsContact C-N 3.34Å; F24-W26 PolarHBondContact O-N 3.02Å; F24-L27 PolarHBondContact O-N 2.96Å; F24-F28 VanDerWaalsContact O-CB 3.26Å; F24-F28 WeakPolarHBondContact O-CB 3.23Å; F24-F28 PolarHBondContact O-N 3.48Å
25F63Low63.3Low129 Ų129119.5 Ų119.557%0.56659%0.587SS**Hα-helixtrans-61.6-39.6173.7-87.1-71.5000112.7I21 F22 F28 M29I21-F25 HydrophobicContact CG2-CD2 3.64Å; I21-F25 HydrophobicContact CG2-CE2 3.72Å; I21-F25 VanDerWaalsContact O-CD2 3.31Å; I21-F25 WeakPolarHBondContact O-CD2 3.46Å; I21-F25 PolarHBondContact O-N 3.33Å; F22-F25 PolarHBondContact O-N 2.82Å; F25-F28 PolarHBondContact O-N 3.28Å; F25-M29 WeakPolarHBondContact O-CB 3.44Å; F25-M29 WeakPolarHBondContact O-CG 3.42Å; F25-M29 PolarHBondContact O-N 3.09Å
26W58.9Low62.3Low178 Ų178121 Ų12167%0.67459%0.587SS**Hα-helixtrans-70.1-36.7-178.9-172.737.1000112.6F22 L23 F24F22-W26 WeakPolarHBondContact O-CB 3.36Å; F22-W26 PolarHBondContact O-N 2.9Å; L23-W26 HydrophobicContact CD2-CE3 4.12Å; L23-W26 HydrophobicContact CD2-CZ3 4.43Å; L23-W26 PolarHBondContact O-N 2.98Å; F24-W26 PolarHBondContact O-N 3.02Å
27L62.1Low61.1Low138 Ų138122 Ų12272%0.72359%0.593SS**Hα-helixtrans-72.1-36.7172.6-73.6166.9000112.1L23 F24L23-L27 WeakPolarHBondContact O-CB 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.31Å; L23-L27 PolarHBondContact O-N 3.49Å; F24-L27 PolarHBondContact O-N 2.96Å
28F48.6Very low59.7Low129 Ų129123.5 Ų123.557%0.56660%0.598SS**Hα-helixtrans-85.5-24.1-175.9-142.1-93.8000114.3F24 F25F24-F28 VanDerWaalsContact O-CB 3.26Å; F24-F28 WeakPolarHBondContact O-CB 3.23Å; F24-F28 PolarHBondContact O-N 3.48Å; F25-F28 PolarHBondContact O-N 3.28Å
29M50.5Low58.6Low132 Ų132121 Ų12165%0.6559%0.591SS**G310 helixtrans-81.7-14177.2-74-77.7-73.300113.7F25 E31F25-M29 WeakPolarHBondContact O-CB 3.44Å; F25-M29 WeakPolarHBondContact O-CG 3.42Å; F25-M29 PolarHBondContact O-N 3.09Å; M29-E31 VanDerWaalsContact C-N 3.33Å; M29-E31 PolarHBondContact O-N 3.41Å
30K48.1Very low57Low167 Ų167122.2 Ų122.273%0.72659%0.59SS**G310 helixtrans-82.8-3.1-172.7-134.9-177.8-179.9-172.50115.3
31E47.6Very low55.2Low176 Ų176121.8 Ų121.882%0.82258%0.582SS**G310 helixtrans-130.349.1176.5-68.8-167145.100112.9M29M29-E31 VanDerWaalsContact C-N 3.33Å; M29-E31 PolarHBondContact O-N 3.41Å
32T46.1Very low53.8Low90 Ų90124.9 Ų124.955%0.55259%0.593SS**  trans-126.780.4158.949.10000110.4Y34T32-Y34 PolarHBondContact O-N 3.38Å
33L46.6Very low52.5Low137 Ų137126.8 Ų126.872%0.71760%0.596SS**  trans-58.1130.6169.1-81.7162.4000109.4D35 E36L33-D35 PolarHBondContact O-N 2.95Å; L33-E36 PolarHBondContact O-N 3.45Å
34Y43.5Very low50.7Low194 Ų194130.5 Ų130.576%0.76161%0.611SS**Hα-helixtrans-53.8-27.7-174.9-132.5-104.4000113.1T32 E36 V37 L38T32-Y34 PolarHBondContact O-N 3.38Å; Y34-E36 PolarHBondContact O-N 3.21Å; Y34-V37 PolarHBondContact O-N 3.1Å; Y34-L38 PolarHBondContact O-N 2.96Å
35D48.8Very low49.1Very low122 Ų122127.1 Ų127.165%0.65260%0.597SS**Hα-helixtrans-64.9-30.6177.3-67.2-46.1000114.3L33 L38 A39L33-D35 PolarHBondContact O-N 2.95Å; D35-L38 PolarHBondContact O-N 2.59Å; D35-A39 WeakPolarHBondContact O-CB 3.22Å; D35-A39 PolarHBondContact O-N 2.95Å
36E49.9Very low47.9Very low93 Ų93129 Ų12944%0.43561%0.605SS.*Hα-helixtrans-72.7-33-179.3-157.5-165131.300111.9L33 Y34 A39 K40L33-E36 PolarHBondContact O-N 3.45Å; Y34-E36 PolarHBondContact O-N 3.21Å; E36-A39 PolarHBondContact O-N 2.79Å; E36-K40 PolarHBondContact O-N 3.48Å; E36-K40 WeakPolarHBondContact OE1-CE 3.5Å; E36-K40 IonicContact OE1-NZ 3.85Å; E36-K40 PolarHBondContact OE1-NZ 2.89Å
37V54Low46.7Very low98 Ų98128.2 Ų128.259%0.59461%0.613SS**Hα-helixtrans-65.6-44.2175.6-178.90000109.9Y34 A39 K40 Q41Y34-V37 PolarHBondContact O-N 3.1Å; V37-A39 VanDerWaalsContact C-N 3.28Å; V37-A39 PolarHBondContact O-N 3.49Å; V37-K40 PolarHBondContact O-N 3.18Å; V37-Q41 PolarHBondContact O-N 3.33Å; V37-Q41 VanDerWaalsContact O-N 3.14Å
38L51.9Low45.2Very low105 Ų105129.7 Ų129.755%0.5562%0.62SS.*Hα-helixtrans-65-32.1175.6-152.671.6000112.3Y34 D35 K42Y34-L38 PolarHBondContact O-N 2.96Å; D35-L38 PolarHBondContact O-N 2.59Å; L38-K42 PolarHBondContact O-N 3.46Å
39A57Low44.1Very low40 Ų40127.5 Ų127.533%0.33162%0.621SS.*Hα-helixtrans-78.5-23.2176.200000114.5D35 E36 V37 R43D35-A39 WeakPolarHBondContact O-CB 3.22Å; D35-A39 PolarHBondContact O-N 2.95Å; E36-A39 PolarHBondContact O-N 2.79Å; V37-A39 VanDerWaalsContact C-N 3.28Å; V37-A39 PolarHBondContact O-N 3.49Å; A39-R43 PolarHBondContact O-NH1 3.21Å
40K47.6Very low43.1Very low97 Ų97127.8 Ų127.842%0.42263%0.63SS.*Hα-helixtrans-75.1-44.6170-88.5168.7173.2143.80111.3E36 V37 K42 R43 E44E36-K40 PolarHBondContact O-N 3.48Å; E36-K40 WeakPolarHBondContact OE1-CE 3.5Å; E36-K40 IonicContact OE1-NZ 3.85Å; E36-K40 PolarHBondContact OE1-NZ 2.89Å; V37-K40 PolarHBondContact O-N 3.18Å; K40-K42 VanDerWaalsContact C-N 3.28Å; K40-K42 PolarHBondContact O-N 2.85Å; K40-R43 PolarHBondContact O-N 2.87Å; K40-E44 PolarHBondContact O-N 3.06Å
41Q42.4Very low42.1Very low76 Ų76128.5 Ų128.536%0.35563%0.633SS.*Hα-helixtrans-59.1-36.4179.7-164.8174.613.300113.3V37 R43 T440V37-Q41 PolarHBondContact O-N 3.33Å; V37-Q41 VanDerWaalsContact O-N 3.14Å; Q41-R43 VanDerWaalsContact C-N 3.34Å; Q41-R43 PolarHBondContact O-N 3.44Å; Q41-T440 PolarHBondContact NE2-OG1 3.02Å
42K46.4Very low41.3Very low146 Ų146126.7 Ų126.764%0.63564%0.635SS**Hα-helixtrans-73.2-15.2173.7-86.8-177.9175.2174.20115.3L38 K40L38-K42 PolarHBondContact O-N 3.46Å; K40-K42 VanDerWaalsContact C-N 3.28Å; K40-K42 PolarHBondContact O-N 2.85Å
43R44.2Very low40.4Very low184 Ų184129.7 Ų129.769%0.69465%0.647SS**Hα-helixtrans-88.2-38177.6-77.2-172.4-176.493.7-13.1112.7A39 K40 Q41 Q45 K46A39-R43 PolarHBondContact O-NH1 3.21Å; K40-R43 PolarHBondContact O-N 2.87Å; Q41-R43 VanDerWaalsContact C-N 3.34Å; Q41-R43 PolarHBondContact O-N 3.44Å; R43-Q45 PolarHBondContact O-N 3.36Å; R43-K46 PolarHBondContact O-N 2.96Å
44E35.5Very low39.7Very low166 Ų166132.7 Ų132.778%0.77665%0.654SS**Hα-helixtrans-70.4-21.3-175.6-67.3-178.1176.300113.2K40 K46K40-E44 PolarHBondContact O-N 3.06Å; E44-K46 VanDerWaalsContact C-N 3.25Å; E44-K46 PolarHBondContact O-N 3.42Å
45Q38Very low39.2Very low72 Ų72132.7 Ų132.734%0.33666%0.658SS.*THydrogen-bonded Turntrans-76.1-4.4177.1-148.317430.500114.5R43 E444R43-Q45 PolarHBondContact O-N 3.36Å; Q45-E444 VanDerWaalsContact NE2-CD 3.26Å; Q45-E444 PolarHBondContact NE2-OE1 2.76Å
46K39.5Very low38.3Very low168 Ų168136.3 Ų136.373%0.7367%0.668SS**THydrogen-bonded Turntrans-127.553.3-175.1-84.2-168175.4-178.50114.3R43 E44R43-K46 PolarHBondContact O-N 2.96Å; E44-K46 VanDerWaalsContact C-N 3.25Å; E44-K46 PolarHBondContact O-N 3.42Å
47L31.9Very low37.4Very low162 Ų162136.7 Ų136.785%0.84869%0.687SS**  trans-164.482.7156.3-109.9148.8000113.4
48I31Very low36.1Very low169 Ų169141.6 Ų141.687%0.86770%0.704SS**  trans-84.6121.9160.6-66.2179000108.4
49S26.5Very low35.1Very low84 Ų84145.3 Ų145.359%0.58772%0.715SS**  trans-70.3125.6-172.9-179.60000113.6
50T28.6Very low33.9Very low138 Ų138151.7 Ų151.785%0.84774%0.736SS**  trans-86.5104.4158.848.20000110
51K28Very low33.1Very low181 Ų181155.2 Ų155.279%0.78775%0.751SS**  trans-90118.4170.5-69.7-172.2177.1-177.30110.9
52T29.4Very low32.3Very low139 Ų139158 Ų15885%0.85377%0.769SS**  trans-100.4103.8163.349.10000109.6
53D27.3Very low31.5Very low152 Ų152159.8 Ų159.881%0.81378%0.776SS**  trans-97.7132.4175.8-131.4-43.7000110.8
54K32.9Very low30.8Very low200 Ų200159 Ų15987%0.8778%0.778SS**  trans-116.6105.5179-82.6-178.5177.8172.70109.6
55K32.6Very low30.6Very low194 Ų194159.6 Ų159.684%0.84378%0.778SS**  trans-158.3127.1153-116.2160.4-172.2171.70115.3
56K30.5Very low30.1Very low198 Ų198162 Ų16286%0.86179%0.789SS**  trans61.7124.6154-69.6-178.2175.2-173.30119.2
57A30.6Very low29.7Very low101 Ų101160.6 Ų160.684%0.83579%0.788SS**  trans-82.7145166.100000111.1
58E25.7Very low29.6Very low201 Ų201162.2 Ų162.294%0.93979%0.791SS**  trans-141.3175.2150-132.4-170.9159.800111.8
59K32.5Very low29.4Very low183 Ų183161.5 Ų161.580%0.79679%0.789SS**  trans-119.2154.7-142.2-143.9172.5-171.8169.10112
60K31Very low29.4Very low174 Ų174160.9 Ų160.976%0.75780%0.796SS**  trans91.2120.1155.2-63.9172.9175.7167.80120.3
61K30.3Very low29.3Very low172 Ų172159.9 Ų159.975%0.74879%0.79SS**  87.2126.3122.2-82.5-172.3171.7-174.10121.2
62N26.9Very low29.3Very low135 Ų135158.3 Ų158.372%0.72279%0.79SS**  102.9108.4126.9-79.12.7000120.7
63K28.7Very low29.2Very low183 Ų183161.3 Ų161.380%0.79679%0.785SS**  101.393.6111.5-165.8176.9-178-177.20119
64K29.9Very low29.3Very low167 Ų167160.5 Ų160.573%0.72678%0.777SS**  49.1114.2120.5-171.4-173180175.40118.6
65K30.4Very low29.1Very low179 Ų179156.9 Ų156.978%0.77878%0.777SS**  168.6164120.2-91.9-162.7172-1690110.3
66E28.2Very low28.8Very low122 Ų122155.3 Ų155.357%0.5778%0.777SS**  cis-176.3121.8-34.9-177.2161.6-166.600108.7
67I31.1Very low28.8Very low138 Ų138151.8 Ų151.871%0.70878%0.777SS**  trans46.2124.5150.8-57.9166.2000120.4
68Q28.8Very low28.7Very low196 Ų196155.8 Ų155.892%0.91678%0.779SS**  -145.8136.1119-150.6163.718.300112.2
69N28.4Very low28.8Very low154 Ų154154.4 Ų154.482%0.82477%0.772SS**  trans-113158.3-174.3-97.8-9.5000111.5
70G26.6Very low28.7Very low71 Ų71151.4 Ų151.473%0.73277%0.769SS**  trans158.2135.2164.100000113.9
71T25.9Very low29.1Very low117 Ų117148 Ų14872%0.71877%0.765SS**  cis-179129.1-49.5-88.20000108.2
72L28.2Very low29Very low149 Ų149149.9 Ų149.978%0.7877%0.767SS**  trans63.1157.6169.6-96.452.8000117.3
73R27.8Very low28.9Very low201 Ų201149.5 Ų149.576%0.75877%0.765SS**  cis-145.8168.810.5-136.7-153.4-161.4-90.67.3113.1
74E28.1Very low28.7Very low136 Ų136149 Ų14964%0.63676%0.763SS**  trans-71.7163.6177.6-43.4110.4125.700114.5
75S29.5Very low28.6Very low124 Ų124149 Ų14987%0.86776%0.763SS**  -173.6126117-108.70000112.9
76D26.4Very low28.6Very low161 Ų161147.3 Ų147.386%0.86176%0.762SS**  trans-76.2156.1165.9-60-65.1000112
77S30.1Very low28.5Very low123 Ų123146.5 Ų146.586%0.8677%0.769SS**  trans-170.2150.4132.3-157.20000112.5
78E28.8Very low28.3Very low185 Ų185147.3 Ų147.386%0.86478%0.775SS**  trans-91.8156.7-172.4-53.6154.9115.100112.4
79H27.8Very low28Very low172 Ų172142.5 Ų142.580%0.79677%0.769SS**  -165.1142.1118.5-152.5-103.6000112.7
80V30.7Very low28.1Very low121 Ų121140 Ų14073%0.73376%0.764SS**  trans-121.7135.4175.3163.50000107.1
81P37.6Very low28.5Very low102 Ų102142.4 Ų142.466%0.66277%0.767SS**  -152.6133.5116.132.7-12000117.6
82R28.8Very low28.6Very low212 Ų212140.7 Ų140.780%0.876%0.764SS**  45.5123.6122.9-75.3-174.4-170.8171.85.8122.7
83D25.2Very low28.6Very low126 Ų126142.5 Ų142.567%0.67477%0.768SS**  91.8128.3115.9-66.5-17.3000123.8
84F23.4Very low28.7Very low172 Ų172139.5 Ų139.575%0.75477%0.767SS**  trans81.6106.6137.9-90.3-116.1000123.1
85K29.1Very low28.7Very low167 Ų167139.9 Ų139.973%0.72677%0.769SS**  60.8120.7125.4-88.8-172.9166.8-179.40122.6
86L29.1Very low28.6Very low145 Ų145140 Ų14076%0.75976%0.756SS**  83.2132.4130-76.1169.2000121.6
87S26.8Very low28.5Very low104 Ų104139.5 Ų139.573%0.72775%0.747SS**  trans73.9111.2144.4-620000121
88D26.3Very low28.3Very low155 Ų155139.1 Ų139.183%0.82974%0.739SS**  69.4113.2116.2-157.418.9000120
89A24.3Very low29Very low95 Ų95136.1 Ų136.179%0.78574%0.735SS**  trans-175.9123.8138.100000110.4
90S30.5Very low28.8Very low103 Ų103132.1 Ų132.172%0.7273%0.732SS**  trans-84.5157.415855.60000110.1
91P33.5Very low29.4Very low121 Ų121131.6 Ų131.679%0.78673%0.731SS**  -127.6144100.534.6-26.7000111.1
92A29.3Very low29Very low80 Ų80133.8 Ų133.866%0.66174%0.736SS**  cis82.1138.446.900000113.5
93E26.8Very low28.9Very low187 Ų187130 Ų13087%0.87473%0.732SS**  trans86.4123-177.4-57.5-172.5177.900117.3
94D30.8Very low28.9Very low138 Ų138131.2 Ų131.274%0.73874%0.744SS**  cis145.6155.9-21.8-88.9-50.6000109.5
95E27.6Very low29Very low145 Ų145127.2 Ų127.268%0.67874%0.742SS**  trans99.4145.2148.2-67.3-135.8118.100122.6
96Q28.5Very low28.8Very low125 Ų125127.6 Ų127.658%0.58475%0.746SS**  cis-173.8174.4-32.2-166.8138.7-10000110.5V98Q96-V98 HydrophobicContact CG-CG2 4.46Å
97F23.9Very low28.5Very low152 Ų152126.9 Ų126.967%0.66775%0.748SS**  trans101.6110.9156.3-66.9-74.5000118.1
98V24.7Very low28.5Very low114 Ų114126.6 Ų126.669%0.69175%0.747SS**  cis77144.221.1-163.90000111.4Q96Q96-V98 HydrophobicContact CG-CG2 4.46Å
99P43.5Very low28.2Very low123 Ų123124.5 Ų124.580%0.79974%0.744SS**  cis-134.4-179.227.418.610.2000120.5
100A23.5Very low28.2Very low87 Ų87125 Ų12572%0.71974%0.742SS**  trans-89.6-167.2-179.700000115.1
101P44.9Very low27.9Very low110 Ų110126 Ų12671%0.71474%0.743SS**  -153.4148.2101.136.1-16.9000119.5
102L28.5Very low27.4Very low148 Ų148130.1 Ų130.178%0.77574%0.743SS**  trans61154.2135.7-57.1171.3000120.4
103N27.6Very low27.2Very low133 Ų133131.4 Ų131.471%0.71174%0.735SS**  cis-167.9142.30.9-121.1-13.4000111.2
104V24.9Very low27.3Very low152 Ų152132.8 Ų132.892%0.92173%0.733SS**  trans-154.7121.2149.6-176.80000111.1
105A25.8Very low27.2Very low87 Ų87135.7 Ų135.772%0.71974%0.739SS**  trans-171.9156.7167.700000107.6
106E24.8Very low27.3Very low175 Ų175137.5 Ų137.582%0.81874%0.744SS**  cis-167.7-173.7-14.6-115.7-166.4163.700108.8
107T22.4Very low27.1Very low130 Ų130138 Ų13880%0.79875%0.745SS**  trans80.1145.6163.475.40000118.9
108S25.4Very low27.2Very low99 Ų99136.5 Ų136.569%0.69274%0.739SS**  cis-171.4152.2-17.650.60000114
109S21.6Very low27.3Very low111 Ų111139 Ų13978%0.77674%0.741SS**  trans75.9137.8144.176.40000124.3
110S23.1Very low26.4Very low105 Ų105141.2 Ų141.273%0.73474%0.738SS**  trans106.2103.6131.6-145.90000123.3
111V23.9Very low26.4Very low123 Ų123146.5 Ų146.575%0.74575%0.748SS**  68.1109.7122.4178.40000122.5
112R24.3Very low25.5Very low209 Ų209149.8 Ų149.879%0.78975%0.751SS**  89.5136125.5-162.8175.2-168.1156.78.7124.5
113E25.6Very low25.8Very low107 Ų107148.4 Ų148.450%0.575%0.751SS.*  trans24.7128154.2-61.4-179.48800125.2
114R28.3Very low25.6Very low216 Ų216146 Ų14682%0.81575%0.745SS**  63.8144.1127.8-65.8174.3163.9147-10.5122.7
115K28.4Very low25.5Very low199 Ų199145.5 Ų145.587%0.86574%0.736SS**  trans91.5101.8155.5-75.3-176.8175.9177.90121.4
116K28.8Very low25.5Very low182 Ų182149.1 Ų149.179%0.79174%0.738SS**  52115.4106.8-143.6-178.6-173.8174.40120.3
117K24.5Very low25.6Very low137 Ų137147.8 Ų147.860%0.59673%0.732SS**  96.5133.9129-107.8-171.9165.4-146.80124.2
118E25.7Very low25.8Very low120 Ų120148.9 Ų148.956%0.56173%0.728SS**  trans67.3152147.9-82.5-179.998.900118.2
119K27.5Very low25.7Very low165 Ų165149.4 Ų149.472%0.71773%0.726SS**  cis-160.6137.725.4-147.1172.3-177.3178.80115
120K25.8Very low25.9Very low171 Ų171150.9 Ų150.974%0.74372%0.724SS**  trans33.9138.6140.7-63.3-175.8-179.5-171.60122.7
121Q23.2Very low26.1Very low198 Ų198154.9 Ų154.993%0.92573%0.728SS**  -156160.490.1-114176-1300115.4
122K26Very low26.2Very low179 Ų179156.5 Ų156.578%0.77873%0.728SS**  trans-128.7163-171.4-151.8-163.7-178.7-175.70107
123P33.9Very low26.4Very low119 Ų119151.6 Ų151.677%0.77373%0.726SS**  -148.2-167.182.922.72.9000113.2
124S22.9Very low26.3Very low83 Ų83154.6 Ų154.658%0.5875%0.745SS**  -172.5170-57.457.30000111.6
125L23.6Very low26.1Very low141 Ų141148.9 Ų148.974%0.73874%0.744SS**  trans100.8122.2-179.2-77.791.1000114.8
126E25.6Very low26.2Very low163 Ų163144.8 Ų144.876%0.76274%0.74SS**  83.6136.252.4-75.8170.4-174.800112.6
127E26.2Very low26.1Very low146 Ų146145 Ų14568%0.68274%0.741SS**  cis-168.5169.1-12-156.4-161.8129.700109.4
128Q26.8Very low26.5Very low154 Ų154145.8 Ų145.872%0.7275%0.751SS**  trans70.7158.2158.2-59.1-169.67.700120.8
129V24.7Very low27.3Very low109 Ų109146.2 Ų146.266%0.66176%0.764SS**  cis-165.3140.3-19.1135.60000110.9
130I25.3Very low27.2Very low143 Ų143141.7 Ų141.773%0.73376%0.763SS**  trans22.8132144-44.2167.7000121.4
131K26.3Very low27.3Very low189 Ų189143.6 Ų143.682%0.82277%0.772SS**  170.3-177.9104.6-141.6147.6-171.7-1770116.2
132E25.6Very low27.4Very low157 Ų157143.7 Ų143.773%0.73477%0.769SS**  trans-109.7168.4-155.1-54.7156.4105.200116.7
133S28.7Very low27.4Very low106 Ų106141.7 Ų141.774%0.74177%0.772SS**  trans70.7123.4134.866.80000125.1
134D24.4Very low26.8Very low169 Ų169143.4 Ų143.490%0.90477%0.769SS**  79.4161.5127.1-1433.7000124
135A23.6Very low27.7Very low97 Ų97144.8 Ų144.880%0.80278%0.777SS**  trans97.5158161.200000121.2
136S31.5Very low27.8Very low112 Ų112143.1 Ų143.178%0.78377%0.772SS**  trans-134.9170.9-154.5-170.40000114.6
137K27.1Very low27.8Very low187 Ų187142.7 Ų142.781%0.81377%0.774SS**  trans93.5112.2157.5-79174.8174.8171.20123.4
138I33.1Very low27.7Very low154 Ų154140.8 Ų140.879%0.7977%0.772SS**  trans-2.8152.6139.2-4.6177000120.8
139P41.6Very low27.6Very low129 Ų129139 Ų13984%0.83877%0.772SS**  -142.8173.785.640.5-27000114.9
140G24.6Very low27.7Very low69 Ų69143.1 Ų143.171%0.71178%0.781SS**  cis137.392.6-12.700000116.6
141K28.1Very low27.8Very low211 Ų211145.2 Ų145.292%0.91779%0.788SS**  trans-157.294.7172.8-134.8177.6-172.4-179.90118
142K25.4Very low28.3Very low200 Ų200142.2 Ų142.287%0.8779%0.787SS**  34.7122127.3-129-176.9-169.5-1750122.8
143V25.9Very low28.3Very low138 Ų138139 Ų13984%0.83679%0.787SS**  159142.4109.7167.50000113.1
144E22.6Very low29.1Very low154 Ų154139.6 Ų139.672%0.7279%0.789SS**  trans-91.6-179.4-177.7-121.7-166119.300113.4
145P41Very low29.8Very low113 Ų113137 Ų13773%0.73478%0.782SS**  cis-149.6155.742.238.4-14.9000121.4
146V24.8Very low30.7Very low106 Ų106138 Ų13864%0.64278%0.78SS**  trans40118.9136.8-169.10000122.5
147L25.5Very low31Very low153 Ų153138.7 Ų138.780%0.80178%0.782SS**  -172.2128.7112.8-126.3102.8000115.6
148V24.6Very low31Very low106 Ų106138.2 Ų138.264%0.64279%0.787SS**  trans69.897.9139.1167.40000122.9
149T24.2Very low30.7Very low118 Ų118139.9 Ų139.972%0.72479%0.792SS**  trans79.9149.3130.866.50000124.6
150K27.3Very low30Very low194 Ų194138.4 Ų138.484%0.84379%0.79SS**  trans90.193.7157.7-73.6168.9-176.3-179.60119
151Q28Very low30Very low188 Ų188139.6 Ų139.688%0.87979%0.793SS**  trans-50153.6131.5-66.9172.5-53.800110.2
152P36.4Very low29.8Very low125 Ų125133.8 Ų133.881%0.81278%0.784SS**  -141.4162.110336.1-22.7000114.8
153A26.1Very low29.8Very low89 Ų89130.7 Ų130.774%0.73678%0.777SS**  trans-98.8174170.700000110.5
154P44.9Very low29.7Very low119 Ų119132.3 Ų132.377%0.77377%0.772SS**  trans-78.6-177.5-166.138.2-38.6000112.6
155P40.2Very low29.9Very low116 Ų116135.2 Ų135.275%0.75378%0.783SS**  cis-143.4-140.626.843-18.8000112.5
156P41.9Very low29.3Very low117 Ų117139.3 Ų139.376%0.7679%0.789SS**  cis-121.3-177.6-29.326.3-3.1000113.4
157P36.9Very low29.4Very low127 Ų127139.4 Ų139.483%0.82580%0.801SS**  trans-100.8165.7-16638.8-35.2000116.6
158L27.4Very low29.4Very low177 Ų177135.9 Ų135.993%0.92780%0.801SS**  trans-134.2136.6169.6-102.4160.7000110.1
159E26.4Very low29.5Very low189 Ų189140.6 Ų140.688%0.88382%0.816SS**  trans-84.6146.4170.2-65.2-176.3116.400111.7
160A26.9Very low29.7Very low98 Ų98144.5 Ų144.581%0.8182%0.823SS**  -178.9136.3125.900000114.4
161A24.8Very low29.7Very low93 Ų93145 Ų14577%0.76983%0.826SS**  trans66.293.9143.800000122.6
162A23.8Very low29.7Very low89 Ų89141.2 Ų141.274%0.73682%0.82SS**  62.1143.5117.600000123.1
163L25.9Very low29.3Very low136 Ų136144.3 Ų144.371%0.71282%0.821SS**  178.1129.4113.4-113.477.1000116.2
164K25Very low29.2Very low171 Ų171146.8 Ų146.874%0.74382%0.821SS**  trans47.4136.6135.6-65.7173-163.8162.40123.4
165K25.9Very low28.2Very low215 Ų215144.3 Ų144.394%0.93582%0.818SS**  -142168.5122.9-106156.4-174.4171.30109.8
166K29.1Very low27.6Very low200 Ų200144 Ų14487%0.8782%0.818SS**  trans-163.3120.1-151.5175.7-160.4176.5-172.30114.7
167A26.9Very low26.7Very low107 Ų107147 Ų14788%0.88482%0.822SS**  trans-165.1148.716100000110.7
168G23.7Very low26.3Very low79 Ų79148.6 Ų148.681%0.81482%0.818SS**  cis-140.7-166.6-11.300000108.6
169Q28.1Very low26.3Very low205 Ų205147.5 Ų147.596%0.95881%0.809SS**  cis-146.9-166.611.7-130.4174.55.800110.1
170K28.4Very low26.4Very low200 Ų200143.9 Ų143.987%0.8780%0.795SS**  trans-145.8153.9-152-164.7-177.9-172.7-177.60115.7
171K26.8Very low26.6Very low205 Ų205146.8 Ų146.889%0.89179%0.79SS**  trans112.7144167.8-69176.5175.5178.90113
172S27.6Very low26.6Very low109 Ų109151.5 Ų151.576%0.76279%0.793SS**  cis-136.3140.715.4420000112.1
173K27.5Very low26.7Very low189 Ų189152.1 Ų152.182%0.82279%0.787SS**  54.2131.991.7-99.1-158.5156-163.60114.6
174N24.8Very low26.8Very low141 Ų141154.3 Ų154.375%0.75479%0.794SS**  cis-138.3174.73.2-61.6-57.1000108.5
175G24.6Very low26.7Very low67 Ų67154 Ų15469%0.69180%0.797SS**  cis157.8153.1-4.900000111.4
176S26.5Very low26.7Very low110 Ų110149.9 Ų149.977%0.76979%0.785SS**  trans58.8150.9172.9-76.90000118.4
177E24.6Very low26.5Very low180 Ų180148.7 Ų148.784%0.84178%0.784SS**  cis-157.3-174-22.9-130.3157.8148.900109.4
178E26.6Very low26.5Very low160 Ų160147.8 Ų147.875%0.74878%0.777SS**  trans-78.3159.2-164.1-109.4179.9-158.400117.9
179Q28.9Very low27.5Very low155 Ų155149.2 Ų149.272%0.72477%0.771SS**  trans104.7124.7136.6-88.2174.252.100123.3
180D27.4Very low27.4Very low112 Ų112144.4 Ų144.460%0.59976%0.761SS**  trans75.6106.7141-91.58.8000124.7
181K31.2Very low27.6Very low160 Ų160142.9 Ų142.970%0.69675%0.754SS**  64.8106.2120-72.2-176.9-167.590.60121.3
182K26.1Very low27.7Very low191 Ų191140.6 Ų140.683%0.8375%0.747SS**  89.8130.9108.4-148-156.7176.1-1720119.1
183V24.1Very low27.8Very low102 Ų102143.5 Ų143.562%0.61875%0.748SS**  trans96.3111.2156.7-168.10000118.6
184E28.8Very low27.7Very low182 Ų182140.5 Ų140.585%0.8574%0.741SS**  trans30.9140.1143-59.5171.193.900123.2
185M23.1Very low27.7Very low166 Ų166139.6 Ų139.682%0.81874%0.74SS**  trans-146.9117.6149.1-170.891.278.400110.5
186L25.9Very low27.7Very low128 Ų128143.5 Ų143.567%0.6774%0.744SS**  trans25.7146.3145.9-68.6101.1000121.1
187M24.2Very low27.4Very low175 Ų175145.2 Ų145.286%0.86275%0.745SS**  cis-141.8151.246.2-72.8-79.5179.900115.3
188A27.7Very low27.3Very low87 Ų87140.8 Ų140.872%0.71973%0.733SS**  trans-111.3-158.4177.400000108.5
189P44.2Very low27.1Very low109 Ų109140.8 Ų140.871%0.70873%0.733SS**  cis-144.9175.53.844.1-24.5000119.3
190S27.1Very low27Very low105 Ų105140.9 Ų140.973%0.73473%0.733SS**  trans83.8110.6142.4-69.60000124
191K32.2Very low27Very low167 Ų167140.8 Ų140.873%0.72673%0.733SS**  69.9118.7129.2-76.5178.6159.5-750123.1
192E29.7Very low26.8Very low158 Ų158138.2 Ų138.274%0.73873%0.731SS**  38.6128.5125.1-57.7167136.300118.4
193Q29.1Very low26.9Very low169 Ų169136.9 Ų136.979%0.7973%0.725SS**  -174.9152.458.3-160.2-171.9-30.100112.9
194D25.8Very low27.3Very low126 Ų126138.2 Ų138.267%0.67472%0.724SS**  trans56.7140150.4-86-40.2000127.6
195V24.9Very low27.3Very low122 Ų122137.3 Ų137.374%0.73972%0.72SS**  trans77.8108.4139.2173.40000123.9
196L23.2Very low27.6Very low149 Ų149133.1 Ų133.178%0.7872%0.719SS**  57.7131.4121.7-147.578.8000125.1
197L21.2Very low27.7Very low147 Ų147130.3 Ų130.377%0.7772%0.721SS**  trans73.1124.4144.1-96.9169.3000124.5
198S21.4Very low28Very low86 Ų86130.5 Ų130.560%0.60173%0.725SS**  97.9122.3125.4-136.70000123.5
199H23.4Very low28.1Very low160 Ų160129.4 Ų129.474%0.74172%0.722SS**  trans58.3139135.2-89-63.1000125.6
200Q26.5Very low27.3Very low158 Ų158133.9 Ų133.974%0.73873%0.73SS**  trans73.7138.4138.5-82.9-171.4-60.200119.4
201D28.3Very low27.5Very low109 Ų109137.5 Ų137.558%0.58373%0.733SS**  cis-177.5167.54.9-137.1-23.6000111.2
202T26.3Very low27.2Very low106 Ų106139 Ų13965%0.6574%0.739SS**  trans68.3146.7150.656.60000121.1
203K28.6Very low27.1Very low163 Ų163134.7 Ų134.771%0.70974%0.738SS**  cis-164.5148.49.7-127.8166.7177.4-159.60116.7
204Q32.8Very low26.9Very low130 Ų130135.1 Ų135.161%0.60775%0.745SS**  trans61.8153.3135.8-86.6177.8-5600122.8
205E26.9Very low27Very low164 Ų164134.3 Ų134.377%0.76675%0.749SS**  cis-164.5156.7-12.7-166.2150.6-94.200111.1
206G29.3Very low27.1Very low77 Ų77138 Ų13879%0.79476%0.755SS**  cis142.748.1-22.400000120
207G29.4Very low27.3Very low69 Ų69139.8 Ų139.871%0.71176%0.756SS**  trans-174.8170.1173.200000117.3
208L30.2Very low27.5Very low180 Ų180139 Ų13994%0.94275%0.748SS**  cis-151.5163.1-2.3-88.2104000107.9
209G29.8Very low27.7Very low64 Ų64142.4 Ų142.466%0.6675%0.753SS**  cis140.2147.9-2.200000113.3
210K27.2Very low27.8Very low202 Ų202139.3 Ų139.388%0.87875%0.749SS**  trans140.9144.7155.8-82.5168.1-177.2175.90113.1
211K30.4Very low27.7Very low181 Ų181137.8 Ų137.879%0.78774%0.742SS**  cis-172.2148.4-29.2-137.1176.5-177.7172.50111.8
212K27.6Very low27.5Very low198 Ų198138.2 Ų138.286%0.86174%0.744SS**  trans87140153.3-66.7-177.9172.9-174.40119.1
213G25.9Very low27.6Very low69 Ų69139.5 Ų139.571%0.71175%0.752SS**  cis158.8133.9-15.800000118.3
214L24.9Very low27.5Very low178 Ų178135.7 Ų135.793%0.93275%0.75SS**  trans77.4160.2145.9-100.579.9000122.8
215S29Very low27.1Very low109 Ų109135 Ų13576%0.76276%0.755SS**  trans-140.6176.7-163.6-36.90000111
216K27Very low27.2Very low199 Ų199134.5 Ų134.587%0.86576%0.756SS**  trans81115.6142.3-165.9176.8-168.6170.20119.3
217K26.2Very low27Very low186 Ų186137.3 Ų137.381%0.80976%0.758SS**  trans178.8156.7133.7-93.4-148.3176.2-153.30110.3
218Q26.4Very low27Very low130 Ų130140.6 Ų140.661%0.60776%0.759SS**  cis-177.9136.4-25.9-171.4176.44.100110.3
219K25.7Very low26.7Very low159 Ų159140 Ų14069%0.69175%0.751SS**  trans59.2159.5158.6-84.2-167.8169-139.60118.7E221K219-E221 WeakPolarHBondContact CE-OE2 3.48Å; K219-E221 IonicContact NZ-OE2 3.4Å; K219-E221 PolarHBondContact NZ-OE2 3.32Å
220S25.1Very low27.2Very low94 Ų94142.2 Ų142.266%0.65775%0.754SS**  cis-154.9136.311.54.70000109.3
221E24Very low27.4Very low126 Ų126140 Ų14059%0.58975%0.751SS**  68.2136.699.4-67.2-176.791.100115.1K219K219-E221 WeakPolarHBondContact CE-OE2 3.48Å; K219-E221 IonicContact NZ-OE2 3.4Å; K219-E221 PolarHBondContact NZ-OE2 3.32Å
222N25.8Very low27.2Very low119 Ų119138.5 Ų138.564%0.63675%0.75SS**  cis-166.9152.710.8-114.4-14.3000115.5
223V26.6Very low27.1Very low133 Ų133137.2 Ų137.281%0.80675%0.747SS**  trans71.4138.2136.7171.10000118.4
224A27.6Very low27.1Very low82 Ų82138 Ų13868%0.67875%0.747SS**  cis-137.8-170.419.800000111.6
225V24.8Very low27.1Very low116 Ų116135.5 Ų135.570%0.70374%0.739SS**  cis-157.1126.7-4.5102.70000105.1
226L28Very low26.9Very low153 Ų153136 Ų13680%0.80174%0.738SS**  57.2124.494.7-74.4142.4000114.8
227V25.4Very low26.6Very low137 Ų137136 Ų13683%0.8373%0.734SS**  cis-145.5162.112.9-173.30000111.3
228D30Very low26.8Very low138 Ų138132.9 Ų132.974%0.73873%0.725SS**  trans-109164-174.2-138.4-24000114.1
229E23.2Very low27Very low166 Ų166132.2 Ų132.278%0.77673%0.732SS**  trans58.7167.8155.7-87.2-166.3113.700122.4
230P40.8Very low27Very low111 Ų111131.2 Ų131.272%0.72173%0.733SS**  cis-131.5179.1-725.4-0.9000117.2
231L30.2Very low27Very low156 Ų156133.3 Ų133.382%0.81774%0.737SS**  trans-37.7144.6169.3-165.676.2000119.2
232I26.9Very low27.1Very low150 Ų150133.3 Ų133.377%0.76974%0.741SS**  179132.4127.6-95161.5000115.7
233H25.2Very low27.2Very low170 Ų170131.6 Ų131.679%0.78774%0.744SS**  trans34.3112.8159.3-72.5-81.2000125.5
234A27.2Very low27.3Very low86 Ų86131.9 Ų131.971%0.71174%0.741SS**  31.1141.5122.300000124.1
235T24.3Very low27.5Very low125 Ų125132.7 Ų132.777%0.76774%0.741SS**  trans133.8120.3130.8-53.10000116
236T23.9Very low27.5Very low121 Ų121133.8 Ų133.874%0.74274%0.743SS**  trans63.9115.5145.7-59.20000123.5
237Y21.3Very low27.5Very low197 Ų197133.2 Ų133.277%0.77374%0.74SS**  40.6112.6121.4-141.4-102.2000121.2
238I31.3Very low27.5Very low122 Ų122133.5 Ų133.563%0.62673%0.734SS**  trans45119.5137.6-51.1-175.2000117.5
239P30Very low27.2Very low115 Ų115136.6 Ų136.675%0.74775%0.747SS**  -152.4-177.872.340.8-19.8000119.1
240L24.7Very low27.5Very low139 Ų139134.7 Ų134.773%0.72874%0.742SS**  trans-30.6165.9167.7-63.978.9000116.7
241D26.8Very low27Very low137 Ų137138.2 Ų138.273%0.73375%0.746SS**  cis-170.5167.937.7-143.5-17.7000116.1
242N25.5Very low27Very low126 Ų126140.7 Ų140.767%0.67474%0.744SS**  trans65.3114.8141.1-161.916.4000122.5
243A27.9Very low27.1Very low84 Ų84140.5 Ų140.569%0.69474%0.74SS**  -162.7100.2121.800000112.8
244N28.9Very low27.3Very low139 Ų139139.7 Ų139.774%0.74374%0.74SS**  trans55.6137.9146.8-59.9-34.2000119.9
245S30.9Very low27.3Very low99 Ų99143.8 Ų143.869%0.69275%0.748SS**  cis-177.61574.846.30000106.2
246N26.3Very low27.4Very low138 Ų138144.4 Ų144.474%0.73875%0.747SS**  cis-172.3158.6-1.5-105.8-17.3000104.3
247L27.1Very low27.6Very low141 Ų141146.2 Ų146.274%0.73875%0.749SS**  cis-156.6149-3.1-168.474.8000107.3
248M25.1Very low27.8Very low144 Ų144144.6 Ų144.671%0.70975%0.752SS**  trans12.7135.7159-65.8-173.5136.400121.8D250M248-D250 HydrophobicContact CE-CB 4.08Å
249M24.2Very low27.6Very low202 Ų202147.5 Ų147.5100%0.99576%0.76SS**  -123109.1123.1-128.5-172.4-16900108.7
250D28.9Very low28.2Very low127 Ų127146.8 Ų146.868%0.67976%0.755SS**  trans-101.8154.8173.6-159.7-0.6000110.5M248M248-D250 HydrophobicContact CE-CB 4.08Å
251K31.2Very low28.1Very low185 Ų185147.2 Ų147.280%0.80476%0.759SS**  trans-94.7130-174.5-62.9170.3-179.2168.70111.5
252R29.3Very low28.2Very low207 Ų207148 Ų14878%0.78176%0.757SS**  trans-158.1139.2136.7-151.5134.1-67.7-144.811.3116.1
253E28.3Very low28.1Very low146 Ų146146.7 Ų146.768%0.68275%0.754SS**  trans48.5107.7150.1-76.3145.9-14600122.3
254I30.1Very low28Very low154 Ų154151.6 Ų151.679%0.7976%0.762SS**  36.8113.4114.1-53.1168.3000117
255I28.4Very low27.7Very low171 Ų171148 Ų14888%0.87776%0.759SS**  -160162.4127.3-100.2153.1000109.2
256D25.6Very low27.5Very low138 Ų138149.4 Ų149.474%0.73876%0.757SS**  trans-69.1166.9-158.1-113.6-44.7000119.2
257M27.1Very low27.5Very low160 Ų160149.7 Ų149.779%0.78875%0.753SS**  trans48.9113.6146.8-69.51664500120.7
258I26.4Very low27.5Very low162 Ų162149 Ų14983%0.83175%0.745SS**  trans-134.2112.8131.7-59.4-176.5000109.7
259K27.1Very low27.7Very low183 Ų183147.2 Ų147.280%0.79675%0.746SS**  trans-96.5155.1148.6-106-170.7178.1-179.10108.3
260P41.7Very low27.7Very low100 Ų100141.1 Ų141.165%0.64974%0.735SS**  trans-85.5146.3-167.134.6-35.1000112.6
261D23.9Very low27.6Very low149 Ų149140.6 Ų140.680%0.79774%0.737SS**  -171.6141.6111.2-112-25.6000113.6
262H27.5Very low27.4Very low152 Ų152140.5 Ų140.570%0.70474%0.736SS**  trans43.2140.1130.1-135.4-37000123.3
263V25.4Very low27.4Very low100 Ų100138.9 Ų138.961%0.60674%0.735SS**  trans105.2120.3146.8-172.70000118.8
264E24.9Very low27.3Very low187 Ų187138.8 Ų138.887%0.87474%0.738SS**  trans45.8140.8151.1-64.9161.7163.300123.2
265G22.7Very low27.3Very low64 Ų64139.5 Ų139.566%0.6674%0.736SS**  136.486.1121.600000118.6
266I26.2Very low27.4Very low128 Ų128137.7 Ų137.766%0.65673%0.727SS**  46.299.8111.7-62.3175.6000115.4
267Q26.7Very low27.5Very low143 Ų143139.6 Ų139.667%0.66873%0.731SS**  166.8140.987.6-118.2173.145.400118.7
268K27Very low27.7Very low128 Ų128137.2 Ų137.256%0.55773%0.725SS**  trans51.4102.1132.8-79.3165.7-163.2147.30122.3D302K268-D302 WeakPolarHBondContact CE-OD2 3.38Å; K268-D302 IonicContact NZ-OD2 2.89Å; K268-D302 PolarHBondContact NZ-OD2 3.01Å
269S30.2Very low27.8Very low106 Ų106135.8 Ų135.874%0.74172%0.72SS**  65.4133.810975.80000123.2
270G23.6Very low28.2Very low74 Ų74136 Ų13676%0.76372%0.72SS**  trans-155.179155.200000110.7
271T25.7Very low27.9Very low115 Ų115140.5 Ų140.571%0.70673%0.733SS**  58.6134.595.2-18.90000118
272K28.9Very low28.3Very low184 Ų184141 Ų14180%0.874%0.735SS**  trans90.4141.9163.4-55162.4-173.5167.10115.6
273K27.6Very low28.8Very low172 Ų172138 Ų13875%0.74874%0.737SS**  cis-172152.2-6.5-115.5-178.2173.7-171.80111.2
274L27.6Very low29.3Very low144 Ų144142.3 Ų142.375%0.75475%0.751SS**  trans66.5152.8159.7-85.790.7000117.8
275K29.1Very low30.5Very low169 Ų169139.1 Ų139.174%0.73574%0.744SS**  cis-158.2140.62.7-151.5-175.4177.5-171.60111.7
276I29.9Very low32.2Very low134 Ų134143.6 Ų143.669%0.68775%0.745SS**  trans21.1131.2139.6-50.6171.3000117.7
277E28Very low33.6Very low178 Ų178145 Ų14583%0.83275%0.747SS**  -162.4170.374.9-149.8137.2-118.800116.6
278T32.7Very low35.2Very low109 Ų109145.9 Ų145.967%0.66975%0.748SS**  trans-61.3168.4-171.7220000117
279D26.9Very low36.7Very low133 Ų133143.4 Ų143.471%0.71174%0.741SS**  cis-145.2141.537.9-90-56.6000112.5
280K36.6Very low38.5Very low186 Ų186144.2 Ų144.281%0.80973%0.731SS**  54.5101.687.3-77.4-175.7177.61740117.7
281E35Very low40.6Very low195 Ų195144.8 Ų144.891%0.91172%0.717SS**  -158.6157.3113.7-139.6171.3-178.400112.1
282N31.5Very low42.6Very low160 Ų160143.8 Ų143.886%0.85671%0.707SS**  trans-90.1175.8177.7-57.2-57.6000110
283A37.8Very low44.3Very low90 Ų90138.5 Ų138.574%0.74469%0.693SS**  cis-159.317818.200000113
284E37.8Very low46.1Very low189 Ų189134.3 Ų134.388%0.88368%0.678SS**  trans71.481.6165.6-61.5-161.7147.900119.5
285V49.1Very low47.9Very low121 Ų121136 Ų13673%0.73368%0.679SS**  trans-72.7136.2162.2173.80000111.1D289V285-D289 HydrophobicContact CG1-CB 4.39Å
286K59Low49.6Very low157 Ų157133.4 Ų133.468%0.68368%0.678SS**  trans-91.5146.2166.4-64.7169.7-177.7168.40109.6K288 D289 F290K286-K288 PolarHBondContact O-N 3.38Å; K286-D289 WeakPolarHBondContact CB-OD2 3.28Å; K286-D289 PolarHBondContact N-OD2 3.5Å; K286-D289 VanDerWaalsContact N-OD2 3.09Å; K286-D289 WeakPolarHBondContact O-CB 3.5Å; K286-D289 PolarHBondContact O-N 2.94Å; K286-F290 PolarHBondContact O-N 3.44Å
287F54.3Low51.2Low158 Ų158132.6 Ų132.669%0.69367%0.672SS**Hα-helixtrans-53-26.9176.8-179.3-103.4000113.5D289 F290 L291F287-D289 VanDerWaalsContact C-N 3.32Å; F287-D289 PolarHBondContact O-N 2.98Å; F287-F290 PolarHBondContact O-N 3.44Å; F287-L291 HydrophobicContact CD1-CD1 4.07Å; F287-L291 HydrophobicContact CE1-CD1 3.64Å; F287-L291 HydrophobicContact CE1-CG 4.27Å; F287-L291 HydrophobicContact CZ-CD1 4.26Å; F287-L291 PolarHBondContact O-N 2.81Å
288K61.9Low52.5Low161 Ų161132.7 Ų132.770%0.768%0.675SS**Hα-helixtrans-64-34.4174.2-149.6175-173.9-178.60112.7K286 L291 L292K286-K288 PolarHBondContact O-N 3.38Å; K288-L291 PolarHBondContact O-N 2.98Å; K288-L292 WeakPolarHBondContact O-CB 3.38Å; K288-L292 WeakPolarHBondContact O-CG 3.28Å; K288-L292 PolarHBondContact O-N 3.09Å
289D57.8Low54.3Low76 Ų76131.3 Ų131.341%0.40666%0.66SS.*Hα-helixtrans-78.3-32.6-179.4-48.3-38.9000111V285 K286 F287 L292 S293V285-D289 HydrophobicContact CG1-CB 4.39Å; K286-D289 WeakPolarHBondContact CB-OD2 3.28Å; K286-D289 PolarHBondContact N-OD2 3.5Å; K286-D289 VanDerWaalsContact N-OD2 3.09Å; K286-D289 WeakPolarHBondContact O-CB 3.5Å; K286-D289 PolarHBondContact O-N 2.94Å; F287-D289 VanDerWaalsContact C-N 3.32Å; F287-D289 PolarHBondContact O-N 2.98Å; D289-L292 PolarHBondContact O-N 3.37Å; D289-S293 VanDerWaalsContact O-CB 3.28Å; D289-S293 WeakPolarHBondContact O-CB 3.47Å; D289-S293 PolarHBondContact O-N 2.81Å
290F67.6Low56.4Low123 Ų123127.6 Ų127.654%0.53965%0.645SS.*Hα-helixtrans-61.8-44.7168.7179.3-102.1000111.5K286 F287 S293 L294K286-F290 PolarHBondContact O-N 3.44Å; F287-F290 PolarHBondContact O-N 3.44Å; F290-S293 PolarHBondContact O-N 3.49Å; F290-L294 WeakPolarHBondContact O-CB 3.39Å; F290-L294 PolarHBondContact O-N 3.3Å
291L66.8Low57.6Low86 Ų86126 Ų12645%0.4564%0.64SS.*Hα-helixtrans-68-35.3174.9-71.7175.3000113.1F287 K288 K295F287-L291 HydrophobicContact CD1-CD1 4.07Å; F287-L291 HydrophobicContact CE1-CD1 3.64Å; F287-L291 HydrophobicContact CE1-CG 4.27Å; F287-L291 HydrophobicContact CZ-CD1 4.26Å; F287-L291 PolarHBondContact O-N 2.81Å; K288-L291 PolarHBondContact O-N 2.98Å; L291-K295 VanDerWaalsContact O-CB 3.28Å; L291-K295 WeakPolarHBondContact O-CB 3.38Å; L291-K295 PolarHBondContact O-N 3.39Å
292L68.3Low59.3Low95 Ų95120.7 Ų120.750%0.49762%0.618SS.*Hα-helixtrans-66.8-42.1173.5-78.8162.2000111.5K288 D289 K295 T296K288-L292 WeakPolarHBondContact O-CB 3.38Å; K288-L292 WeakPolarHBondContact O-CG 3.28Å; K288-L292 PolarHBondContact O-N 3.09Å; D289-L292 PolarHBondContact O-N 3.37Å; L292-K295 WeakPolarHBondContact O-CB 3.37Å; L292-K295 PolarHBondContact O-N 3.03Å; L292-T296 PolarHBondContact O-N 3.19Å; L292-T296 PolarHBondContact O-OG1 2.9Å
293S64.5Low61.3Low72 Ų72118.1 Ų118.150%0.50360%0.601SS.*Hα-helixtrans-65.9-40.6175.7-167.60000112D289 F290 K295 T296 M297D289-S293 VanDerWaalsContact O-CB 3.28Å; D289-S293 WeakPolarHBondContact O-CB 3.47Å; D289-S293 PolarHBondContact O-N 2.81Å; F290-S293 PolarHBondContact O-N 3.49Å; S293-K295 PolarHBondContact O-N 3.36Å; S293-T296 PolarHBondContact O-N 3.05Å; S293-T296 PolarHBondContact O-OG1 3.38Å; S293-M297 WeakPolarHBondContact O-CB 3.34Å; S293-M297 PolarHBondContact O-N 3.42Å
294L66.8Low62.8Low84 Ų84115.6 Ų115.644%0.4458%0.58SS.*Hα-helixtrans-65.2-29173.9-161.477000111.8F290 F299F290-L294 WeakPolarHBondContact O-CB 3.39Å; F290-L294 PolarHBondContact O-N 3.3Å; L294-F299 HydrophobicContact CD1-CZ 3.98Å
295K65.4Low64.4Low181 Ų181111 Ų11179%0.78756%0.561SS**Hα-helixtrans-79-24.2176.7-175.4176.7178.7-177.60113.5L291 L292 S293L291-K295 VanDerWaalsContact O-CB 3.28Å; L291-K295 WeakPolarHBondContact O-CB 3.38Å; L291-K295 PolarHBondContact O-N 3.39Å; L292-K295 WeakPolarHBondContact O-CB 3.37Å; L292-K295 PolarHBondContact O-N 3.03Å; S293-K295 PolarHBondContact O-N 3.36Å
296T63.7Low65.5Low114 Ų114109.6 Ų109.670%0.69956%0.555SS**Hα-helixtrans-99.3-7.517744.40000114.3L292 S293 M298L292-T296 PolarHBondContact O-N 3.19Å; L292-T296 PolarHBondContact O-OG1 2.9Å; S293-T296 PolarHBondContact O-N 3.05Å; S293-T296 PolarHBondContact O-OG1 3.38Å; T296-M298 PolarHBondContact O-N 3.47Å
297M64.5Low66.1Low116 Ų116105.2 Ų105.257%0.57154%0.541SS*.  trans-81.7115.3176.9-166.1166.5-175.400110.9S293 F299S293-M297 WeakPolarHBondContact O-CB 3.34Å; S293-M297 PolarHBondContact O-N 3.42Å; M297-F299 PolarHBondContact O-N 3.19Å
298M54.4Low66.8Low180 Ų180100.9 Ų100.989%0.88753%0.528SS*.  trans-79.2110.1170.5-60.5-145.8-50.900109.6T296T296-M298 PolarHBondContact O-N 3.47Å
299F69.6Low67.4Low80 Ų8097 Ų9735%0.35152%0.515SS..  trans-72.2141.4169.4-61-85.5000110.2L294 M297 E303 A304 V307L294-F299 HydrophobicContact CD1-CZ 3.98Å; M297-F299 PolarHBondContact O-N 3.19Å; F299-E303 HydrophobicContact CB-CB 4.48Å; F299-E303 HydrophobicContact CD1-CB 4.33Å; F299-A304 HydrophobicContact CB-CB 3.83Å; F299-A304 HydrophobicContact CG-CB 4.35Å; F299-V307 HydrophobicContact CE1-CG2 4.02Å
300S71.3Confident68.1Low56 Ų5698.1 Ų98.139%0.39252%0.52SS..  trans-70158.7154.665.90000110.2D302 E303 A304S300-D302 VanDerWaalsContact C-N 3.29Å; S300-D302 PolarHBondContact O-N 2.73Å; S300-E303 VanDerWaalsContact CB-OE2 3.3Å; S300-E303 WeakPolarHBondContact CB-OE2 3.47Å; S300-E303 PolarHBondContact N-OE2 3.48Å; S300-E303 PolarHBondContact O-N 3.08Å; S300-E303 VanDerWaalsContact OG-CG 3.26Å; S300-E303 WeakPolarHBondContact OG-CG 3.41Å; S300-E303 PolarHBondContact OG-OE2 3.12Å; S300-A304 PolarHBondContact O-N 3.08Å
301E62.9Low68.2Low151 Ų15197.7 Ų97.771%0.70652%0.523SS*.Hα-helixtrans-59.3-39.5-177-163.5165.3-153.100112.2E303 L305E301-E303 PolarHBondContact O-N 2.97Å; E301-L305 WeakPolarHBondContact O-CB 3.48Å; E301-L305 WeakPolarHBondContact O-CG 3.39Å; E301-L305 PolarHBondContact O-N 3.31Å; E301-L305 VanDerWaalsContact O-N 3.1Å
302D69.6Low68.2Low85 Ų8599.6 Ų99.646%0.45553%0.528SS..Hα-helixtrans-60.3-41.3172.3-76.6-4.1000111.8K268 S300 C306K268-D302 WeakPolarHBondContact CE-OD2 3.38Å; K268-D302 IonicContact NZ-OD2 2.89Å; K268-D302 PolarHBondContact NZ-OD2 3.01Å; S300-D302 VanDerWaalsContact C-N 3.29Å; S300-D302 PolarHBondContact O-N 2.73Å; D302-C306 PolarHBondContact O-N 2.93Å; D302-C306 VanDerWaalsContact O-N 3.09Å
303E73.6Confident68.2Low106 Ų106101.6 Ų101.650%0.49554%0.535SS..Hα-helixtrans-75.7-38.6-178.8-70.6163.8142.600112.6F299 S300 E301 L305 C306 V307F299-E303 HydrophobicContact CB-CB 4.48Å; F299-E303 HydrophobicContact CD1-CB 4.33Å; S300-E303 VanDerWaalsContact CB-OE2 3.3Å; S300-E303 WeakPolarHBondContact CB-OE2 3.47Å; S300-E303 PolarHBondContact N-OE2 3.48Å; S300-E303 PolarHBondContact O-N 3.08Å; S300-E303 VanDerWaalsContact OG-CG 3.26Å; S300-E303 WeakPolarHBondContact OG-CG 3.41Å; S300-E303 PolarHBondContact OG-OE2 3.12Å; E301-E303 PolarHBondContact O-N 2.97Å; E303-L305 VanDerWaalsContact C-N 3.33Å; E303-C306 PolarHBondContact O-N 3.22Å; E303-V307 WeakPolarHBondContact O-CG2 3.43Å; E303-V307 PolarHBondContact O-N 2.89Å
304A70.6Confident68.1Low37 Ų37104.6 Ų104.631%0.30654%0.539SS..Hα-helixtrans-61.5-43.2174.500000111F299 S300 V307 V308F299-A304 HydrophobicContact CB-CB 3.83Å; F299-A304 HydrophobicContact CG-CB 4.35Å; S300-A304 PolarHBondContact O-N 3.08Å; A304-V307 PolarHBondContact O-N 3.44Å; A304-V308 WeakPolarHBondContact O-CB 3.47Å; A304-V308 VanDerWaalsContact O-CG2 3.31Å; A304-V308 WeakPolarHBondContact O-CG2 3.35Å; A304-V308 PolarHBondContact O-N 3.01Å
305L69.8Low67.8Low92 Ų92102.8 Ų102.848%0.48253%0.533SS..Hα-helixtrans-62.5-44.8174-76.4167.2000111.6E301 E303 V307 V308 D309E301-L305 WeakPolarHBondContact O-CB 3.48Å; E301-L305 WeakPolarHBondContact O-CG 3.39Å; E301-L305 PolarHBondContact O-N 3.31Å; E301-L305 VanDerWaalsContact O-N 3.1Å; E303-L305 VanDerWaalsContact C-N 3.33Å; L305-V307 VanDerWaalsContact C-N 3.34Å; L305-V307 PolarHBondContact O-N 3.01Å; L305-V308 PolarHBondContact O-N 3.49Å; L305-D309 WeakPolarHBondContact O-CB 3.21Å; L305-D309 PolarHBondContact O-N 3.04Å
306C73.4Confident67.7Low92 Ų9295.9 Ų95.962%0.62251%0.513SS*.Hα-helixtrans-59.8-40.5176.8-1220000113D302 E303 L310D302-C306 PolarHBondContact O-N 2.93Å; D302-C306 VanDerWaalsContact O-N 3.09Å; E303-C306 PolarHBondContact O-N 3.22Å; C306-L310 VanDerWaalsContact O-CB 3.3Å; C306-L310 WeakPolarHBondContact O-CB 3.32Å; C306-L310 PolarHBondContact O-N 3.48Å
307V70.8Confident67.4Low64 Ų6495.3 Ų95.339%0.38851%0.509SS..Hα-helixtrans-68.2-42.1175.3171.50000111.3F299 E303 A304 L305 L311F299-V307 HydrophobicContact CE1-CG2 4.02Å; E303-V307 WeakPolarHBondContact O-CG2 3.43Å; E303-V307 PolarHBondContact O-N 2.89Å; A304-V307 PolarHBondContact O-N 3.44Å; L305-V307 VanDerWaalsContact C-N 3.34Å; L305-V307 PolarHBondContact O-N 3.01Å; V307-L311 HydrophobicContact CG1-CD1 3.99Å; V307-L311 WeakPolarHBondContact O-CB 3.47Å; V307-L311 VanDerWaalsContact O-CG 3.24Å; V307-L311 WeakPolarHBondContact O-CG 3.46Å; V307-L311 PolarHBondContact O-N 3.39Å
308V70.1Confident67Low67 Ų6795.3 Ų95.341%0.40651%0.51SS..Hα-helixtrans-64.4-40.2176.71650000111.6A304 L305 L311 K312A304-V308 WeakPolarHBondContact O-CB 3.47Å; A304-V308 VanDerWaalsContact O-CG2 3.31Å; A304-V308 WeakPolarHBondContact O-CG2 3.35Å; A304-V308 PolarHBondContact O-N 3.01Å; L305-V308 PolarHBondContact O-N 3.49Å; V308-L311 PolarHBondContact O-N 3.48Å; V308-K312 HydrophobicContact CG1-CD 4.37Å; V308-K312 WeakPolarHBondContact O-CG 3.29Å; V308-K312 PolarHBondContact O-N 3.01Å
309D74.8Confident66.9Low80 Ų8093.7 Ų93.743%0.42850%0.498SS..Hα-helixtrans-75.3-36-179.7-71.9-20.1000112.1L305 L311 K312 E313L305-D309 WeakPolarHBondContact O-CB 3.21Å; L305-D309 PolarHBondContact O-N 3.04Å; D309-L311 VanDerWaalsContact C-N 3.31Å; D309-L311 PolarHBondContact O-N 2.93Å; D309-K312 PolarHBondContact O-N 3.05Å; D309-K312 WeakPolarHBondContact OD1-CD 3.46Å; D309-K312 IonicContact OD1-NZ 2.7Å; D309-K312 PolarHBondContact OD1-NZ 3.03Å; D309-E313 WeakPolarHBondContact O-CB 3.28Å; D309-E313 PolarHBondContact O-N 3.32Å
310L71.9Confident66.2Low99 Ų9997.4 Ų97.452%0.51852%0.517SS..Hα-helixtrans-63.3-37169.2-171.168.2000111.8C306 K314C306-L310 VanDerWaalsContact O-CB 3.3Å; C306-L310 WeakPolarHBondContact O-CB 3.32Å; C306-L310 PolarHBondContact O-N 3.48Å; L310-K314 WeakPolarHBondContact O-CB 3.45Å; L310-K314 WeakPolarHBondContact O-CG 3.5Å; L310-K314 PolarHBondContact O-N 3.28Å
311L68.4Low65.3Low115 Ų11598.4 Ų98.460%0.60253%0.529SS*.Hα-helixtrans-69.7-35.5172.6-74.6169.7000112.5V307 V308 D309 S315V307-L311 HydrophobicContact CG1-CD1 3.99Å; V307-L311 WeakPolarHBondContact O-CB 3.47Å; V307-L311 VanDerWaalsContact O-CG 3.24Å; V307-L311 WeakPolarHBondContact O-CG 3.46Å; V307-L311 PolarHBondContact O-N 3.39Å; V308-L311 PolarHBondContact O-N 3.48Å; D309-L311 VanDerWaalsContact C-N 3.31Å; D309-L311 PolarHBondContact O-N 2.93Å; L311-S315 WeakPolarHBondContact O-CB 3.42Å; L311-S315 PolarHBondContact O-N 3.11Å
312K68.4Low64.7Low125 Ų12597.9 Ų97.954%0.54353%0.53SS..Hα-helixtrans-67.3-42172-74.3172.9-164.3152.90111.8V308 D309 S315 G316V308-K312 HydrophobicContact CG1-CD 4.37Å; V308-K312 WeakPolarHBondContact O-CG 3.29Å; V308-K312 PolarHBondContact O-N 3.01Å; D309-K312 PolarHBondContact O-N 3.05Å; D309-K312 WeakPolarHBondContact OD1-CD 3.46Å; D309-K312 IonicContact OD1-NZ 2.7Å; D309-K312 PolarHBondContact OD1-NZ 3.03Å; K312-S315 CarbonylContact O-C 3.58Å; K312-S315 WeakPolarHBondContact O-CB 3.48Å; K312-S315 PolarHBondContact O-N 2.73Å; K312-S315 VanDerWaalsContact O-N 3.17Å; K312-G316 PolarHBondContact O-N 3.4Å
313E68.5Low63.7Low138 Ų138102.8 Ų102.865%0.64555%0.547SS*.Hα-helixtrans-61.6-46.6177.3-170.3-178.2-167.600110.6D309 G316D309-E313 WeakPolarHBondContact O-CB 3.28Å; D309-E313 PolarHBondContact O-N 3.32Å; E313-G316 PolarHBondContact O-N 2.88Å
314K61.8Low62.6Low135 Ų135107.5 Ų107.559%0.58757%0.566SS**Hα-helixtrans-66.8-33.6171.9-67.3-67.6-177.8-176.20113.1L310 G316 V317 I318L310-K314 WeakPolarHBondContact O-CB 3.45Å; L310-K314 WeakPolarHBondContact O-CG 3.5Å; L310-K314 PolarHBondContact O-N 3.28Å; K314-G316 VanDerWaalsContact C-N 3.31Å; K314-G316 PolarHBondContact O-N 2.88Å; K314-V317 PolarHBondContact O-N 3.47Å; K314-I318 WeakPolarHBondContact O-CG1 3.41Å; K314-I318 PolarHBondContact O-N 2.86Å
315S60.4Low61.4Low45 Ų45110.4 Ų110.432%0.31558%0.584SS.*Hα-helixtrans-64.8-33174.1-1770000112.4L311 K312 I318 K319L311-S315 WeakPolarHBondContact O-CB 3.42Å; L311-S315 PolarHBondContact O-N 3.11Å; K312-S315 CarbonylContact O-C 3.58Å; K312-S315 WeakPolarHBondContact O-CB 3.48Å; K312-S315 PolarHBondContact O-N 2.73Å; K312-S315 VanDerWaalsContact O-N 3.17Å; S315-I318 PolarHBondContact O-N 3.07Å; S315-K319 WeakPolarHBondContact O-CB 3.34Å; S315-K319 PolarHBondContact O-N 3.46Å
316G62.3Low60Low36 Ų36113.6 Ų113.637%0.37160%0.601SS.*Hα-helixtrans-57.6-48.8174.200000112.3K312 E313 K314 I318 K319 E320K312-G316 PolarHBondContact O-N 3.4Å; E313-G316 PolarHBondContact O-N 2.88Å; K314-G316 VanDerWaalsContact C-N 3.31Å; K314-G316 PolarHBondContact O-N 2.88Å; G316-I318 VanDerWaalsContact C-N 3.31Å; G316-I318 PolarHBondContact O-N 3.14Å; G316-K319 PolarHBondContact O-N 2.81Å; G316-E320 WeakPolarHBondContact O-CB 3.42Å; G316-E320 PolarHBondContact O-N 3.15Å
317V58.7Low58.8Low103 Ų103118.8 Ų118.862%0.62461%0.613SS**Hα-helixtrans-62.7-37.2177.8-175.20000111.7K314 A321K314-V317 PolarHBondContact O-N 3.47Å; V317-A321 PolarHBondContact O-N 2.96Å; V317-A321 VanDerWaalsContact O-N 3.15Å
318I55.5Low57.9Low116 Ų116119.1 Ų119.160%0.59563%0.63SS**Hα-helixtrans-70.7-41175.9-63.7168.2000111.2K314 S315 G316 A321 L322K314-I318 WeakPolarHBondContact O-CG1 3.41Å; K314-I318 PolarHBondContact O-N 2.86Å; S315-I318 PolarHBondContact O-N 3.07Å; G316-I318 VanDerWaalsContact C-N 3.31Å; G316-I318 PolarHBondContact O-N 3.14Å; I318-A321 PolarHBondContact O-N 3.13Å; I318-L322 WeakPolarHBondContact O-CB 3.36Å; I318-L322 PolarHBondContact O-N 3.17Å
319K53.6Low57Low146 Ų146123.8 Ų123.864%0.63565%0.647SS**Hα-helixtrans-67.2-33.6176.8-82.7-179.8174.2175.30112.8S315 G316 L322 K323S315-K319 WeakPolarHBondContact O-CB 3.34Å; S315-K319 PolarHBondContact O-N 3.46Å; G316-K319 PolarHBondContact O-N 2.81Å; K319-L322 PolarHBondContact O-N 2.85Å; K319-K323 PolarHBondContact O-N 2.74Å
320E53.8Low56.2Low157 Ų157126.2 Ų126.273%0.73466%0.66SS**Hα-helixtrans-74.5-36.3177.3-164163.9-140.900111.9G316 K323G316-E320 WeakPolarHBondContact O-CB 3.42Å; G316-E320 PolarHBondContact O-N 3.15Å; E320-K323 PolarHBondContact O-N 3.36Å
321A52.6Low55.8Low78 Ų78126 Ų12665%0.64567%0.666SS**Hα-helixtrans-63.5-38.2169.700000112.8V317 I318 K323V317-A321 PolarHBondContact O-N 2.96Å; V317-A321 VanDerWaalsContact O-N 3.15Å; I318-A321 PolarHBondContact O-N 3.13Å; A321-K323 VanDerWaalsContact C-N 3.33Å; A321-K323 PolarHBondContact O-N 3.03Å
322L49.9Very low55.9Low139 Ų139123.1 Ų123.173%0.72866%0.664SS**Hα-helixtrans-73.2-22.6179.9-146.576.1000113.5I318 K319 K324I318-L322 WeakPolarHBondContact O-CB 3.36Å; I318-L322 PolarHBondContact O-N 3.17Å; K319-L322 PolarHBondContact O-N 2.85Å; L322-K324 PolarHBondContact O-N 3.33Å; L322-K324 VanDerWaalsContact O-N 3.14Å
323K49.7Very low56Low189 Ų189122.1 Ų122.182%0.82267%0.665SS**THydrogen-bonded Turntrans-76.74.9-173.8-135.1175.1-176.3-179.50115.1K319 E320 A321K319-K323 PolarHBondContact O-N 2.74Å; E320-K323 PolarHBondContact O-N 3.36Å; A321-K323 VanDerWaalsContact C-N 3.33Å; A321-K323 PolarHBondContact O-N 3.03Å
324K50.1Low56.1Low204 Ų204120.9 Ų120.989%0.88766%0.662SS**THydrogen-bonded Turntrans-106.76.9-177.5-112.5177-178.7174.60115.1L322L322-K324 PolarHBondContact O-N 3.33Å; L322-K324 VanDerWaalsContact O-N 3.14Å
325S44.4Very low56.8Low98 Ų98120.6 Ų120.669%0.68566%0.662SS**SBendtrans-113.8123.6179.4-167.40000112.9
326N40.4Very low57.5Low159 Ų159124.2 Ų124.285%0.8567%0.674SS**  trans25.9142.3163.7-71-13.3000123.2G328N326-G328 PolarHBondContact O-N 2.97Å
327K48.6Very low58.2Low201 Ų201127.9 Ų127.987%0.87469%0.685SS**SBendtrans-103.929-154.4-140175.4-174-178.70115.3
328G52.4Low59.3Low71 Ų71128.7 Ų128.773%0.73268%0.681SS**  trans-97.5-38.9-163.900000118.2N326 L330N326-G328 PolarHBondContact O-N 2.97Å; G328-L330 PolarHBondContact O-N 3.49Å
329E51.7Low60.4Low166 Ų166128.3 Ų128.378%0.77668%0.677SS**  trans-101.526.6-160.6-64.5-175.8136.100115.5
330L56.5Low61.7Low131 Ų131128 Ų12869%0.68668%0.676SS**Hα-helixtrans-76.2-26.9-168.7-94.7158000116G328 L334G328-L330 PolarHBondContact O-N 3.49Å; L330-L334 WeakPolarHBondContact O-CB 3.49Å; L330-L334 PolarHBondContact O-N 2.93Å
331S64.8Low63.2Low93 Ų93126.3 Ų126.365%0.6567%0.668SS**Hα-helixtrans-79.9-45.6-171.9-170.60000113.8L333 L334 H335S331-L333 PolarHBondContact O-N 3.33Å; S331-L334 WeakPolarHBondContact O-CB 3.35Å; S331-L334 PolarHBondContact O-N 2.96Å; S331-H335 PolarHBondContact O-N 3.47Å
332G69.2Low65Low55 Ų55129.9 Ų129.957%0.56767%0.665SS**Hα-helixtrans-64.5-41.818000000112.4L334 H335 Q336G332-L334 VanDerWaalsContact C-N 3.32Å; G332-L334 PolarHBondContact O-N 3.04Å; G332-H335 PolarHBondContact O-N 2.84Å; G332-Q336 WeakPolarHBondContact O-CB 3.34Å; G332-Q336 PolarHBondContact O-N 3.36Å
333L70.6Confident66.8Low105 Ų105127.1 Ų127.155%0.5565%0.65SS.*Hα-helixtrans-65.6-32.3175.1-72.2172.5000112.7S331 L337S331-L333 PolarHBondContact O-N 3.33Å; L333-L337 VanDerWaalsContact O-CB 3.23Å; L333-L337 WeakPolarHBondContact O-CB 3.5Å; L333-L337 PolarHBondContact O-N 2.91Å
334L72Confident68.4Low111 Ų111122.5 Ų122.558%0.58163%0.634SS**Hα-helixtrans-65.5-46.6175-164.787.7000111.4L330 S331 G332 Q336 L337 Q338L330-L334 WeakPolarHBondContact O-CB 3.49Å; L330-L334 PolarHBondContact O-N 2.93Å; S331-L334 WeakPolarHBondContact O-CB 3.35Å; S331-L334 PolarHBondContact O-N 2.96Å; G332-L334 VanDerWaalsContact C-N 3.32Å; G332-L334 PolarHBondContact O-N 3.04Å; L334-Q336 VanDerWaalsContact C-N 3.35Å; L334-Q336 PolarHBondContact O-N 3.37Å; L334-L337 WeakPolarHBondContact O-CB 3.34Å; L334-L337 PolarHBondContact O-N 3.42Å; L334-Q338 WeakPolarHBondContact O-CB 3.43Å; L334-Q338 PolarHBondContact O-N 2.88Å
335H74.8Confident70.1Confident130 Ų130115.8 Ų115.860%0.60261%0.613SS**Hα-helixtrans-65-40.3178.4-124.8-66.4000111.8S331 G332 Q338 E339S331-H335 PolarHBondContact O-N 3.47Å; G332-H335 PolarHBondContact O-N 2.84Å; H335-Q338 PolarHBondContact O-N 3.12Å; H335-E339 PolarHBondContact O-N 2.96Å
336Q75.6Confident72.2Confident121 Ų121113 Ų11357%0.56560%0.596SS**Hα-helixtrans-68.9-34.4177.4-157.9175.444.700112G332 L334 K340G332-Q336 WeakPolarHBondContact O-CB 3.34Å; G332-Q336 PolarHBondContact O-N 3.36Å; L334-Q336 VanDerWaalsContact C-N 3.35Å; L334-Q336 PolarHBondContact O-N 3.37Å; Q336-K340 WeakPolarHBondContact O-CB 3.24Å; Q336-K340 WeakPolarHBondContact O-CG 3.45Å; Q336-K340 PolarHBondContact O-N 3.19Å
337L77.4Confident74.3Confident113 Ų113112.1 Ų112.159%0.59259%0.588SS**Hα-helixtrans-64.6-47171.2-17375.8000111.1L333 L334 E339 K340 E341L333-L337 VanDerWaalsContact O-CB 3.23Å; L333-L337 WeakPolarHBondContact O-CB 3.5Å; L333-L337 PolarHBondContact O-N 2.91Å; L334-L337 WeakPolarHBondContact O-CB 3.34Å; L334-L337 PolarHBondContact O-N 3.42Å; L337-E339 VanDerWaalsContact C-N 3.34Å; L337-E339 PolarHBondContact O-N 3.43Å; L337-K340 WeakPolarHBondContact O-CB 3.48Å; L337-K340 PolarHBondContact O-N 2.92Å; L337-E341 WeakPolarHBondContact O-CB 3.48Å; L337-E341 PolarHBondContact O-N 3.3Å
338Q81.5Confident76.1Confident119 Ų119109.2 Ų109.256%0.55658%0.576SS**Hα-helixtrans-62.3-38.7179-173.1178.9-2.600112.2L334 H335 E341 R342L334-Q338 WeakPolarHBondContact O-CB 3.43Å; L334-Q338 PolarHBondContact O-N 2.88Å; H335-Q338 PolarHBondContact O-N 3.12Å; Q338-E341 PolarHBondContact O-N 2.87Å; Q338-R342 PolarHBondContact O-N 2.94Å
339E79.3Confident77.8Confident109 Ų109113 Ų11351%0.50957%0.574SS.*Hα-helixtrans-69.6-37.9175-175.3164.8-14800112.5H335 L337 E341 R342 L343H335-E339 PolarHBondContact O-N 2.96Å; L337-E339 VanDerWaalsContact C-N 3.34Å; L337-E339 PolarHBondContact O-N 3.43Å; E339-E341 VanDerWaalsContact C-N 3.3Å; E339-E341 PolarHBondContact O-N 3.41Å; E339-R342 PolarHBondContact O-N 3.29Å; E339-L343 WeakPolarHBondContact O-CG 3.47Å; E339-L343 PolarHBondContact O-N 3.43Å
340K81.1Confident79.3Confident138 Ų138110.1 Ų110.160%0.656%0.564SS**Hα-helixtrans-63.3-36.3170.6-71.5-71.3-179.4-175.80112Q336 L337 L343 L344Q336-K340 WeakPolarHBondContact O-CB 3.24Å; Q336-K340 WeakPolarHBondContact O-CG 3.45Å; Q336-K340 PolarHBondContact O-N 3.19Å; L337-K340 WeakPolarHBondContact O-CB 3.48Å; L337-K340 PolarHBondContact O-N 2.92Å; K340-L343 PolarHBondContact O-N 2.93Å; K340-L344 VanDerWaalsContact O-CB 3.23Å; K340-L344 WeakPolarHBondContact O-CB 3.26Å; K340-L344 PolarHBondContact O-N 2.86Å
341E84.5Confident80.8Confident122 Ų122106.5 Ų106.557%0.5755%0.553SS**Hα-helixtrans-71.3-35.4177.4-168.4155.8-142.800112.4L337 Q338 E339 L344 S345L337-E341 WeakPolarHBondContact O-CB 3.48Å; L337-E341 PolarHBondContact O-N 3.3Å; Q338-E341 PolarHBondContact O-N 2.87Å; E339-E341 VanDerWaalsContact C-N 3.3Å; E339-E341 PolarHBondContact O-N 3.41Å; E341-L344 PolarHBondContact O-N 3.18Å; E341-S345 WeakPolarHBondContact O-CB 3.45Å; E341-S345 PolarHBondContact O-N 3.07Å; E341-S345 PolarHBondContact O-OG 3.36Å
342R90.1Very high81.9Confident153 Ų153104.8 Ų104.858%0.57755%0.545SS*.Hα-helixtrans-61.7-48.6168.7-171.3-172.770.984.9-3.4111.7Q338 E339 L344 S345 A346Q338-R342 PolarHBondContact O-N 2.94Å; E339-R342 PolarHBondContact O-N 3.29Å; R342-L344 VanDerWaalsContact C-N 3.33Å; R342-L344 PolarHBondContact O-N 2.96Å; R342-S345 WeakPolarHBondContact O-CB 3.49Å; R342-S345 PolarHBondContact O-N 2.89Å; R342-A346 PolarHBondContact O-N 3.19Å
343L87.6Confident82.9Confident81 Ų81103.9 Ų103.942%0.42453%0.532SS..Hα-helixtrans-64.1-37.4177.5-73.6169.8000112.4E339 K340 S345 A346 M347E339-L343 WeakPolarHBondContact O-CG 3.47Å; E339-L343 PolarHBondContact O-N 3.43Å; K340-L343 PolarHBondContact O-N 2.93Å; L343-S345 VanDerWaalsContact C-N 3.31Å; L343-A346 PolarHBondContact O-N 3.27Å; L343-M347 WeakPolarHBondContact O-CB 3.31Å; L343-M347 WeakPolarHBondContact O-CG 3.38Å; L343-M347 PolarHBondContact O-N 3Å
344L84.7Confident83.4Confident92 Ų92102 Ų10248%0.48253%0.528SS..Hα-helixtrans-68.7-30.5175.7-172.9145.4000112.1K340 E341 R342 K348K340-L344 VanDerWaalsContact O-CB 3.23Å; K340-L344 WeakPolarHBondContact O-CB 3.26Å; K340-L344 PolarHBondContact O-N 2.86Å; E341-L344 PolarHBondContact O-N 3.18Å; R342-L344 VanDerWaalsContact C-N 3.33Å; R342-L344 PolarHBondContact O-N 2.96Å; L344-K348 HydrophobicContact CD2-CD 3.97Å; L344-K348 VanDerWaalsContact CD2-CE 3.48Å; L344-K348 WeakPolarHBondContact O-CG 3.34Å; L344-K348 PolarHBondContact O-N 2.84Å; L344-K348 VanDerWaalsContact O-N 3.08Å
345S85.8Confident84.4Confident64 Ų64102.9 Ų102.945%0.44853%0.527SS..Hα-helixtrans-71.2-44.9173-57.40000111.6E341 R342 L343 M347 K348 E349E341-S345 WeakPolarHBondContact O-CB 3.45Å; E341-S345 PolarHBondContact O-N 3.07Å; E341-S345 PolarHBondContact O-OG 3.36Å; R342-S345 WeakPolarHBondContact O-CB 3.49Å; R342-S345 PolarHBondContact O-N 2.89Å; L343-S345 VanDerWaalsContact C-N 3.31Å; S345-M347 PolarHBondContact O-N 3.49Å; S345-K348 WeakPolarHBondContact O-CB 3.46Å; S345-K348 PolarHBondContact O-N 3.34Å; S345-K348 VanDerWaalsContact O-N 3.12Å; S345-E349 PolarHBondContact O-N 2.94Å
346A86.8Confident85.2Confident39 Ų39101.7 Ų101.732%0.32252%0.521SS..Hα-helixtrans-60.3-44.6173.200000112.1R342 L343 K348 E349 D350R342-A346 PolarHBondContact O-N 3.19Å; L343-A346 PolarHBondContact O-N 3.27Å; A346-K348 VanDerWaalsContact C-N 3.27Å; A346-K348 PolarHBondContact O-N 2.93Å; A346-E349 WeakPolarHBondContact O-CB 3.39Å; A346-E349 PolarHBondContact O-N 2.99Å; A346-E349 VanDerWaalsContact O-N 3.08Å; A346-D350 PolarHBondContact O-N 3.17Å
347M84.4Confident85.9Confident141 Ų141103.9 Ų103.970%0.69553%0.525SS*.Hα-helixtrans-60.5-32.7173.5-83.9-95.9161.900113.4L343 S345 A351L343-M347 WeakPolarHBondContact O-CB 3.31Å; L343-M347 WeakPolarHBondContact O-CG 3.38Å; L343-M347 PolarHBondContact O-N 3Å; S345-M347 PolarHBondContact O-N 3.49Å; M347-A351 WeakPolarHBondContact O-CB 3.37Å; M347-A351 PolarHBondContact O-N 3.44Å
348K86.7Confident86.4Confident139 Ų139102.2 Ų102.260%0.60452%0.521SS*.Hα-helixtrans-72-36173-80172.7175.41730112.3L344 S345 A346 A351 A352L344-K348 HydrophobicContact CD2-CD 3.97Å; L344-K348 VanDerWaalsContact CD2-CE 3.48Å; L344-K348 WeakPolarHBondContact O-CG 3.34Å; L344-K348 PolarHBondContact O-N 2.84Å; L344-K348 VanDerWaalsContact O-N 3.08Å; S345-K348 WeakPolarHBondContact O-CB 3.46Å; S345-K348 PolarHBondContact O-N 3.34Å; S345-K348 VanDerWaalsContact O-N 3.12Å; A346-K348 VanDerWaalsContact C-N 3.27Å; A346-K348 PolarHBondContact O-N 2.93Å; K348-A351 PolarHBondContact O-N 3.17Å; K348-A352 WeakPolarHBondContact O-CB 3.4Å; K348-A352 PolarHBondContact O-N 3.47Å
349E88.6Confident87Confident150 Ų150101.6 Ų101.670%0.70152%0.517SS*.Hα-helixtrans-68.5-43.8175.5-167.8170.7-177.200111.1S345 A346 A351 A352 A353S345-E349 PolarHBondContact O-N 2.94Å; A346-E349 WeakPolarHBondContact O-CB 3.39Å; A346-E349 PolarHBondContact O-N 2.99Å; A346-E349 VanDerWaalsContact O-N 3.08Å; E349-A351 PolarHBondContact O-N 3.34Å; E349-A352 WeakPolarHBondContact O-CB 3.38Å; E349-A352 PolarHBondContact O-N 2.92Å; E349-A352 VanDerWaalsContact O-N 3.15Å; E349-A353 WeakPolarHBondContact O-CB 3.42Å; E349-A353 PolarHBondContact O-N 3.28Å
350D83.8Confident87.6Confident106 Ų106101.6 Ų101.657%0.56752%0.517SS*.Hα-helixtrans-63.7-37.8171.9-79-31.5000112.4A346 A352 A353 S354A346-D350 PolarHBondContact O-N 3.17Å; D350-A352 VanDerWaalsContact C-N 3.34Å; D350-A353 PolarHBondContact O-N 3.05Å; D350-S354 WeakPolarHBondContact O-CB 3.28Å; D350-S354 PolarHBondContact O-N 3.4Å; D350-S354 PolarHBondContact O-OG 3.02Å
351A86.9Confident88Confident55 Ų55100.5 Ų100.546%0.45552%0.517SS..Hα-helixtrans-65.7-35.7172.300000112.3M347 K348 E349 S354 K355M347-A351 WeakPolarHBondContact O-CB 3.37Å; M347-A351 PolarHBondContact O-N 3.44Å; K348-A351 PolarHBondContact O-N 3.17Å; E349-A351 PolarHBondContact O-N 3.34Å; A351-S354 WeakPolarHBondContact CA-OG 3.47Å; A351-S354 PolarHBondContact O-OG 2.94Å; A351-S354 VanDerWaalsContact O-OG 3.11Å; A351-K355 VanDerWaalsContact O-CB 3.29Å; A351-K355 WeakPolarHBondContact O-CB 3.35Å; A351-K355 PolarHBondContact O-N 3.08Å
352A88.6Confident88.3Confident58 Ų5898 Ų9848%0.47951%0.51SS..Hα-helixtrans-70.5-44.217400000111.6K348 E349 D350 K355 E356K348-A352 WeakPolarHBondContact O-CB 3.4Å; K348-A352 PolarHBondContact O-N 3.47Å; E349-A352 WeakPolarHBondContact O-CB 3.38Å; E349-A352 PolarHBondContact O-N 2.92Å; E349-A352 VanDerWaalsContact O-N 3.15Å; D350-A352 VanDerWaalsContact C-N 3.34Å; A352-K355 PolarHBondContact O-N 2.97Å; A352-E356 PolarHBondContact O-N 3.09Å
353A89.2Confident88.4Confident36 Ų3697.3 Ų97.330%0.29851%0.513SS..Hα-helixtrans-64.6-39.9177.800000112.4E349 D350 E356 R357E349-A353 WeakPolarHBondContact O-CB 3.42Å; E349-A353 PolarHBondContact O-N 3.28Å; D350-A353 PolarHBondContact O-N 3.05Å; A353-E356 PolarHBondContact O-N 3.36Å; A353-R357 WeakPolarHBondContact O-CG 3.48Å; A353-R357 PolarHBondContact O-N 3.41Å
354S82.8Confident88.5Confident65 Ų6597.9 Ų97.946%0.45551%0.514SS..Hα-helixtrans-68.9-38.1173.552.40000112.5D350 A351 E356 C358D350-S354 WeakPolarHBondContact O-CB 3.28Å; D350-S354 PolarHBondContact O-N 3.4Å; D350-S354 PolarHBondContact O-OG 3.02Å; A351-S354 WeakPolarHBondContact CA-OG 3.47Å; A351-S354 PolarHBondContact O-OG 2.94Å; A351-S354 VanDerWaalsContact O-OG 3.11Å; S354-E356 VanDerWaalsContact C-N 3.34Å; S354-E356 PolarHBondContact O-N 3.4Å; S354-C358 WeakPolarHBondContact O-CB 3.25Å; S354-C358 PolarHBondContact O-N 3.25Å
355K91.8Very high88.9Confident130 Ų13099.2 Ų99.257%0.56552%0.519SS*.Hα-helixtrans-61.3-41170.9-173.7173.8-177176.20111.8A351 A352 C358 K359A351-K355 VanDerWaalsContact O-CB 3.29Å; A351-K355 WeakPolarHBondContact O-CB 3.35Å; A351-K355 PolarHBondContact O-N 3.08Å; A352-K355 PolarHBondContact O-N 2.97Å; K355-C358 WeakPolarHBondContact O-CB 3.27Å; K355-C358 PolarHBondContact O-N 3.48Å; K355-K359 PolarHBondContact O-N 3.35Å
356E91.9Very high89.1Confident104 Ų10499.5 Ų99.549%0.48651%0.514SS..Hα-helixtrans-70.1-42.4179.4-159.159.2-152.300112.1A352 A353 S354 C358 K359 Q360A352-E356 PolarHBondContact O-N 3.09Å; A353-E356 PolarHBondContact O-N 3.36Å; S354-E356 VanDerWaalsContact C-N 3.34Å; S354-E356 PolarHBondContact O-N 3.4Å; E356-C358 VanDerWaalsContact C-N 3.26Å; E356-C358 PolarHBondContact O-N 2.97Å; E356-K359 WeakPolarHBondContact O-CB 3.5Å; E356-K359 PolarHBondContact O-N 3.19Å; E356-K359 IonicContact OE1-NZ 2.73Å; E356-K359 WeakPolarHBondContact OE2-CD 3.43Å; E356-K359 WeakPolarHBondContact OE2-CE 3.48Å; E356-K359 IonicContact OE2-NZ 2.74Å; E356-K359 PolarHBondContact OE2-NZ 3.38Å; E356-Q360 PolarHBondContact O-N 3.38Å
357R91Very high89.2Confident168 Ų16899.9 Ų99.963%0.63451%0.513SS*.Hα-helixtrans-57.9-38.5170.2-72174.4-170.6145.75.3112.3A353 Q360 L361A353-R357 WeakPolarHBondContact O-CG 3.48Å; A353-R357 PolarHBondContact O-N 3.41Å; R357-Q360 PolarHBondContact O-N 3.16Å; R357-L361 WeakPolarHBondContact O-CB 3.35Å; R357-L361 PolarHBondContact O-N 3.45Å
358C88.2Confident89.3Confident77 Ų7798.1 Ų98.152%0.5250%0.503SS..Hα-helixtrans-65.9-39.8177.2-170.20000112.1S354 K355 E356 T362S354-C358 WeakPolarHBondContact O-CB 3.25Å; S354-C358 PolarHBondContact O-N 3.25Å; K355-C358 WeakPolarHBondContact O-CB 3.27Å; K355-C358 PolarHBondContact O-N 3.48Å; E356-C358 VanDerWaalsContact C-N 3.26Å; E356-C358 PolarHBondContact O-N 2.97Å; C358-T362 WeakPolarHBondContact O-CB 3.37Å; C358-T362 PolarHBondContact O-N 3.26Å; C358-T362 PolarHBondContact O-OG1 3.48Å
359K93.4Very high89.6Confident106 Ų10698.4 Ų98.446%0.46150%0.504SS..Hα-helixtrans-63-45.5170.5-66.6-179-165.1159.20112K355 E356 T362 Q363K355-K359 PolarHBondContact O-N 3.35Å; E356-K359 WeakPolarHBondContact O-CB 3.5Å; E356-K359 PolarHBondContact O-N 3.19Å; E356-K359 IonicContact OE1-NZ 2.73Å; E356-K359 WeakPolarHBondContact OE2-CD 3.43Å; E356-K359 WeakPolarHBondContact OE2-CE 3.48Å; E356-K359 IonicContact OE2-NZ 2.74Å; E356-K359 PolarHBondContact OE2-NZ 3.38Å; K359-T362 WeakPolarHBondContact O-CB 3.43Å; K359-T362 PolarHBondContact O-N 3.17Å; K359-T362 VanDerWaalsContact O-N 3.13Å; K359-Q363 PolarHBondContact O-N 3.26Å
360Q91.3Very high89.8Confident109 Ų10996.8 Ų96.851%0.50950%0.496SS..Hα-helixtrans-60.3-48.4-179.3-174.8178-12.600111.1E356 R357 T362 Q363 E364E356-Q360 PolarHBondContact O-N 3.38Å; R357-Q360 PolarHBondContact O-N 3.16Å; Q360-T362 VanDerWaalsContact C-N 3.29Å; Q360-T362 PolarHBondContact O-N 2.9Å; Q360-Q363 PolarHBondContact O-N 3.07Å; Q360-Q363 VanDerWaalsContact O-N 3.14Å; Q360-E364 WeakPolarHBondContact CG-OE1 3.47Å; Q360-E364 PolarHBondContact NE2-OE1 2.85Å; Q360-E364 WeakPolarHBondContact O-CG 3.29Å; Q360-E364 PolarHBondContact O-N 3.15Å
361L90.6Very high90.2Very high115 Ų11598.6 Ų98.660%0.60250%0.495SS*.Hα-helixtrans-58.3-39.5173.1-80.6164.1000112.6R357 M365R357-L361 WeakPolarHBondContact O-CB 3.35Å; R357-L361 PolarHBondContact O-N 3.45Å; L361-M365 VanDerWaalsContact O-CB 3.24Å; L361-M365 WeakPolarHBondContact O-CB 3.37Å; L361-M365 PolarHBondContact O-N 3.39Å
362T89.5Confident90.3Very high70 Ų7098.7 Ų98.743%0.42949%0.493SS..Hα-helixtrans-65.1-40.1176.3-570000111.4C358 K359 Q360 M365 M366C358-T362 WeakPolarHBondContact O-CB 3.37Å; C358-T362 PolarHBondContact O-N 3.26Å; C358-T362 PolarHBondContact O-OG1 3.48Å; K359-T362 WeakPolarHBondContact O-CB 3.43Å; K359-T362 PolarHBondContact O-N 3.17Å; K359-T362 VanDerWaalsContact O-N 3.13Å; Q360-T362 VanDerWaalsContact C-N 3.29Å; Q360-T362 PolarHBondContact O-N 2.9Å; T362-M365 HydrophobicContact CG2-CE 4.29Å; T362-M366 VanDerWaalsContact O-CG 3.28Å; T362-M366 WeakPolarHBondContact O-CG 3.5Å; T362-M366 PolarHBondContact O-N 2.9Å; T362-M366 VanDerWaalsContact O-N 3.07Å
363Q92.3Very high90.4Very high138 Ų13899.5 Ų99.565%0.64550%0.495SS*.Hα-helixtrans-69.3-44.2176.7-176.4173.2-6.700111.8K359 Q360 M366 T367K359-Q363 PolarHBondContact O-N 3.26Å; Q360-Q363 PolarHBondContact O-N 3.07Å; Q360-Q363 VanDerWaalsContact O-N 3.14Å; Q363-M366 PolarHBondContact O-N 3.5Å; Q363-T367 WeakPolarHBondContact O-CG2 3.4Å; Q363-T367 PolarHBondContact O-N 2.75Å
364E89.8Confident90.6Very high94 Ų94101.2 Ų101.244%0.43950%0.501SS..Hα-helixtrans-59.5-49.2175.8-74.6171.2-169.500110.7Q360 M366 T367 E368Q360-E364 WeakPolarHBondContact CG-OE1 3.47Å; Q360-E364 PolarHBondContact NE2-OE1 2.85Å; Q360-E364 WeakPolarHBondContact O-CG 3.29Å; Q360-E364 PolarHBondContact O-N 3.15Å; E364-M366 VanDerWaalsContact C-N 3.29Å; E364-M366 PolarHBondContact O-N 3.32Å; E364-T367 PolarHBondContact O-N 3.32Å; E364-T367 VanDerWaalsContact O-N 3.12Å; E364-T367 PolarHBondContact O-OG1 3.39Å; E364-E368 WeakPolarHBondContact O-CB 3.4Å; E364-E368 PolarHBondContact O-N 3.22Å
365M92.8Very high91Very high119 Ų119101.6 Ų101.659%0.58650%0.501SS*.Hα-helixtrans-54.2-41.5173.2178.9-171.666.300112.6L361 T362 E368 K369L361-M365 VanDerWaalsContact O-CB 3.24Å; L361-M365 WeakPolarHBondContact O-CB 3.37Å; L361-M365 PolarHBondContact O-N 3.39Å; T362-M365 HydrophobicContact CG2-CE 4.29Å; M365-E368 PolarHBondContact O-N 3.26Å; M365-K369 WeakPolarHBondContact O-CB 3.27Å; M365-K369 PolarHBondContact O-N 2.9Å
366M91.1Very high91Very high70 Ų7099.5 Ų99.535%0.34550%0.495SS..Hα-helixtrans-67.1-43.4176.8-75.2-66.7-67.500112.1T362 Q363 E364 E368 K369 E370T362-M366 VanDerWaalsContact O-CG 3.28Å; T362-M366 WeakPolarHBondContact O-CG 3.5Å; T362-M366 PolarHBondContact O-N 2.9Å; T362-M366 VanDerWaalsContact O-N 3.07Å; Q363-M366 PolarHBondContact O-N 3.5Å; E364-M366 VanDerWaalsContact C-N 3.29Å; E364-M366 PolarHBondContact O-N 3.32Å; M366-E368 VanDerWaalsContact C-N 3.29Å; M366-E368 PolarHBondContact O-N 2.68Å; M366-K369 PolarHBondContact O-N 2.99Å; M366-E370 WeakPolarHBondContact O-CG 3.49Å; M366-E370 PolarHBondContact O-N 2.9Å
367T89.5Confident91Very high47 Ų4796.8 Ų96.829%0.28849%0.491SS..Hα-helixtrans-65.6-33.1175.466.50000112.4Q363 E364 E370 R371Q363-T367 WeakPolarHBondContact O-CG2 3.4Å; Q363-T367 PolarHBondContact O-N 2.75Å; E364-T367 PolarHBondContact O-N 3.32Å; E364-T367 VanDerWaalsContact O-N 3.12Å; E364-T367 PolarHBondContact O-OG1 3.39Å; T367-E370 PolarHBondContact O-N 3.16Å; T367-R371 WeakPolarHBondContact O-CG 3.35Å; T367-R371 PolarHBondContact O-N 3.01Å; T367-R371 PolarHBondContact OG1-NH1 2.97Å
368E85.1Confident91.1Very high105 Ų10597 Ų9749%0.49149%0.491SS..Hα-helixtrans-75-35178.4-161.852.3-144.900112.1E364 M365 M366 E370 R371 S372E364-E368 WeakPolarHBondContact O-CB 3.4Å; E364-E368 PolarHBondContact O-N 3.22Å; M365-E368 PolarHBondContact O-N 3.26Å; M366-E368 VanDerWaalsContact C-N 3.29Å; M366-E368 PolarHBondContact O-N 2.68Å; E368-E370 VanDerWaalsContact C-N 3.32Å; E368-E370 PolarHBondContact O-N 3.49Å; E368-R371 PolarHBondContact O-N 3.45Å; E368-R371 IonicContact OE2-NH1 3.87Å; E368-R371 PolarHBondContact OE2-NH1 3.48Å; E368-S372 VanDerWaalsContact O-CB 3.26Å; E368-S372 WeakPolarHBondContact O-CB 3.39Å; E368-S372 PolarHBondContact O-N 3.15Å
369K93.5Very high91.3Very high145 Ų14598.9 Ų98.963%0.6349%0.494SS*.Hα-helixtrans-60.2-40.9168-175.6-179.3178-1770111.9M365 M366 S373M365-K369 WeakPolarHBondContact O-CB 3.27Å; M365-K369 PolarHBondContact O-N 2.9Å; M366-K369 PolarHBondContact O-N 2.99Å; K369-S373 WeakPolarHBondContact O-CB 3.47Å; K369-S373 PolarHBondContact O-N 2.98Å
370E91.9Very high91.3Very high115 Ų115100.6 Ų100.654%0.53750%0.501SS..Hα-helixtrans-66-45.7174.5-73.6174.5179.200111.9M366 T367 E368 S372 S373 V374M366-E370 WeakPolarHBondContact O-CG 3.49Å; M366-E370 PolarHBondContact O-N 2.9Å; T367-E370 PolarHBondContact O-N 3.16Å; E368-E370 VanDerWaalsContact C-N 3.32Å; E368-E370 PolarHBondContact O-N 3.49Å; E370-S372 PolarHBondContact O-N 3.09Å; E370-S373 WeakPolarHBondContact O-CB 3.25Å; E370-S373 PolarHBondContact O-N 3.23Å; E370-V374 WeakPolarHBondContact O-CG2 3.32Å; E370-V374 PolarHBondContact O-N 3.36Å
371R93Very high91.4Very high144 Ų144101 Ų10154%0.54351%0.507SS..Hα-helixtrans-58.7-48174.2-73.1-171.5-170.590.47.7112.1T367 E368 S373 V374 V375T367-R371 WeakPolarHBondContact O-CG 3.35Å; T367-R371 PolarHBondContact O-N 3.01Å; T367-R371 PolarHBondContact OG1-NH1 2.97Å; E368-R371 PolarHBondContact O-N 3.45Å; E368-R371 IonicContact OE2-NH1 3.87Å; E368-R371 PolarHBondContact OE2-NH1 3.48Å; R371-S373 VanDerWaalsContact C-N 3.33Å; R371-S373 PolarHBondContact O-N 2.97Å; R371-V374 PolarHBondContact O-N 3.01Å; R371-V375 WeakPolarHBondContact O-CG2 3.42Å; R371-V375 PolarHBondContact O-N 3.44Å
372S88.5Confident91.5Very high57 Ų57101.6 Ų101.640%0.39950%0.501SS..Hα-helixtrans-58.7-43.2176.7-1790000111.8E368 E370 V374 V375 I376E368-S372 VanDerWaalsContact O-CB 3.26Å; E368-S372 WeakPolarHBondContact O-CB 3.39Å; E368-S372 PolarHBondContact O-N 3.15Å; E370-S372 PolarHBondContact O-N 3.09Å; S372-V374 PolarHBondContact O-N 3.01Å; S372-V375 PolarHBondContact O-N 2.93Å; S372-I376 VanDerWaalsContact O-CG1 3.31Å; S372-I376 WeakPolarHBondContact O-CG1 3.46Å; S372-I376 PolarHBondContact O-N 3.26Å
373S91.3Very high91.6Very high75 Ų75102.6 Ų102.652%0.52450%0.503SS..Hα-helixtrans-59-42.9175-169.10000112.7K369 E370 R371 I376 A377K369-S373 WeakPolarHBondContact O-CB 3.47Å; K369-S373 PolarHBondContact O-N 2.98Å; E370-S373 WeakPolarHBondContact O-CB 3.25Å; E370-S373 PolarHBondContact O-N 3.23Å; R371-S373 VanDerWaalsContact C-N 3.33Å; R371-S373 PolarHBondContact O-N 2.97Å; S373-I376 PolarHBondContact O-N 3.38Å; S373-A377 PolarHBondContact O-N 3.5Å
374V93.3Very high91.6Very high72 Ų7297 Ų9744%0.43648%0.482SS..Hα-helixtrans-65.4-39.2175.91730000111.9E370 R371 S372 A377 R378E370-V374 WeakPolarHBondContact O-CG2 3.32Å; E370-V374 PolarHBondContact O-N 3.36Å; R371-V374 PolarHBondContact O-N 3.01Å; S372-V374 PolarHBondContact O-N 3.01Å; V374-A377 PolarHBondContact O-N 3.27Å; V374-R378 WeakPolarHBondContact O-CG 3.5Å; V374-R378 PolarHBondContact O-N 3.47Å
375V91.4Very high91.7Very high74 Ų7495.1 Ų95.145%0.44848%0.477SS..Hα-helixtrans-64.4-45174.8173.90000110.9R371 S372 A377 R378 M379R371-V375 WeakPolarHBondContact O-CG2 3.42Å; R371-V375 PolarHBondContact O-N 3.44Å; S372-V375 PolarHBondContact O-N 2.93Å; V375-A377 VanDerWaalsContact C-N 3.31Å; V375-A377 PolarHBondContact O-N 2.98Å; V375-R378 PolarHBondContact O-N 2.97Å; V375-M379 HydrophobicContact CG1-CG 4.42Å; V375-M379 WeakPolarHBondContact O-CG 3.39Å; V375-M379 PolarHBondContact O-N 3.32Å
376I90.6Very high91.5Very high85 Ų8593.4 Ų93.444%0.43647%0.47SS..Hα-helixtrans-61.1-39.6176.7-68.4164.5000111.2S372 S373 M379 K380S372-I376 VanDerWaalsContact O-CG1 3.31Å; S372-I376 WeakPolarHBondContact O-CG1 3.46Å; S372-I376 PolarHBondContact O-N 3.26Å; S373-I376 PolarHBondContact O-N 3.38Å; I376-M379 PolarHBondContact O-N 3.27Å; I376-K380 HydrophobicContact CG2-CD 4.28Å; I376-K380 WeakPolarHBondContact O-CG 3.5Å; I376-K380 PolarHBondContact O-N 3.01Å
377A93.2Very high91.5Very high48 Ų4895.5 Ų95.540%0.39748%0.479SS..Hα-helixtrans-62.2-49.8175.100000111.8S373 V374 V375 M379 K380 D381S373-A377 PolarHBondContact O-N 3.5Å; V374-A377 PolarHBondContact O-N 3.27Å; V375-A377 VanDerWaalsContact C-N 3.31Å; V375-A377 PolarHBondContact O-N 2.98Å; A377-M379 VanDerWaalsContact C-N 3.3Å; A377-M379 PolarHBondContact O-N 3.32Å; A377-K380 PolarHBondContact O-N 3.38Å; A377-K380 VanDerWaalsContact O-N 3.17Å; A377-D381 PolarHBondContact O-N 2.98Å
378R93.6Very high91.7Very high173 Ų173100.1 Ų100.165%0.65350%0.495SS*.Hα-helixtrans-59.5-38.8176.5-68.9178.4-166.4167.75.3112.8V374 V375 D381 R382V374-R378 WeakPolarHBondContact O-CG 3.5Å; V374-R378 PolarHBondContact O-N 3.47Å; V375-R378 PolarHBondContact O-N 2.97Å; R378-D381 PolarHBondContact O-N 3.42Å; R378-R382 WeakPolarHBondContact O-CB 3.25Å; R378-R382 PolarHBondContact O-N 3.43Å
379M91.5Very high91.9Very high116 Ų116100 Ų10057%0.57149%0.494SS*.Hα-helixtrans-67.4-40.4177.1-70-61.917600111.7V375 I376 A377 R382 I383V375-M379 HydrophobicContact CG1-CG 4.42Å; V375-M379 WeakPolarHBondContact O-CG 3.39Å; V375-M379 PolarHBondContact O-N 3.32Å; I376-M379 PolarHBondContact O-N 3.27Å; A377-M379 VanDerWaalsContact C-N 3.3Å; A377-M379 PolarHBondContact O-N 3.32Å; M379-R382 PolarHBondContact O-N 2.99Å; M379-I383 WeakPolarHBondContact O-CB 3.31Å; M379-I383 WeakPolarHBondContact O-CD1 2.97Å; M379-I383 VanDerWaalsContact O-CG1 3.25Å; M379-I383 WeakPolarHBondContact O-CG1 3Å; M379-I383 PolarHBondContact O-N 3.28Å
380K93.1Very high91.8Very high142 Ų14298.7 Ų98.762%0.61749%0.49SS*.Hα-helixtrans-62.8-43.6173.4-75.8175.1178.71770112.3I376 A377 R382 I383 G384I376-K380 HydrophobicContact CG2-CD 4.28Å; I376-K380 WeakPolarHBondContact O-CG 3.5Å; I376-K380 PolarHBondContact O-N 3.01Å; A377-K380 PolarHBondContact O-N 3.38Å; A377-K380 VanDerWaalsContact O-N 3.17Å; K380-R382 VanDerWaalsContact C-N 3.34Å; K380-R382 PolarHBondContact O-N 3.21Å; K380-I383 PolarHBondContact O-N 2.94Å; K380-G384 PolarHBondContact O-N 3.47Å
381D93.5Very high91.7Very high116 Ų11697.2 Ų97.262%0.6249%0.486SS*.Hα-helixtrans-62.3-42.6175-73.4-17.7000111.1A377 R378 G384 T385A377-D381 PolarHBondContact O-N 2.98Å; R378-D381 PolarHBondContact O-N 3.42Å; D381-G384 CarbonylContact O-C 3.5Å; D381-G384 PolarHBondContact O-N 2.76Å; D381-T385 PolarHBondContact O-N 2.63Å
382R92.6Very high91.7Very high128 Ų12894.9 Ų94.948%0.48348%0.483SS..Hα-helixtrans-63.8-44.3177.2-173.161-177.5136.7-5111.9R378 M379 K380 G384 T385 L386 E389R378-R382 WeakPolarHBondContact O-CB 3.25Å; R378-R382 PolarHBondContact O-N 3.43Å; M379-R382 PolarHBondContact O-N 2.99Å; K380-R382 VanDerWaalsContact C-N 3.34Å; K380-R382 PolarHBondContact O-N 3.21Å; R382-G384 VanDerWaalsContact C-N 3.34Å; R382-G384 PolarHBondContact O-N 3.4Å; R382-T385 PolarHBondContact NH1-OG1 3.16Å; R382-T385 PolarHBondContact O-N 2.73Å; R382-T385 VanDerWaalsContact O-N 3.17Å; R382-T385 PolarHBondContact O-OG1 3.17Å; R382-L386 HydrophobicContact CG-CD1 4.25Å; R382-L386 WeakPolarHBondContact O-CG 3.39Å; R382-L386 PolarHBondContact O-N 2.78Å; R382-E389 IonicContact NH1-OE1 2.59Å
383I90.9Very high92Very high92 Ų9298.3 Ų98.347%0.47249%0.491SS..Hα-helixtrans-57-48.8173.2-69.6162.8000109.9M379 K380 T385 L386 E387M379-I383 WeakPolarHBondContact O-CB 3.31Å; M379-I383 WeakPolarHBondContact O-CD1 2.97Å; M379-I383 VanDerWaalsContact O-CG1 3.25Å; M379-I383 WeakPolarHBondContact O-CG1 3Å; M379-I383 PolarHBondContact O-N 3.28Å; K380-I383 PolarHBondContact O-N 2.94Å; I383-T385 VanDerWaalsContact C-N 3.28Å; I383-T385 PolarHBondContact O-N 2.6Å; I383-L386 PolarHBondContact O-N 3.1Å; I383-L386 VanDerWaalsContact O-N 3.07Å; I383-E387 HydrophobicContact CG2-CG 4.25Å; I383-E387 WeakPolarHBondContact CG2-OE1 3.43Å; I383-E387 WeakPolarHBondContact O-CG 3.34Å; I383-E387 PolarHBondContact O-N 2.97Å
384G92.8Very high92Very high19 Ų1999.7 Ų99.720%0.19649%0.489CS..Hα-helixtrans-63.5-25.8177.300000114.9K380 D381 R382 K388K380-G384 PolarHBondContact O-N 3.47Å; D381-G384 CarbonylContact O-C 3.5Å; D381-G384 PolarHBondContact O-N 2.76Å; R382-G384 VanDerWaalsContact C-N 3.34Å; R382-G384 PolarHBondContact O-N 3.4Å; G384-K388 WeakPolarHBondContact O-CD 3.27Å; G384-K388 VanDerWaalsContact O-CG 3.27Å; G384-K388 WeakPolarHBondContact O-CG 3.47Å; G384-K388 PolarHBondContact O-N 3.25Å
385T92.3Very high91.9Very high56 Ų56101.4 Ų101.434%0.34450%0.496SS..Hα-helixtrans-72.7-45.5168.458.10000112.1D381 R382 I383 E387 K388 E389D381-T385 PolarHBondContact O-N 2.63Å; R382-T385 PolarHBondContact NH1-OG1 3.16Å; R382-T385 PolarHBondContact O-N 2.73Å; R382-T385 VanDerWaalsContact O-N 3.17Å; R382-T385 PolarHBondContact O-OG1 3.17Å; I383-T385 VanDerWaalsContact C-N 3.28Å; I383-T385 PolarHBondContact O-N 2.6Å; T385-E387 PolarHBondContact O-N 3.36Å; T385-K388 PolarHBondContact O-N 2.94Å; T385-E389 WeakPolarHBondContact O-CG 3.43Å; T385-E389 PolarHBondContact O-N 3.37Å
386L89.8Confident92.1Very high83 Ų83104.9 Ų104.944%0.43551%0.505SS..Hα-helixtrans-64.8-38.1179.6-69169.3000112R382 I383 K388 E389 H390R382-L386 HydrophobicContact CG-CD1 4.25Å; R382-L386 WeakPolarHBondContact O-CG 3.39Å; R382-L386 PolarHBondContact O-N 2.78Å; I383-L386 PolarHBondContact O-N 3.1Å; I383-L386 VanDerWaalsContact O-N 3.07Å; L386-K388 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 3.35Å; L386-E389 PolarHBondContact O-N 2.9Å; L386-H390 WeakPolarHBondContact O-CB 3.21Å; L386-H390 PolarHBondContact O-N 3.01Å
387E89.9Confident92Very high114 Ų114106 Ų10653%0.53351%0.51SS..Hα-helixtrans-61.4-41.3173.3-73172.3168.700111.7I383 T385 N391I383-E387 HydrophobicContact CG2-CG 4.25Å; I383-E387 WeakPolarHBondContact CG2-OE1 3.43Å; I383-E387 WeakPolarHBondContact O-CG 3.34Å; I383-E387 PolarHBondContact O-N 2.97Å; T385-E387 PolarHBondContact O-N 3.36Å; E387-N391 PolarHBondContact O-N 3.46Å; E387-N391 PolarHBondContact O-ND2 3.01Å
388K93.5Very high91.9Very high144 Ų144109.9 Ų109.963%0.62652%0.52SS*.Hα-helixtrans-68.3-43.7175.8-71.7168.5-172.9171.70111.7G384 T385 L386 H390 N391 I392G384-K388 WeakPolarHBondContact O-CD 3.27Å; G384-K388 VanDerWaalsContact O-CG 3.27Å; G384-K388 WeakPolarHBondContact O-CG 3.47Å; G384-K388 PolarHBondContact O-N 3.25Å; T385-K388 PolarHBondContact O-N 2.94Å; L386-K388 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 3.35Å; K388-H390 VanDerWaalsContact C-N 3.33Å; K388-H390 PolarHBondContact O-N 3.48Å; K388-N391 PolarHBondContact O-N 2.84Å; K388-I392 WeakPolarHBondContact O-CB 3.47Å; K388-I392 WeakPolarHBondContact O-CD1 3.49Å; K388-I392 VanDerWaalsContact O-CG1 3.25Å; K388-I392 WeakPolarHBondContact O-CG1 3.34Å; K388-I392 PolarHBondContact O-N 3.46Å
389E90.2Very high91.7Very high102 Ų102103.8 Ų103.848%0.47751%0.506SS..Hα-helixtrans-59.4-43.5175.1-73.5167-163.800111.1R382 T385 L386 I392 F393R382-E389 IonicContact NH1-OE1 2.59Å; T385-E389 WeakPolarHBondContact O-CG 3.43Å; T385-E389 PolarHBondContact O-N 3.37Å; L386-E389 PolarHBondContact O-N 2.9Å; E389-I392 PolarHBondContact O-N 2.97Å; E389-F393 WeakPolarHBondContact O-CB 3.25Å; E389-F393 PolarHBondContact O-N 3.4Å
390H90.1Very high91.5Very high118 Ų118101.4 Ų101.455%0.54650%0.501SS..Hα-helixtrans-63.1-46.2176.1-172.678.1000112.5L386 K388 I392 F393 Q394L386-H390 WeakPolarHBondContact O-CB 3.21Å; L386-H390 PolarHBondContact O-N 3.01Å; K388-H390 VanDerWaalsContact C-N 3.33Å; K388-H390 PolarHBondContact O-N 3.48Å; H390-I392 VanDerWaalsContact C-N 3.35Å; H390-I392 PolarHBondContact O-N 3.48Å; H390-F393 PolarHBondContact O-N 3.18Å; H390-Q394 WeakPolarHBondContact O-CB 3.34Å; H390-Q394 PolarHBondContact O-N 3.4Å
391N91.1Very high91.6Very high84 Ų84101.2 Ų101.245%0.44950%0.497SS..Hα-helixtrans-61.9-40.5175.4-82.6-79.2000112.2E387 K388 Q394 N395E387-N391 PolarHBondContact O-N 3.46Å; E387-N391 PolarHBondContact O-ND2 3.01Å; K388-N391 PolarHBondContact O-N 2.84Å; N391-Q394 PolarHBondContact O-N 2.99Å; N391-N395 WeakPolarHBondContact O-CB 3.36Å; N391-N395 VanDerWaalsContact O-CG 3.27Å; N391-N395 PolarHBondContact O-N 3.44Å; N391-N395 PolarHBondContact O-ND2 3.2Å; N391-N395 VanDerWaalsContact O-ND2 3.16Å
392I92.7Very high91.5Very high95 Ų95101.9 Ų101.949%0.48750%0.496SS..Hα-helixtrans-64-42.1175.2-69.3163.6000110.6K388 E389 H390 K396K388-I392 WeakPolarHBondContact O-CB 3.47Å; K388-I392 WeakPolarHBondContact O-CD1 3.49Å; K388-I392 VanDerWaalsContact O-CG1 3.25Å; K388-I392 WeakPolarHBondContact O-CG1 3.34Å; K388-I392 PolarHBondContact O-N 3.46Å; E389-I392 PolarHBondContact O-N 2.97Å; H390-I392 VanDerWaalsContact C-N 3.35Å; H390-I392 PolarHBondContact O-N 3.48Å; I392-K396 HydrophobicContact CG2-CD 4.28Å; I392-K396 WeakPolarHBondContact O-CB 3.01Å; I392-K396 WeakPolarHBondContact O-CG 3.31Å; I392-K396 PolarHBondContact O-N 3.49Å
393F94Very high91.3Very high128 Ų128102 Ų10256%0.56150%0.503SS*.Hα-helixtrans-64.8-44.8176.9-178.8-104.6000112.1E389 H390 N395 K396 M397E389-F393 WeakPolarHBondContact O-CB 3.25Å; E389-F393 PolarHBondContact O-N 3.4Å; H390-F393 PolarHBondContact O-N 3.18Å; F393-N395 PolarHBondContact O-N 3.21Å; F393-K396 PolarHBondContact O-N 2.98Å; F393-M397 HydrophobicContact CD1-CE 4.02Å; F393-M397 HydrophobicContact CE1-CE 3.36Å; F393-M397 HydrophobicContact CZ-CE 3.98Å; F393-M397 WeakPolarHBondContact O-CB 3.43Å; F393-M397 PolarHBondContact O-N 3.37Å
394Q91.6Very high91.1Very high104 Ų104101.4 Ų101.449%0.48650%0.503SS..Hα-helixtrans-60.3-44.7176.3-170.417821.900111.7H390 N391 M397 H398H390-Q394 WeakPolarHBondContact O-CB 3.34Å; H390-Q394 PolarHBondContact O-N 3.4Å; N391-Q394 PolarHBondContact O-N 2.99Å; Q394-M397 PolarHBondContact O-N 3.13Å; Q394-H398 PolarHBondContact O-N 3.17Å
395N92.6Very high91Very high108 Ų108104.7 Ų104.758%0.57851%0.514SS*.Hα-helixtrans-64-40.8175.7-73.4-30000112.4N391 F393 H398 A399N391-N395 WeakPolarHBondContact O-CB 3.36Å; N391-N395 VanDerWaalsContact O-CG 3.27Å; N391-N395 PolarHBondContact O-N 3.44Å; N391-N395 PolarHBondContact O-ND2 3.2Å; N391-N395 VanDerWaalsContact O-ND2 3.16Å; F393-N395 PolarHBondContact O-N 3.21Å; N395-H398 PolarHBondContact O-N 3.43Å; N395-A399 WeakPolarHBondContact O-CB 3.36Å; N395-A399 PolarHBondContact O-N 3.16Å
396K93.8Very high90.9Very high147 Ų147107.6 Ų107.664%0.63952%0.523SS*.Hα-helixtrans-63.7-40.2174-76.9178.2177.1-174.50112.3I392 F393 A399 S400I392-K396 HydrophobicContact CG2-CD 4.28Å; I392-K396 WeakPolarHBondContact O-CB 3.01Å; I392-K396 WeakPolarHBondContact O-CG 3.31Å; I392-K396 PolarHBondContact O-N 3.49Å; F393-K396 PolarHBondContact O-N 2.98Å; K396-A399 PolarHBondContact O-N 2.88Å; K396-S400 VanDerWaalsContact O-CB 3.3Å; K396-S400 WeakPolarHBondContact O-CB 3.47Å; K396-S400 PolarHBondContact O-N 2.97Å
397M88.8Confident90.9Very high110 Ų110110.1 Ų110.154%0.54254%0.535SS..Hα-helixtrans-63.4-43.7176.4-169.3-165.9-58.100111.1F393 Q394 S400 Y401F393-M397 HydrophobicContact CD1-CE 4.02Å; F393-M397 HydrophobicContact CE1-CE 3.36Å; F393-M397 HydrophobicContact CZ-CE 3.98Å; F393-M397 WeakPolarHBondContact O-CB 3.43Å; F393-M397 PolarHBondContact O-N 3.37Å; Q394-M397 PolarHBondContact O-N 3.13Å; M397-S400 PolarHBondContact O-N 3.13Å; M397-Y401 WeakPolarHBondContact O-CB 3.35Å; M397-Y401 PolarHBondContact O-N 3.37Å
398H91.1Very high90.7Very high129 Ų129111 Ų11160%0.59754%0.538SS*.Hα-helixtrans-66.7-41177.7-166.457.6000112.6Q394 N395 Y401 Q402Q394-H398 PolarHBondContact O-N 3.17Å; N395-H398 PolarHBondContact O-N 3.43Å; H398-Y401 PolarHBondContact O-N 3.31Å; H398-Q402 PolarHBondContact O-N 2.99Å
399A90.5Very high90.6Very high45 Ų45110.3 Ų110.337%0.37254%0.539SS..Hα-helixtrans-63.1-45.9174.100000112.2N395 K396 Y401 Q402 E403N395-A399 WeakPolarHBondContact O-CB 3.36Å; N395-A399 PolarHBondContact O-N 3.16Å; K396-A399 PolarHBondContact O-N 2.88Å; A399-Y401 VanDerWaalsContact C-N 3.31Å; A399-Y401 PolarHBondContact O-N 2.94Å; A399-Q402 WeakPolarHBondContact O-CB 3.41Å; A399-Q402 PolarHBondContact O-N 3.25Å; A399-Q402 VanDerWaalsContact O-N 3.12Å; A399-E403 PolarHBondContact O-N 3.01Å
400S87.6Confident90.7Very high65 Ų65110.9 Ų110.946%0.45554%0.54SS..Hα-helixtrans-59.4-40.4175.3177.90000112.2K396 M397 E403 T404K396-S400 VanDerWaalsContact O-CB 3.3Å; K396-S400 WeakPolarHBondContact O-CB 3.47Å; K396-S400 PolarHBondContact O-N 2.97Å; M397-S400 PolarHBondContact O-N 3.13Å; S400-E403 PolarHBondContact O-N 3.31Å; S400-T404 WeakPolarHBondContact O-CB 3.35Å; S400-T404 PolarHBondContact O-N 3.46Å; S400-T404 PolarHBondContact O-OG1 3.2Å
401Y93.4Very high90.7Very high139 Ų139112 Ų11255%0.54554%0.544SS..Hα-helixtrans-62.8-42173.9-177.1-102.8000112.1M397 H398 A399 T404 Q405M397-Y401 WeakPolarHBondContact O-CB 3.35Å; M397-Y401 PolarHBondContact O-N 3.37Å; H398-Y401 PolarHBondContact O-N 3.31Å; A399-Y401 VanDerWaalsContact C-N 3.31Å; A399-Y401 PolarHBondContact O-N 2.94Å; Y401-T404 WeakPolarHBondContact O-CB 3.43Å; Y401-T404 PolarHBondContact O-N 3.07Å; Y401-Q405 HydrophobicContact CE1-CG 4.2Å; Y401-Q405 VanDerWaalsContact CZ-NE2 3.34Å; Y401-Q405 WeakPolarHBondContact O-CG 3.34Å; Y401-Q405 PolarHBondContact O-N 2.89Å; Y401-Q405 PolarHBondContact OH-NE2 3.39Å; Y401-Q405 VanDerWaalsContact OH-NE2 3.1Å
402Q92.9Very high90.9Very high129 Ų129112.7 Ų112.760%0.60354%0.544SS*.Hα-helixtrans-66.9-40.3176.7-168.3175.717.300112.5H398 A399 T404 Q405 Q406H398-Q402 PolarHBondContact O-N 2.99Å; A399-Q402 WeakPolarHBondContact O-CB 3.41Å; A399-Q402 PolarHBondContact O-N 3.25Å; A399-Q402 VanDerWaalsContact O-N 3.12Å; Q402-T404 VanDerWaalsContact C-N 3.35Å; Q402-Q405 PolarHBondContact O-N 2.84Å; Q402-Q406 PolarHBondContact O-N 3.4Å
403E87.7Confident90.9Very high131 Ų131114.4 Ų114.461%0.61255%0.55SS*.Hα-helixtrans-63.9-39.7172.8-73.1-179.6179.500111.6A399 S400 Q406 M407A399-E403 PolarHBondContact O-N 3.01Å; S400-E403 PolarHBondContact O-N 3.31Å; E403-Q406 PolarHBondContact O-N 2.96Å; E403-M407 WeakPolarHBondContact O-CB 3.4Å; E403-M407 PolarHBondContact O-N 2.69Å
404T87.6Confident90.7Very high79 Ų79112.7 Ų112.749%0.48555%0.55SS.*Hα-helixtrans-62.5-46175.4-580000111.3S400 Y401 Q402 Q406 M407 Q408S400-T404 WeakPolarHBondContact O-CB 3.35Å; S400-T404 PolarHBondContact O-N 3.46Å; S400-T404 PolarHBondContact O-OG1 3.2Å; Y401-T404 WeakPolarHBondContact O-CB 3.43Å; Y401-T404 PolarHBondContact O-N 3.07Å; Q402-T404 VanDerWaalsContact C-N 3.35Å; T404-Q406 VanDerWaalsContact C-N 3.34Å; T404-Q406 PolarHBondContact O-N 2.71Å; T404-M407 PolarHBondContact O-N 3.36Å; T404-Q408 WeakPolarHBondContact O-CB 3.4Å; T404-Q408 PolarHBondContact O-N 3.26Å
405Q90.2Very high90.7Very high89 Ų89111.6 Ų111.642%0.41655%0.545SS..Hα-helixtrans-60.5-41.4173.4-74.1-171.2-17.800112.1Y401 Q402 M407 Q408 M409Y401-Q405 HydrophobicContact CE1-CG 4.2Å; Y401-Q405 VanDerWaalsContact CZ-NE2 3.34Å; Y401-Q405 WeakPolarHBondContact O-CG 3.34Å; Y401-Q405 PolarHBondContact O-N 2.89Å; Y401-Q405 PolarHBondContact OH-NE2 3.39Å; Y401-Q405 VanDerWaalsContact OH-NE2 3.1Å; Q402-Q405 PolarHBondContact O-N 2.84Å; Q405-M407 VanDerWaalsContact C-N 3.33Å; Q405-M407 PolarHBondContact O-N 3.37Å; Q405-Q408 PolarHBondContact O-N 2.95Å; Q405-M409 WeakPolarHBondContact O-CG 3.49Å; Q405-M409 PolarHBondContact O-N 2.68Å
406Q90.1Very high90.7Very high116 Ų116111.8 Ų111.854%0.54254%0.542SS..Hα-helixtrans-64.9-37.8176.8-163.1-168.843.300111.9Q402 E403 T404 K410Q402-Q406 PolarHBondContact O-N 3.4Å; E403-Q406 PolarHBondContact O-N 2.96Å; T404-Q406 VanDerWaalsContact C-N 3.34Å; T404-Q406 PolarHBondContact O-N 2.71Å; Q406-K410 WeakPolarHBondContact O-CG 3.47Å; Q406-K410 PolarHBondContact O-N 2.84Å; Q406-K410 VanDerWaalsContact O-N 3.11Å
407M90.1Very high90.6Very high137 Ų137111.1 Ų111.168%0.67554%0.541SS*.Hα-helixtrans-67-41.5175.4-167.2-178-58.800111.4E403 T404 Q405 K410 F411E403-M407 WeakPolarHBondContact O-CB 3.4Å; E403-M407 PolarHBondContact O-N 2.69Å; T404-M407 PolarHBondContact O-N 3.36Å; Q405-M407 VanDerWaalsContact C-N 3.33Å; Q405-M407 PolarHBondContact O-N 3.37Å; M407-K410 PolarHBondContact O-N 3.44Å; M407-F411 PolarHBondContact O-N 2.74Å
408Q86.2Confident90.8Very high131 Ų131111 Ų11161%0.61254%0.541SS*.Hα-helixtrans-62.6-43.9176.8-169.8171.110.800111.9T404 Q405 K410 F411 Q412T404-Q408 WeakPolarHBondContact O-CB 3.4Å; T404-Q408 PolarHBondContact O-N 3.26Å; Q405-Q408 PolarHBondContact O-N 2.95Å; Q408-K410 PolarHBondContact O-N 2.91Å; Q408-F411 PolarHBondContact O-N 3.46Å; Q408-Q412 PolarHBondContact O-N 3.17Å
409M90.8Very high90.9Very high130 Ų130109.7 Ų109.764%0.6454%0.535SS*.Hα-helixtrans-60.9-41.1173.4-72.8-62.8-5900112.5Q405 Q412 Q413Q405-M409 WeakPolarHBondContact O-CG 3.49Å; Q405-M409 PolarHBondContact O-N 2.68Å; M409-Q412 PolarHBondContact O-N 2.83Å; M409-Q413 WeakPolarHBondContact O-CB 3.41Å; M409-Q413 PolarHBondContact O-N 3.41Å
410K92.1Very high91Very high114 Ų114110.5 Ų110.550%0.49654%0.541SS..Hα-helixtrans-66.1-40.1175.4-75.6172.4179.2169.50112.2Q406 M407 Q408 Q413 V414Q406-K410 WeakPolarHBondContact O-CG 3.47Å; Q406-K410 PolarHBondContact O-N 2.84Å; Q406-K410 VanDerWaalsContact O-N 3.11Å; M407-K410 PolarHBondContact O-N 3.44Å; Q408-K410 PolarHBondContact O-N 2.91Å; K410-Q413 PolarHBondContact O-N 3.43Å; K410-V414 WeakPolarHBondContact O-CG2 3.49Å; K410-V414 PolarHBondContact O-N 2.87Å
411F90.5Very high91.3Very high143 Ų143113.1 Ų113.163%0.62755%0.547SS*.Hα-helixtrans-61.7-45.9175.9-176.6-91.5000110.8M407 Q408 Q413 V414 Q415M407-F411 PolarHBondContact O-N 2.74Å; Q408-F411 PolarHBondContact O-N 3.46Å; F411-Q413 PolarHBondContact O-N 2.83Å; F411-V414 PolarHBondContact O-N 3.29Å; F411-Q415 WeakPolarHBondContact O-CB 3.27Å; F411-Q415 PolarHBondContact O-N 3.08Å
412Q93.9Very high91.2Very high97 Ų97110 Ų11045%0.45354%0.538SS..Hα-helixtrans-62.8-40.9176.5-173.7162-4.500112.3Q408 M409 V414 Q415 E416Q408-Q412 PolarHBondContact O-N 3.17Å; M409-Q412 PolarHBondContact O-N 2.83Å; Q412-V414 PolarHBondContact O-N 3.47Å; Q412-Q415 WeakPolarHBondContact O-CB 3.4Å; Q412-Q415 PolarHBondContact O-N 2.91Å; Q412-E416 WeakPolarHBondContact O-CG 3.38Å; Q412-E416 PolarHBondContact O-N 3.38Å
413Q92.6Very high91.1Very high131 Ų131106.5 Ų106.561%0.61253%0.531SS*.Hα-helixtrans-62.4-39.8174.8-171.5177.914.800112.8M409 K410 F411 Q417M409-Q413 WeakPolarHBondContact O-CB 3.41Å; M409-Q413 PolarHBondContact O-N 3.41Å; K410-Q413 PolarHBondContact O-N 3.43Å; F411-Q413 PolarHBondContact O-N 2.83Å; Q413-Q417 WeakPolarHBondContact O-CB 3.46Å; Q413-Q417 PolarHBondContact O-N 3.37Å
414V91.8Very high91.5Very high93 Ų93104.9 Ų104.956%0.56452%0.524SS*.Hα-helixtrans-68.7-37.3175.1170.80000111.2K410 F411 Q412 Q417 M418K410-V414 WeakPolarHBondContact O-CG2 3.49Å; K410-V414 PolarHBondContact O-N 2.87Å; F411-V414 PolarHBondContact O-N 3.29Å; Q412-V414 PolarHBondContact O-N 3.47Å; V414-Q417 PolarHBondContact O-N 2.91Å; V414-M418 WeakPolarHBondContact O-CB 3.48Å; V414-M418 PolarHBondContact O-N 2.96Å
415Q90.3Very high91.7Very high81 Ų81105 Ų10538%0.37952%0.521SS..Hα-helixtrans-62.8-48.7174.2-177.1-179.3-1800111.3F411 Q412 Q417 M418 E419F411-Q415 WeakPolarHBondContact O-CB 3.27Å; F411-Q415 PolarHBondContact O-N 3.08Å; Q412-Q415 WeakPolarHBondContact O-CB 3.4Å; Q412-Q415 PolarHBondContact O-N 2.91Å; Q415-Q417 VanDerWaalsContact C-N 3.3Å; Q415-Q417 PolarHBondContact O-N 2.79Å; Q415-M418 PolarHBondContact O-N 3.15Å; Q415-E419 HydrophobicContact CG-CG 4.49Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.25Å; Q415-E419 PolarHBondContact NE2-OE1 2.98Å; Q415-E419 WeakPolarHBondContact O-CG 3.48Å; Q415-E419 PolarHBondContact O-N 3.24Å
416E93.9Very high91.8Very high112 Ų112107.7 Ų107.752%0.52353%0.531SS..Hα-helixtrans-59.4-39.8176.5-73.7172.8-168.100112Q412 E419 A420Q412-E416 WeakPolarHBondContact O-CG 3.38Å; Q412-E416 PolarHBondContact O-N 3.38Å; E416-E419 PolarHBondContact O-N 2.99Å; E416-A420 WeakPolarHBondContact O-CB 3.39Å; E416-A420 PolarHBondContact O-N 3.26Å
417Q91.6Very high92.1Very high133 Ų133108.3 Ų108.362%0.62153%0.534SS*.Hα-helixtrans-63.7-44.8174.7-175.9176.9-7.600112Q413 V414 Q415 A420 E421Q413-Q417 WeakPolarHBondContact O-CB 3.46Å; Q413-Q417 PolarHBondContact O-N 3.37Å; V414-Q417 PolarHBondContact O-N 2.91Å; Q415-Q417 VanDerWaalsContact C-N 3.3Å; Q415-Q417 PolarHBondContact O-N 2.79Å; Q417-A420 PolarHBondContact O-N 3.24Å; Q417-E421 PolarHBondContact O-N 2.99Å
418M92.4Very high92.2Very high106 Ų106105.9 Ų105.952%0.52252%0.521SS..Hα-helixtrans-65.5-40177.3-177.4179.663.500111.8V414 Q415 E421 I422V414-M418 WeakPolarHBondContact O-CB 3.48Å; V414-M418 PolarHBondContact O-N 2.96Å; Q415-M418 PolarHBondContact O-N 3.15Å; M418-E421 PolarHBondContact O-N 2.84Å; M418-I422 HydrophobicContact CG-CD1 3.97Å; M418-I422 WeakPolarHBondContact O-CB 3.44Å; M418-I422 VanDerWaalsContact O-CG1 3.26Å; M418-I422 WeakPolarHBondContact O-CG1 3.2Å; M418-I422 PolarHBondContact O-N 2.89Å
419E92.6Very high92.5Very high103 Ų103103.7 Ų103.748%0.48151%0.514SS..Hα-helixtrans-65-39.3175.8-74.7179.8-160.400111.9Q415 E416 I422 A423Q415-E419 HydrophobicContact CG-CG 4.49Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.25Å; Q415-E419 PolarHBondContact NE2-OE1 2.98Å; Q415-E419 WeakPolarHBondContact O-CG 3.48Å; Q415-E419 PolarHBondContact O-N 3.24Å; E416-E419 PolarHBondContact O-N 2.99Å; E419-I422 PolarHBondContact O-N 3.32Å; E419-A423 WeakPolarHBondContact O-CB 3.32Å; E419-A423 PolarHBondContact O-N 3.4Å
420A92.7Very high92.7Very high61 Ų6198.4 Ų98.450%0.50449%0.493SS..Hα-helixtrans-64.2-41173.300000112.5E416 Q417 A423 H424E416-A420 WeakPolarHBondContact O-CB 3.39Å; E416-A420 PolarHBondContact O-N 3.26Å; Q417-A420 PolarHBondContact O-N 3.24Å; A420-A423 WeakPolarHBondContact O-CB 3.42Å; A420-A423 PolarHBondContact O-N 3.47Å; A420-H424 PolarHBondContact O-N 3.47Å
421E93.2Very high92.7Very high121 Ų12197.9 Ų97.957%0.56549%0.494SS*.Hα-helixtrans-69.1-38.3176.6-169.5163.4-161.700112Q417 M418 A423 H424 L425Q417-E421 PolarHBondContact O-N 2.99Å; M418-E421 PolarHBondContact O-N 2.84Å; E421-A423 VanDerWaalsContact C-N 3.33Å; E421-A423 PolarHBondContact O-N 3.22Å; E421-H424 PolarHBondContact O-N 3.45Å; E421-L425 HydrophobicContact CG-CD1 4.4Å; E421-L425 WeakPolarHBondContact O-CB 3.23Å; E421-L425 WeakPolarHBondContact O-CG 3.25Å; E421-L425 PolarHBondContact O-N 2.7Å
422I92.3Very high92.9Very high73 Ų7395.5 Ų95.537%0.37449%0.488SS..Hα-helixtrans-62.4-39.5170.4-70.9166000111.1M418 E419 K426M418-I422 HydrophobicContact CG-CD1 3.97Å; M418-I422 WeakPolarHBondContact O-CB 3.44Å; M418-I422 VanDerWaalsContact O-CG1 3.26Å; M418-I422 WeakPolarHBondContact O-CG1 3.2Å; M418-I422 PolarHBondContact O-N 2.89Å; E419-I422 PolarHBondContact O-N 3.32Å; I422-K426 HydrophobicContact CG2-CD 4.04Å; I422-K426 WeakPolarHBondContact O-CB 3.36Å; I422-K426 VanDerWaalsContact O-CG 3.24Å; I422-K426 WeakPolarHBondContact O-CG 3.1Å; I422-K426 PolarHBondContact O-N 3.4Å
423A91.5Very high92.9Very high55 Ų5598.8 Ų98.846%0.45550%0.496SS..Hα-helixtrans-65.3-42.7175.600000111.7E419 A420 E421 K426 Q427E419-A423 WeakPolarHBondContact O-CB 3.32Å; E419-A423 PolarHBondContact O-N 3.4Å; A420-A423 WeakPolarHBondContact O-CB 3.42Å; A420-A423 PolarHBondContact O-N 3.47Å; E421-A423 VanDerWaalsContact C-N 3.33Å; E421-A423 PolarHBondContact O-N 3.22Å; A423-K426 PolarHBondContact O-N 3.46Å; A423-Q427 PolarHBondContact O-N 3.49Å
424H94.6Very high93Very high98 Ų9898.1 Ų98.145%0.45450%0.496SS..Hα-helixtrans-60.3-50.9174.2-173.3-92.3000111.8A420 E421 K426 Q427 E428A420-H424 PolarHBondContact O-N 3.47Å; E421-H424 PolarHBondContact O-N 3.45Å; H424-K426 VanDerWaalsContact C-N 3.29Å; H424-K426 PolarHBondContact O-N 2.98Å; H424-Q427 WeakPolarHBondContact O-CA 3.06Å; H424-Q427 WeakPolarHBondContact O-CB 3.19Å; H424-Q427 PolarHBondContact O-N 3.5Å; H424-E428 IonicContact CE1-OE1 2.91Å; H424-E428 PolarHBondContact CE1-OE1 3.44Å; H424-E428 VanDerWaalsContact CE1-OE1 3.25Å; H424-E428 IonicContact CE1-OE2 2.76Å; H424-E428 IonicContact ND1-OE1 2.66Å; H424-E428 IonicContact ND1-OE2 2.79Å; H424-E428 PolarHBondContact ND1-OE2 2.98Å; H424-E428 PolarHBondContact O-N 3.4Å
425L93.6Very high93Very high82 Ų8296 Ų9643%0.42949%0.489SS..Hα-helixtrans-61.4-35.5177.1-71.6169.6000112.1E421 Q427 N429E421-L425 HydrophobicContact CG-CD1 4.4Å; E421-L425 WeakPolarHBondContact O-CB 3.23Å; E421-L425 WeakPolarHBondContact O-CG 3.25Å; E421-L425 PolarHBondContact O-N 2.7Å; L425-Q427 VanDerWaalsContact C-N 3.35Å; L425-N429 WeakPolarHBondContact O-CB 3.17Å; L425-N429 PolarHBondContact O-N 3.23Å; L425-N429 PolarHBondContact O-ND2 3.49Å
426K92.1Very high93.1Very high145 Ų14595.7 Ų95.763%0.6349%0.492SS*.Hα-helixtrans-64.7-37.8172.4-78.8170.2-179.7172.30112.1I422 A423 H424 G430I422-K426 HydrophobicContact CG2-CD 4.04Å; I422-K426 WeakPolarHBondContact O-CB 3.36Å; I422-K426 VanDerWaalsContact O-CG 3.24Å; I422-K426 WeakPolarHBondContact O-CG 3.1Å; I422-K426 PolarHBondContact O-N 3.4Å; A423-K426 PolarHBondContact O-N 3.46Å; H424-K426 VanDerWaalsContact C-N 3.29Å; H424-K426 PolarHBondContact O-N 2.98Å; K426-G430 PolarHBondContact O-N 3.21Å
427Q96Very high93.1Very high128 Ų12893.2 Ų93.260%0.59849%0.487SS*.Hα-helixtrans-67.7-46.8175.4-176.5179-4.500111.6A423 H424 L425 N429 G430 I431A423-Q427 PolarHBondContact O-N 3.49Å; H424-Q427 WeakPolarHBondContact O-CA 3.06Å; H424-Q427 WeakPolarHBondContact O-CB 3.19Å; H424-Q427 PolarHBondContact O-N 3.5Å; L425-Q427 VanDerWaalsContact C-N 3.35Å; Q427-N429 PolarHBondContact O-N 3.44Å; Q427-G430 WeakPolarHBondContact O-CA 3.45Å; Q427-G430 PolarHBondContact O-N 3.14Å; Q427-I431 HydrophobicContact CG-CD1 4.31Å; Q427-I431 WeakPolarHBondContact O-CG1 3.35Å; Q427-I431 PolarHBondContact O-N 3.22Å
428E92.3Very high93.1Very high87 Ų8792.3 Ų92.341%0.40749%0.487SS..Hα-helixtrans-60.3-44175.5-70.7-174.9134.600111.7H424 G430 I431 L432H424-E428 IonicContact CE1-OE1 2.91Å; H424-E428 PolarHBondContact CE1-OE1 3.44Å; H424-E428 VanDerWaalsContact CE1-OE1 3.25Å; H424-E428 IonicContact CE1-OE2 2.76Å; H424-E428 IonicContact ND1-OE1 2.66Å; H424-E428 IonicContact ND1-OE2 2.79Å; H424-E428 PolarHBondContact ND1-OE2 2.98Å; H424-E428 PolarHBondContact O-N 3.4Å; E428-G430 PolarHBondContact O-N 3.48Å; E428-I431 PolarHBondContact O-N 3.02Å; E428-L432 WeakPolarHBondContact O-CB 3.21Å; E428-L432 WeakPolarHBondContact O-CG 3.49Å; E428-L432 PolarHBondContact O-N 3.02Å
429N91.4Very high93.1Very high84 Ų8491.5 Ų91.545%0.44949%0.488SS..Hα-helixtrans-65.2-24.1172.6-79.4-70.1000113.2L425 Q427 R433L425-N429 WeakPolarHBondContact O-CB 3.17Å; L425-N429 PolarHBondContact O-N 3.23Å; L425-N429 PolarHBondContact O-ND2 3.49Å; Q427-N429 PolarHBondContact O-N 3.44Å; N429-R433 WeakPolarHBondContact O-CB 3.22Å; N429-R433 WeakPolarHBondContact O-CG 3.34Å; N429-R433 PolarHBondContact O-N 2.98Å; N429-R433 PolarHBondContact O-NE 3.43Å
430G94.8Very high93Very high20 Ų2087.8 Ų87.821%0.20647%0.473CS..Hα-helixtrans-64.7-57.7166.400000111K426 Q427 E428 L432 R433 D434K426-G430 PolarHBondContact O-N 3.21Å; Q427-G430 WeakPolarHBondContact O-CA 3.45Å; Q427-G430 PolarHBondContact O-N 3.14Å; E428-G430 PolarHBondContact O-N 3.48Å; G430-L432 VanDerWaalsContact C-N 3.3Å; G430-L432 PolarHBondContact O-N 3.43Å; G430-R433 PolarHBondContact O-N 3.46Å; G430-D434 PolarHBondContact O-N 2.95Å
431I93.6Very high92.9Very high102 Ų10288.9 Ų88.952%0.52347%0.47SS..Hα-helixtrans-56.7-42-180-63.2165.7000111.6Q427 E428 D434 A435Q427-I431 HydrophobicContact CG-CD1 4.31Å; Q427-I431 WeakPolarHBondContact O-CG1 3.35Å; Q427-I431 PolarHBondContact O-N 3.22Å; E428-I431 PolarHBondContact O-N 3.02Å; I431-D434 PolarHBondContact O-N 3.49Å; I431-A435 WeakPolarHBondContact O-CB 3.35Å; I431-A435 PolarHBondContact O-N 3.31Å
432L93.3Very high92.8Very high94 Ų9488.2 Ų88.249%0.49247%0.467SS..Hα-helixtrans-65.4-41.2176.7-71173.6000112.2E428 G430 A435 V436E428-L432 WeakPolarHBondContact O-CB 3.21Å; E428-L432 WeakPolarHBondContact O-CG 3.49Å; E428-L432 PolarHBondContact O-N 3.02Å; G430-L432 VanDerWaalsContact C-N 3.3Å; G430-L432 PolarHBondContact O-N 3.43Å; L432-A435 PolarHBondContact O-N 2.94Å; L432-V436 WeakPolarHBondContact O-CB 3.5Å; L432-V436 VanDerWaalsContact O-CG2 3.28Å; L432-V436 WeakPolarHBondContact O-CG2 3.48Å; L432-V436 PolarHBondContact O-N 2.89Å
433R94.4Very high92.8Very high166 Ų16688.7 Ų88.763%0.62647%0.469SS*.Hα-helixtrans-64.9-40174.2-80.3178.5-67.4-161.41.3112N429 G430 V436 S437N429-R433 WeakPolarHBondContact O-CB 3.22Å; N429-R433 WeakPolarHBondContact O-CG 3.34Å; N429-R433 PolarHBondContact O-N 2.98Å; N429-R433 PolarHBondContact O-NE 3.43Å; G430-R433 PolarHBondContact O-N 3.46Å; R433-V436 PolarHBondContact O-N 3.39Å; R433-S437 VanDerWaalsContact O-CB 3.26Å; R433-S437 WeakPolarHBondContact O-CB 3.22Å; R433-S437 PolarHBondContact O-N 2.98Å
434D93.9Very high92.6Very high116 Ų11690 Ų9062%0.6247%0.466SS*.Hα-helixtrans-66.8-39.9176.7-68.1-20.8000111.3G430 I431 S437 N438G430-D434 PolarHBondContact O-N 2.95Å; I431-D434 PolarHBondContact O-N 3.49Å; D434-S437 PolarHBondContact O-N 3.01Å; D434-N438 VanDerWaalsContact O-CB 3.24Å; D434-N438 WeakPolarHBondContact O-CB 3.5Å; D434-N438 PolarHBondContact O-N 3.26Å
435A93.4Very high92.4Very high50 Ų5089 Ų8941%0.41347%0.471SS..Hα-helixtrans-65.3-42.8174.200000112.4I431 L432 N438 T439I431-A435 WeakPolarHBondContact O-CB 3.35Å; I431-A435 PolarHBondContact O-N 3.31Å; L432-A435 PolarHBondContact O-N 2.94Å; A435-N438 PolarHBondContact O-N 3.46Å; A435-T439 WeakPolarHBondContact O-CB 3.37Å; A435-T439 WeakPolarHBondContact O-CG2 3.46Å; A435-T439 PolarHBondContact O-N 2.89Å; A435-T439 PolarHBondContact O-OG1 3.38Å
436V91.8Very high92.4Very high73 Ų7390.6 Ų90.644%0.44247%0.474SS..Hα-helixtrans-63.9-45173.8169.70000110.6L432 R433 N438 T439 T440L432-V436 WeakPolarHBondContact O-CB 3.5Å; L432-V436 VanDerWaalsContact O-CG2 3.28Å; L432-V436 WeakPolarHBondContact O-CG2 3.48Å; L432-V436 PolarHBondContact O-N 2.89Å; R433-V436 PolarHBondContact O-N 3.39Å; V436-N438 PolarHBondContact O-N 2.72Å; V436-T439 WeakPolarHBondContact CA-OG1 3.3Å; V436-T439 PolarHBondContact O-N 2.71Å; V436-T439 PolarHBondContact O-OG1 3.44Å; V436-T440 VanDerWaalsContact O-CB 3.23Å; V436-T440 WeakPolarHBondContact O-CB 3.16Å; V436-T440 PolarHBondContact O-N 2.93Å; V436-T440 PolarHBondContact O-OG1 3.24Å
437S93.3Very high92.3Very high60 Ų6086.8 Ų86.842%0.4246%0.459SS..Hα-helixtrans-60.9-44.9176.2-175.70000111.9R433 D434 T440 N441R433-S437 VanDerWaalsContact O-CB 3.26Å; R433-S437 WeakPolarHBondContact O-CB 3.22Å; R433-S437 PolarHBondContact O-N 2.98Å; D434-S437 PolarHBondContact O-N 3.01Å; S437-T440 WeakPolarHBondContact O-CB 3.37Å; S437-T440 PolarHBondContact O-N 3Å; S437-N441 WeakPolarHBondContact O-CB 3.46Å; S437-N441 PolarHBondContact O-N 3.35Å; S437-N441 PolarHBondContact O-ND2 2.91Å; S437-N441 VanDerWaalsContact O-ND2 3.13Å
438N92.6Very high92Very high114 Ų11483.9 Ų83.961%0.6145%0.452SS*.Hα-helixtrans-68.7-41.7-179.8-163.512.3000112.5D434 A435 V436 T440 N441 Q442D434-N438 VanDerWaalsContact O-CB 3.24Å; D434-N438 WeakPolarHBondContact O-CB 3.5Å; D434-N438 PolarHBondContact O-N 3.26Å; A435-N438 PolarHBondContact O-N 3.46Å; V436-N438 PolarHBondContact O-N 2.72Å; N438-T440 VanDerWaalsContact C-N 3.34Å; N438-N441 PolarHBondContact O-N 3.28Å; N438-Q442 WeakPolarHBondContact O-CB 3.22Å; N438-Q442 PolarHBondContact O-N 2.76Å
439T91.6Very high92Very high90 Ų9082.5 Ų82.555%0.55246%0.456SS*.Hα-helixtrans-66.6-35.7173.650.80000112.3A435 V436 Q442 L443A435-T439 WeakPolarHBondContact O-CB 3.37Å; A435-T439 WeakPolarHBondContact O-CG2 3.46Å; A435-T439 PolarHBondContact O-N 2.89Å; A435-T439 PolarHBondContact O-OG1 3.38Å; V436-T439 WeakPolarHBondContact CA-OG1 3.3Å; V436-T439 PolarHBondContact O-N 2.71Å; V436-T439 PolarHBondContact O-OG1 3.44Å; T439-Q442 PolarHBondContact O-N 3.44Å; T439-L443 WeakPolarHBondContact O-CB 3.43Å; T439-L443 PolarHBondContact O-N 3.43Å
440T91.8Very high92.1Very high25 Ų2585.1 Ų85.115%0.15347%0.465CS..Hα-helixtrans-58.3-58.7170.3-60.10000110.4Q41 V436 S437 N438 Q442 L443 E444Q41-T440 PolarHBondContact NE2-OG1 3.02Å; V436-T440 VanDerWaalsContact O-CB 3.23Å; V436-T440 WeakPolarHBondContact O-CB 3.16Å; V436-T440 PolarHBondContact O-N 2.93Å; V436-T440 PolarHBondContact O-OG1 3.24Å; S437-T440 WeakPolarHBondContact O-CB 3.37Å; S437-T440 PolarHBondContact O-N 3Å; N438-T440 VanDerWaalsContact C-N 3.34Å; T440-Q442 PolarHBondContact O-N 3.43Å; T440-L443 CarbonylContact O-C 3.54Å; T440-L443 WeakPolarHBondContact O-CA 3.49Å; T440-L443 WeakPolarHBondContact O-CB 3.43Å; T440-L443 PolarHBondContact O-N 3.49Å; T440-E444 HydrophobicContact CG2-CG 4.12Å; T440-E444 WeakPolarHBondContact O-CG 3.4Å; T440-E444 PolarHBondContact O-N 2.89Å
441N90.1Very high91.9Very high83 Ų8388.4 Ų88.444%0.44448%0.478SS..Hα-helixtrans-57.6-37.7-179.1-66-25.6000111.8S437 N438 E444 S445S437-N441 WeakPolarHBondContact O-CB 3.46Å; S437-N441 PolarHBondContact O-N 3.35Å; S437-N441 PolarHBondContact O-ND2 2.91Å; S437-N441 VanDerWaalsContact O-ND2 3.13Å; N438-N441 PolarHBondContact O-N 3.28Å; N441-E444 PolarHBondContact O-N 2.85Å; N441-S445 VanDerWaalsContact O-CB 3.28Å; N441-S445 WeakPolarHBondContact O-CB 3.49Å; N441-S445 PolarHBondContact O-N 3.21Å
442Q91.2Very high91.8Very high108 Ų10888 Ų8851%0.50548%0.477SS..Hα-helixtrans-66.3-38.8174-164.6-168.589.400112.3N438 T439 T440 K446N438-Q442 WeakPolarHBondContact O-CB 3.22Å; N438-Q442 PolarHBondContact O-N 2.76Å; T439-Q442 PolarHBondContact O-N 3.44Å; T440-Q442 PolarHBondContact O-N 3.43Å; Q442-K446 HydrophobicContact CG-CD 4.46Å; Q442-K446 WeakPolarHBondContact O-CB 3.36Å; Q442-K446 VanDerWaalsContact O-CG 3.31Å; Q442-K446 WeakPolarHBondContact O-CG 3.35Å; Q442-K446 PolarHBondContact O-N 2.83Å
443L90.8Very high91.9Very high82 Ų8289.7 Ų89.743%0.42948%0.48SS..Hα-helixtrans-68.4-42.5175-178.364.4000111.7T439 T440 S445 K446 Q447T439-L443 WeakPolarHBondContact O-CB 3.43Å; T439-L443 PolarHBondContact O-N 3.43Å; T440-L443 CarbonylContact O-C 3.54Å; T440-L443 WeakPolarHBondContact O-CA 3.49Å; T440-L443 WeakPolarHBondContact O-CB 3.43Å; T440-L443 PolarHBondContact O-N 3.49Å; L443-S445 VanDerWaalsContact C-N 3.32Å; L443-S445 PolarHBondContact O-N 2.92Å; L443-K446 PolarHBondContact O-N 3.3Å; L443-Q447 HydrophobicContact CD1-CG 4.49Å; L443-Q447 WeakPolarHBondContact O-CB 3.43Å; L443-Q447 WeakPolarHBondContact O-CG 3.38Å; L443-Q447 PolarHBondContact O-N 3.09Å
444E87.8Confident91.8Very high82 Ų8287.2 Ų87.238%0.38348%0.479SS..Hα-helixtrans-60.9-42.5175.2-51.7-142.712100111.3Q45 T440 N441 Q447 S448Q45-E444 VanDerWaalsContact NE2-CD 3.26Å; Q45-E444 PolarHBondContact NE2-OE1 2.76Å; T440-E444 HydrophobicContact CG2-CG 4.12Å; T440-E444 WeakPolarHBondContact O-CG 3.4Å; T440-E444 PolarHBondContact O-N 2.89Å; N441-E444 PolarHBondContact O-N 2.85Å; E444-Q447 PolarHBondContact O-N 3.31Å; E444-S448 VanDerWaalsContact O-CB 3.31Å; E444-S448 WeakPolarHBondContact O-CB 3.43Å; E444-S448 PolarHBondContact O-N 3.09Å; E444-S448 PolarHBondContact O-OG 3.23Å
445S91.3Very high91.8Very high79 Ų7989.8 Ų89.855%0.55248%0.48SS*.Hα-helixtrans-62.7-45.7175.7-1760000111.8N441 L443 S448 A449N441-S445 VanDerWaalsContact O-CB 3.28Å; N441-S445 WeakPolarHBondContact O-CB 3.49Å; N441-S445 PolarHBondContact O-N 3.21Å; L443-S445 VanDerWaalsContact C-N 3.32Å; L443-S445 PolarHBondContact O-N 2.92Å; S445-S448 PolarHBondContact O-N 3.38Å; S445-A449 PolarHBondContact O-N 2.86Å
446K92.4Very high91.8Very high115 Ų11592.7 Ų92.750%0.549%0.485SS..Hα-helixtrans-61.4-48.1175.3-77.8169.1174.2170.20112.1Q442 L443 S448 A449 E450Q442-K446 HydrophobicContact CG-CD 4.46Å; Q442-K446 WeakPolarHBondContact O-CB 3.36Å; Q442-K446 VanDerWaalsContact O-CG 3.31Å; Q442-K446 WeakPolarHBondContact O-CG 3.35Å; Q442-K446 PolarHBondContact O-N 2.83Å; L443-K446 PolarHBondContact O-N 3.3Å; K446-S448 VanDerWaalsContact C-N 3.3Å; K446-S448 PolarHBondContact O-N 3.43Å; K446-A449 WeakPolarHBondContact O-CB 3.35Å; K446-A449 PolarHBondContact O-N 2.73Å; K446-E450 PolarHBondContact O-N 2.76Å
447Q90.1Very high91.8Very high65 Ų6591.7 Ų91.730%0.30448%0.477SS..Hα-helixtrans-60.3-40.3175.5-74.3-171.75100111.9L443 E444 A449 E450 L451L443-Q447 HydrophobicContact CD1-CG 4.49Å; L443-Q447 WeakPolarHBondContact O-CB 3.43Å; L443-Q447 WeakPolarHBondContact O-CG 3.38Å; L443-Q447 PolarHBondContact O-N 3.09Å; E444-Q447 PolarHBondContact O-N 3.31Å; Q447-A449 VanDerWaalsContact C-N 3.35Å; Q447-A449 PolarHBondContact O-N 2.68Å; Q447-E450 PolarHBondContact O-N 2.84Å; Q447-L451 VanDerWaalsContact O-CB 3.27Å; Q447-L451 WeakPolarHBondContact O-CB 3.09Å; Q447-L451 PolarHBondContact O-N 3.46Å
448S90.3Very high91.6Very high66 Ų6692.1 Ų92.146%0.46248%0.479SS..Hα-helixtrans-64.2-39176.1-61.20000112.1E444 S445 K446 N452E444-S448 VanDerWaalsContact O-CB 3.31Å; E444-S448 WeakPolarHBondContact O-CB 3.43Å; E444-S448 PolarHBondContact O-N 3.09Å; E444-S448 PolarHBondContact O-OG 3.23Å; S445-S448 PolarHBondContact O-N 3.38Å; K446-S448 VanDerWaalsContact C-N 3.3Å; K446-S448 PolarHBondContact O-N 3.43Å; S448-N452 WeakPolarHBondContact O-CB 3.35Å; S448-N452 VanDerWaalsContact O-CG 3.27Å; S448-N452 PolarHBondContact O-N 2.87Å; S448-N452 PolarHBondContact O-ND2 3.47Å
449A92.4Very high91.6Very high59 Ų5988.4 Ų88.449%0.48847%0.468SS..Hα-helixtrans-66.9-42.9174.700000112.2S445 K446 Q447 N452 K453S445-A449 PolarHBondContact O-N 2.86Å; K446-A449 WeakPolarHBondContact O-CB 3.35Å; K446-A449 PolarHBondContact O-N 2.73Å; Q447-A449 VanDerWaalsContact C-N 3.35Å; Q447-A449 PolarHBondContact O-N 2.68Å; A449-N452 PolarHBondContact O-N 2.77Å; A449-K453 WeakPolarHBondContact O-CB 3.25Å; A449-K453 PolarHBondContact O-N 2.66Å
450E92.8Very high91.7Very high138 Ų13889 Ų8965%0.64546%0.46SS*.Hα-helixtrans-64.2-41.6174.6-73.8-177.917800112.4K446 Q447 N452 K453 L454K446-E450 PolarHBondContact O-N 2.76Å; Q447-E450 PolarHBondContact O-N 2.84Å; E450-N452 VanDerWaalsContact C-N 3.35Å; E450-N452 PolarHBondContact O-N 2.89Å; E450-K453 WeakPolarHBondContact O-CB 3.19Å; E450-K453 PolarHBondContact O-N 3.12Å; E450-L454 WeakPolarHBondContact O-CB 3.31Å; E450-L454 PolarHBondContact O-N 3.4Å
451L92.3Very high91.8Very high89 Ų8992.4 Ų92.447%0.46648%0.477SS..Hα-helixtrans-63.9-41.4176.7-162.2164.4000110.8Q447 L454 R455Q447-L451 VanDerWaalsContact O-CB 3.27Å; Q447-L451 WeakPolarHBondContact O-CB 3.09Å; Q447-L451 PolarHBondContact O-N 3.46Å; L451-L454 PolarHBondContact O-N 2.97Å; L451-R455 HydrophobicContact CD2-CG 4.17Å; L451-R455 VanDerWaalsContact CD2-CZ 3.42Å; L451-R455 WeakPolarHBondContact O-CG 3.42Å; L451-R455 PolarHBondContact O-N 2.87Å
452N91.5Very high91.9Very high94 Ų9492.3 Ų92.350%0.50348%0.479SS..Hα-helixtrans-66-38.6173.2-74.5-27.5000112.6S448 A449 E450 R455 Q456S448-N452 WeakPolarHBondContact O-CB 3.35Å; S448-N452 VanDerWaalsContact O-CG 3.27Å; S448-N452 PolarHBondContact O-N 2.87Å; S448-N452 PolarHBondContact O-ND2 3.47Å; A449-N452 PolarHBondContact O-N 2.77Å; E450-N452 VanDerWaalsContact C-N 3.35Å; E450-N452 PolarHBondContact O-N 2.89Å; N452-R455 PolarHBondContact O-N 3.3Å; N452-Q456 PolarHBondContact O-N 2.92Å
453K94.5Very high91.9Very high130 Ų13090.9 Ų90.957%0.56548%0.481SS*.Hα-helixtrans-62.5-45.9172.8-175.2-176.9174.8-173.50111.3A449 E450 R455 Q456 D457A449-K453 WeakPolarHBondContact O-CB 3.25Å; A449-K453 PolarHBondContact O-N 2.66Å; E450-K453 WeakPolarHBondContact O-CB 3.19Å; E450-K453 PolarHBondContact O-N 3.12Å; K453-R455 VanDerWaalsContact C-N 3.33Å; K453-R455 PolarHBondContact O-N 2.96Å; K453-Q456 CarbonylContact O-C 3.56Å; K453-Q456 WeakPolarHBondContact O-CA 3.28Å; K453-Q456 VanDerWaalsContact O-CB 3.3Å; K453-Q456 WeakPolarHBondContact O-CB 3.37Å; K453-Q456 PolarHBondContact O-N 3.37Å; K453-D457 PolarHBondContact O-N 3.01Å
454L92.9Very high92Very high114 Ų11491 Ų9160%0.59748%0.479SS*.Hα-helixtrans-63.3-38.5177.7-168.668.5000111.8E450 L451 Q456 D457 C458E450-L454 WeakPolarHBondContact O-CB 3.31Å; E450-L454 PolarHBondContact O-N 3.4Å; L451-L454 PolarHBondContact O-N 2.97Å; L454-Q456 VanDerWaalsContact C-N 3.33Å; L454-Q456 PolarHBondContact O-N 3.16Å; L454-D457 PolarHBondContact O-N 2.88Å; L454-C458 PolarHBondContact O-N 3.47Å; L454-C458 PolarHBondContact O-SG 2.96Å
455R92.8Very high92.1Very high169 Ų16992.3 Ų92.364%0.63849%0.488SS*.Hα-helixtrans-60.9-40.3170.2-75.7173.7174.5174.41.4112.1L451 N452 K453 G459L451-R455 HydrophobicContact CD2-CG 4.17Å; L451-R455 VanDerWaalsContact CD2-CZ 3.42Å; L451-R455 WeakPolarHBondContact O-CG 3.42Å; L451-R455 PolarHBondContact O-N 2.87Å; N452-R455 PolarHBondContact O-N 3.3Å; K453-R455 VanDerWaalsContact C-N 3.33Å; K453-R455 PolarHBondContact O-N 2.96Å; R455-G459 PolarHBondContact O-N 2.91Å
456Q93.3Very high92.1Very high112 Ų11293.7 Ų93.752%0.52349%0.489SS..Hα-helixtrans-66.1-40.6175.2-165.5-169.938.600111.8N452 K453 L454 G459 R460N452-Q456 PolarHBondContact O-N 2.92Å; K453-Q456 CarbonylContact O-C 3.56Å; K453-Q456 WeakPolarHBondContact O-CA 3.28Å; K453-Q456 VanDerWaalsContact O-CB 3.3Å; K453-Q456 WeakPolarHBondContact O-CB 3.37Å; K453-Q456 PolarHBondContact O-N 3.37Å; L454-Q456 VanDerWaalsContact C-N 3.33Å; L454-Q456 PolarHBondContact O-N 3.16Å; Q456-G459 WeakPolarHBondContact O-CA 3.46Å; Q456-G459 PolarHBondContact O-N 3.34Å; Q456-R460 PolarHBondContact O-N 3.39Å; Q456-R460 VanDerWaalsContact OE1-NH1 3.15Å; Q456-R460 VanDerWaalsContact OE1-NH2 3.1Å
457D91.6Very high92.1Very high51 Ų5193.3 Ų93.327%0.27349%0.49SS..Hα-helixtrans-66.2-41.8175.8-75.3-41.7000112.1K453 L454 G459 R460 L461K453-D457 PolarHBondContact O-N 3.01Å; L454-D457 PolarHBondContact O-N 2.88Å; D457-G459 VanDerWaalsContact C-N 3.29Å; D457-G459 PolarHBondContact O-N 3.39Å; D457-R460 PolarHBondContact O-N 3.08Å; D457-R460 IonicContact OD1-CZ 3.25Å; D457-R460 IonicContact OD1-NE 2.8Å; D457-R460 PolarHBondContact OD1-NE 3.45Å; D457-R460 IonicContact OD1-NH2 3.91Å; D457-R460 PolarHBondContact OD1-NH2 3.01Å; D457-R460 IonicContact OD2-NH2 3.49Å; D457-L461 WeakPolarHBondContact O-CB 3.5Å; D457-L461 WeakPolarHBondContact O-CG 3.37Å; D457-L461 PolarHBondContact O-N 3.27Å
458C90.3Very high92.2Very high70 Ų7096.5 Ų96.547%0.47350%0.502SS..Hα-helixtrans-59.3-41.2169.5-68.80000111.7L454 L461 V462L454-C458 PolarHBondContact O-N 3.47Å; L454-C458 PolarHBondContact O-SG 2.96Å; C458-L461 PolarHBondContact O-N 3.36Å; C458-V462 WeakPolarHBondContact O-CB 3.47Å; C458-V462 VanDerWaalsContact O-CG2 3.27Å; C458-V462 WeakPolarHBondContact O-CG2 3.33Å; C458-V462 PolarHBondContact O-N 2.98Å
459G93Very high92.2Very high36 Ų3697.2 Ų97.237%0.37150%0.504SS..Hα-helixtrans-60.1-47.1173.800000112.9R455 Q456 D457 V462 S463R455-G459 PolarHBondContact O-N 2.91Å; Q456-G459 WeakPolarHBondContact O-CA 3.46Å; Q456-G459 PolarHBondContact O-N 3.34Å; D457-G459 VanDerWaalsContact C-N 3.29Å; D457-G459 PolarHBondContact O-N 3.39Å; G459-V462 PolarHBondContact O-N 3.3Å; G459-S463 PolarHBondContact O-N 2.87Å; G459-S463 PolarHBondContact O-OG 2.92Å
460R93.8Very high92.1Very high101 Ų10196.2 Ų96.238%0.38150%0.499SS..Hα-helixtrans-57.2-52.6174.2-78.9-171.1-88.5-95.4-0.2111.7Q456 D457 V462 S463 E464Q456-R460 PolarHBondContact O-N 3.39Å; Q456-R460 VanDerWaalsContact OE1-NH1 3.15Å; Q456-R460 VanDerWaalsContact OE1-NH2 3.1Å; D457-R460 PolarHBondContact O-N 3.08Å; D457-R460 IonicContact OD1-CZ 3.25Å; D457-R460 IonicContact OD1-NE 2.8Å; D457-R460 PolarHBondContact OD1-NE 3.45Å; D457-R460 IonicContact OD1-NH2 3.91Å; D457-R460 PolarHBondContact OD1-NH2 3.01Å; D457-R460 IonicContact OD2-NH2 3.49Å; R460-V462 VanDerWaalsContact C-N 3.32Å; R460-V462 PolarHBondContact O-N 3.38Å; R460-S463 WeakPolarHBondContact O-CA 3.5Å; R460-S463 WeakPolarHBondContact O-CB 3.45Å; R460-S463 PolarHBondContact O-N 2.84Å; R460-S463 VanDerWaalsContact O-N 3.07Å; R460-E464 PolarHBondContact O-N 2.66Å
461L92.4Very high92Very high98 Ų9894.6 Ų94.651%0.51349%0.49SS..Hα-helixtrans-62.8-36.5-178.4-71.1170.9000112.5D457 C458 E464 L465D457-L461 WeakPolarHBondContact O-CB 3.5Å; D457-L461 WeakPolarHBondContact O-CG 3.37Å; D457-L461 PolarHBondContact O-N 3.27Å; C458-L461 PolarHBondContact O-N 3.36Å; L461-E464 PolarHBondContact O-N 2.93Å; L461-L465 VanDerWaalsContact O-CB 3.32Å; L461-L465 WeakPolarHBondContact O-CB 3.29Å; L461-L465 VanDerWaalsContact O-CG 3.26Å; L461-L465 WeakPolarHBondContact O-CG 3.39Å; L461-L465 PolarHBondContact O-N 3.2Å
462V92.3Very high91.8Very high80 Ų8096.1 Ų96.149%0.48550%0.498SS..Hα-helixtrans-65.4-41.3172.61680000111.2C458 G459 R460 L465 N466C458-V462 WeakPolarHBondContact O-CB 3.47Å; C458-V462 VanDerWaalsContact O-CG2 3.27Å; C458-V462 WeakPolarHBondContact O-CG2 3.33Å; C458-V462 PolarHBondContact O-N 2.98Å; G459-V462 PolarHBondContact O-N 3.3Å; R460-V462 VanDerWaalsContact C-N 3.32Å; R460-V462 PolarHBondContact O-N 3.38Å; V462-L465 PolarHBondContact O-N 3.46Å; V462-N466 WeakPolarHBondContact O-CB 3.32Å; V462-N466 VanDerWaalsContact O-CG 3.28Å; V462-N466 PolarHBondContact O-N 3.29Å; V462-N466 PolarHBondContact O-ND2 2.95Å
463S91.8Very high91.4Very high78 Ų7898.4 Ų98.455%0.54551%0.506SS..Hα-helixtrans-63-45.7174-64.10000112.3G459 R460 L465 N466 E467G459-S463 PolarHBondContact O-N 2.87Å; G459-S463 PolarHBondContact O-OG 2.92Å; R460-S463 WeakPolarHBondContact O-CA 3.5Å; R460-S463 WeakPolarHBondContact O-CB 3.45Å; R460-S463 PolarHBondContact O-N 2.84Å; R460-S463 VanDerWaalsContact O-N 3.07Å; S463-L465 PolarHBondContact O-N 3.21Å; S463-N466 PolarHBondContact O-N 2.81Å; S463-E467 WeakPolarHBondContact O-CB 3.4Å; S463-E467 PolarHBondContact O-N 2.87Å
464E93Very high91.1Very high86 Ų8697.9 Ų97.940%0.40251%0.506SS..Hα-helixtrans-63.6-38.8176.2-72.9178.6-145.800112.8R460 L461 E467 K468R460-E464 PolarHBondContact O-N 2.66Å; L461-E464 PolarHBondContact O-N 2.93Å; E464-E467 PolarHBondContact O-N 3.28Å; E464-K468 WeakPolarHBondContact O-CB 3.37Å; E464-K468 WeakPolarHBondContact O-CG 3.15Å; E464-K468 PolarHBondContact O-N 2.99Å
465L90.6Very high90.7Very high108 Ų10898.3 Ų98.357%0.56550%0.504SS*.Hα-helixtrans-66.2-40.9174.8-78.4171000111.5L461 V462 S463 K468 T469L461-L465 VanDerWaalsContact O-CB 3.32Å; L461-L465 WeakPolarHBondContact O-CB 3.29Å; L461-L465 VanDerWaalsContact O-CG 3.26Å; L461-L465 WeakPolarHBondContact O-CG 3.39Å; L461-L465 PolarHBondContact O-N 3.2Å; V462-L465 PolarHBondContact O-N 3.46Å; S463-L465 PolarHBondContact O-N 3.21Å; L465-K468 PolarHBondContact O-N 3.26Å; L465-T469 VanDerWaalsContact O-CB 3.29Å; L465-T469 WeakPolarHBondContact O-CB 3.44Å; L465-T469 PolarHBondContact O-N 3.1Å; L465-T469 PolarHBondContact O-OG1 3.31Å
466N89.8Confident90.3Very high108 Ų10891.9 Ų91.958%0.57849%0.491SS*.Hα-helixtrans-64.4-42.2174.1-74.9-22.2000111.4V462 S463 T469 G470V462-N466 WeakPolarHBondContact O-CB 3.32Å; V462-N466 VanDerWaalsContact O-CG 3.28Å; V462-N466 PolarHBondContact O-N 3.29Å; V462-N466 PolarHBondContact O-ND2 2.95Å; S463-N466 PolarHBondContact O-N 2.81Å; N466-T469 PolarHBondContact O-N 3.49Å; N466-G470 PolarHBondContact O-N 2.76Å
467E93.3Very high90.1Very high108 Ų10890.2 Ų90.251%0.50549%0.488SS..Hα-helixtrans-63.7-45.5176.2-166.1-167.6157.100111.7S463 E464 T469 G470 K471S463-E467 WeakPolarHBondContact O-CB 3.4Å; S463-E467 PolarHBondContact O-N 2.87Å; E464-E467 PolarHBondContact O-N 3.28Å; E467-T469 VanDerWaalsContact C-N 3.33Å; E467-T469 PolarHBondContact O-N 2.92Å; E467-G470 PolarHBondContact O-N 3.4Å; E467-K471 WeakPolarHBondContact O-CG 3.46Å; E467-K471 PolarHBondContact O-N 2.79Å; E467-K471 WeakPolarHBondContact OE1-CE 3.39Å; E467-K471 IonicContact OE1-NZ 2.63Å; E467-K471 PolarHBondContact OE1-NZ 3.44Å
468K91.3Very high89.7Confident132 Ų13293.5 Ų93.557%0.57450%0.502SS*.Hα-helixtrans-62.7-38.6174.4-77.7173.9178.1164.90112.2E464 L465 K471 L472E464-K468 WeakPolarHBondContact O-CB 3.37Å; E464-K468 WeakPolarHBondContact O-CG 3.15Å; E464-K468 PolarHBondContact O-N 2.99Å; L465-K468 PolarHBondContact O-N 3.26Å; K468-K471 PolarHBondContact O-N 2.66Å; K468-L472 WeakPolarHBondContact O-CB 3.32Å; K468-L472 PolarHBondContact O-N 2.98Å
469T90.7Very high89.6Confident80 Ų8096.2 Ų96.249%0.49151%0.506SS..Hα-helixtrans-64.1-43175.2-58.20000110.9L465 N466 E467 L472 Q473L465-T469 VanDerWaalsContact O-CB 3.29Å; L465-T469 WeakPolarHBondContact O-CB 3.44Å; L465-T469 PolarHBondContact O-N 3.1Å; L465-T469 PolarHBondContact O-OG1 3.31Å; N466-T469 PolarHBondContact O-N 3.49Å; E467-T469 VanDerWaalsContact C-N 3.33Å; E467-T469 PolarHBondContact O-N 2.92Å; T469-L472 PolarHBondContact O-N 3.1Å; T469-Q473 WeakPolarHBondContact O-CB 3.44Å; T469-Q473 PolarHBondContact O-N 2.97Å
470G91Very high89.4Confident38 Ų38101 Ų10139%0.39252%0.516SS..Hα-helixtrans-61.5-45.6173.600000113N466 E467 Q473 Q474N466-G470 PolarHBondContact O-N 2.76Å; E467-G470 PolarHBondContact O-N 3.4Å; G470-Q473 PolarHBondContact O-N 2.79Å; G470-Q474 PolarHBondContact O-N 2.91Å
471K90.8Very high89Confident104 Ų104100.5 Ų100.545%0.45252%0.521SS..Hα-helixtrans-62.1-44.7175.5-72.8176.2-175.4171.70112.2E467 K468 Q473 Q474 E475E467-K471 WeakPolarHBondContact O-CG 3.46Å; E467-K471 PolarHBondContact O-N 2.79Å; E467-K471 WeakPolarHBondContact OE1-CE 3.39Å; E467-K471 IonicContact OE1-NZ 2.63Å; E467-K471 PolarHBondContact OE1-NZ 3.44Å; K468-K471 PolarHBondContact O-N 2.66Å; K471-Q473 VanDerWaalsContact C-N 3.3Å; K471-Q473 PolarHBondContact O-N 3.12Å; K471-Q474 CarbonylContact O-C 3.53Å; K471-Q474 WeakPolarHBondContact O-CA 3.44Å; K471-Q474 WeakPolarHBondContact O-CB 3.37Å; K471-Q474 PolarHBondContact O-N 2.79Å; K471-Q474 VanDerWaalsContact O-N 3.11Å; K471-E475 WeakPolarHBondContact O-CG 3.39Å; K471-E475 PolarHBondContact O-N 3.25Å
472L86.2Confident88.6Confident122 Ų12298.7 Ų98.764%0.63952%0.521SS*.Hα-helixtrans-64.1-35.2176.7-171.9123.2000112K468 T469 G476K468-L472 WeakPolarHBondContact O-CB 3.32Å; K468-L472 PolarHBondContact O-N 2.98Å; T469-L472 PolarHBondContact O-N 3.1Å; L472-G476 PolarHBondContact O-N 3.21Å
473Q84.5Confident88.4Confident141 Ų14199.3 Ų99.366%0.65952%0.518SS*.Hα-helixtrans-67.7-37.6172.5-170.4170.6-4.400111.8T469 G470 K471 G476 V477T469-Q473 WeakPolarHBondContact O-CB 3.44Å; T469-Q473 PolarHBondContact O-N 2.97Å; G470-Q473 PolarHBondContact O-N 2.79Å; K471-Q473 VanDerWaalsContact C-N 3.3Å; K471-Q473 PolarHBondContact O-N 3.12Å; Q473-G476 PolarHBondContact O-N 3.48Å; Q473-V477 WeakPolarHBondContact O-CG2 3.29Å; Q473-V477 PolarHBondContact O-N 2.76Å; Q473-V477 VanDerWaalsContact O-N 3.1Å
474Q87.2Confident88.1Confident120 Ų120101.6 Ų101.656%0.56152%0.52SS*.Hα-helixtrans-66-44.7173.8-171.2179.917.800112.1G470 K471 G476 V477 Q478G470-Q474 PolarHBondContact O-N 2.91Å; K471-Q474 CarbonylContact O-C 3.53Å; K471-Q474 WeakPolarHBondContact O-CA 3.44Å; K471-Q474 WeakPolarHBondContact O-CB 3.37Å; K471-Q474 PolarHBondContact O-N 2.79Å; K471-Q474 VanDerWaalsContact O-N 3.11Å; Q474-G476 VanDerWaalsContact C-N 3.3Å; Q474-G476 PolarHBondContact O-N 3.26Å; Q474-V477 PolarHBondContact O-N 3.22Å; Q474-V477 VanDerWaalsContact O-N 3.13Å; Q474-Q478 PolarHBondContact O-N 2.85Å
475E84.7Confident87.8Confident122 Ų12299.8 Ų99.857%0.5752%0.52SS*.Hα-helixtrans-59.9-39.6171.8-73.3177.6179.300111.5K471 V477 Q478 K479K471-E475 WeakPolarHBondContact O-CG 3.39Å; K471-E475 PolarHBondContact O-N 3.25Å; E475-V477 VanDerWaalsContact C-N 3.29Å; E475-V477 PolarHBondContact O-N 2.85Å; E475-Q478 PolarHBondContact O-N 3.3Å; E475-K479 WeakPolarHBondContact O-CB 3.5Å; E475-K479 PolarHBondContact O-N 3.37Å
476G84.3Confident87.5Confident34 Ų3497.4 Ų97.435%0.35152%0.516SS..Hα-helixtrans-60.9-34.3173.400000113.7L472 Q473 Q474 K480L472-G476 PolarHBondContact O-N 3.21Å; Q473-G476 PolarHBondContact O-N 3.48Å; Q474-G476 VanDerWaalsContact C-N 3.3Å; Q474-G476 PolarHBondContact O-N 3.26Å; G476-K480 WeakPolarHBondContact O-CG 3.27Å; G476-K480 PolarHBondContact O-N 3.42Å
477V89.1Confident87.4Confident78 Ų7896.5 Ų96.547%0.47351%0.514SS..Hα-helixtrans-73-44.5172.1173.30000111Q473 Q474 E475 K479 K480 N481Q473-V477 WeakPolarHBondContact O-CG2 3.29Å; Q473-V477 PolarHBondContact O-N 2.76Å; Q473-V477 VanDerWaalsContact O-N 3.1Å; Q474-V477 PolarHBondContact O-N 3.22Å; Q474-V477 VanDerWaalsContact O-N 3.13Å; E475-V477 VanDerWaalsContact C-N 3.29Å; E475-V477 PolarHBondContact O-N 2.85Å; V477-K479 VanDerWaalsContact C-N 3.33Å; V477-K479 PolarHBondContact O-N 2.87Å; V477-K480 PolarHBondContact O-N 3.43Å; V477-N481 PolarHBondContact O-N 2.85Å; V477-N481 PolarHBondContact O-OD1 2.95Å
478Q84.4Confident87.1Confident120 Ų12097.7 Ų97.756%0.56152%0.52SS*.Hα-helixtrans-61.2-40.3176.7-71.1-175.6-0.700112.3Q474 E475 K480 N481 A482Q474-Q478 PolarHBondContact O-N 2.85Å; E475-Q478 PolarHBondContact O-N 3.3Å; Q478-K480 PolarHBondContact O-N 2.84Å; Q478-N481 PolarHBondContact O-N 2.82Å; Q478-A482 WeakPolarHBondContact O-CB 3.5Å; Q478-A482 PolarHBondContact O-N 2.76Å
479K87.4Confident87Confident127 Ų12796.7 Ų96.755%0.55252%0.52SS*.Hα-helixtrans-60-44.7174.7-175.4171.1-170.7-73.50111.7E475 V477 N481 A482 E483E475-K479 WeakPolarHBondContact O-CB 3.5Å; E475-K479 PolarHBondContact O-N 3.37Å; V477-K479 VanDerWaalsContact C-N 3.33Å; V477-K479 PolarHBondContact O-N 2.87Å; K479-N481 PolarHBondContact O-N 3.34Å; K479-A482 PolarHBondContact O-N 3.47Å; K479-E483 IonicContact NZ-OE1 3.47Å; K479-E483 PolarHBondContact NZ-OE1 3.39Å; K479-E483 WeakPolarHBondContact O-CB 3.27Å; K479-E483 WeakPolarHBondContact O-CG 3.43Å; K479-E483 PolarHBondContact O-N 2.89Å
480K88.3Confident86.8Confident135 Ų13599.8 Ų99.859%0.58753%0.527SS*.Hα-helixtrans-61.7-41.4174.4-75.4177.1178.4-178.50112.4G476 V477 Q478 E483 Q484G476-K480 WeakPolarHBondContact O-CG 3.27Å; G476-K480 PolarHBondContact O-N 3.42Å; V477-K480 PolarHBondContact O-N 3.43Å; Q478-K480 PolarHBondContact O-N 2.84Å; K480-E483 PolarHBondContact O-N 3.36Å; K480-Q484 WeakPolarHBondContact O-CG 3.46Å; K480-Q484 PolarHBondContact O-N 3.19Å
481N86.8Confident86.8Confident91 Ų91102 Ų10249%0.48753%0.533SS..Hα-helixtrans-65.6-39.6177-65.7-4.7000111.5V477 Q478 K479 Q484 A485V477-N481 PolarHBondContact O-N 2.85Å; V477-N481 PolarHBondContact O-OD1 2.95Å; Q478-N481 PolarHBondContact O-N 2.82Å; K479-N481 PolarHBondContact O-N 3.34Å; N481-Q484 PolarHBondContact O-N 2.98Å; N481-A485 PolarHBondContact O-N 3.48Å
482A84Confident86.6Confident61 Ų61102.9 Ų102.950%0.50454%0.538SS..Hα-helixtrans-67.6-38.7174.800000112.5Q478 K479 A485 A486Q478-A482 WeakPolarHBondContact O-CB 3.5Å; Q478-A482 PolarHBondContact O-N 2.76Å; K479-A482 PolarHBondContact O-N 3.47Å; A482-A485 PolarHBondContact O-N 3.39Å; A482-A486 WeakPolarHBondContact O-CB 3.4Å; A482-A486 PolarHBondContact O-N 3.42Å
483E86.6Confident86.6Confident92 Ų92102 Ų10243%0.4353%0.534SS..Hα-helixtrans-62.9-41.3172.5-75.5169.2179.700111.4K479 K480 A486 T487K479-E483 IonicContact NZ-OE1 3.47Å; K479-E483 PolarHBondContact NZ-OE1 3.39Å; K479-E483 WeakPolarHBondContact O-CB 3.27Å; K479-E483 WeakPolarHBondContact O-CG 3.43Å; K479-E483 PolarHBondContact O-N 2.89Å; K480-E483 PolarHBondContact O-N 3.36Å; E483-A486 PolarHBondContact O-N 3.39Å; E483-T487 PolarHBondContact O-N 2.75Å; E483-T487 PolarHBondContact O-OG1 3.4Å; E483-T487 VanDerWaalsContact O-OG1 3.14Å
484Q85.4Confident86.6Confident127 Ų127101.1 Ų101.159%0.59353%0.53SS*.Hα-helixtrans-63.4-44.3173.2-74.2177.3-5.200112.3K480 N481 A486 T487 Q488K480-Q484 WeakPolarHBondContact O-CG 3.46Å; K480-Q484 PolarHBondContact O-N 3.19Å; N481-Q484 PolarHBondContact O-N 2.98Å; Q484-A486 PolarHBondContact O-N 3.27Å; Q484-T487 WeakPolarHBondContact CA-OG1 3.43Å; Q484-T487 PolarHBondContact O-N 3.38Å; Q484-T487 PolarHBondContact O-OG1 2.93Å; Q484-Q488 PolarHBondContact O-N 3.24Å
485A88.4Confident86.5Confident48 Ų4899.2 Ų99.240%0.39752%0.521SS..Hα-helixtrans-62.1-41.3173.600000112.4N481 A482 Q488 L489N481-A485 PolarHBondContact O-N 3.48Å; A482-A485 PolarHBondContact O-N 3.39Å; A485-Q488 PolarHBondContact O-N 2.92Å; A485-L489 WeakPolarHBondContact O-CG 3.45Å; A485-L489 PolarHBondContact O-N 3.23Å
486A83.9Confident86.4Confident58 Ų5896 Ų9648%0.47952%0.515SS..Hα-helixtrans-65.2-40.6177.900000112.4A482 E483 Q484 L489 K490A482-A486 WeakPolarHBondContact O-CB 3.4Å; A482-A486 PolarHBondContact O-N 3.42Å; E483-A486 PolarHBondContact O-N 3.39Å; Q484-A486 PolarHBondContact O-N 3.27Å; A486-L489 PolarHBondContact O-N 3.41Å; A486-K490 WeakPolarHBondContact O-CB 3.4Å; A486-K490 PolarHBondContact O-N 3.19Å
487T87.7Confident86.3Confident88 Ų8899.2 Ų99.254%0.5452%0.521SS..Hα-helixtrans-64.6-38.6172.950.80000112.4E483 Q484 K490 V491E483-T487 PolarHBondContact O-N 2.75Å; E483-T487 PolarHBondContact O-OG1 3.4Å; E483-T487 VanDerWaalsContact O-OG1 3.14Å; Q484-T487 WeakPolarHBondContact CA-OG1 3.43Å; Q484-T487 PolarHBondContact O-N 3.38Å; Q484-T487 PolarHBondContact O-OG1 2.93Å; T487-K490 WeakPolarHBondContact O-CB 3.07Å; T487-K490 PolarHBondContact O-N 2.99Å; T487-V491 PolarHBondContact O-N 3.06Å; T487-V491 VanDerWaalsContact O-N 3.11Å
488Q86.8Confident86.3Confident134 Ų134100.6 Ų100.663%0.62652%0.518SS*.Hα-helixtrans-66.2-41.1175.3-167.6168.819.500112.5Q484 A485 K490 V491 Q492Q484-Q488 PolarHBondContact O-N 3.24Å; A485-Q488 PolarHBondContact O-N 2.92Å; Q488-K490 VanDerWaalsContact C-N 3.32Å; Q488-K490 PolarHBondContact O-N 2.98Å; Q488-V491 PolarHBondContact O-N 3.07Å; Q488-Q492 PolarHBondContact O-N 2.96Å; Q488-Q492 VanDerWaalsContact O-N 3.13Å
489L88.8Confident86.5Confident111 Ų111102.1 Ų102.158%0.58152%0.518SS*.Hα-helixtrans-63.5-36.3172.5-73.3172.3000112.2A485 A486 V491 Q492 L493A485-L489 WeakPolarHBondContact O-CG 3.45Å; A485-L489 PolarHBondContact O-N 3.23Å; A486-L489 PolarHBondContact O-N 3.41Å; L489-V491 VanDerWaalsContact C-N 3.34Å; L489-V491 PolarHBondContact O-N 2.93Å; L489-Q492 PolarHBondContact O-N 3.48Å; L489-L493 PolarHBondContact O-N 2.93Å
490K86.8Confident86.3Confident144 Ų144103.8 Ų103.863%0.62652%0.521SS*.Hα-helixtrans-64.3-37.3175.7-170.5173.4-176.91770112.5A486 T487 Q488 L493 Q494A486-K490 WeakPolarHBondContact O-CB 3.4Å; A486-K490 PolarHBondContact O-N 3.19Å; T487-K490 WeakPolarHBondContact O-CB 3.07Å; T487-K490 PolarHBondContact O-N 2.99Å; Q488-K490 VanDerWaalsContact C-N 3.32Å; Q488-K490 PolarHBondContact O-N 2.98Å; K490-L493 PolarHBondContact O-N 3.31Å; K490-Q494 PolarHBondContact O-N 2.95Å; K490-Q494 VanDerWaalsContact O-N 3.11Å
491V91.3Very high86.2Confident86 Ų86103.8 Ų103.852%0.52152%0.523SS..Hα-helixtrans-64.5-43.4172.1173.90000110.8T487 Q488 L489 L493 Q494 E495T487-V491 PolarHBondContact O-N 3.06Å; T487-V491 VanDerWaalsContact O-N 3.11Å; Q488-V491 PolarHBondContact O-N 3.07Å; L489-V491 VanDerWaalsContact C-N 3.34Å; L489-V491 PolarHBondContact O-N 2.93Å; V491-L493 VanDerWaalsContact C-N 3.3Å; V491-L493 PolarHBondContact O-N 2.97Å; V491-Q494 PolarHBondContact O-N 2.92Å; V491-E495 WeakPolarHBondContact O-CB 3.33Å; V491-E495 PolarHBondContact O-N 3.31Å
492Q85.3Confident86.3Confident122 Ų122104.2 Ų104.257%0.5752%0.523SS*.Hα-helixtrans-62.5-35.2175.2-69.5-175-1.300113Q488 L489 E495 A496Q488-Q492 PolarHBondContact O-N 2.96Å; Q488-Q492 VanDerWaalsContact O-N 3.13Å; L489-Q492 PolarHBondContact O-N 3.48Å; Q492-E495 PolarHBondContact O-N 3.01Å; Q492-A496 WeakPolarHBondContact O-CB 3.23Å; Q492-A496 PolarHBondContact O-N 2.86Å
493L86.3Confident86.5Confident103 Ų103104.6 Ų104.654%0.53952%0.518SS..Hα-helixtrans-63.7-48.9174.7-167.875.6000111.2L489 K490 V491 E495 A496 E497L489-L493 PolarHBondContact O-N 2.93Å; K490-L493 PolarHBondContact O-N 3.31Å; V491-L493 VanDerWaalsContact C-N 3.3Å; V491-L493 PolarHBondContact O-N 2.97Å; L493-E495 VanDerWaalsContact C-N 3.29Å; L493-E495 PolarHBondContact O-N 3.44Å; L493-A496 WeakPolarHBondContact O-CB 3.4Å; L493-A496 PolarHBondContact O-N 2.65Å; L493-A496 VanDerWaalsContact O-N 3.1Å; L493-E497 WeakPolarHBondContact O-CG 3.28Å; L493-E497 PolarHBondContact O-N 3.34Å
494Q85.6Confident86.2Confident123 Ų123103.6 Ų103.658%0.57551%0.514SS*.Hα-helixtrans-61.4-36.8175.6-74.3-169.3-73.800112.7K490 V491 A496 E497 R498K490-Q494 PolarHBondContact O-N 2.95Å; K490-Q494 VanDerWaalsContact O-N 3.11Å; V491-Q494 PolarHBondContact O-N 2.92Å; Q494-A496 VanDerWaalsContact C-N 3.31Å; Q494-A496 PolarHBondContact O-N 2.93Å; Q494-E497 PolarHBondContact O-N 2.99Å; Q494-R498 WeakPolarHBondContact O-CB 3.33Å; Q494-R498 PolarHBondContact O-N 3.33Å
495E85.4Confident86.3Confident80 Ų80101 Ų10137%0.37451%0.51SS..Hα-helixtrans-63.6-37.8174.8-162.883.4-117.500111.6V491 Q492 L493 R498 R499V491-E495 WeakPolarHBondContact O-CB 3.33Å; V491-E495 PolarHBondContact O-N 3.31Å; Q492-E495 PolarHBondContact O-N 3.01Å; L493-E495 VanDerWaalsContact C-N 3.29Å; L493-E495 PolarHBondContact O-N 3.44Å; E495-R498 IonicContact OE1-CZ 3.44Å; E495-R498 IonicContact OE1-NE 3.76Å; E495-R498 PolarHBondContact OE1-NE 2.96Å; E495-R498 IonicContact OE1-NH2 3.35Å; E495-R498 PolarHBondContact OE1-NH2 3.29Å; E495-R499 VanDerWaalsContact O-CG 3.25Å; E495-R499 WeakPolarHBondContact O-CG 3.35Å; E495-R499 PolarHBondContact O-N 3.25Å
496A83Confident86.3Confident55 Ų55105.6 Ų105.646%0.45552%0.518SS..Hα-helixtrans-73.3-40175.700000112.5Q492 L493 Q494 R499 W500Q492-A496 WeakPolarHBondContact O-CB 3.23Å; Q492-A496 PolarHBondContact O-N 2.86Å; L493-A496 WeakPolarHBondContact O-CB 3.4Å; L493-A496 PolarHBondContact O-N 2.65Å; L493-A496 VanDerWaalsContact O-N 3.1Å; Q494-A496 VanDerWaalsContact C-N 3.31Å; Q494-A496 PolarHBondContact O-N 2.93Å; A496-R499 PolarHBondContact O-N 2.96Å; A496-W500 PolarHBondContact O-N 3.35Å
497E82.3Confident86.4Confident101 Ų101107 Ų10747%0.47252%0.516SS..Hα-helixtrans-59.8-48.6173.5-73171.1160.100110.8L493 Q494 R499 W500 E501L493-E497 WeakPolarHBondContact O-CG 3.28Å; L493-E497 PolarHBondContact O-N 3.34Å; Q494-E497 PolarHBondContact O-N 2.99Å; E497-R499 VanDerWaalsContact C-N 3.34Å; E497-R499 PolarHBondContact O-N 3.28Å; E497-W500 WeakPolarHBondContact O-CA 3.47Å; E497-W500 WeakPolarHBondContact O-CB 3.36Å; E497-W500 PolarHBondContact O-N 2.78Å; E497-E501 PolarHBondContact O-N 2.86Å
498R87.2Confident86.4Confident106 Ų106110 Ų11040%0.452%0.518SS..Hα-helixtrans-56.5-45174.7-176.5-177.966.580.2-4.5112.3Q494 E495 W500 E501 E502Q494-R498 WeakPolarHBondContact O-CB 3.33Å; Q494-R498 PolarHBondContact O-N 3.33Å; E495-R498 IonicContact OE1-CZ 3.44Å; E495-R498 IonicContact OE1-NE 3.76Å; E495-R498 PolarHBondContact OE1-NE 2.96Å; E495-R498 IonicContact OE1-NH2 3.35Å; E495-R498 PolarHBondContact OE1-NH2 3.29Å; R498-W500 VanDerWaalsContact C-N 3.31Å; R498-W500 PolarHBondContact O-N 3.4Å; R498-E501 PolarHBondContact O-N 2.78Å; R498-E502 IonicContact CZ-OE1 2.62Å; R498-E502 VanDerWaalsContact NH1-CD 3.34Å; R498-E502 IonicContact NH1-OE1 3.21Å; R498-E502 PolarHBondContact NH1-OE1 3.3Å; R498-E502 IonicContact NH1-OE2 2.62Å; R498-E502 PolarHBondContact NH1-OE2 3.38Å; R498-E502 WeakPolarHBondContact O-CG 3.31Å; R498-E502 PolarHBondContact O-N 3.47Å
499R88.6Confident86.5Confident153 Ų153110.2 Ų110.258%0.57752%0.516SS*.Hα-helixtrans-63.7-36176.3-73171.7-173.9-156.82.5112.1E495 A496 E497 E502 V503E495-R499 VanDerWaalsContact O-CG 3.25Å; E495-R499 WeakPolarHBondContact O-CG 3.35Å; E495-R499 PolarHBondContact O-N 3.25Å; A496-R499 PolarHBondContact O-N 2.96Å; E497-R499 VanDerWaalsContact C-N 3.34Å; E497-R499 PolarHBondContact O-N 3.28Å; R499-E502 PolarHBondContact O-N 2.85Å; R499-V503 WeakPolarHBondContact O-CG2 3.49Å; R499-V503 PolarHBondContact O-N 3.25Å
500W83.8Confident86.3Confident161 Ų161111.9 Ų111.961%0.6152%0.515SS*.Hα-helixtrans-68.8-39.9175.6-178.4-111.9000112.1A496 E497 R498 V503 Q504A496-W500 PolarHBondContact O-N 3.35Å; E497-W500 WeakPolarHBondContact O-CA 3.47Å; E497-W500 WeakPolarHBondContact O-CB 3.36Å; E497-W500 PolarHBondContact O-N 2.78Å; R498-W500 VanDerWaalsContact C-N 3.31Å; R498-W500 PolarHBondContact O-N 3.4Å; W500-V503 HydrophobicContact CZ3-CG1 4.47Å; W500-V503 PolarHBondContact O-N 3.15Å; W500-Q504 HydrophobicContact CD2-CG 4.48Å; W500-Q504 HydrophobicContact CZ2-CG 4.38Å; W500-Q504 WeakPolarHBondContact O-CB 3.46Å; W500-Q504 WeakPolarHBondContact O-CG 3.24Å; W500-Q504 PolarHBondContact O-N 2.8Å
501E86.1Confident86Confident135 Ų135108.1 Ų108.163%0.63150%0.504SS*.Hα-helixtrans-62.5-40.6172.9-70.5-175.7157.500112.2E497 R498 Q504 S505E497-E501 PolarHBondContact O-N 2.86Å; R498-E501 PolarHBondContact O-N 2.78Å; E501-Q504 PolarHBondContact O-N 3.37Å; E501-S505 WeakPolarHBondContact O-CB 3.35Å; E501-S505 PolarHBondContact O-N 3.36Å
502E89.1Confident85.5Confident101 Ų101106.6 Ų106.647%0.47250%0.501SS..Hα-helixtrans-61.1-44.4173.4-75.6167.9-174.100111.9R498 R499 S505 Y506R498-E502 IonicContact CZ-OE1 2.62Å; R498-E502 VanDerWaalsContact NH1-CD 3.34Å; R498-E502 IonicContact NH1-OE1 3.21Å; R498-E502 PolarHBondContact NH1-OE1 3.3Å; R498-E502 IonicContact NH1-OE2 2.62Å; R498-E502 PolarHBondContact NH1-OE2 3.38Å; R498-E502 WeakPolarHBondContact O-CG 3.31Å; R498-E502 PolarHBondContact O-N 3.47Å; R499-E502 PolarHBondContact O-N 2.85Å; E502-S505 WeakPolarHBondContact O-CB 3.29Å; E502-S505 PolarHBondContact O-N 3.39Å; E502-Y506 PolarHBondContact O-N 2.82Å
503V87.7Confident85.4Confident69 Ų69105.2 Ų105.242%0.41849%0.494SS..Hα-helixtrans-64.8-42.7174.5169.90000111.5R499 W500 S505 Y506 I507R499-V503 WeakPolarHBondContact O-CG2 3.49Å; R499-V503 PolarHBondContact O-N 3.25Å; W500-V503 HydrophobicContact CZ3-CG1 4.47Å; W500-V503 PolarHBondContact O-N 3.15Å; V503-S505 VanDerWaalsContact C-N 3.33Å; V503-S505 PolarHBondContact O-N 2.85Å; V503-Y506 WeakPolarHBondContact O-CB 3.46Å; V503-Y506 PolarHBondContact O-N 3.24Å; V503-I507 HydrophobicContact CG1-CD1 3.94Å; V503-I507 WeakPolarHBondContact O-CG1 3.4Å; V503-I507 PolarHBondContact O-N 2.87Å
504Q81.3Confident84.9Confident70 Ų70106 Ų10633%0.32750%0.495SS..Hα-helixtrans-62.9-39.3174.9-76.1-128.8-31.400112.4W500 E501 I507 R508W500-Q504 HydrophobicContact CD2-CG 4.48Å; W500-Q504 HydrophobicContact CZ2-CG 4.38Å; W500-Q504 WeakPolarHBondContact O-CB 3.46Å; W500-Q504 WeakPolarHBondContact O-CG 3.24Å; W500-Q504 PolarHBondContact O-N 2.8Å; E501-Q504 PolarHBondContact O-N 3.37Å; Q504-I507 PolarHBondContact O-N 3.23Å; Q504-R508 WeakPolarHBondContact O-CG 3.46Å; Q504-R508 PolarHBondContact O-N 3.42Å
505S87.6Confident84.6Confident73 Ų73105.7 Ų105.751%0.5149%0.493SS..Hα-helixtrans-62.2-44.8174.4-1720000111.4E501 E502 V503 I507 R508 K509E501-S505 WeakPolarHBondContact O-CB 3.35Å; E501-S505 PolarHBondContact O-N 3.36Å; E502-S505 WeakPolarHBondContact O-CB 3.29Å; E502-S505 PolarHBondContact O-N 3.39Å; V503-S505 VanDerWaalsContact C-N 3.33Å; V503-S505 PolarHBondContact O-N 2.85Å; S505-I507 PolarHBondContact O-N 2.76Å; S505-R508 PolarHBondContact O-N 3.18Å; S505-K509 PolarHBondContact O-N 2.87Å
506Y89Confident84.4Confident144 Ų144104.7 Ų104.757%0.56550%0.499SS*.Hα-helixtrans-59.2-45.4173.9-179.7-93.5000112.4E502 V503 K509 R510E502-Y506 PolarHBondContact O-N 2.82Å; V503-Y506 WeakPolarHBondContact O-CB 3.46Å; V503-Y506 PolarHBondContact O-N 3.24Å; Y506-K509 PolarHBondContact O-N 3.11Å; Y506-R510 HydrophobicContact CE1-CG 3.92Å; Y506-R510 PolarHBondContact O-N 2.89Å
507I85.4Confident84.3Confident89 Ų89104.6 Ų104.646%0.45650%0.498SS..Hα-helixtrans-61.4-50.3176.7-68.3166.2000110.5V503 Q504 S505 K509 R510 T511V503-I507 HydrophobicContact CG1-CD1 3.94Å; V503-I507 WeakPolarHBondContact O-CG1 3.4Å; V503-I507 PolarHBondContact O-N 2.87Å; Q504-I507 PolarHBondContact O-N 3.23Å; S505-I507 PolarHBondContact O-N 2.76Å; I507-K509 VanDerWaalsContact C-N 3.27Å; I507-K509 PolarHBondContact O-N 3.5Å; I507-R510 PolarHBondContact O-N 3Å; I507-R510 VanDerWaalsContact O-N 3.12Å; I507-T511 PolarHBondContact O-N 3.34Å; I507-T511 PolarHBondContact O-OG1 3.37Å; I507-T511 VanDerWaalsContact O-OG1 3.1Å
508R86.9Confident83.8Confident151 Ų151104.6 Ų104.657%0.5750%0.498SS*.Hα-helixtrans-55.4-42.6177.4-73-179.8-168.8101.86.9112Q504 S505 T511 A512Q504-R508 WeakPolarHBondContact O-CG 3.46Å; Q504-R508 PolarHBondContact O-N 3.42Å; S505-R508 PolarHBondContact O-N 3.18Å; R508-T511 PolarHBondContact O-N 3.01Å; R508-A512 PolarHBondContact O-N 3.48Å
509K89.3Confident83.2Confident137 Ų137106.6 Ų106.660%0.59651%0.512SS*.Hα-helixtrans-63.9-44.9177.6-171.3178.4177.9-176.80111.8S505 Y506 I507 T511 A512 E513S505-K509 PolarHBondContact O-N 2.87Å; Y506-K509 PolarHBondContact O-N 3.11Å; I507-K509 VanDerWaalsContact C-N 3.27Å; I507-K509 PolarHBondContact O-N 3.5Å; K509-T511 VanDerWaalsContact C-N 3.34Å; K509-T511 PolarHBondContact O-N 3.35Å; K509-A512 PolarHBondContact O-N 2.99Å; K509-E513 VanDerWaalsContact CE-OE1 3.28Å; K509-E513 WeakPolarHBondContact CE-OE1 3.39Å; K509-E513 WeakPolarHBondContact O-CG 3.46Å; K509-E513 PolarHBondContact O-N 2.84Å
510R84.6Confident82.7Confident146 Ų146103.2 Ų103.255%0.55151%0.506SS*.Hα-helixtrans-62.3-38174.7-88.5-60.7-146.7158.24.3113Y506 I507 E513 H514Y506-R510 HydrophobicContact CE1-CG 3.92Å; Y506-R510 PolarHBondContact O-N 2.89Å; I507-R510 PolarHBondContact O-N 3Å; I507-R510 VanDerWaalsContact O-N 3.12Å; R510-E513 WeakPolarHBondContact CD-OE2 3.5Å; R510-H514 PolarHBondContact O-N 3.38Å
511T79.6Confident82.4Confident66 Ų66100.7 Ų100.741%0.40550%0.503SS..Hα-helixtrans-65.4-45.2174.5-54.40000111.2I507 R508 K509 E513 H514 E515I507-T511 PolarHBondContact O-N 3.34Å; I507-T511 PolarHBondContact O-OG1 3.37Å; I507-T511 VanDerWaalsContact O-OG1 3.1Å; R508-T511 PolarHBondContact O-N 3.01Å; K509-T511 VanDerWaalsContact C-N 3.34Å; K509-T511 PolarHBondContact O-N 3.35Å; T511-E513 PolarHBondContact O-N 2.91Å; T511-H514 WeakPolarHBondContact O-CB 3.49Å; T511-H514 PolarHBondContact O-N 3.09Å; T511-H514 VanDerWaalsContact O-N 3.11Å; T511-E515 HydrophobicContact CG2-CG 4.45Å; T511-E515 WeakPolarHBondContact O-CG 3.49Å; T511-E515 PolarHBondContact O-N 2.89Å
512A82.8Confident81.9Confident53 Ų53100 Ų10044%0.43850%0.5SS..Hα-helixtrans-63.5-38.1176.800000112.8R508 K509 H514 E515 A516R508-A512 PolarHBondContact O-N 3.48Å; K509-A512 PolarHBondContact O-N 2.99Å; A512-H514 VanDerWaalsContact C-N 3.33Å; A512-E515 PolarHBondContact O-N 2.9Å; A512-A516 WeakPolarHBondContact O-CB 3.3Å; A512-A516 PolarHBondContact O-N 3.35Å
513E82.1Confident81.2Confident93 Ų9399 Ų9944%0.43550%0.504SS..Hα-helixtrans-62.5-38.4172.1-73.7168.8-170.600111.8K509 R510 T511 A517K509-E513 VanDerWaalsContact CE-OE1 3.28Å; K509-E513 WeakPolarHBondContact CE-OE1 3.39Å; K509-E513 WeakPolarHBondContact O-CG 3.46Å; K509-E513 PolarHBondContact O-N 2.84Å; R510-E513 WeakPolarHBondContact CD-OE2 3.5Å; T511-E513 PolarHBondContact O-N 2.91Å; E513-A517 PolarHBondContact O-N 3.48Å
514H76.7Confident80.8Confident121 Ų121101.2 Ų101.256%0.5651%0.508SS*.Hα-helixtrans-69.1-45.1174.6-178.3-77.6000112.3R510 T511 A512 A516 A517 Q518R510-H514 PolarHBondContact O-N 3.38Å; T511-H514 WeakPolarHBondContact O-CB 3.49Å; T511-H514 PolarHBondContact O-N 3.09Å; T511-H514 VanDerWaalsContact O-N 3.11Å; A512-H514 VanDerWaalsContact C-N 3.33Å; H514-A516 VanDerWaalsContact C-N 3.33Å; H514-A516 PolarHBondContact O-N 2.95Å; H514-A517 PolarHBondContact O-N 3.35Å; H514-Q518 WeakPolarHBondContact O-CB 3.32Å; H514-Q518 PolarHBondContact O-N 3.42Å
515E77.9Confident80.4Confident115 Ų115105.1 Ų105.154%0.53752%0.524SS..Hα-helixtrans-61.2-39.8176.8-74.2174.917400112T511 A512 Q518 Q519T511-E515 HydrophobicContact CG2-CG 4.45Å; T511-E515 WeakPolarHBondContact O-CG 3.49Å; T511-E515 PolarHBondContact O-N 2.89Å; A512-E515 PolarHBondContact O-N 2.9Å; E515-Q518 PolarHBondContact O-N 2.83Å; E515-Q519 PolarHBondContact O-N 3.31Å
516A81.9Confident80Confident59 Ų59104.8 Ų104.849%0.48852%0.519SS..Hα-helixtrans-63.8-43.3174.500000112.3A512 H514 Q518 Q519 D520A512-A516 WeakPolarHBondContact O-CB 3.3Å; A512-A516 PolarHBondContact O-N 3.35Å; H514-A516 VanDerWaalsContact C-N 3.33Å; H514-A516 PolarHBondContact O-N 2.95Å; A516-Q518 VanDerWaalsContact C-N 3.3Å; A516-Q518 PolarHBondContact O-N 2.94Å; A516-Q519 PolarHBondContact O-N 2.99Å; A516-D520 PolarHBondContact O-N 3.31Å; A516-D520 VanDerWaalsContact O-N 3.12Å
517A79.9Confident79.2Confident54 Ų54100.9 Ų100.945%0.44652%0.517SS..Hα-helixtrans-64.6-35.217400000112.2E513 H514 L521E513-A517 PolarHBondContact O-N 3.48Å; H514-A517 PolarHBondContact O-N 3.35Å; A517-L521 PolarHBondContact O-N 3.12Å; A517-L521 VanDerWaalsContact O-N 3.16Å
518Q71.7Confident78.7Confident101 Ų101102.6 Ų102.647%0.47252%0.521SS..Hα-helixtrans-69.6-38.6175.6-172173.3-1600112H514 E515 A516 L521 Q522H514-Q518 WeakPolarHBondContact O-CB 3.32Å; H514-Q518 PolarHBondContact O-N 3.42Å; E515-Q518 PolarHBondContact O-N 2.83Å; A516-Q518 VanDerWaalsContact C-N 3.3Å; A516-Q518 PolarHBondContact O-N 2.94Å; Q518-L521 PolarHBondContact O-N 3.15Å; Q518-Q522 WeakPolarHBondContact O-CB 3.4Å; Q518-Q522 PolarHBondContact O-N 3.35Å
519Q75.3Confident78Confident148 Ų148100.4 Ų100.469%0.69252%0.517SS*.Hα-helixtrans-65.3-37.9173.6-81.8-170.3-1500113E515 A516 Q522 S523E515-Q519 PolarHBondContact O-N 3.31Å; A516-Q519 PolarHBondContact O-N 2.99Å; Q519-Q522 PolarHBondContact O-N 2.97Å; Q519-S523 WeakPolarHBondContact O-CB 3.47Å; Q519-S523 PolarHBondContact O-N 3.27Å
520D78.3Confident77.4Confident82 Ų8298.3 Ų98.344%0.43951%0.512SS..Hα-helixtrans-63.3-41.8173.6172.962.9000111.8A516 S523 K524A516-D520 PolarHBondContact O-N 3.31Å; A516-D520 VanDerWaalsContact O-N 3.12Å; D520-S523 PolarHBondContact O-N 3.05Å; D520-K524 VanDerWaalsContact CG-NZ 3.28Å; D520-K524 WeakPolarHBondContact O-CG 3.45Å; D520-K524 PolarHBondContact O-N 3.17Å; D520-K524 VanDerWaalsContact O-N 3.1Å; D520-K524 VanDerWaalsContact OD1-CE 3.28Å; D520-K524 WeakPolarHBondContact OD1-CE 3.3Å; D520-K524 IonicContact OD1-NZ 3.04Å; D520-K524 PolarHBondContact OD1-NZ 2.93Å; D520-K524 WeakPolarHBondContact OD2-CE 3.35Å; D520-K524 IonicContact OD2-NZ 2.66Å; D520-K524 PolarHBondContact OD2-NZ 3.06Å
521L77.8Confident76.9Confident108 Ų10896.5 Ų96.557%0.56551%0.51SS*.Hα-helixtrans-64.7-41.3171.6-75.5170.1000112.6A517 Q518 S523 K524 F525A517-L521 PolarHBondContact O-N 3.12Å; A517-L521 VanDerWaalsContact O-N 3.16Å; Q518-L521 PolarHBondContact O-N 3.15Å; L521-S523 VanDerWaalsContact C-N 3.35Å; L521-S523 PolarHBondContact O-N 2.94Å; L521-K524 PolarHBondContact O-N 3.08Å; L521-F525 PolarHBondContact O-N 3.06Å
522Q74.6Confident76.6Confident119 Ų11997.5 Ų97.556%0.55652%0.516SS*.Hα-helixtrans-61.5-43.1176.6-161.687.716.700111Q518 Q519 F525 V526Q518-Q522 WeakPolarHBondContact O-CB 3.4Å; Q518-Q522 PolarHBondContact O-N 3.35Å; Q519-Q522 PolarHBondContact O-N 2.97Å; Q522-F525 WeakPolarHBondContact O-CB 3.3Å; Q522-F525 PolarHBondContact O-N 3.48Å; Q522-V526 WeakPolarHBondContact O-CG2 3.47Å; Q522-V526 PolarHBondContact O-N 2.98Å
523S74.4Confident75.9Confident80 Ų80100.5 Ų100.556%0.55952%0.521SS*.Hα-helixtrans-62.7-41.9177.1-170.40000111.9Q519 D520 L521 F525 V526 A527Q519-S523 WeakPolarHBondContact O-CB 3.47Å; Q519-S523 PolarHBondContact O-N 3.27Å; D520-S523 PolarHBondContact O-N 3.05Å; L521-S523 VanDerWaalsContact C-N 3.35Å; L521-S523 PolarHBondContact O-N 2.94Å; S523-F525 VanDerWaalsContact C-N 3.33Å; S523-F525 PolarHBondContact O-N 3.25Å; S523-V526 PolarHBondContact O-N 3.47Å; S523-A527 PolarHBondContact O-N 3.03Å
524K79.6Confident75.3Confident116 Ų11699.5 Ų99.550%0.50452%0.524SS..Hα-helixtrans-64.1-35.1173.1-71.7164.5-176.8166.40112.6D520 L521 K528D520-K524 VanDerWaalsContact CG-NZ 3.28Å; D520-K524 WeakPolarHBondContact O-CG 3.45Å; D520-K524 PolarHBondContact O-N 3.17Å; D520-K524 VanDerWaalsContact O-N 3.1Å; D520-K524 VanDerWaalsContact OD1-CE 3.28Å; D520-K524 WeakPolarHBondContact OD1-CE 3.3Å; D520-K524 IonicContact OD1-NZ 3.04Å; D520-K524 PolarHBondContact OD1-NZ 2.93Å; D520-K524 WeakPolarHBondContact OD2-CE 3.35Å; D520-K524 IonicContact OD2-NZ 2.66Å; D520-K524 PolarHBondContact OD2-NZ 3.06Å; L521-K524 PolarHBondContact O-N 3.08Å; K524-K528 PolarHBondContact O-N 3.37Å
525F74.1Confident75Confident152 Ų15299.5 Ų99.567%0.66753%0.528SS*.Hα-helixtrans-66.2-49.3172.9-109.5-81.9000112.1L521 Q522 S523 A527 K528 E529L521-F525 PolarHBondContact O-N 3.06Å; Q522-F525 WeakPolarHBondContact O-CB 3.3Å; Q522-F525 PolarHBondContact O-N 3.48Å; S523-F525 VanDerWaalsContact C-N 3.33Å; S523-F525 PolarHBondContact O-N 3.25Å; F525-A527 VanDerWaalsContact C-N 3.28Å; F525-A527 PolarHBondContact O-N 3.44Å; F525-K528 CarbonylContact O-C 3.53Å; F525-K528 WeakPolarHBondContact O-CA 3.43Å; F525-K528 WeakPolarHBondContact O-CB 3.37Å; F525-K528 PolarHBondContact O-N 2.88Å; F525-E529 PolarHBondContact O-N 3.05Å
526V77.6Confident74.3Confident66 Ų6699.4 Ų99.440%0.453%0.527SS..Hα-helixtrans-60.7-37.4178.3171.80000111.5Q522 S523 K528 E529 N530Q522-V526 WeakPolarHBondContact O-CG2 3.47Å; Q522-V526 PolarHBondContact O-N 2.98Å; S523-V526 PolarHBondContact O-N 3.47Å; V526-K528 VanDerWaalsContact C-N 3.3Å; V526-K528 PolarHBondContact O-N 3.46Å; V526-E529 PolarHBondContact O-N 2.96Å; V526-N530 PolarHBondContact O-N 3.46Å; V526-N530 PolarHBondContact O-ND2 2.9Å
527A73.8Confident73.5Confident62 Ų62100.2 Ų100.251%0.51253%0.529SS..Hα-helixtrans-60.7-37.2173.400000112.9S523 F525S523-A527 PolarHBondContact O-N 3.03Å; F525-A527 VanDerWaalsContact C-N 3.28Å; F525-A527 PolarHBondContact O-N 3.44Å
528K74.9Confident72.6Confident125 Ų125105.3 Ų105.354%0.54354%0.542SS..Hα-helixtrans-76.8-33.9175-75-75.3153.5-161.60112.8K524 F525 V526 E531 V532K524-K528 PolarHBondContact O-N 3.37Å; F525-K528 CarbonylContact O-C 3.53Å; F525-K528 WeakPolarHBondContact O-CA 3.43Å; F525-K528 WeakPolarHBondContact O-CB 3.37Å; F525-K528 PolarHBondContact O-N 2.88Å; V526-K528 VanDerWaalsContact C-N 3.3Å; V526-K528 PolarHBondContact O-N 3.46Å; K528-E531 WeakPolarHBondContact CD-OE2 3.48Å; K528-E531 WeakPolarHBondContact CE-OE2 3.35Å; K528-E531 IonicContact NZ-OE1 3.82Å; K528-E531 IonicContact NZ-OE2 2.64Å; K528-E531 PolarHBondContact NZ-OE2 3.43Å; K528-E531 VanDerWaalsContact O-CB 3.32Å; K528-E531 WeakPolarHBondContact O-CB 3.46Å; K528-E531 PolarHBondContact O-N 3.33Å; K528-V532 PolarHBondContact O-N 2.79Å; K528-V532 VanDerWaalsContact O-N 3.14Å
529E71.2Confident72.2Confident105 Ų105105.9 Ų105.949%0.49155%0.547SS..Hα-helixtrans-67.7-37.4177.7-167.5164-15700112.1F525 V526 E531 V532 Q533F525-E529 PolarHBondContact O-N 3.05Å; V526-E529 PolarHBondContact O-N 2.96Å; E529-E531 VanDerWaalsContact C-N 3.29Å; E529-E531 PolarHBondContact O-N 3.25Å; E529-V532 PolarHBondContact O-N 3.25Å; E529-Q533 WeakPolarHBondContact O-CG 3.46Å; E529-Q533 PolarHBondContact O-N 3.27Å
530N76.2Confident71.3Confident93 Ų93102.5 Ų102.550%0.49754%0.536SS..Hα-helixtrans-62.1-34.9171.2-71.8-33.4000112.9V526 Q533 S534V526-N530 PolarHBondContact O-N 3.46Å; V526-N530 PolarHBondContact O-ND2 2.9Å; N530-Q533 PolarHBondContact O-N 2.94Å; N530-S534 PolarHBondContact O-N 2.92Å; N530-S534 VanDerWaalsContact O-N 3.07Å
531E75.3Confident70.3Confident108 Ų108105.3 Ų105.351%0.50555%0.552SS.*Hα-helixtrans-66.7-37.9175.2-153.6172.8-153.900111K528 E529 L535K528-E531 WeakPolarHBondContact CD-OE2 3.48Å; K528-E531 WeakPolarHBondContact CE-OE2 3.35Å; K528-E531 IonicContact NZ-OE1 3.82Å; K528-E531 IonicContact NZ-OE2 2.64Å; K528-E531 PolarHBondContact NZ-OE2 3.43Å; K528-E531 VanDerWaalsContact O-CB 3.32Å; K528-E531 WeakPolarHBondContact O-CB 3.46Å; K528-E531 PolarHBondContact O-N 3.33Å; E529-E531 VanDerWaalsContact C-N 3.29Å; E529-E531 PolarHBondContact O-N 3.25Å; E531-L535 PolarHBondContact O-N 3.45Å
532V71.9Confident69.1Low88 Ų88105.1 Ų105.153%0.53356%0.555SS.*Hα-helixtrans-71.1-42.5173.7174.40000112.1K528 E529 S534 L535 H536K528-V532 PolarHBondContact O-N 2.79Å; K528-V532 VanDerWaalsContact O-N 3.14Å; E529-V532 PolarHBondContact O-N 3.25Å; V532-S534 VanDerWaalsContact C-N 3.3Å; V532-S534 PolarHBondContact O-N 3.36Å; V532-L535 WeakPolarHBondContact O-CB 3.46Å; V532-L535 PolarHBondContact O-N 2.82Å; V532-L535 VanDerWaalsContact O-N 3.14Å; V532-H536 PolarHBondContact O-N 2.99Å
533Q68.8Low67.9Low116 Ų116106.4 Ų106.454%0.54257%0.565SS.*Hα-helixtrans-64.3-33.6177.6-72.8-175.47.200112.5E529 N530 L535 H536 S537E529-Q533 WeakPolarHBondContact O-CG 3.46Å; E529-Q533 PolarHBondContact O-N 3.27Å; N530-Q533 PolarHBondContact O-N 2.94Å; Q533-L535 VanDerWaalsContact C-N 3.33Å; Q533-L535 PolarHBondContact O-N 2.78Å; Q533-H536 PolarHBondContact O-N 2.88Å; Q533-S537 PolarHBondContact O-N 3.5Å
534S69.9Low67.1Low72 Ų72109 Ų10950%0.50358%0.577SS.*Hα-helixtrans-61.2-39.5172.2-171.40000112.6N530 V532N530-S534 PolarHBondContact O-N 2.92Å; N530-S534 VanDerWaalsContact O-N 3.07Å; V532-S534 VanDerWaalsContact C-N 3.3Å; V532-S534 PolarHBondContact O-N 3.36Å
535L70.8Confident65.9Low121 Ų121108.7 Ų108.763%0.63459%0.589SS**Hα-helixtrans-70.7-37.9173.6-65.8170.6000111.7E531 V532 Q533 K538E531-L535 PolarHBondContact O-N 3.45Å; V532-L535 WeakPolarHBondContact O-CB 3.46Å; V532-L535 PolarHBondContact O-N 2.82Å; V532-L535 VanDerWaalsContact O-N 3.14Å; Q533-L535 VanDerWaalsContact C-N 3.33Å; Q533-L535 PolarHBondContact O-N 2.78Å; L535-K538 PolarHBondContact O-N 3.25Å
536H62.2Low64.3Low112 Ų112110 Ų11052%0.51960%0.595SS.*Hα-helixtrans-68.3-34.3179.7-148.2-32.9000112.7V532 Q533 K538 L539 T540V532-H536 PolarHBondContact O-N 2.99Å; Q533-H536 PolarHBondContact O-N 2.88Å; H536-K538 VanDerWaalsContact C-N 3.34Å; H536-K538 PolarHBondContact O-N 3.07Å; H536-L539 PolarHBondContact O-N 3.14Å; H536-L539 VanDerWaalsContact O-N 3.16Å; H536-T540 PolarHBondContact O-N 3.4Å; H536-T540 PolarHBondContact O-OG1 3.07Å
537S64.8Low62.6Low77 Ų77112.8 Ų112.854%0.53860%0.604SS.*Hα-helixtrans-60.7-40.4174.9-171.40000112.3Q533 L539 T540Q533-S537 PolarHBondContact O-N 3.5Å; S537-L539 PolarHBondContact O-N 3.38Å; S537-T540 PolarHBondContact O-N 2.92Å
538K62Low61.2Low161 Ų161119.7 Ų119.770%0.763%0.625SS**Hα-helixtrans-68.1-18.8176.1-71.7178.3177.7173.50114.5L535 H536L535-K538 PolarHBondContact O-N 3.25Å; H536-K538 VanDerWaalsContact C-N 3.34Å; H536-K538 PolarHBondContact O-N 3.07Å
539L62.5Low59.9Low113 Ų113119.9 Ų119.959%0.59263%0.632SS**Hα-helixtrans-88.8-24.8176.7-174.962.4000112.3H536 S537 T542H536-L539 PolarHBondContact O-N 3.14Å; H536-L539 VanDerWaalsContact O-N 3.16Å; S537-L539 PolarHBondContact O-N 3.38Å; L539-T542 PolarHBondContact O-N 2.91Å; L539-T542 PolarHBondContact O-OG1 3.29Å
540T56.9Low58.6Low76 Ų76123.4 Ų123.447%0.46665%0.648SS.*Hα-helixtrans-77-32.9-174.9-570000112.6H536 S537 T542 L543H536-T540 PolarHBondContact O-N 3.4Å; H536-T540 PolarHBondContact O-OG1 3.07Å; S537-T540 PolarHBondContact O-N 2.92Å; T540-T542 PolarHBondContact O-N 3.1Å; T540-T542 VanDerWaalsContact O-N 3.12Å; T540-L543 PolarHBondContact O-N 2.98Å
541D57.2Low57.1Low141 Ų141127.6 Ų127.675%0.75467%0.665SS**THydrogen-bonded Turntrans-64.2-14174.6-77.5-18.2000113.7
542T52.5Low55.4Low104 Ų104133.4 Ų133.464%0.63868%0.682SS**THydrogen-bonded Turntrans-94.6-1.7179.62.70000114.5L539 T540L539-T542 PolarHBondContact O-N 2.91Å; L539-T542 PolarHBondContact O-OG1 3.29Å; T540-T542 PolarHBondContact O-N 3.1Å; T540-T542 VanDerWaalsContact O-N 3.12Å
543L50Low54Low147 Ų147137.9 Ų137.977%0.7770%0.702SS**  trans-119.27.5-170.5-138.175.7000115.8T540 S545T540-L543 PolarHBondContact O-N 2.98Å; L543-S545 VanDerWaalsContact C-N 3.29Å; L543-S545 PolarHBondContact O-N 3.24Å
544V57.9Low52.7Low133 Ų133138.4 Ų138.481%0.80671%0.706SS**  trans-83.958.8-177.3-171.30000111.9
545S52.8Low51.4Low110 Ų110142.7 Ų142.777%0.76972%0.718SS**  trans-151.223.7-173.960.40000117.4L543L543-S545 VanDerWaalsContact C-N 3.29Å; L543-S545 PolarHBondContact O-N 3.24Å
546K41.8Very low49.7Very low181 Ų181145 Ų14579%0.78773%0.73SS**SBendtrans-142.6118175.5-152.4-178.2-174.5-159.80116.3
547Q41Very low48.4Very low124 Ų124147.8 Ų147.858%0.57975%0.745SS**  trans70.264.9156.1-73.3173.8-75.100120L549Q547-L549 HydrophobicContact CB-CB 4.36Å; Q547-L549 HydrophobicContact CG-CB 4.37Å; Q547-L549 PolarHBondContact O-N 3.04Å
548Q44.4Very low47.5Very low207 Ų207153.7 Ų153.797%0.96777%0.765SS**THydrogen-bonded Turntrans-59.955.9141.9-165.6176.823.200112.7
549L47Very low46.2Very low129 Ų129150.1 Ų150.168%0.67576%0.76SS**THydrogen-bonded Turntrans-128.9-23.7-170.7-147.689.5000118.1Q547Q547-L549 HydrophobicContact CB-CB 4.36Å; Q547-L549 HydrophobicContact CG-CB 4.37Å; Q547-L549 PolarHBondContact O-N 3.04Å
550E45.5Very low45Very low179 Ų179154.6 Ų154.684%0.83678%0.778SS**SBendtrans-109.818.8-167.2-68.7-174.3160.800115.8R552E550-R552 VanDerWaalsContact C-N 3.32Å; E550-R552 PolarHBondContact O-N 3.05Å
551Q44.9Very low43.8Very low180 Ų180158.6 Ų158.684%0.84179%0.791SS**SBendtrans-88.922.4180-146.7177.926.500114.3
552R39.2Very low42.6Very low230 Ų230159.8 Ų159.887%0.86879%0.789SS**  trans-144.321.1-166.6-118.9179.1-166.9152.84.7119.4E550 M554E550-R552 VanDerWaalsContact C-N 3.32Å; E550-R552 PolarHBondContact O-N 3.05Å; R552-M554 VanDerWaalsContact C-N 3.35Å
553L42.4Very low41.6Very low183 Ų183166 Ų16696%0.95880%0.801SS**SBendtrans-104.226.4156.3-132.380.4000112.9
554M40.8Very low40.7Very low126 Ų126162.9 Ų162.962%0.62180%0.797SS**  trans-58146.2157.2167179.4-76.300110.8R552R552-M554 VanDerWaalsContact C-N 3.35Å
555Q41.8Very low39.3Very low163 Ų163161.9 Ų161.976%0.76280%0.796SS**  trans53.589.5159.8-67.9157.5-6.100117.3
556L35.1Very low38.6Very low168 Ų168166 Ų16688%0.8880%0.8SS**  trans179.793.2136.9-101.7161.3000111.8
557M35.7Very low38.2Very low171 Ų171165.5 Ų165.584%0.84280%0.8SS**  trans-179.254.7134.1-98.9-173.5-58.600110.4S559M557-S559 PolarHBondContact O-N 3.01Å
558E45.8Very low38.5Very low202 Ų202168.7 Ų168.794%0.94482%0.815SS**  trans-76.963.1159.9-170.9169.4-15500108.5
559S35.8Very low38.6Very low86 Ų86163.4 Ų163.460%0.60180%0.801SS**  trans-165.873.4-176.764.70000114.4M557M557-S559 PolarHBondContact O-N 3.01Å
560E35.8Very low38.8Very low206 Ų206164.1 Ų164.196%0.96381%0.805SS**  trans-150.2116.2140.5-125.7-172.2-175.600112.7
561Q32.5Very low38.6Very low161 Ų161164.1 Ų164.175%0.75281%0.805SS**  trans-120.4124.4-168.4165.466-27.200109
562K31.4Very low39.3Very low165 Ų165162.5 Ų162.572%0.71780%0.8SS**  trans70.5108.7175.5-57.4168.4176.2179.10118.8
563R32.9Very low39.7Very low234 Ų234159.1 Ų159.188%0.88379%0.794SS**  178137.495.4-114.3172.4-72.6132.65117
564A29.7Very low40.4Very low83 Ų83155.3 Ų155.369%0.68678%0.779SS**  trans70.6128.9130.500000125
565S28.9Very low40.9Very low111 Ų111154.7 Ų154.778%0.77677%0.774SS**  trans82.9107.2136.171.30000121.5
566K38.6Very low41.5Very low196 Ų196153 Ų15385%0.85277%0.77SS**  171.1107.3105.5-96.7-174.5173.1-176.40111.2
567E33.3Very low42.6Very low171 Ų171150.7 Ų150.780%0.79976%0.758SS**  trans-153.736.3152.2-157.168-107.300109.3
568E46.6Very low43.5Very low192 Ų192147.7 Ų147.790%0.89775%0.745SS**  trans-103.457.4177.5-166.8173.1-137.500108.1
569S46.1Very low44.1Very low95 Ų95144.8 Ų144.866%0.66473%0.731SS**SBendtrans-136.64-170.6-165.60000114.7
570L52.1Low45Very low144 Ų144148.1 Ų148.175%0.75474%0.737SS**SBendtrans-135.731-179.3-76176.3000113.8
571Q42.3Very low46Very low179 Ų179143.8 Ų143.884%0.83672%0.721SS**SBendtrans-135.823.5171.2-149.9160.95.100114.2
572I58.6Low47.6Very low146 Ų146141.9 Ų141.975%0.74971%0.712SS**SBendtrans-111.715.6171.7-61.6176.3000110.7
573Q48.5Very low48.9Very low159 Ų159137.5 Ų137.574%0.74371%0.706SS**SBendtrans-112.37.7179.2-149.5173.719.400114.2
574V57.3Low50.2Low104 Ų104131.6 Ų131.663%0.6369%0.691SS**SBendtrans-108.5-12.9176.7178.80000112
575Q50.2Low51.6Low112 Ų112133.9 Ų133.952%0.52369%0.686SS.*SBendtrans-77.2-33.3-178.4-170.259.53100113.3I577 L578Q575-I577 VanDerWaalsContact C-N 3.25Å; Q575-I577 PolarHBondContact O-N 3.43Å; Q575-L578 PolarHBondContact O-N 3.42Å
576D54.6Low53.1Low127 Ų127131.5 Ų131.568%0.67967%0.673SS**THydrogen-bonded Turntrans-67.1-18.5-178.8-93.713.4000114.6
577I58.9Low54Low121 Ų121127.6 Ų127.662%0.62166%0.658SS**THydrogen-bonded Turntrans-87.3-16.3-179.6-65.3176.5000111.7Q575Q575-I577 VanDerWaalsContact C-N 3.25Å; Q575-I577 PolarHBondContact O-N 3.43Å
578L54.4Low55.3Low108 Ų108124.7 Ų124.757%0.56565%0.646SS**THydrogen-bonded Turntrans-81.9-31.4178.5-77.9165.6000113.1Q575 N581Q575-L578 PolarHBondContact O-N 3.42Å; L578-N581 PolarHBondContact O-N 3.47Å
579E58.3Low55.7Low140 Ų140122.2 Ų122.265%0.65464%0.635SS**Hα-helixtrans-77.4-20.8-177.3-66.9-171.4168.300113.9N581E579-N581 VanDerWaalsContact C-N 3.35Å; E579-N581 PolarHBondContact O-N 3.29Å
580Q54.3Low56.3Low157 Ų157124.4 Ų124.473%0.73464%0.635SS**Hα-helixtrans-75.8-18.3174.9-67.2-169.2-11.100114
581N57.5Low56.6Low115 Ų115123.7 Ų123.762%0.61563%0.626SS**Hα-helixtrans-86.8-23.8-179.6-104.1-60.2000114.2L578 E579L578-N581 PolarHBondContact O-N 3.47Å; E579-N581 VanDerWaalsContact C-N 3.35Å; E579-N581 PolarHBondContact O-N 3.29Å
582E64.9Low56.9Low121 Ų121121.7 Ų121.757%0.56562%0.616SS**Hα-helixtrans-72.4-32.5175.5-83.3-87114.600112L584 K585 A586E582-L584 PolarHBondContact O-N 3.5Å; E582-K585 WeakPolarHBondContact O-CB 3.38Å; E582-K585 PolarHBondContact O-N 3.49Å; E582-K585 VanDerWaalsContact O-N 3.14Å; E582-K585 IonicContact OE1-NZ 2.6Å; E582-K585 PolarHBondContact OE1-NZ 2.92Å; E582-A586 PolarHBondContact O-N 2.85Å
583A58.1Low56.7Low73 Ų73118.9 Ų118.960%0.60361%0.61SS**Hα-helixtrans-65-33.8-178.400000114.2K585A583-K585 VanDerWaalsContact C-N 3.32Å
584L60.5Low56.7Low109 Ų109118 Ų11857%0.57161%0.605SS**Hα-helixtrans-73.1-24.3175.5-98155000113E582E582-L584 PolarHBondContact O-N 3.5Å
585K59.6Low56.6Low131 Ų131119.9 Ų119.957%0.5761%0.611SS**Hα-helixtrans-78.3-36.2-177.7-159.1173.1169.7-166.20111.9E582 A583 Q587 I588 Q589E582-K585 WeakPolarHBondContact O-CB 3.38Å; E582-K585 PolarHBondContact O-N 3.49Å; E582-K585 VanDerWaalsContact O-N 3.14Å; E582-K585 IonicContact OE1-NZ 2.6Å; E582-K585 PolarHBondContact OE1-NZ 2.92Å; A583-K585 VanDerWaalsContact C-N 3.32Å; K585-Q587 VanDerWaalsContact C-N 3.31Å; K585-Q587 PolarHBondContact O-N 3.14Å; K585-I588 PolarHBondContact O-N 3.21Å; K585-Q589 PolarHBondContact O-N 3.47Å
586A60.7Low56.7Low61 Ų61118.9 Ų118.950%0.50462%0.621SS.*Hα-helixtrans-63.8-33.1174.500000113.1E582 Q589 Q590E582-A586 PolarHBondContact O-N 2.85Å; A586-Q589 PolarHBondContact O-N 2.8Å; A586-Q590 PolarHBondContact O-N 3.47Å
587Q56.3Low56.8Low115 Ų115116.9 Ų116.954%0.53762%0.622SS.*Hα-helixtrans-70.8-33.6179.7-162.3173.746.400112.8K585 Q589 Q590 F591K585-Q587 VanDerWaalsContact C-N 3.31Å; K585-Q587 PolarHBondContact O-N 3.14Å; Q587-Q589 VanDerWaalsContact C-N 3.32Å; Q587-Q590 PolarHBondContact O-N 3.49Å; Q587-F591 HydrophobicContact CG-CE2 4.47Å; Q587-F591 WeakPolarHBondContact O-CD2 3.4Å
588I60.8Low56.1Low109 Ų109119.3 Ų119.356%0.55963%0.631SS**Hα-helixtrans-69.7-31.3176.5-66.8171.4000111.6K585 H592K585-I588 PolarHBondContact O-N 3.21Å; I588-H592 PolarHBondContact O-ND1 3.14Å
589Q55.8Low55.7Low141 Ų141120.9 Ų120.966%0.65965%0.645SS**Hα-helixtrans-74.4-28.7179.1-157.9167.62.900112.4K585 A586 Q587 H592 S593K585-Q589 PolarHBondContact O-N 3.47Å; A586-Q589 PolarHBondContact O-N 2.8Å; Q587-Q589 VanDerWaalsContact C-N 3.32Å; Q589-H592 PolarHBondContact O-N 3.01Å; Q589-S593 PolarHBondContact O-N 2.92Å
590Q59Low55.5Low140 Ų140120.3 Ų120.365%0.65466%0.657SS**Hα-helixtrans-68-39.7177.5-169.1174.3-0.700112.9A586 Q587A586-Q590 PolarHBondContact O-N 3.47Å; Q587-Q590 PolarHBondContact O-N 3.49Å
591F58.3Low55.3Low130 Ų130116.1 Ų116.157%0.5765%0.649SS**Hα-helixtrans-69.6-32.1176.2-74.5-67.8000113.3Q587 S593 Q594 I595Q587-F591 HydrophobicContact CG-CE2 4.47Å; Q587-F591 WeakPolarHBondContact O-CD2 3.4Å; F591-S593 PolarHBondContact O-N 3.3Å; F591-Q594 PolarHBondContact O-N 3.24Å; F591-I595 PolarHBondContact O-N 3.41Å
592H49.1Very low55.1Low136 Ų136115 Ų11563%0.6365%0.651SS**Hα-helixtrans-64.6-38.1176.7-82.583.9000112.6I588 Q589 Q594I588-H592 PolarHBondContact O-ND1 3.14Å; Q589-H592 PolarHBondContact O-N 3.01Å; H592-Q594 VanDerWaalsContact C-N 3.27Å; H592-Q594 PolarHBondContact O-N 2.93Å
593S53.4Low54.8Low88 Ų88114.6 Ų114.662%0.61566%0.656SS**Hα-helixtrans-71.6-18.8177.1-61.80000113.7Q589 F591Q589-S593 PolarHBondContact O-N 2.92Å; F591-S593 PolarHBondContact O-N 3.3Å
594Q48.1Very low54.8Low139 Ų139116.9 Ų116.965%0.6566%0.657SS**Hα-helixtrans-87.2-25.9-179.1-152.1167.820.600112.9F591 H592 A596F591-Q594 PolarHBondContact O-N 3.24Å; H592-Q594 VanDerWaalsContact C-N 3.27Å; H592-Q594 PolarHBondContact O-N 2.93Å; Q594-A596 PolarHBondContact O-N 3.15Å
595I56.8Low54.8Low145 Ų145113.6 Ų113.674%0.74465%0.646SS**Hα-helixtrans-73.6-18.2172.7-66.2174.9000111.7F591 A597F591-I595 PolarHBondContact O-N 3.41Å; I595-A597 PolarHBondContact O-N 3.13Å; I595-A597 VanDerWaalsContact O-N 3.17Å
596A52.3Low55.1Low91 Ų91114.1 Ų114.175%0.75265%0.65SS**THydrogen-bonded Turntrans-71-0.7174.600000114.8Q594Q594-A596 PolarHBondContact O-N 3.15Å
597A55.3Low55.3Low84 Ų84117.6 Ų117.669%0.69466%0.656SS**THydrogen-bonded Turntrans-129.917.2-166.100000116.2I595I595-A597 PolarHBondContact O-N 3.13Å; I595-A597 VanDerWaalsContact O-N 3.17Å
598Q45.1Very low56.1Low173 Ų173116.7 Ų116.781%0.80866%0.655SS**  trans-157.584.3175.8-159.3171.713.700115.7
599T44.9Very low56.8Low140 Ų140117.8 Ų117.886%0.85966%0.657SS**  trans-178.4151.3138.119.80000113.5A601T599-A601 PolarHBondContact O-N 2.69Å
600S55.1Low57.8Low128 Ų128119.1 Ų119.190%0.89566%0.661SS**  trans-82.386.5-172.851.90000113.7
601A49.4Very low58.4Low70 Ų70116.5 Ų116.558%0.57965%0.654SS**  trans-119.25.9-176.500000116.3T599T599-A601 PolarHBondContact O-N 2.69Å
602S54.1Low59.3Low92 Ų92114.2 Ų114.264%0.64365%0.647SS**Hα-helixtrans-74.1-39.1-173.4-161.20000114.7
603V58.9Low60.8Low112 Ų112110.6 Ų110.668%0.67964%0.64SS**Hα-helixtrans-76.7-36.3-172.9-179.10000111.9A605 E606 E607V603-A605 VanDerWaalsContact C-N 3.27Å; V603-A605 PolarHBondContact O-N 3.02Å; V603-E606 PolarHBondContact O-N 2.97Å; V603-E607 PolarHBondContact O-N 3.29Å
604L57.4Low61.9Low121 Ų121110.6 Ų110.663%0.63463%0.631SS**Hα-helixtrans-67.9-28.1178.4-149.787.4000112.3L608L604-L608 HydrophobicContact CD2-CD1 4.46Å; L604-L608 WeakPolarHBondContact O-CB 3.48Å; L604-L608 PolarHBondContact O-N 3.01Å; L604-L608 VanDerWaalsContact O-N 3.08Å
605A60.2Low63.4Low40 Ų40108.6 Ų108.633%0.33162%0.62SS.*Hα-helixtrans-72.5-35.6-18000000112.7V603 H609V603-A605 VanDerWaalsContact C-N 3.27Å; V603-A605 PolarHBondContact O-N 3.02Å; A605-H609 PolarHBondContact O-N 3.07Å; A605-H609 PolarHBondContact O-ND1 3.36Å; A605-H609 VanDerWaalsContact O-ND1 3.12Å
606E66Low64.5Low142 Ų142106 Ų10666%0.66461%0.608SS**Hα-helixtrans-72.4-39.9177.3-70-174.6136.100112.2V603 H609 K610V603-E606 PolarHBondContact O-N 2.97Å; E606-H609 PolarHBondContact O-N 3.38Å; E606-K610 WeakPolarHBondContact O-CB 3.38Å; E606-K610 PolarHBondContact O-N 3Å
607E65.7Low66Low134 Ų134107.6 Ų107.663%0.62660%0.597SS**Hα-helixtrans-65.4-39.8172.3-72.9-164.8133.800112.1V603 K610 V611V603-E607 PolarHBondContact O-N 3.29Å; E607-K610 PolarHBondContact O-N 3.46Å; E607-V611 WeakPolarHBondContact O-CG2 3.41Å; E607-V611 PolarHBondContact O-N 3.37Å
608L72.8Confident67.1Low96 Ų96107.2 Ų107.250%0.50358%0.581SS.*Hα-helixtrans-61.7-46.6173.4-88.5165.4000112L604 K610 V611 I612L604-L608 HydrophobicContact CD2-CD1 4.46Å; L604-L608 WeakPolarHBondContact O-CB 3.48Å; L604-L608 PolarHBondContact O-N 3.01Å; L604-L608 VanDerWaalsContact O-N 3.08Å; L608-K610 VanDerWaalsContact C-N 3.3Å; L608-K610 PolarHBondContact O-N 3.46Å; L608-V611 PolarHBondContact O-N 3.01Å; L608-I612 WeakPolarHBondContact O-CB 3.25Å; L608-I612 WeakPolarHBondContact O-CD1 3.27Å; L608-I612 WeakPolarHBondContact O-CG1 3.45Å; L608-I612 PolarHBondContact O-N 3.32Å
609H74.5Confident68.7Low132 Ų132102.9 Ų102.961%0.61156%0.563SS**Hα-helixtrans-60.7-37.7175.5-77.3132.9000112.7A605 E606 I612 A613A605-H609 PolarHBondContact O-N 3.07Å; A605-H609 PolarHBondContact O-ND1 3.36Å; A605-H609 VanDerWaalsContact O-ND1 3.12Å; E606-H609 PolarHBondContact O-N 3.38Å; H609-I612 PolarHBondContact O-N 3.38Å; H609-A613 WeakPolarHBondContact O-CB 3.46Å; H609-A613 PolarHBondContact O-N 3.47Å
610K76.9Confident70.6Confident169 Ų169102.3 Ų102.374%0.73555%0.549SS*.Hα-helixtrans-69.7-38.6177.9-156.1172.2-172176.10112.5E606 E607 L608 E614E606-K610 WeakPolarHBondContact O-CB 3.38Å; E606-K610 PolarHBondContact O-N 3Å; E607-K610 PolarHBondContact O-N 3.46Å; L608-K610 VanDerWaalsContact C-N 3.3Å; L608-K610 PolarHBondContact O-N 3.46Å; K610-E614 PolarHBondContact O-N 2.89Å; K610-E614 VanDerWaalsContact O-N 3.1Å
611V73.2Confident71.8Confident85 Ų85102 Ų10252%0.51553%0.533SS..Hα-helixtrans-69.9-36.4173.5171.70000111.6E607 L608 K615E607-V611 WeakPolarHBondContact O-CG2 3.41Å; E607-V611 PolarHBondContact O-N 3.37Å; L608-V611 PolarHBondContact O-N 3.01Å; V611-K615 HydrophobicContact CG1-CG 4.38Å; V611-K615 VanDerWaalsContact O-CB 3.3Å; V611-K615 WeakPolarHBondContact O-CB 3.44Å; V611-K615 WeakPolarHBondContact O-CG 3.44Å; V611-K615 PolarHBondContact O-N 3.42Å
612I77.1Confident73.1Confident81 Ų81102.7 Ų102.742%0.41553%0.531SS..Hα-helixtrans-63.7-50.6173.8-71.2162.8000109.8L608 H609 E614 K615 D616L608-I612 WeakPolarHBondContact O-CB 3.25Å; L608-I612 WeakPolarHBondContact O-CD1 3.27Å; L608-I612 WeakPolarHBondContact O-CG1 3.45Å; L608-I612 PolarHBondContact O-N 3.32Å; H609-I612 PolarHBondContact O-N 3.38Å; I612-E614 VanDerWaalsContact C-N 3.35Å; I612-E614 PolarHBondContact O-N 2.85Å; I612-K615 CarbonylContact O-C 3.58Å; I612-K615 WeakPolarHBondContact O-CA 3.35Å; I612-K615 PolarHBondContact O-N 3.23Å; I612-D616 WeakPolarHBondContact CG2-OD2 3.2Å; I612-D616 PolarHBondContact O-N 2.97Å
613A79.4Confident74.2Confident60 Ų60103.8 Ų103.850%0.49653%0.525SS..Hα-helixtrans-58.9-41178.400000113.3H609 K615 D616 K617H609-A613 WeakPolarHBondContact O-CB 3.46Å; H609-A613 PolarHBondContact O-N 3.47Å; A613-K615 VanDerWaalsContact C-N 3.34Å; A613-D616 PolarHBondContact O-N 3.28Å; A613-K617 WeakPolarHBondContact O-CB 3.42Å; A613-K617 PolarHBondContact O-N 2.94Å
614E76.9Confident75.4Confident89 Ų89102.5 Ų102.542%0.41652%0.515SS..Hα-helixtrans-69.5-31.8174.7-176.157.2-14800112.1K610 I612 Q618K610-E614 PolarHBondContact O-N 2.89Å; K610-E614 VanDerWaalsContact O-N 3.1Å; I612-E614 VanDerWaalsContact C-N 3.35Å; I612-E614 PolarHBondContact O-N 2.85Å; E614-Q618 WeakPolarHBondContact O-CG 3.37Å; E614-Q618 PolarHBondContact O-N 3.17Å; E614-Q618 PolarHBondContact OE1-NE2 3.38Å
615K79.8Confident76.5Confident96 Ų96100.1 Ų100.142%0.41751%0.509SS..Hα-helixtrans-73.7-36.2174.4-75.3-71.1160.3-149.90113V611 I612 A613 Q618 L619V611-K615 HydrophobicContact CG1-CG 4.38Å; V611-K615 VanDerWaalsContact O-CB 3.3Å; V611-K615 WeakPolarHBondContact O-CB 3.44Å; V611-K615 WeakPolarHBondContact O-CG 3.44Å; V611-K615 PolarHBondContact O-N 3.42Å; I612-K615 CarbonylContact O-C 3.58Å; I612-K615 WeakPolarHBondContact O-CA 3.35Å; I612-K615 PolarHBondContact O-N 3.23Å; A613-K615 VanDerWaalsContact C-N 3.34Å; K615-Q618 PolarHBondContact O-N 3.45Å; K615-L619 WeakPolarHBondContact O-CB 3.4Å; K615-L619 PolarHBondContact O-N 3.24Å
616D79.3Confident77.6Confident91 Ų91103.1 Ų103.149%0.48752%0.518SS..Hα-helixtrans-69.7-36.6174.6-67.4-20.3000110.7I612 A613 L619 K620I612-D616 WeakPolarHBondContact CG2-OD2 3.2Å; I612-D616 PolarHBondContact O-N 2.97Å; A613-D616 PolarHBondContact O-N 3.28Å; D616-L619 PolarHBondContact O-N 3.48Å; D616-K620 WeakPolarHBondContact O-CB 3.39Å; D616-K620 PolarHBondContact O-N 3.38Å
617K84.9Confident78.4Confident124 Ų12498.2 Ų98.254%0.53950%0.502SS..Hα-helixtrans-62.5-42.8170.5-173-177.5176.2-169.90112.4A613 K620 Q621A613-K617 WeakPolarHBondContact O-CB 3.42Å; A613-K617 PolarHBondContact O-N 2.94Å; K617-K620 PolarHBondContact O-N 3.38Å; K617-Q621 PolarHBondContact O-N 2.91Å
618Q76.9Confident79.2Confident77 Ų7797.1 Ų97.136%0.3650%0.501SS..Hα-helixtrans-66.7-39173.8-74.6174.814.700112E614 K615 Q621 T622E614-Q618 WeakPolarHBondContact O-CG 3.37Å; E614-Q618 PolarHBondContact O-N 3.17Å; E614-Q618 PolarHBondContact OE1-NE2 3.38Å; K615-Q618 PolarHBondContact O-N 3.45Å; Q618-Q621 PolarHBondContact O-N 3.46Å; Q618-T622 PolarHBondContact O-N 2.92Å; Q618-T622 PolarHBondContact O-OG1 2.82Å
619L79.5Confident79.5Confident82 Ų8298.1 Ų98.143%0.42950%0.503SS..Hα-helixtrans-60.1-48.5174.8-122.8167.7000110.4K615 D616 Q621 T622 E623K615-L619 WeakPolarHBondContact O-CB 3.4Å; K615-L619 PolarHBondContact O-N 3.24Å; D616-L619 PolarHBondContact O-N 3.48Å; L619-Q621 PolarHBondContact O-N 3.43Å; L619-T622 WeakPolarHBondContact CA-OG1 3.31Å; L619-T622 CarbonylContact O-C 3.57Å; L619-T622 WeakPolarHBondContact O-CA 3.44Å; L619-T622 PolarHBondContact O-N 3.32Å; L619-T622 PolarHBondContact O-OG1 3.48Å; L619-E623 HydrophobicContact CD2-CG 4.24Å; L619-E623 WeakPolarHBondContact O-CG 3.48Å; L619-E623 PolarHBondContact O-N 3.08Å
620K85.2Confident79.8Confident128 Ų12897.5 Ų97.556%0.55750%0.5SS*.Hα-helixtrans-62-43.4178.1-169.2162.4-174.9170.40112.6D616 K617 T622 E623 D624D616-K620 WeakPolarHBondContact O-CB 3.39Å; D616-K620 PolarHBondContact O-N 3.38Å; K617-K620 PolarHBondContact O-N 3.38Å; K620-T622 VanDerWaalsContact C-N 3.28Å; K620-T622 PolarHBondContact O-N 3.46Å; K620-E623 PolarHBondContact O-N 3.14Å; K620-E623 VanDerWaalsContact O-N 3.15Å; K620-D624 WeakPolarHBondContact O-CB 3.45Å; K620-D624 PolarHBondContact O-N 2.93Å
621Q79.8Confident80.1Confident120 Ų12094.7 Ų94.756%0.56149%0.493SS*.Hα-helixtrans-61-34.6172.2-80.2-170.4-58.700113.2K617 Q618 L619 S625K617-Q621 PolarHBondContact O-N 2.91Å; Q618-Q621 PolarHBondContact O-N 3.46Å; L619-Q621 PolarHBondContact O-N 3.43Å; Q621-S625 WeakPolarHBondContact O-CB 3.45Å; Q621-S625 PolarHBondContact O-N 3.4Å; Q621-S625 PolarHBondContact O-OG 3.33Å
622T76.4Confident80.4Confident86 Ų8695 Ų9553%0.52849%0.489SS..Hα-helixtrans-74.9-31.2173.954.10000113.3Q618 L619 K620 L626Q618-T622 PolarHBondContact O-N 2.92Å; Q618-T622 PolarHBondContact O-OG1 2.82Å; L619-T622 WeakPolarHBondContact CA-OG1 3.31Å; L619-T622 CarbonylContact O-C 3.57Å; L619-T622 WeakPolarHBondContact O-CA 3.44Å; L619-T622 PolarHBondContact O-N 3.32Å; L619-T622 PolarHBondContact O-OG1 3.48Å; K620-T622 VanDerWaalsContact C-N 3.28Å; K620-T622 PolarHBondContact O-N 3.46Å; T622-L626 VanDerWaalsContact O-CB 3.23Å; T622-L626 WeakPolarHBondContact O-CB 3.49Å; T622-L626 PolarHBondContact O-N 2.97Å
623E77.5Confident80.5Confident114 Ų11496.2 Ų96.253%0.53350%0.495SS..Hα-helixtrans-70.4-45.4173.3-73.5173.8158.100111L619 K620 S625 L626 A627L619-E623 HydrophobicContact CD2-CG 4.24Å; L619-E623 WeakPolarHBondContact O-CG 3.48Å; L619-E623 PolarHBondContact O-N 3.08Å; K620-E623 PolarHBondContact O-N 3.14Å; K620-E623 VanDerWaalsContact O-N 3.15Å; E623-S625 VanDerWaalsContact C-N 3.31Å; E623-S625 PolarHBondContact O-N 2.88Å; E623-L626 CarbonylContact O-C 3.55Å; E623-L626 PolarHBondContact O-N 3.16Å; E623-A627 WeakPolarHBondContact O-CB 3.41Å; E623-A627 PolarHBondContact O-N 3.31Å
624D84.3Confident80.6Confident85 Ų8595.9 Ų95.946%0.45549%0.493SS..Hα-helixtrans-62.4-37.8175-62.4-26.1000111.2K620 N628K620-D624 WeakPolarHBondContact O-CB 3.45Å; K620-D624 PolarHBondContact O-N 2.93Å; D624-N628 PolarHBondContact O-N 3.06Å; D624-N628 VanDerWaalsContact O-N 3.1Å
625S81.5Confident81Confident72 Ų7294.2 Ų94.250%0.50349%0.491SS..Hα-helixtrans-69.4-37.7174.2-57.50000112.4Q621 E623 E629Q621-S625 WeakPolarHBondContact O-CB 3.45Å; Q621-S625 PolarHBondContact O-N 3.4Å; Q621-S625 PolarHBondContact O-OG 3.33Å; E623-S625 VanDerWaalsContact C-N 3.31Å; E623-S625 PolarHBondContact O-N 2.88Å; S625-E629 PolarHBondContact O-N 3.21Å; S625-E629 VanDerWaalsContact O-N 3.08Å
626L83.1Confident81.1Confident102 Ų10294.7 Ų94.753%0.53449%0.493SS..Hα-helixtrans-71.8-33.2176.8-174.964.5000111.8T622 E623 E629 Q630T622-L626 VanDerWaalsContact O-CB 3.23Å; T622-L626 WeakPolarHBondContact O-CB 3.49Å; T622-L626 PolarHBondContact O-N 2.97Å; E623-L626 CarbonylContact O-C 3.55Å; E623-L626 PolarHBondContact O-N 3.16Å; L626-E629 PolarHBondContact O-N 3.48Å; L626-Q630 WeakPolarHBondContact O-CB 3.48Å; L626-Q630 VanDerWaalsContact O-CG 3.31Å; L626-Q630 WeakPolarHBondContact O-CG 3.36Å; L626-Q630 PolarHBondContact O-N 2.85Å
627A81.6Confident81Confident39 Ų3997.3 Ų97.332%0.32250%0.502SS..Hα-helixtrans-64.2-47.1172.300000110.9E623 E629 Q630 D631E623-A627 WeakPolarHBondContact O-CB 3.41Å; E623-A627 PolarHBondContact O-N 3.31Å; A627-E629 VanDerWaalsContact C-N 3.32Å; A627-E629 PolarHBondContact O-N 2.99Å; A627-Q630 CarbonylContact O-C 3.51Å; A627-Q630 WeakPolarHBondContact O-CA 3.37Å; A627-Q630 WeakPolarHBondContact O-CB 3.32Å; A627-Q630 PolarHBondContact O-N 2.91Å; A627-D631 PolarHBondContact O-N 3.33Å
628N83.3Confident81Confident112 Ų11297.7 Ų97.760%0.59951%0.506SS*.Hα-helixtrans-60.6-37.9174.2-74-20.4000112.9D624 H632D624-N628 PolarHBondContact O-N 3.06Å; D624-N628 VanDerWaalsContact O-N 3.1Å; N628-H632 VanDerWaalsContact O-CB 3.31Å; N628-H632 WeakPolarHBondContact O-CB 3.26Å; N628-H632 PolarHBondContact O-N 3.43Å
629E79.5Confident81.2Confident117 Ų11799.7 Ų99.755%0.54752%0.516SS..Hα-helixtrans-65-38.6172.1-79-86.4136.200111.9S625 L626 A627 L633S625-E629 PolarHBondContact O-N 3.21Å; S625-E629 VanDerWaalsContact O-N 3.08Å; L626-E629 PolarHBondContact O-N 3.48Å; A627-E629 VanDerWaalsContact C-N 3.32Å; A627-E629 PolarHBondContact O-N 2.99Å; E629-L633 WeakPolarHBondContact O-CB 3.31Å; E629-L633 VanDerWaalsContact O-CG 3.27Å; E629-L633 WeakPolarHBondContact O-CG 3.46Å; E629-L633 PolarHBondContact O-N 3.3Å
630Q79.3Confident81.3Confident118 Ų118100.6 Ų100.655%0.55152%0.52SS*.Hα-helixtrans-67.4-41.6175.5-76.4175.7-3.500112.4L626 A627 L633 A634L626-Q630 WeakPolarHBondContact O-CB 3.48Å; L626-Q630 VanDerWaalsContact O-CG 3.31Å; L626-Q630 WeakPolarHBondContact O-CG 3.36Å; L626-Q630 PolarHBondContact O-N 2.85Å; A627-Q630 CarbonylContact O-C 3.51Å; A627-Q630 WeakPolarHBondContact O-CA 3.37Å; A627-Q630 WeakPolarHBondContact O-CB 3.32Å; A627-Q630 PolarHBondContact O-N 2.91Å; Q630-L633 PolarHBondContact O-N 2.96Å; Q630-A634 WeakPolarHBondContact O-CB 3.48Å; Q630-A634 PolarHBondContact O-N 3.41Å
631D83.4Confident81.2Confident110 Ų110100.8 Ų100.859%0.58852%0.521SS*.Hα-helixtrans-65.6-39.8176-70.3-21.3000111.5A627 A634 S635A627-D631 PolarHBondContact O-N 3.33Å; D631-A634 PolarHBondContact O-N 3.02Å; D631-S635 WeakPolarHBondContact O-CB 3.39Å; D631-S635 PolarHBondContact O-N 2.66Å
632H80.7Confident81.5Confident93 Ų9399.5 Ų99.543%0.43152%0.518SS..Hα-helixtrans-70.2-32.4174.7178.1-123.7000112.8N628 K636N628-H632 VanDerWaalsContact O-CB 3.31Å; N628-H632 WeakPolarHBondContact O-CB 3.26Å; N628-H632 PolarHBondContact O-N 3.43Å; H632-K636 PolarHBondContact CE1-NZ 3.44Å; H632-K636 VanDerWaalsContact CE1-NZ 3.34Å; H632-K636 WeakPolarHBondContact NE2-CE 3.45Å; H632-K636 WeakPolarHBondContact O-CG 3.46Å; H632-K636 PolarHBondContact O-N 3.44Å; H632-K636 VanDerWaalsContact O-N 3.09Å
633L78.9Confident81.7Confident105 Ų105100 Ų10055%0.5552%0.521SS..Hα-helixtrans-68.9-41.2170.2-78.2169000111.8E629 Q630 K636 E637E629-L633 WeakPolarHBondContact O-CB 3.31Å; E629-L633 VanDerWaalsContact O-CG 3.27Å; E629-L633 WeakPolarHBondContact O-CG 3.46Å; E629-L633 PolarHBondContact O-N 3.3Å; Q630-L633 PolarHBondContact O-N 2.96Å; L633-K636 PolarHBondContact O-N 2.89Å; L633-E637 WeakPolarHBondContact O-CB 3.43Å; L633-E637 PolarHBondContact O-N 3.41Å
634A80.4Confident81.7Confident53 Ų53100.3 Ų100.344%0.43852%0.522SS..Hα-helixtrans-62.3-42.817500000111.6Q630 D631 K636 E637 E638Q630-A634 WeakPolarHBondContact O-CB 3.48Å; Q630-A634 PolarHBondContact O-N 3.41Å; D631-A634 PolarHBondContact O-N 3.02Å; A634-K636 VanDerWaalsContact C-N 3.34Å; A634-K636 PolarHBondContact O-N 3.23Å; A634-E637 PolarHBondContact O-N 2.9Å; A634-E638 PolarHBondContact O-N 3.25Å
635S86.3Confident81.9Confident55 Ų55100.2 Ų100.239%0.38552%0.522SS..Hα-helixtrans-60.3-40.3173.3174.70000112.4D631 E638 E639D631-S635 WeakPolarHBondContact O-CB 3.39Å; D631-S635 PolarHBondContact O-N 2.66Å; S635-E638 PolarHBondContact O-N 2.74Å; S635-E639 PolarHBondContact O-N 3.3Å
636K81.6Confident82.1Confident105 Ų105102.8 Ų102.846%0.45753%0.527SS..Hα-helixtrans-71.5-29.9174.6-76.6-178.9174.5-179.10113.9H632 L633 A634 L640H632-K636 PolarHBondContact CE1-NZ 3.44Å; H632-K636 VanDerWaalsContact CE1-NZ 3.34Å; H632-K636 WeakPolarHBondContact NE2-CE 3.45Å; H632-K636 WeakPolarHBondContact O-CG 3.46Å; H632-K636 PolarHBondContact O-N 3.44Å; H632-K636 VanDerWaalsContact O-N 3.09Å; L633-K636 PolarHBondContact O-N 2.89Å; A634-K636 VanDerWaalsContact C-N 3.34Å; A634-K636 PolarHBondContact O-N 3.23Å; K636-L640 VanDerWaalsContact O-CB 3.29Å; K636-L640 WeakPolarHBondContact O-CB 3.46Å; K636-L640 PolarHBondContact O-N 3.42Å
637E77.2Confident81.7Confident146 Ų146102.9 Ų102.968%0.68253%0.528SS*.Hα-helixtrans-69.4-36.2172.9-169.3172.4-175.800110.9L633 A634 K641L633-E637 WeakPolarHBondContact O-CB 3.43Å; L633-E637 PolarHBondContact O-N 3.41Å; A634-E637 PolarHBondContact O-N 2.9Å; E637-K641 WeakPolarHBondContact O-CB 3.34Å; E637-K641 PolarHBondContact O-N 3.24Å
638E83.6Confident82Confident132 Ų132108.5 Ų108.562%0.61755%0.546SS*.Hα-helixtrans-66.2-48.8171.7-169.7164-144.800112A634 S635 L640 K641 D642A634-E638 PolarHBondContact O-N 3.25Å; S635-E638 PolarHBondContact O-N 2.74Å; E638-L640 VanDerWaalsContact C-N 3.31Å; E638-L640 PolarHBondContact O-N 2.95Å; E638-K641 WeakPolarHBondContact O-CB 3.38Å; E638-K641 PolarHBondContact O-N 3.03Å; E638-K641 VanDerWaalsContact O-N 3.08Å; E638-D642 PolarHBondContact O-N 3.01Å
639E81.8Confident82.1Confident120 Ų120108.3 Ų108.356%0.56154%0.544SS*.Hα-helixtrans-56.8-42.6173.2-74.1-177.5169.900112.3S635 K641 D642 V643S635-E639 PolarHBondContact O-N 3.3Å; E639-K641 VanDerWaalsContact C-N 3.31Å; E639-K641 PolarHBondContact O-N 2.91Å; E639-D642 PolarHBondContact O-N 3.32Å; E639-V643 WeakPolarHBondContact O-CG2 3.28Å; E639-V643 PolarHBondContact O-N 2.92Å
640L82.1Confident82.2Confident100 Ų100108.3 Ų108.352%0.52455%0.547SS..Hα-helixtrans-64.6-36.5177.4-177.263.3000111.8K636 E638 V643 Q644K636-L640 VanDerWaalsContact O-CB 3.29Å; K636-L640 WeakPolarHBondContact O-CB 3.46Å; K636-L640 PolarHBondContact O-N 3.42Å; E638-L640 VanDerWaalsContact C-N 3.31Å; E638-L640 PolarHBondContact O-N 2.95Å; L640-V643 PolarHBondContact O-N 2.84Å; L640-Q644 WeakPolarHBondContact O-CG 3.45Å; L640-Q644 PolarHBondContact O-N 3.02Å
641K83.8Confident82.4Confident132 Ų132108.7 Ų108.757%0.57455%0.547SS*.Hα-helixtrans-68.9-38.8177.4-167.7177.1-175.7179.70111.7E637 E638 E639 Q644 N645E637-K641 WeakPolarHBondContact O-CB 3.34Å; E637-K641 PolarHBondContact O-N 3.24Å; E638-K641 WeakPolarHBondContact O-CB 3.38Å; E638-K641 PolarHBondContact O-N 3.03Å; E638-K641 VanDerWaalsContact O-N 3.08Å; E639-K641 VanDerWaalsContact C-N 3.31Å; E639-K641 PolarHBondContact O-N 2.91Å; K641-Q644 PolarHBondContact O-N 3.08Å; K641-N645 WeakPolarHBondContact O-CB 3.32Å; K641-N645 PolarHBondContact O-N 2.82Å; K641-N645 PolarHBondContact O-ND2 2.84Å
642D84.9Confident82.3Confident94 Ų94105.4 Ų105.450%0.50354%0.536SS..Hα-helixtrans-67.3-40173-80-11.5000112.2E638 E639 Q644 N645 M646E638-D642 PolarHBondContact O-N 3.01Å; E639-D642 PolarHBondContact O-N 3.32Å; D642-Q644 VanDerWaalsContact C-N 3.32Å; D642-Q644 PolarHBondContact O-N 3.42Å; D642-N645 PolarHBondContact O-N 3.3Å; D642-M646 WeakPolarHBondContact O-CB 3.38Å; D642-M646 WeakPolarHBondContact O-CG 3.32Å; D642-M646 PolarHBondContact O-N 3.23Å
643V80.8Confident82.5Confident97 Ų97105 Ų10559%0.58853%0.533SS*.Hα-helixtrans-62-39171.3171.20000111.5E639 L640 N647E639-V643 WeakPolarHBondContact O-CG2 3.28Å; E639-V643 PolarHBondContact O-N 2.92Å; L640-V643 PolarHBondContact O-N 2.84Å; V643-N647 WeakPolarHBondContact O-CB 3.36Å; V643-N647 PolarHBondContact O-N 3.38Å
644Q77.9Confident82.5Confident120 Ų120104.1 Ų104.156%0.56153%0.532SS*.Hα-helixtrans-65.8-42.5173.7-76.3179.13.900112.5L640 K641 D642 N647 F648L640-Q644 WeakPolarHBondContact O-CG 3.45Å; L640-Q644 PolarHBondContact O-N 3.02Å; K641-Q644 PolarHBondContact O-N 3.08Å; D642-Q644 VanDerWaalsContact C-N 3.32Å; D642-Q644 PolarHBondContact O-N 3.42Å; Q644-N647 PolarHBondContact O-N 2.95Å; Q644-F648 WeakPolarHBondContact O-CB 3.19Å; Q644-F648 PolarHBondContact O-N 3.37Å
645N87.1Confident82.5Confident83 Ų83107.6 Ų107.644%0.44454%0.54SS..Hα-helixtrans-62.2-44.1175.6-71.5-29.3000111.5K641 D642 N647 F648 L649K641-N645 WeakPolarHBondContact O-CB 3.32Å; K641-N645 PolarHBondContact O-N 2.82Å; K641-N645 PolarHBondContact O-ND2 2.84Å; D642-N645 PolarHBondContact O-N 3.3Å; N645-N647 VanDerWaalsContact C-N 3.35Å; N645-F648 WeakPolarHBondContact O-CB 3.18Å; N645-F648 PolarHBondContact O-N 3.1Å; N645-L649 WeakPolarHBondContact O-CG 3.38Å; N645-L649 PolarHBondContact O-N 3.42Å
646M86.5Confident82.4Confident126 Ų126110.8 Ų110.862%0.62155%0.547SS*.Hα-helixtrans-65.4-36.8175-72-61.6-68.500112.2D642 L649 L650D642-M646 WeakPolarHBondContact O-CB 3.38Å; D642-M646 WeakPolarHBondContact O-CG 3.32Å; D642-M646 PolarHBondContact O-N 3.23Å; M646-L649 PolarHBondContact O-N 3.3Å; M646-L649 HydrophobicContact SD-CD1 4.25Å; M646-L650 VanDerWaalsContact O-CB 3.3Å; M646-L650 WeakPolarHBondContact O-CB 3.42Å; M646-L650 PolarHBondContact O-N 2.92Å
647N74.3Confident82.4Confident104 Ų104110.7 Ų110.756%0.55655%0.55SS**Hα-helixtrans-65.8-39.5173.6-162.8-87.8000111.7V643 Q644 N645 L650 K651V643-N647 WeakPolarHBondContact O-CB 3.36Å; V643-N647 PolarHBondContact O-N 3.38Å; Q644-N647 PolarHBondContact O-N 2.95Å; N645-N647 VanDerWaalsContact C-N 3.35Å; N647-L650 PolarHBondContact O-N 3.33Å; N647-K651 WeakPolarHBondContact O-CB 3.37Å; N647-K651 PolarHBondContact O-N 2.99Å
648F89Confident82.3Confident156 Ų156109 Ų10968%0.68454%0.542SS*.Hα-helixtrans-64.1-45.2174.9-175.3-94.7000112Q644 N645 K651 A652Q644-F648 WeakPolarHBondContact O-CB 3.19Å; Q644-F648 PolarHBondContact O-N 3.37Å; N645-F648 WeakPolarHBondContact O-CB 3.18Å; N645-F648 PolarHBondContact O-N 3.1Å; F648-K651 PolarHBondContact O-N 3.06Å; F648-A652 WeakPolarHBondContact O-CB 3.37Å; F648-A652 PolarHBondContact O-N 3.12Å
649L85.9Confident82Confident108 Ų108105.3 Ų105.357%0.56554%0.535SS*.Hα-helixtrans-62.1-45.5174.8-75.3167.2000112.1N645 M646 K651 A652 E653N645-L649 WeakPolarHBondContact O-CG 3.38Å; N645-L649 PolarHBondContact O-N 3.42Å; M646-L649 PolarHBondContact O-N 3.3Å; M646-L649 HydrophobicContact SD-CD1 4.25Å; L649-K651 VanDerWaalsContact C-N 3.31Å; L649-K651 PolarHBondContact O-N 3.48Å; L649-A652 PolarHBondContact O-N 2.99Å; L649-E653 PolarHBondContact O-N 2.93Å
650L81.4Confident81.8Confident117 Ų117104.4 Ų104.461%0.61353%0.533SS*.Hα-helixtrans-63-39.2176.9-171.267.8000111.4M646 N647 E653 V654M646-L650 VanDerWaalsContact O-CB 3.3Å; M646-L650 WeakPolarHBondContact O-CB 3.42Å; M646-L650 PolarHBondContact O-N 2.92Å; N647-L650 PolarHBondContact O-N 3.33Å; L650-E653 PolarHBondContact O-N 2.94Å; L650-V654 WeakPolarHBondContact O-CB 3.36Å; L650-V654 VanDerWaalsContact O-CG2 3.3Å; L650-V654 WeakPolarHBondContact O-CG2 3.42Å; L650-V654 PolarHBondContact O-N 3.21Å
651K83.6Confident81.5Confident126 Ų126101.8 Ų101.855%0.54853%0.526SS..Hα-helixtrans-66.3-38.1175.7-171.7174.2-176.7177.40112.2N647 F648 L649 Q655N647-K651 WeakPolarHBondContact O-CB 3.37Å; N647-K651 PolarHBondContact O-N 2.99Å; F648-K651 PolarHBondContact O-N 3.06Å; L649-K651 VanDerWaalsContact C-N 3.31Å; L649-K651 PolarHBondContact O-N 3.48Å; K651-Q655 WeakPolarHBondContact O-CB 3.43Å; K651-Q655 WeakPolarHBondContact O-CG 3.1Å; K651-Q655 PolarHBondContact O-N 3.46Å
652A81.3Confident81.1Confident42 Ų42100.1 Ų100.135%0.34752%0.524SS..Hα-helixtrans-65.6-42.2173.800000111.9F648 L649 Q655 K656F648-A652 WeakPolarHBondContact O-CB 3.37Å; F648-A652 PolarHBondContact O-N 3.12Å; L649-A652 PolarHBondContact O-N 2.99Å; A652-Q655 PolarHBondContact O-N 2.88Å; A652-K656 WeakPolarHBondContact O-CB 3.35Å; A652-K656 PolarHBondContact O-N 2.83Å
653E83Confident80.9Confident83 Ų83101.9 Ų101.939%0.38853%0.529SS..Hα-helixtrans-69.7-36.8177.2-164.160.3-151.500111.8L649 L650 Q655 K656 L657L649-E653 PolarHBondContact O-N 2.93Å; L650-E653 PolarHBondContact O-N 2.94Å; E653-Q655 PolarHBondContact O-N 3.31Å; E653-K656 PolarHBondContact O-N 3.25Å; E653-K656 IonicContact OE1-NZ 2.76Å; E653-K656 PolarHBondContact OE1-NZ 3.49Å; E653-K656 IonicContact OE2-NZ 3.74Å; E653-K656 PolarHBondContact OE2-NZ 3.34Å; E653-L657 WeakPolarHBondContact O-CB 3.46Å; E653-L657 WeakPolarHBondContact O-CG 3.49Å; E653-L657 PolarHBondContact O-N 2.91Å
654V79.1Confident80.5Confident87 Ų87103.6 Ų103.653%0.52753%0.53SS..Hα-helixtrans-61.9-41.5170.6168.50000111.5L650 K656 L657 Q658L650-V654 WeakPolarHBondContact O-CB 3.36Å; L650-V654 VanDerWaalsContact O-CG2 3.3Å; L650-V654 WeakPolarHBondContact O-CG2 3.42Å; L650-V654 PolarHBondContact O-N 3.21Å; V654-K656 VanDerWaalsContact C-N 3.34Å; V654-L657 PolarHBondContact O-N 3.28Å; V654-Q658 WeakPolarHBondContact O-CB 3.44Å; V654-Q658 PolarHBondContact O-N 2.89Å
655Q80.4Confident80.4Confident127 Ų127100.7 Ų100.759%0.59353%0.527SS*.Hα-helixtrans-64.6-37.5174.1-77.6179.6-27.700112.4K651 A652 E653 Q658 A659K651-Q655 WeakPolarHBondContact O-CB 3.43Å; K651-Q655 WeakPolarHBondContact O-CG 3.1Å; K651-Q655 PolarHBondContact O-N 3.46Å; A652-Q655 PolarHBondContact O-N 2.88Å; E653-Q655 PolarHBondContact O-N 3.31Å; Q655-Q658 PolarHBondContact O-N 2.9Å; Q655-A659 WeakPolarHBondContact O-CB 3.4Å; Q655-A659 PolarHBondContact O-N 2.83Å
656K85.2Confident79.9Confident121 Ų12199.6 Ų99.653%0.52653%0.529SS..Hα-helixtrans-67.9-42.1176.4178.4161151.4-99.70112.4A652 E653 V654 A659 L660A652-K656 WeakPolarHBondContact O-CB 3.35Å; A652-K656 PolarHBondContact O-N 2.83Å; E653-K656 PolarHBondContact O-N 3.25Å; E653-K656 IonicContact OE1-NZ 2.76Å; E653-K656 PolarHBondContact OE1-NZ 3.49Å; E653-K656 IonicContact OE2-NZ 3.74Å; E653-K656 PolarHBondContact OE2-NZ 3.34Å; V654-K656 VanDerWaalsContact C-N 3.34Å; K656-A659 PolarHBondContact O-N 2.85Å; K656-L660 WeakPolarHBondContact O-CB 3.12Å; K656-L660 PolarHBondContact O-N 3.47Å
657L80.8Confident79.4Confident103 Ų10397.3 Ų97.354%0.53952%0.523SS..Hα-helixtrans-64.8-39.3172.2-70.4171.1000111.9E653 V654 L660 A661E653-L657 WeakPolarHBondContact O-CB 3.46Å; E653-L657 WeakPolarHBondContact O-CG 3.49Å; E653-L657 PolarHBondContact O-N 2.91Å; V654-L657 PolarHBondContact O-N 3.28Å; L657-L660 PolarHBondContact O-N 3.45Å; L657-A661 WeakPolarHBondContact O-CB 3.45Å; L657-A661 PolarHBondContact O-N 3.1Å
658Q75.1Confident79.3Confident110 Ų11095.2 Ų95.251%0.51452%0.52SS..Hα-helixtrans-65-39.7174.6-173.764.560.700112.1V654 Q655 N662V654-Q658 WeakPolarHBondContact O-CB 3.44Å; V654-Q658 PolarHBondContact O-N 2.89Å; Q655-Q658 PolarHBondContact O-N 2.9Å; Q658-N662 PolarHBondContact NE2-OD1 3.13Å; Q658-N662 WeakPolarHBondContact O-CB 3.41Å; Q658-N662 PolarHBondContact O-N 3.32Å; Q658-N662 PolarHBondContact O-ND2 3.44Å; Q658-N662 PolarHBondContact O-OD1 2.9Å
659A77.4Confident78.9Confident55 Ų5592.2 Ų92.246%0.45551%0.508SS..Hα-helixtrans-63.3-45.4174.600000111.4Q655 K656 A661 N662 E663Q655-A659 WeakPolarHBondContact O-CB 3.4Å; Q655-A659 PolarHBondContact O-N 2.83Å; K656-A659 PolarHBondContact O-N 2.85Å; A659-A661 PolarHBondContact O-N 3.49Å; A659-N662 WeakPolarHBondContact O-CB 3.49Å; A659-N662 PolarHBondContact O-N 2.93Å; A659-E663 WeakPolarHBondContact O-CB 3.26Å; A659-E663 PolarHBondContact O-N 3.34Å
660L78.9Confident78.4Confident101 Ų10191 Ų9153%0.52950%0.499SS..Hα-helixtrans-65.7-37.6179.1-165.1145.3000112.2K656 L657 E663 Q664K656-L660 WeakPolarHBondContact O-CB 3.12Å; K656-L660 PolarHBondContact O-N 3.47Å; L657-L660 PolarHBondContact O-N 3.45Å; L660-E663 PolarHBondContact O-N 3.14Å; L660-Q664 WeakPolarHBondContact O-CB 3.25Å; L660-Q664 PolarHBondContact O-N 3.38Å
661A75.8Confident78.1Confident46 Ų4689.2 Ų89.238%0.3849%0.493SS..Hα-helixtrans-65-39.5171.700000112.5L657 A659 Q664 A665L657-A661 WeakPolarHBondContact O-CB 3.45Å; L657-A661 PolarHBondContact O-N 3.1Å; A659-A661 PolarHBondContact O-N 3.49Å; A661-Q664 PolarHBondContact O-N 2.93Å; A661-A665 WeakPolarHBondContact O-CB 3.35Å; A661-A665 PolarHBondContact O-N 3Å
662N75.7Confident77.8Confident96 Ų9687.1 Ų87.151%0.51349%0.485SS..Hα-helixtrans-67.6-38.1175.9-68.1-10.9000111.9Q658 A659 A665 A666Q658-N662 PolarHBondContact NE2-OD1 3.13Å; Q658-N662 WeakPolarHBondContact O-CB 3.41Å; Q658-N662 PolarHBondContact O-N 3.32Å; Q658-N662 PolarHBondContact O-ND2 3.44Å; Q658-N662 PolarHBondContact O-OD1 2.9Å; A659-N662 WeakPolarHBondContact O-CB 3.49Å; A659-N662 PolarHBondContact O-N 2.93Å; N662-A665 PolarHBondContact O-N 2.93Å; N662-A666 WeakPolarHBondContact O-CB 3.38Å; N662-A666 PolarHBondContact O-N 2.98Å
663E79.6Confident77.7Confident132 Ų13290.2 Ų90.262%0.61749%0.491SS*.Hα-helixtrans-68-38.8174.8-170.8174.7-174.100111.6A659 L660 A665 A666 T667A659-E663 WeakPolarHBondContact O-CB 3.26Å; A659-E663 PolarHBondContact O-N 3.34Å; L660-E663 PolarHBondContact O-N 3.14Å; E663-A665 VanDerWaalsContact C-N 3.34Å; E663-A665 PolarHBondContact O-N 3.4Å; E663-A666 PolarHBondContact O-N 3.23Å; E663-T667 WeakPolarHBondContact O-CG2 3.39Å; E663-T667 PolarHBondContact O-N 2.99Å; E663-T667 PolarHBondContact O-OG1 3.39Å
664Q73.4Confident77.5Confident132 Ų13291.1 Ų91.162%0.61750%0.496SS*.Hα-helixtrans-65.1-36.5172.6-165.7171.211.400112.2L660 A661 T667 A668L660-Q664 WeakPolarHBondContact O-CB 3.25Å; L660-Q664 PolarHBondContact O-N 3.38Å; A661-Q664 PolarHBondContact O-N 2.93Å; Q664-T667 WeakPolarHBondContact CA-OG1 3.07Å; Q664-T667 PolarHBondContact O-OG1 3.45Å; Q664-T667 VanDerWaalsContact O-OG1 3.05Å; Q664-A668 VanDerWaalsContact O-CB 3.31Å; Q664-A668 WeakPolarHBondContact O-CB 3.31Å; Q664-A668 PolarHBondContact O-N 3.45Å
665A74.6Confident77.3Confident59 Ų5992 Ų9249%0.48849%0.494SS..Hα-helixtrans-69.4-38.4172.600000112.6A661 N662 E663 H669A661-A665 WeakPolarHBondContact O-CB 3.35Å; A661-A665 PolarHBondContact O-N 3Å; N662-A665 PolarHBondContact O-N 2.93Å; E663-A665 VanDerWaalsContact C-N 3.34Å; E663-A665 PolarHBondContact O-N 3.4Å; A665-H669 WeakPolarHBondContact O-CB 3.47Å; A665-H669 PolarHBondContact O-N 2.91Å
666A76.2Confident77.3Confident60 Ų6091.2 Ų91.250%0.49649%0.489SS..Hα-helixtrans-67.1-4317700000112.2N662 E663 H669 E670N662-A666 WeakPolarHBondContact O-CB 3.38Å; N662-A666 PolarHBondContact O-N 2.98Å; E663-A666 PolarHBondContact O-N 3.23Å; A666-H669 PolarHBondContact O-N 2.85Å; A666-E670 PolarHBondContact O-N 3.33Å
667T76.9Confident77.1Confident79 Ų7988 Ų8849%0.48548%0.482SS..Hα-helixtrans-66.1-40.5175.148.20000111.9E663 Q664 H669 E670 V671E663-T667 WeakPolarHBondContact O-CG2 3.39Å; E663-T667 PolarHBondContact O-N 2.99Å; E663-T667 PolarHBondContact O-OG1 3.39Å; Q664-T667 WeakPolarHBondContact CA-OG1 3.07Å; Q664-T667 PolarHBondContact O-OG1 3.45Å; Q664-T667 VanDerWaalsContact O-OG1 3.05Å; T667-H669 VanDerWaalsContact C-N 3.34Å; T667-H669 PolarHBondContact O-N 3.27Å; T667-E670 PolarHBondContact O-N 3.19Å; T667-V671 WeakPolarHBondContact O-CG2 3.44Å; T667-V671 PolarHBondContact O-N 3.48Å
668A72.8Confident77.1Confident59 Ų5986.7 Ų86.749%0.48848%0.475SS..Hα-helixtrans-60.4-41.2172.400000112.6Q664 V671 E672Q664-A668 VanDerWaalsContact O-CB 3.31Å; Q664-A668 WeakPolarHBondContact O-CB 3.31Å; Q664-A668 PolarHBondContact O-N 3.45Å; A668-V671 PolarHBondContact O-N 2.94Å; A668-E672 PolarHBondContact O-N 2.78Å
669H79Confident77.3Confident94 Ų9486 Ų8644%0.43547%0.471SS..Hα-helixtrans-67.7-38.5177.3-177.1-83.4000112.7A665 A666 T667 E672 K673A665-H669 WeakPolarHBondContact O-CB 3.47Å; A665-H669 PolarHBondContact O-N 2.91Å; A666-H669 PolarHBondContact O-N 2.85Å; T667-H669 VanDerWaalsContact C-N 3.34Å; T667-H669 PolarHBondContact O-N 3.27Å; H669-E672 PolarHBondContact O-N 3.26Å; H669-K673 WeakPolarHBondContact O-CB 3.46Å; H669-K673 PolarHBondContact O-N 3.3Å
670E76.6Confident77.6Confident82 Ų8288.2 Ų88.238%0.38348%0.479SS..Hα-helixtrans-70.9-33.1175.1-16360.7-151.100111.6A666 T667 K673 M674A666-E670 PolarHBondContact O-N 3.33Å; T667-E670 PolarHBondContact O-N 3.19Å; E670-K673 PolarHBondContact O-N 2.96Å; E670-K673 IonicContact OE1-NZ 2.93Å; E670-K673 PolarHBondContact OE1-NZ 3.11Å; E670-K673 WeakPolarHBondContact OE2-CD 3.26Å; E670-K673 IonicContact OE2-NZ 2.83Å; E670-K673 PolarHBondContact OE2-NZ 2.95Å; E670-M674 WeakPolarHBondContact O-CB 3.46Å; E670-M674 WeakPolarHBondContact O-CG 3.33Å; E670-M674 PolarHBondContact O-N 3.5Å
671V74.3Confident77.7Confident79 Ų7989.5 Ų89.548%0.47948%0.48SS..Hα-helixtrans-63.7-45.2168.5169.50000111.5T667 A668 K673 M674 Q675T667-V671 WeakPolarHBondContact O-CG2 3.44Å; T667-V671 PolarHBondContact O-N 3.48Å; A668-V671 PolarHBondContact O-N 2.94Å; V671-K673 VanDerWaalsContact C-N 3.29Å; V671-K673 PolarHBondContact O-N 3.49Å; V671-M674 HydrophobicContact CG2-CE 4.03Å; V671-M674 PolarHBondContact O-N 2.99Å; V671-Q675 WeakPolarHBondContact O-CB 3.34Å; V671-Q675 PolarHBondContact O-N 3.41Å
672E78.7Confident77.8Confident83 Ų8391.9 Ų91.939%0.38848%0.483SS..Hα-helixtrans-61.3-38175.7-164.5-156.9153.500111.9A668 H669 Q675 K676A668-E672 PolarHBondContact O-N 2.78Å; H669-E672 PolarHBondContact O-N 3.26Å; E672-Q675 WeakPolarHBondContact O-CB 3.39Å; E672-Q675 PolarHBondContact O-N 2.96Å; E672-K676 WeakPolarHBondContact O-CB 3.4Å; E672-K676 WeakPolarHBondContact O-CG 3.47Å; E672-K676 PolarHBondContact O-N 3.41Å; E672-K676 VanDerWaalsContact OE1-CE 3.29Å; E672-K676 WeakPolarHBondContact OE1-CE 3.45Å; E672-K676 IonicContact OE1-NZ 2.69Å; E672-K676 PolarHBondContact OE1-NZ 2.97Å
673K79.1Confident78.1Confident107 Ų10791 Ų9147%0.46548%0.479SS..Hα-helixtrans-68.8-39.2175.4176.8171157.6-118.50112.3H669 E670 V671 S677H669-K673 WeakPolarHBondContact O-CB 3.46Å; H669-K673 PolarHBondContact O-N 3.3Å; E670-K673 PolarHBondContact O-N 2.96Å; E670-K673 IonicContact OE1-NZ 2.93Å; E670-K673 PolarHBondContact OE1-NZ 3.11Å; E670-K673 WeakPolarHBondContact OE2-CD 3.26Å; E670-K673 IonicContact OE2-NZ 2.83Å; E670-K673 PolarHBondContact OE2-NZ 2.95Å; V671-K673 VanDerWaalsContact C-N 3.29Å; V671-K673 PolarHBondContact O-N 3.49Å; K673-S677 WeakPolarHBondContact O-CB 3.29Å; K673-S677 PolarHBondContact O-N 2.98Å
674M77.4Confident78.4Confident101 Ų10191.4 Ų91.450%0.49848%0.478SS..Hα-helixtrans-64.6-44.9170-74.2-170.8-66.100111.3E670 V671 K676 S677 I678E670-M674 WeakPolarHBondContact O-CB 3.46Å; E670-M674 WeakPolarHBondContact O-CG 3.33Å; E670-M674 PolarHBondContact O-N 3.5Å; V671-M674 HydrophobicContact CG2-CE 4.03Å; V671-M674 PolarHBondContact O-N 2.99Å; M674-K676 VanDerWaalsContact C-N 3.34Å; M674-K676 PolarHBondContact O-N 3.31Å; M674-S677 CarbonylContact O-C 3.59Å; M674-S677 PolarHBondContact O-N 3.18Å; M674-S677 VanDerWaalsContact O-N 3.13Å; M674-I678 WeakPolarHBondContact O-CB 3.35Å; M674-I678 VanDerWaalsContact O-CG1 3.28Å; M674-I678 WeakPolarHBondContact O-CG1 3.26Å; M674-I678 PolarHBondContact O-N 2.97Å
675Q75.7Confident78.8Confident106 Ų10689.3 Ų89.350%0.49547%0.47SS..Hα-helixtrans-54.7-48.9176-16582.12.900110.9V671 E672 I678 H679V671-Q675 WeakPolarHBondContact O-CB 3.34Å; V671-Q675 PolarHBondContact O-N 3.41Å; E672-Q675 WeakPolarHBondContact O-CB 3.39Å; E672-Q675 PolarHBondContact O-N 2.96Å; Q675-I678 WeakPolarHBondContact O-CB 3.43Å; Q675-I678 PolarHBondContact O-N 3.36Å; Q675-H679 PolarHBondContact O-N 2.95Å; Q675-H679 PolarHBondContact O-ND1 3.38Å
676K80.1Confident79.3Confident110 Ų11092.4 Ų92.448%0.47847%0.469SS..Hα-helixtrans-65.8-38.7176.4-74.2172.5175.3175.50112.7E672 M674 I678 H679 V680E672-K676 WeakPolarHBondContact O-CB 3.4Å; E672-K676 WeakPolarHBondContact O-CG 3.47Å; E672-K676 PolarHBondContact O-N 3.41Å; E672-K676 VanDerWaalsContact OE1-CE 3.29Å; E672-K676 WeakPolarHBondContact OE1-CE 3.45Å; E672-K676 IonicContact OE1-NZ 2.69Å; E672-K676 PolarHBondContact OE1-NZ 2.97Å; M674-K676 VanDerWaalsContact C-N 3.34Å; M674-K676 PolarHBondContact O-N 3.31Å; K676-I678 VanDerWaalsContact C-N 3.27Å; K676-I678 PolarHBondContact O-N 3.03Å; K676-H679 PolarHBondContact O-N 3.34Å; K676-V680 WeakPolarHBondContact O-CG2 3.23Å; K676-V680 PolarHBondContact O-N 3.29Å
677S81.6Confident79.7Confident53 Ų5394 Ų9437%0.37147%0.469SS..Hα-helixtrans-66.6-28.7172.7-179.50000112.8K673 M674 K681K673-S677 WeakPolarHBondContact O-CB 3.29Å; K673-S677 PolarHBondContact O-N 2.98Å; M674-S677 CarbonylContact O-C 3.59Å; M674-S677 PolarHBondContact O-N 3.18Å; M674-S677 VanDerWaalsContact O-N 3.13Å; S677-K681 WeakPolarHBondContact O-CB 3.39Å; S677-K681 WeakPolarHBondContact O-CD 3.3Å; S677-K681 WeakPolarHBondContact O-CG 3.42Å; S677-K681 PolarHBondContact O-N 3.04Å
678I80.1Confident80.1Confident77 Ų7794.6 Ų94.640%0.39547%0.469SS..Hα-helixtrans-72.5-49.2175.2-72.3162.9000109.1M674 Q675 K676 V680 K681 E682M674-I678 WeakPolarHBondContact O-CB 3.35Å; M674-I678 VanDerWaalsContact O-CG1 3.28Å; M674-I678 WeakPolarHBondContact O-CG1 3.26Å; M674-I678 PolarHBondContact O-N 2.97Å; Q675-I678 WeakPolarHBondContact O-CB 3.43Å; Q675-I678 PolarHBondContact O-N 3.36Å; K676-I678 VanDerWaalsContact C-N 3.27Å; K676-I678 PolarHBondContact O-N 3.03Å; I678-V680 PolarHBondContact O-N 2.98Å; I678-K681 CarbonylContact O-C 3.59Å; I678-K681 WeakPolarHBondContact O-CA 3.45Å; I678-K681 WeakPolarHBondContact O-CB 3.43Å; I678-K681 PolarHBondContact O-N 2.95Å; I678-E682 HydrophobicContact CG2-CG 4.26Å; I678-E682 WeakPolarHBondContact CG2-OE1 3.4Å; I678-E682 WeakPolarHBondContact CG2-OE2 3.39Å; I678-E682 WeakPolarHBondContact O-CG 3.37Å; I678-E682 PolarHBondContact O-N 3.5Å
679H79.3Confident80.4Confident95 Ų9596.9 Ų96.944%0.4447%0.469SS..Hα-helixtrans-58-45176.9-73.456.8000112Q675 K676 K681 E682 D683Q675-H679 PolarHBondContact O-N 2.95Å; Q675-H679 PolarHBondContact O-ND1 3.38Å; K676-H679 PolarHBondContact O-N 3.34Å; H679-K681 VanDerWaalsContact C-N 3.27Å; H679-K681 PolarHBondContact O-N 3.14Å; H679-E682 PolarHBondContact O-N 3.45Å; H679-E682 VanDerWaalsContact O-N 3.16Å; H679-D683 PolarHBondContact O-N 2.81Å
680V84.6Confident80.6Confident102 Ų10297.5 Ų97.562%0.61847%0.473SS*.Hα-helixtrans-64.8-30.2175.8171.80000112.4K676 I678 K684K676-V680 WeakPolarHBondContact O-CG2 3.23Å; K676-V680 PolarHBondContact O-N 3.29Å; I678-V680 PolarHBondContact O-N 2.98Å; V680-K684 WeakPolarHBondContact O-CB 3.48Å; V680-K684 PolarHBondContact O-N 3.35Å
681K79.6Confident80.9Confident128 Ų12899 Ų9956%0.55748%0.479SS*.Hα-helixtrans-73.8-39.7172.3-77.4168.7-177.4172.80111.3S677 I678 H679 K684 I685S677-K681 WeakPolarHBondContact O-CB 3.39Å; S677-K681 WeakPolarHBondContact O-CD 3.3Å; S677-K681 WeakPolarHBondContact O-CG 3.42Å; S677-K681 PolarHBondContact O-N 3.04Å; I678-K681 CarbonylContact O-C 3.59Å; I678-K681 WeakPolarHBondContact O-CA 3.45Å; I678-K681 WeakPolarHBondContact O-CB 3.43Å; I678-K681 PolarHBondContact O-N 2.95Å; H679-K681 VanDerWaalsContact C-N 3.27Å; H679-K681 PolarHBondContact O-N 3.14Å; K681-K684 CarbonylContact O-C 3.59Å; K681-K684 PolarHBondContact O-N 3.27Å; K681-I685 WeakPolarHBondContact O-CB 3.33Å; K681-I685 WeakPolarHBondContact O-CD1 3.44Å; K681-I685 WeakPolarHBondContact O-CG1 3.41Å; K681-I685 PolarHBondContact O-N 3.19Å
682E78.4Confident81.4Confident95 Ų95100.4 Ų100.444%0.44448%0.484SS..Hα-helixtrans-68.3-42.5178.4-72.6166.1154.600112I678 H679 K684 I685 R686I678-E682 HydrophobicContact CG2-CG 4.26Å; I678-E682 WeakPolarHBondContact CG2-OE1 3.4Å; I678-E682 WeakPolarHBondContact CG2-OE2 3.39Å; I678-E682 WeakPolarHBondContact O-CG 3.37Å; I678-E682 PolarHBondContact O-N 3.5Å; H679-E682 PolarHBondContact O-N 3.45Å; H679-E682 VanDerWaalsContact O-N 3.16Å; E682-K684 VanDerWaalsContact C-N 3.32Å; E682-K684 PolarHBondContact O-N 3.11Å; E682-I685 PolarHBondContact O-N 3.33Å; E682-R686 WeakPolarHBondContact O-CB 3.48Å; E682-R686 PolarHBondContact O-N 2.85Å
683D81.9Confident81.4Confident78 Ų78103.3 Ų103.342%0.41750%0.498SS..Hα-helixtrans-65.6-35.9172.4-71-31000111.5H679 R686 L687H679-D683 PolarHBondContact O-N 2.81Å; D683-R686 PolarHBondContact O-N 2.83Å; D683-R686 IonicContact OD1-CZ 3.75Å; D683-R686 IonicContact OD1-NH1 2.66Å; D683-R686 PolarHBondContact OD1-NH1 3.34Å; D683-R686 IonicContact OD1-NH2 3.01Å; D683-R686 PolarHBondContact OD1-NH2 2.7Å; D683-L687 WeakPolarHBondContact O-CB 3.36Å; D683-L687 PolarHBondContact O-N 3.5Å
684K86.9Confident81.5Confident140 Ų140105 Ų10561%0.60951%0.507SS*.Hα-helixtrans-71.6-33.7173.8-172.3169.9-176.8175.80112.5V680 K681 E682 L688V680-K684 WeakPolarHBondContact O-CB 3.48Å; V680-K684 PolarHBondContact O-N 3.35Å; K681-K684 CarbonylContact O-C 3.59Å; K681-K684 PolarHBondContact O-N 3.27Å; E682-K684 VanDerWaalsContact C-N 3.32Å; E682-K684 PolarHBondContact O-N 3.11Å; K684-L688 HydrophobicContact CG-CD1 4.2Å; K684-L688 VanDerWaalsContact O-CB 3.31Å; K684-L688 WeakPolarHBondContact O-CB 3.35Å; K684-L688 WeakPolarHBondContact O-CG 3.45Å; K684-L688 PolarHBondContact O-N 3.48Å
685I82.1Confident81.7Confident88 Ų88105.5 Ų105.545%0.45151%0.508SS..Hα-helixtrans-64.4-48.9170.9-74.9161000108.8K681 E682 L687 L688 E689K681-I685 WeakPolarHBondContact O-CB 3.33Å; K681-I685 WeakPolarHBondContact O-CD1 3.44Å; K681-I685 WeakPolarHBondContact O-CG1 3.41Å; K681-I685 PolarHBondContact O-N 3.19Å; E682-I685 PolarHBondContact O-N 3.33Å; I685-L687 VanDerWaalsContact C-N 3.35Å; I685-L687 PolarHBondContact O-N 3.22Å; I685-L688 CarbonylContact O-C 3.52Å; I685-L688 WeakPolarHBondContact O-CA 3.36Å; I685-L688 PolarHBondContact O-N 2.8Å; I685-E689 HydrophobicContact CG2-CG 4.19Å; I685-E689 WeakPolarHBondContact CG2-OE1 3.27Å; I685-E689 WeakPolarHBondContact O-CB 3.24Å; I685-E689 VanDerWaalsContact O-CG 3.31Å; I685-E689 WeakPolarHBondContact O-CG 3.49Å; I685-E689 PolarHBondContact O-N 2.94Å
686R84.9Confident81.9Confident124 Ų124104.4 Ų104.447%0.46851%0.508SS..Hα-helixtrans-57.1-45.3176.7-162.1-172.9-5112519.4112.2E682 D683 L688 E689 E690E682-R686 WeakPolarHBondContact O-CB 3.48Å; E682-R686 PolarHBondContact O-N 2.85Å; D683-R686 PolarHBondContact O-N 2.83Å; D683-R686 IonicContact OD1-CZ 3.75Å; D683-R686 IonicContact OD1-NH1 2.66Å; D683-R686 PolarHBondContact OD1-NH1 3.34Å; D683-R686 IonicContact OD1-NH2 3.01Å; D683-R686 PolarHBondContact OD1-NH2 2.7Å; R686-L688 PolarHBondContact O-N 3.05Å; R686-E689 WeakPolarHBondContact O-CB 3.42Å; R686-E689 PolarHBondContact O-N 3.44Å; R686-E690 WeakPolarHBondContact O-CB 3.35Å; R686-E690 WeakPolarHBondContact O-CG 3.3Å; R686-E690 PolarHBondContact O-N 2.95Å
687L83.4Confident81.9Confident94 Ų94102 Ų10249%0.49251%0.509SS..Hα-helixtrans-65.9-36.8176.1-172.468.9000112.5D683 I685 Q691D683-L687 WeakPolarHBondContact O-CB 3.36Å; D683-L687 PolarHBondContact O-N 3.5Å; I685-L687 VanDerWaalsContact C-N 3.35Å; I685-L687 PolarHBondContact O-N 3.22Å; L687-Q691 WeakPolarHBondContact O-CB 3.13Å; L687-Q691 VanDerWaalsContact O-CG 3.27Å; L687-Q691 WeakPolarHBondContact O-CG 3.27Å; L687-Q691 PolarHBondContact O-N 3.17Å
688L85.8Confident81.9Confident91 Ų91102 Ų10248%0.47651%0.509SS..Hα-helixtrans-70.9-31.8173.7-75.5169.8000112.2K684 I685 R686 L692K684-L688 HydrophobicContact CG-CD1 4.2Å; K684-L688 VanDerWaalsContact O-CB 3.31Å; K684-L688 WeakPolarHBondContact O-CB 3.35Å; K684-L688 WeakPolarHBondContact O-CG 3.45Å; K684-L688 PolarHBondContact O-N 3.48Å; I685-L688 CarbonylContact O-C 3.52Å; I685-L688 WeakPolarHBondContact O-CA 3.36Å; I685-L688 PolarHBondContact O-N 2.8Å; R686-L688 PolarHBondContact O-N 3.05Å; L688-L692 WeakPolarHBondContact O-CB 3.45Å; L688-L692 PolarHBondContact O-N 2.97Å
689E79.3Confident82Confident107 Ų107102.4 Ų102.450%0.551%0.508SS..Hα-helixtrans-70.6-41.7173.3-74.2171.3162.800111I685 R686 L692 Q693I685-E689 HydrophobicContact CG2-CG 4.19Å; I685-E689 WeakPolarHBondContact CG2-OE1 3.27Å; I685-E689 WeakPolarHBondContact O-CB 3.24Å; I685-E689 VanDerWaalsContact O-CG 3.31Å; I685-E689 WeakPolarHBondContact O-CG 3.49Å; I685-E689 PolarHBondContact O-N 2.94Å; R686-E689 WeakPolarHBondContact O-CB 3.42Å; R686-E689 PolarHBondContact O-N 3.44Å; E689-L692 PolarHBondContact O-N 2.84Å; E689-Q693 WeakPolarHBondContact O-CB 3.42Å; E689-Q693 WeakPolarHBondContact O-CG 3.21Å; E689-Q693 PolarHBondContact O-N 3.01Å
690E83.3Confident81.9Confident108 Ų108104.1 Ų104.151%0.50552%0.517SS..Hα-helixtrans-63.7-44.6172.2-73.9168.8-165.300111.5R686 Q693 H694R686-E690 WeakPolarHBondContact O-CB 3.35Å; R686-E690 WeakPolarHBondContact O-CG 3.3Å; R686-E690 PolarHBondContact O-N 2.95Å; E690-Q693 PolarHBondContact O-N 3.33Å; E690-H694 WeakPolarHBondContact O-CB 3.44Å; E690-H694 PolarHBondContact O-N 3.08Å
691Q83.6Confident81.7Confident112 Ų112103.8 Ų103.852%0.52351%0.509SS..Hα-helixtrans-63.3-41.7173.1-77.5-178.5-16.500111.8L687 H694 E695L687-Q691 WeakPolarHBondContact O-CB 3.13Å; L687-Q691 VanDerWaalsContact O-CG 3.27Å; L687-Q691 WeakPolarHBondContact O-CG 3.27Å; L687-Q691 PolarHBondContact O-N 3.17Å; Q691-H694 PolarHBondContact O-N 2.9Å; Q691-E695 WeakPolarHBondContact O-CB 3.32Å; Q691-E695 PolarHBondContact O-N 2.78Å
692L84Confident81.6Confident109 Ų109101.3 Ų101.357%0.57150%0.499SS*.Hα-helixtrans-67.8-36176.4-176.165.6000111.4L688 E689 V696L688-L692 WeakPolarHBondContact O-CB 3.45Å; L688-L692 PolarHBondContact O-N 2.97Å; E689-L692 PolarHBondContact O-N 2.84Å; L692-V696 HydrophobicContact CD1-CG2 4.28Å; L692-V696 HydrophobicContact CG-CG2 4.33Å; L692-V696 WeakPolarHBondContact O-CB 3.44Å; L692-V696 WeakPolarHBondContact O-CG2 3.35Å; L692-V696 PolarHBondContact O-N 2.99Å
693Q78.8Confident81.6Confident145 Ų145102.3 Ų102.368%0.67851%0.507SS*.Hα-helixtrans-67.6-42.7173.2-78.2-171.419.200111.6E689 E690 V696 A697E689-Q693 WeakPolarHBondContact O-CB 3.42Å; E689-Q693 WeakPolarHBondContact O-CG 3.21Å; E689-Q693 PolarHBondContact O-N 3.01Å; E690-Q693 PolarHBondContact O-N 3.33Å; Q693-V696 PolarHBondContact O-N 3.48Å; Q693-A697 WeakPolarHBondContact O-CB 3.36Å; Q693-A697 PolarHBondContact O-N 3.31Å
694H80.1Confident81.5Confident142 Ų142103.4 Ų103.466%0.65751%0.509SS*.Hα-helixtrans-64.3-41.4174.5-174.8-76.9000111.6E690 Q691 A697 S698E690-H694 WeakPolarHBondContact O-CB 3.44Å; E690-H694 PolarHBondContact O-N 3.08Å; Q691-H694 PolarHBondContact O-N 2.9Å; H694-A697 PolarHBondContact O-N 3.5Å; H694-S698 WeakPolarHBondContact O-CB 3.45Å; H694-S698 PolarHBondContact O-N 2.83Å
695E81.6Confident81.2Confident112 Ų112100.5 Ų100.552%0.52350%0.499SS..Hα-helixtrans-71.9-35.4176.4-173.4151.9-160.700111.8Q691 S698 K699Q691-E695 WeakPolarHBondContact O-CB 3.32Å; Q691-E695 PolarHBondContact O-N 2.78Å; E695-S698 PolarHBondContact O-N 3.01Å; E695-K699 HydrophobicContact CG-CG 3.98Å; E695-K699 WeakPolarHBondContact O-CA 3.3Å; E695-K699 WeakPolarHBondContact O-CB 3.45Å; E695-K699 WeakPolarHBondContact O-CG 3.33Å; E695-K699 PolarHBondContact O-N 3.36Å
696V80.5Confident81.2Confident82 Ų82100 Ų10050%0.49750%0.496SS..Hα-helixtrans-64.5-39.1170.41650000111L692 Q693 M700L692-V696 HydrophobicContact CD1-CG2 4.28Å; L692-V696 HydrophobicContact CG-CG2 4.33Å; L692-V696 WeakPolarHBondContact O-CB 3.44Å; L692-V696 WeakPolarHBondContact O-CG2 3.35Å; L692-V696 PolarHBondContact O-N 2.99Å; Q693-V696 PolarHBondContact O-N 3.48Å; V696-M700 WeakPolarHBondContact O-CB 3.4Å; V696-M700 PolarHBondContact O-N 2.95Å
697A79.6Confident80.7Confident59 Ų5997 Ų9749%0.48849%0.494SS..Hα-helixtrans-66-46173.800000111.7Q693 H694 K699 M700 E701Q693-A697 WeakPolarHBondContact O-CB 3.36Å; Q693-A697 PolarHBondContact O-N 3.31Å; H694-A697 PolarHBondContact O-N 3.5Å; A697-K699 PolarHBondContact O-N 2.7Å; A697-M700 PolarHBondContact O-N 3.05Å; A697-E701 PolarHBondContact O-N 2.88Å
698S82.9Confident80.4Confident53 Ų5398.2 Ų98.237%0.37150%0.498SS..Hα-helixtrans-61.3-42.8174.7-168.80000111.6H694 E695 E701 E702H694-S698 WeakPolarHBondContact O-CB 3.45Å; H694-S698 PolarHBondContact O-N 2.83Å; E695-S698 PolarHBondContact O-N 3.01Å; S698-E701 PolarHBondContact O-N 3.32Å; S698-E702 WeakPolarHBondContact O-CB 3.3Å; S698-E702 WeakPolarHBondContact O-CG 3.32Å; S698-E702 PolarHBondContact O-N 3.32Å
699K82.6Confident80.2Confident86 Ų8698.6 Ų98.637%0.37450%0.497SS..Hα-helixtrans-72.9-26.2177.1-68.2-71169.4-130.40112.4E695 A697 E702 L703E695-K699 HydrophobicContact CG-CG 3.98Å; E695-K699 WeakPolarHBondContact O-CA 3.3Å; E695-K699 WeakPolarHBondContact O-CB 3.45Å; E695-K699 WeakPolarHBondContact O-CG 3.33Å; E695-K699 PolarHBondContact O-N 3.36Å; A697-K699 PolarHBondContact O-N 2.7Å; K699-E702 IonicContact NZ-OE1 3.57Å; K699-E702 PolarHBondContact NZ-OE1 2.98Å; K699-E702 IonicContact NZ-OE2 3.93Å; K699-E702 PolarHBondContact NZ-OE2 3.23Å; K699-L703 WeakPolarHBondContact O-CB 3.39Å; K699-L703 WeakPolarHBondContact O-CG 3.33Å; K699-L703 PolarHBondContact O-N 2.93Å
700M77.1Confident79.9Confident131 Ų13197.8 Ų97.865%0.64550%0.496SS*.Hα-helixtrans-71.1-41.5171.1-180175-8400110.9V696 A697 L703 K704V696-M700 WeakPolarHBondContact O-CB 3.4Å; V696-M700 PolarHBondContact O-N 2.95Å; A697-M700 PolarHBondContact O-N 3.05Å; M700-L703 PolarHBondContact O-N 3.03Å; M700-K704 WeakPolarHBondContact O-CB 3.3Å; M700-K704 PolarHBondContact O-N 3.24Å
701E78.8Confident79.5Confident95 Ų9599.7 Ų99.744%0.44450%0.503SS..Hα-helixtrans-72-39174.6-16163.8-159.100111.4A697 S698 L703 K704 I705A697-E701 PolarHBondContact O-N 2.88Å; S698-E701 PolarHBondContact O-N 3.32Å; E701-L703 PolarHBondContact O-N 3.01Å; E701-K704 VanDerWaalsContact CD-NZ 3.31Å; E701-K704 WeakPolarHBondContact O-CB 3.48Å; E701-K704 PolarHBondContact O-N 2.77Å; E701-K704 IonicContact OE1-NZ 2.96Å; E701-K704 PolarHBondContact OE1-NZ 2.94Å; E701-K704 IonicContact OE2-NZ 2.67Å; E701-K704 PolarHBondContact OE2-NZ 2.79Å; E701-I705 WeakPolarHBondContact O-CG1 3.36Å; E701-I705 PolarHBondContact O-N 3.37Å
702E78.6Confident78.8Confident76 Ų7697 Ų9736%0.35550%0.5SS..Hα-helixtrans-60.5-40.8167.9-76.6176.7-141.100111.9S698 K699 K704 I705 L706S698-E702 WeakPolarHBondContact O-CB 3.3Å; S698-E702 WeakPolarHBondContact O-CG 3.32Å; S698-E702 PolarHBondContact O-N 3.32Å; K699-E702 IonicContact NZ-OE1 3.57Å; K699-E702 PolarHBondContact NZ-OE1 2.98Å; K699-E702 IonicContact NZ-OE2 3.93Å; K699-E702 PolarHBondContact NZ-OE2 3.23Å; E702-K704 VanDerWaalsContact C-N 3.29Å; E702-K704 PolarHBondContact O-N 3.44Å; E702-I705 PolarHBondContact O-N 2.85Å; E702-L706 WeakPolarHBondContact O-CB 3.39Å; E702-L706 VanDerWaalsContact O-CG 3.26Å; E702-L706 WeakPolarHBondContact O-CG 3.41Å; E702-L706 PolarHBondContact O-N 2.86Å
703L78.7Confident78.3Confident117 Ų11795.7 Ų95.761%0.61349%0.493SS*.Hα-helixtrans-66.7-30.4175.5-87.5168.5000112.3K699 M700 E701 L706 S707K699-L703 WeakPolarHBondContact O-CB 3.39Å; K699-L703 WeakPolarHBondContact O-CG 3.33Å; K699-L703 PolarHBondContact O-N 2.93Å; M700-L703 PolarHBondContact O-N 3.03Å; E701-L703 PolarHBondContact O-N 3.01Å; L703-L706 CarbonylContact O-C 3.6Å; L703-S707 WeakPolarHBondContact O-CA 3.41Å; L703-S707 WeakPolarHBondContact O-CB 3.44Å; L703-S707 PolarHBondContact O-N 2.92Å
704K78.8Confident77.9Confident101 Ų10195.3 Ų95.344%0.43949%0.491SS..Hα-helixtrans-71.5-46.5174.7-176.8171153.1-134.80110.7M700 E701 E702 L706 S707 E708M700-K704 WeakPolarHBondContact O-CB 3.3Å; M700-K704 PolarHBondContact O-N 3.24Å; E701-K704 VanDerWaalsContact CD-NZ 3.31Å; E701-K704 WeakPolarHBondContact O-CB 3.48Å; E701-K704 PolarHBondContact O-N 2.77Å; E701-K704 IonicContact OE1-NZ 2.96Å; E701-K704 PolarHBondContact OE1-NZ 2.94Å; E701-K704 IonicContact OE2-NZ 2.67Å; E701-K704 PolarHBondContact OE2-NZ 2.79Å; E702-K704 VanDerWaalsContact C-N 3.29Å; E702-K704 PolarHBondContact O-N 3.44Å; K704-L706 PolarHBondContact O-N 3.24Å; K704-S707 WeakPolarHBondContact O-CB 3.28Å; K704-S707 PolarHBondContact O-N 3.36Å; K704-S707 VanDerWaalsContact O-N 3.14Å; K704-E708 WeakPolarHBondContact O-CG 3.28Å; K704-E708 PolarHBondContact O-N 3.35Å
705I80.4Confident77.1Confident79 Ų7991.2 Ų91.241%0.40548%0.478SS..Hα-helixtrans-60.4-44.7171-65.3164.7000110.7E701 E702 S707 E708 Q709E701-I705 WeakPolarHBondContact O-CG1 3.36Å; E701-I705 PolarHBondContact O-N 3.37Å; E702-I705 PolarHBondContact O-N 2.85Å; I705-S707 VanDerWaalsContact C-N 3.3Å; I705-S707 PolarHBondContact O-N 3.31Å; I705-E708 PolarHBondContact O-N 2.82Å; I705-Q709 HydrophobicContact CG2-CG 4.46Å; I705-Q709 WeakPolarHBondContact O-CB 3.41Å; I705-Q709 VanDerWaalsContact O-CG 3.29Å; I705-Q709 WeakPolarHBondContact O-CG 3.29Å; I705-Q709 PolarHBondContact O-N 3.07Å
706L81.9Confident76.4Confident76 Ų7690.5 Ų90.540%0.39848%0.475SS..Hα-helixtrans-69.7-22.6176.1-76.8167.3000112.9E702 L703 K704 N710E702-L706 WeakPolarHBondContact O-CB 3.39Å; E702-L706 VanDerWaalsContact O-CG 3.26Å; E702-L706 WeakPolarHBondContact O-CG 3.41Å; E702-L706 PolarHBondContact O-N 2.86Å; L703-L706 CarbonylContact O-C 3.6Å; K704-L706 PolarHBondContact O-N 3.24Å; L706-N710 WeakPolarHBondContact O-CA 3.39Å; L706-N710 WeakPolarHBondContact O-CB 3.42Å; L706-N710 PolarHBondContact O-N 3.35Å; L706-N710 PolarHBondContact O-ND2 3.09Å
707S74.8Confident75.5Confident61 Ų6190 Ų9043%0.42747%0.472SS..Hα-helixtrans-76.9-39.6172.61790000110.9L703 K704 I705 N710 K711L703-S707 WeakPolarHBondContact O-CA 3.41Å; L703-S707 WeakPolarHBondContact O-CB 3.44Å; L703-S707 PolarHBondContact O-N 2.92Å; K704-S707 WeakPolarHBondContact O-CB 3.28Å; K704-S707 PolarHBondContact O-N 3.36Å; K704-S707 VanDerWaalsContact O-N 3.14Å; I705-S707 VanDerWaalsContact C-N 3.3Å; I705-S707 PolarHBondContact O-N 3.31Å; S707-N710 PolarHBondContact O-N 3.49Å; S707-K711 PolarHBondContact O-N 2.96Å
708E78.2Confident74.5Confident121 Ų12194.7 Ų94.757%0.56548%0.484SS*.Hα-helixtrans-67-43172-70.2170.5-177.600111K704 I705 K711 A712K704-E708 WeakPolarHBondContact O-CG 3.28Å; K704-E708 PolarHBondContact O-N 3.35Å; I705-E708 PolarHBondContact O-N 2.82Å; E708-K711 PolarHBondContact O-N 3.23Å; E708-A712 PolarHBondContact O-N 3.01Å
709Q80.4Confident73.1Confident99 Ų9998.7 Ų98.746%0.46350%0.495SS..Hα-helixtrans-66.9-35.1170.9-70.3176.4100112.5I705 A712 L713I705-Q709 HydrophobicContact CG2-CG 4.46Å; I705-Q709 WeakPolarHBondContact O-CB 3.41Å; I705-Q709 VanDerWaalsContact O-CG 3.29Å; I705-Q709 WeakPolarHBondContact O-CG 3.29Å; I705-Q709 PolarHBondContact O-N 3.07Å; Q709-A712 CarbonylContact O-C 3.58Å; Q709-A712 PolarHBondContact O-N 2.83Å; Q709-L713 VanDerWaalsContact O-CB 3.28Å; Q709-L713 WeakPolarHBondContact O-CB 3.45Å; Q709-L713 WeakPolarHBondContact O-CG 3.36Å; Q709-L713 PolarHBondContact O-N 3.13Å
710N72.6Confident71.7Confident89 Ų8999.9 Ų99.948%0.47650%0.504SS..Hα-helixtrans-70.9-29173.2-92.8-62.3000112.4L706 S707 Q714L706-N710 WeakPolarHBondContact O-CA 3.39Å; L706-N710 WeakPolarHBondContact O-CB 3.42Å; L706-N710 PolarHBondContact O-N 3.35Å; L706-N710 PolarHBondContact O-ND2 3.09Å; S707-N710 PolarHBondContact O-N 3.49Å; N710-Q714 WeakPolarHBondContact O-CB 3.49Å; N710-Q714 VanDerWaalsContact O-CG 3.26Å; N710-Q714 WeakPolarHBondContact O-CG 3.33Å; N710-Q714 PolarHBondContact O-N 3.5Å
711K75.2Confident70.1Confident149 Ų149101.2 Ų101.265%0.64851%0.509SS*.Hα-helixtrans-65.7-43.1167.5-79.8177.1176.2174.30111.1S707 E708 S715S707-K711 PolarHBondContact O-N 2.96Å; E708-K711 PolarHBondContact O-N 3.23Å; K711-S715 PolarHBondContact O-N 2.84Å
712A70.1Confident68.5Low55 Ų55102.3 Ų102.346%0.45552%0.522SS..Hα-helixtrans-63.5-47.917500000111.8E708 Q709 S715 E716E708-A712 PolarHBondContact O-N 3.01Å; Q709-A712 CarbonylContact O-C 3.58Å; Q709-A712 PolarHBondContact O-N 2.83Å; A712-S715 WeakPolarHBondContact O-CA 3.46Å; A712-S715 WeakPolarHBondContact O-CB 3.37Å; A712-S715 PolarHBondContact O-N 2.97Å; A712-S715 VanDerWaalsContact O-N 3.14Å; A712-S715 PolarHBondContact O-OG 2.86Å; A712-E716 PolarHBondContact O-N 3.38Å
713L73.2Confident67Low82 Ų82101.8 Ų101.843%0.42953%0.531SS..Hα-helixtrans-71.5-31.1179-74.2169.2000112.7Q709 S715 E716 V717Q709-L713 VanDerWaalsContact O-CB 3.28Å; Q709-L713 WeakPolarHBondContact O-CB 3.45Å; Q709-L713 WeakPolarHBondContact O-CG 3.36Å; Q709-L713 PolarHBondContact O-N 3.13Å; L713-S715 VanDerWaalsContact C-N 3.26Å; L713-S715 PolarHBondContact O-N 3.25Å; L713-E716 CarbonylContact O-C 3.47Å; L713-E716 PolarHBondContact O-N 3.13Å; L713-V717 WeakPolarHBondContact O-CB 3.43Å; L713-V717 WeakPolarHBondContact O-CG2 3.43Å; L713-V717 PolarHBondContact O-N 2.93Å
714Q69.1Low65.2Low137 Ų137102.3 Ų102.364%0.6454%0.538SS*.Hα-helixtrans-60.9-39.4168-85.7-176.5-21.400110.4N710 E716 Q718N710-Q714 WeakPolarHBondContact O-CB 3.49Å; N710-Q714 VanDerWaalsContact O-CG 3.26Å; N710-Q714 WeakPolarHBondContact O-CG 3.33Å; N710-Q714 PolarHBondContact O-N 3.5Å; Q714-E716 PolarHBondContact O-N 3.08Å; Q714-Q718 WeakPolarHBondContact O-CB 3.48Å; Q714-Q718 PolarHBondContact O-N 3.5Å
715S63.6Low63.4Low55 Ų55103.1 Ų103.139%0.38556%0.557SS.*Hα-helixtrans-68.3-10.4174.390.80000114.3K711 A712 L713 K719K711-S715 PolarHBondContact O-N 2.84Å; A712-S715 WeakPolarHBondContact O-CA 3.46Å; A712-S715 WeakPolarHBondContact O-CB 3.37Å; A712-S715 PolarHBondContact O-N 2.97Å; A712-S715 VanDerWaalsContact O-N 3.14Å; A712-S715 PolarHBondContact O-OG 2.86Å; L713-S715 VanDerWaalsContact C-N 3.26Å; L713-S715 PolarHBondContact O-N 3.25Å; S715-K719 WeakPolarHBondContact O-CD 3.31Å; S715-K719 WeakPolarHBondContact O-CE 3.41Å; S715-K719 WeakPolarHBondContact O-CG 3.27Å; S715-K719 PolarHBondContact O-NZ 3.18Å
716E67.3Low61.4Low97 Ų97108.1 Ų108.145%0.45358%0.579SS.*Hα-helixtrans-111.1-37-178-166.8161-139.700112.6A712 L713 Q714 Q718 K719 L720A712-E716 PolarHBondContact O-N 3.38Å; L713-E716 CarbonylContact O-C 3.47Å; L713-E716 PolarHBondContact O-N 3.13Å; Q714-E716 PolarHBondContact O-N 3.08Å; E716-Q718 VanDerWaalsContact C-N 3.29Å; E716-K719 CarbonylContact O-C 3.6Å; E716-K719 WeakPolarHBondContact O-CA 3.38Å; E716-K719 VanDerWaalsContact O-CB 3.3Å; E716-K719 WeakPolarHBondContact O-CB 3.44Å; E716-K719 PolarHBondContact O-N 2.82Å; E716-L720 HydrophobicContact CG-CD1 4.17Å; E716-L720 WeakPolarHBondContact O-CB 3.4Å; E716-L720 WeakPolarHBondContact O-CG 3.44Å; E716-L720 PolarHBondContact O-N 2.9Å
717V61.8Low59.2Low73 Ų73113.1 Ų113.144%0.44260%0.6SS.*Hα-helixtrans-63.3-36.6164.5173.70000109.9L713 K719 L720 Q721L713-V717 WeakPolarHBondContact O-CB 3.43Å; L713-V717 WeakPolarHBondContact O-CG2 3.43Å; L713-V717 PolarHBondContact O-N 2.93Å; V717-K719 PolarHBondContact O-N 3.48Å; V717-K719 VanDerWaalsContact O-N 3.16Å; V717-L720 PolarHBondContact O-N 2.98Å; V717-L720 VanDerWaalsContact O-N 3.16Å; V717-Q721 HydrophobicContact CG1-CB 4.37Å; V717-Q721 WeakPolarHBondContact O-CB 3.43Å; V717-Q721 PolarHBondContact O-N 2.96Å
718Q57.8Low57.9Low156 Ų156115.3 Ų115.373%0.72961%0.613SS**Hα-helixtrans-64.2-16.4169.6-164.3174.328.500113.1Q714 E716 T722Q714-Q718 WeakPolarHBondContact O-CB 3.48Å; Q714-Q718 PolarHBondContact O-N 3.5Å; E716-Q718 VanDerWaalsContact C-N 3.29Å; Q718-T722 PolarHBondContact O-OG1 2.98Å
719K54.1Low55.9Low138 Ų138116.4 Ų116.460%0.662%0.622SS**Hα-helixtrans-93.4-32.6170.4-61.4166.8-173.61520112.9S715 E716 V717 T722S715-K719 WeakPolarHBondContact O-CD 3.31Å; S715-K719 WeakPolarHBondContact O-CE 3.41Å; S715-K719 WeakPolarHBondContact O-CG 3.27Å; S715-K719 PolarHBondContact O-NZ 3.18Å; E716-K719 CarbonylContact O-C 3.6Å; E716-K719 WeakPolarHBondContact O-CA 3.38Å; E716-K719 VanDerWaalsContact O-CB 3.3Å; E716-K719 WeakPolarHBondContact O-CB 3.44Å; E716-K719 PolarHBondContact O-N 2.82Å; V717-K719 PolarHBondContact O-N 3.48Å; V717-K719 VanDerWaalsContact O-N 3.16Å; K719-T722 WeakPolarHBondContact O-CB 3.48Å; K719-T722 PolarHBondContact O-OG1 3.32Å
720L52.8Low54.2Low110 Ų110118.7 Ų118.758%0.57663%0.631SS**Hα-helixtrans-93.6-23.9-174.7-69.1171.9000114.2E716 V717 T722 A723E716-L720 HydrophobicContact CG-CD1 4.17Å; E716-L720 WeakPolarHBondContact O-CB 3.4Å; E716-L720 WeakPolarHBondContact O-CG 3.44Å; E716-L720 PolarHBondContact O-N 2.9Å; V717-L720 PolarHBondContact O-N 2.98Å; V717-L720 VanDerWaalsContact O-N 3.16Å; L720-T722 PolarHBondContact O-N 3.04Å; L720-A723 WeakPolarHBondContact O-CA 3.48Å; L720-A723 VanDerWaalsContact O-CB 3.26Å; L720-A723 WeakPolarHBondContact O-CB 3.32Å; L720-A723 PolarHBondContact O-N 2.78Å
721Q43.1Very low53.1Low160 Ų160121.3 Ų121.375%0.74865%0.645SS**THydrogen-bonded Turntrans-69.4-14.8170.3-167.5163.40.900111.7V717 A723V717-Q721 HydrophobicContact CG1-CB 4.37Å; V717-Q721 WeakPolarHBondContact O-CB 3.43Å; V717-Q721 PolarHBondContact O-N 2.96Å; Q721-A723 VanDerWaalsContact C-N 3.3Å
722T45.6Very low51.9Low118 Ų118119.8 Ų119.872%0.72465%0.648SS**THydrogen-bonded Turntrans-73.5-17.6164.7-35.60000112.9Q718 K719 L720Q718-T722 PolarHBondContact O-OG1 2.98Å; K719-T722 WeakPolarHBondContact O-CB 3.48Å; K719-T722 PolarHBondContact O-OG1 3.32Å; L720-T722 PolarHBondContact O-N 3.04Å
723A47Very low51.2Low65 Ų65121.1 Ų121.154%0.53765%0.65SS.*THydrogen-bonded Turntrans-99.2-57.7-164.400000114.6L720 Q721L720-A723 WeakPolarHBondContact O-CA 3.48Å; L720-A723 VanDerWaalsContact O-CB 3.26Å; L720-A723 WeakPolarHBondContact O-CB 3.32Å; L720-A723 PolarHBondContact O-N 2.78Å; Q721-A723 VanDerWaalsContact C-N 3.3Å
724V40.8Very low50.3Low127 Ų127125 Ų12577%0.7767%0.666SS**  trans-145.9101.2-166-169.60000113.7
725S42.4Very low49.4Very low118 Ų118126.4 Ų126.483%0.82567%0.673SS**  trans-130.665.6165.9175.60000110.8
726Q36.8Very low49Very low185 Ų185129.1 Ų129.186%0.86468%0.681SS**  trans-137.694.5173.5-69.9-166.5-1.400113.3
727Q36.3Very low48.4Very low180 Ų180130.8 Ų130.884%0.84169%0.689SS**  trans41.4147.3145.2-81-164.6-26.200125.6
728P47.4Very low48Very low108 Ų108135.5 Ų135.570%0.70170%0.703SS**  trans-102.1169.1165.841.5-33.9000113.6
729N35.6Very low48Very low143 Ų143131.2 Ų131.277%0.76569%0.69SS**  trans-154154.7165.6-84.2-67.2000109.5
730K44.8Very low48.5Very low147 Ų147128.7 Ų128.764%0.63968%0.682SS**  cis-164.6-40.5-23.9178.7175.1175.3-173.50111.7V732K730-V732 PolarHBondContact O-N 3.44Å
731D49.9Very low48.9Very low144 Ų144130.1 Ų130.177%0.7769%0.685SS**THydrogen-bonded Turntrans-61.29.1-154.9-56.3-22.9000118.5V733D731-V733 VanDerWaalsContact C-N 3.33Å
732V51.3Low49.7Very low118 Ų118128.4 Ų128.472%0.71568%0.678SS**THydrogen-bonded Turntrans-75.1-24175.2-179.40000112.1K730 E734K730-V732 PolarHBondContact O-N 3.44Å; V732-E734 PolarHBondContact O-N 2.9Å
733V54.6Low50.6Low82 Ų82129.3 Ų129.350%0.49767%0.671SS.*Hα-helixtrans-65.5-38.2-173-178.60000112.6D731 Q735 M736 E737D731-V733 VanDerWaalsContact C-N 3.33Å; V733-Q735 PolarHBondContact O-N 2.88Å; V733-M736 VanDerWaalsContact O-CB 3.31Å; V733-M736 WeakPolarHBondContact O-CB 3.47Å; V733-M736 PolarHBondContact O-N 3.15Å; V733-M736 VanDerWaalsContact O-N 3.08Å; V733-E737 PolarHBondContact O-N 3.24Å
734E54.3Low51.6Low163 Ų163129.6 Ų129.676%0.76266%0.664SS**Hα-helixtrans-77.2-21.1-171.4-154.3166.1-156.400113.1V732V732-E734 PolarHBondContact O-N 2.9Å
735Q51Low52.9Low167 Ų167129.3 Ų129.378%0.7865%0.654SS**Hα-helixtrans-76.5-28.1166.5-77.3-166.3-7.400112.9V733V733-Q735 PolarHBondContact O-N 2.88Å
736M53.7Low54.1Low112 Ų112129.1 Ų129.155%0.55264%0.638SS**Hα-helixtrans-70.4-38-176.5-164.5163.663.600111.3V733 K738 C739 I740V733-M736 VanDerWaalsContact O-CB 3.31Å; V733-M736 WeakPolarHBondContact O-CB 3.47Å; V733-M736 PolarHBondContact O-N 3.15Å; V733-M736 VanDerWaalsContact O-N 3.08Å; M736-K738 VanDerWaalsContact C-N 3.32Å; M736-K738 PolarHBondContact O-N 2.93Å; M736-C739 WeakPolarHBondContact O-CB 3.35Å; M736-C739 PolarHBondContact O-N 3.36Å; M736-C739 VanDerWaalsContact O-N 3.09Å; M736-I740 HydrophobicContact CG-CD1 4.32Å; M736-I740 WeakPolarHBondContact O-CG1 3.33Å; M736-I740 PolarHBondContact O-N 3.43Å; M736-I740 VanDerWaalsContact O-N 3.16Å
737E54.6Low55.7Low133 Ų133124.5 Ų124.562%0.62162%0.619SS**Hα-helixtrans-62.4-35.9-177.7-157.9153.4-148.600113V733 I740V733-E737 PolarHBondContact O-N 3.24Å; E737-I740 PolarHBondContact O-N 3.01Å
738K54.7Low57.4Low171 Ų171122.2 Ų122.274%0.74360%0.603SS**Hα-helixtrans-76-23.2175.8-159.6171.1-174.6175.70113.8M736M736-K738 VanDerWaalsContact C-N 3.32Å; M736-K738 PolarHBondContact O-N 2.93Å
739C57.7Low58.5Low67 Ų67120.8 Ų120.845%0.45359%0.592SS.*Hα-helixtrans-79.4-24.5174.9-173.60000112.3M736 K743M736-C739 WeakPolarHBondContact O-CB 3.35Å; M736-C739 PolarHBondContact O-N 3.36Å; M736-C739 VanDerWaalsContact O-N 3.09Å; C739-K743 WeakPolarHBondContact O-CG 3.26Å
740I64.4Low60.2Low85 Ų85117.4 Ų117.444%0.43658%0.577SS.*Hα-helixtrans-70.6-52.6178.9-71.3164000110.5M736 E737 E742 K743 D744M736-I740 HydrophobicContact CG-CD1 4.32Å; M736-I740 WeakPolarHBondContact O-CG1 3.33Å; M736-I740 PolarHBondContact O-N 3.43Å; M736-I740 VanDerWaalsContact O-N 3.16Å; E737-I740 PolarHBondContact O-N 3.01Å; I740-E742 VanDerWaalsContact C-N 3.31Å; I740-E742 PolarHBondContact O-N 2.73Å; I740-K743 CarbonylContact O-C 3.56Å; I740-K743 WeakPolarHBondContact O-CA 3.42Å; I740-K743 WeakPolarHBondContact O-CB 3.4Å; I740-K743 PolarHBondContact O-N 3.29Å; I740-D744 WeakPolarHBondContact CG2-OD2 3.49Å; I740-D744 VanDerWaalsContact O-CG 3.29Å; I740-D744 PolarHBondContact O-N 2.9Å
741Q60.2Low61.6Low139 Ų139115.2 Ų115.265%0.6557%0.569SS**Hα-helixtrans-57.3-39.1-178.3-71.3179.1-26.200113.8K743 D744Q741-K743 PolarHBondContact O-N 3.41Å; Q741-D744 PolarHBondContact O-N 3.48Å
742E60.5Low62.6Low125 Ų125114 Ų11458%0.58456%0.558SS**Hα-helixtrans-77.3-10.1178.8-148.1-160-115.800113.6I740 K746I740-E742 VanDerWaalsContact C-N 3.31Å; I740-E742 PolarHBondContact O-N 2.73Å; E742-K746 PolarHBondContact O-NZ 3.05Å; E742-K746 VanDerWaalsContact O-NZ 3.16Å; E742-K746 IonicContact OE2-NZ 2.67Å; E742-K746 PolarHBondContact OE2-NZ 2.89Å
743K65.7Low63.5Low136 Ų136114.5 Ų114.559%0.59156%0.556SS**Hα-helixtrans-90.6-35.2167.6-78.1-175.6175.7-178.70111.9C739 I740 Q741 E745 K746 L747C739-K743 WeakPolarHBondContact O-CG 3.26Å; I740-K743 CarbonylContact O-C 3.56Å; I740-K743 WeakPolarHBondContact O-CA 3.42Å; I740-K743 WeakPolarHBondContact O-CB 3.4Å; I740-K743 PolarHBondContact O-N 3.29Å; Q741-K743 PolarHBondContact O-N 3.41Å; K743-E745 VanDerWaalsContact C-N 3.29Å; K743-E745 PolarHBondContact O-N 3.49Å; K743-K746 CarbonylContact O-C 3.58Å; K743-K746 PolarHBondContact O-N 3.19Å; K743-K746 VanDerWaalsContact O-N 3.1Å; K743-L747 WeakPolarHBondContact O-CB 3.49Å; K743-L747 PolarHBondContact O-N 3.04Å
744D66.3Low64.4Low71 Ų71115.3 Ų115.338%0.3856%0.558SS.*Hα-helixtrans-62.7-32.4-178.5-61.5-27.1000112.9I740 Q741 L747 R748I740-D744 WeakPolarHBondContact CG2-OD2 3.49Å; I740-D744 VanDerWaalsContact O-CG 3.29Å; I740-D744 PolarHBondContact O-N 2.9Å; Q741-D744 PolarHBondContact O-N 3.48Å; D744-L747 PolarHBondContact O-N 2.71Å; D744-R748 PolarHBondContact O-N 2.89Å
745E68.8Low65.3Low122 Ų122113.6 Ų113.657%0.5755%0.549SS*.Hα-helixtrans-74.3-32.5174.3-61.8-17114300113.3K743 T749K743-E745 VanDerWaalsContact C-N 3.29Å; K743-E745 PolarHBondContact O-N 3.49Å; E745-T749 PolarHBondContact O-N 3.42Å; E745-T749 PolarHBondContact O-OG1 3.15Å; E745-T749 VanDerWaalsContact O-OG1 3.08Å
746K66.9Low66.3Low113 Ų113109.5 Ų109.549%0.49154%0.536SS..Hα-helixtrans-75.8-30.3172.4-66.5174.1-171.6124.90111.2E742 K743 T749 V750E742-K746 PolarHBondContact O-NZ 3.05Å; E742-K746 VanDerWaalsContact O-NZ 3.16Å; E742-K746 IonicContact OE2-NZ 2.67Å; E742-K746 PolarHBondContact OE2-NZ 2.89Å; K743-K746 CarbonylContact O-C 3.58Å; K743-K746 PolarHBondContact O-N 3.19Å; K743-K746 VanDerWaalsContact O-N 3.1Å; K746-T749 PolarHBondContact O-OG1 3.05Å; K746-V750 WeakPolarHBondContact O-CB 3.13Å; K746-V750 VanDerWaalsContact O-CG2 3.28Å; K746-V750 WeakPolarHBondContact O-CG2 3.47Å; K746-V750 PolarHBondContact O-N 2.91Å; K746-V750 VanDerWaalsContact O-N 3.11Å
747L71.6Confident67.4Low89 Ų89105.6 Ų105.647%0.46653%0.525SS..Hα-helixtrans-65-48.7173.1-166.271.7000109.4K743 D744 T749 V750 E751K743-L747 WeakPolarHBondContact O-CB 3.49Å; K743-L747 PolarHBondContact O-N 3.04Å; D744-L747 PolarHBondContact O-N 2.71Å; L747-T749 VanDerWaalsContact C-N 3.32Å; L747-T749 PolarHBondContact O-N 2.8Å; L747-V750 CarbonylContact O-C 3.57Å; L747-V750 WeakPolarHBondContact O-CA 3.16Å; L747-V750 WeakPolarHBondContact O-CB 3.31Å; L747-V750 PolarHBondContact O-N 3.37Å; L747-E751 HydrophobicContact CG-CG 4.36Å; L747-E751 WeakPolarHBondContact O-CB 3.26Å; L747-E751 WeakPolarHBondContact O-CG 3.46Å; L747-E751 PolarHBondContact O-N 3.31Å
748R72.6Confident68.4Low131 Ų131104.8 Ų104.849%0.49452%0.524SS..Hα-helixtrans-55.9-41.3178.2-161.5-177.7-54.5122.99.5113.9D744 E751 E752D744-R748 PolarHBondContact O-N 2.89Å; R748-E751 WeakPolarHBondContact CA-OE2 3.38Å; R748-E751 PolarHBondContact O-N 3.42Å; R748-E752 WeakPolarHBondContact O-CG 3.31Å; R748-E752 PolarHBondContact O-N 2.84Å
749T70.2Confident69.3Low78 Ų78101.7 Ų101.748%0.47952%0.515SS..Hα-helixtrans-75.5-25.6176.538.40000113.3E745 K746 L747 L753E745-T749 PolarHBondContact O-N 3.42Å; E745-T749 PolarHBondContact O-OG1 3.15Å; E745-T749 VanDerWaalsContact O-OG1 3.08Å; K746-T749 PolarHBondContact O-OG1 3.05Å; L747-T749 VanDerWaalsContact C-N 3.32Å; L747-T749 PolarHBondContact O-N 2.8Å; T749-L753 WeakPolarHBondContact O-CG 3.16Å; T749-L753 PolarHBondContact O-N 3.17Å
750V70.9Confident70.1Confident73 Ų73103.3 Ų103.344%0.44252%0.515SS..Hα-helixtrans-75.9-34.9168.8168.20000111.1K746 L747 L753 L754K746-V750 WeakPolarHBondContact O-CB 3.13Å; K746-V750 VanDerWaalsContact O-CG2 3.28Å; K746-V750 WeakPolarHBondContact O-CG2 3.47Å; K746-V750 PolarHBondContact O-N 2.91Å; K746-V750 VanDerWaalsContact O-N 3.11Å; L747-V750 CarbonylContact O-C 3.57Å; L747-V750 WeakPolarHBondContact O-CA 3.16Å; L747-V750 WeakPolarHBondContact O-CB 3.31Å; L747-V750 PolarHBondContact O-N 3.37Å; V750-L753 PolarHBondContact O-N 3.46Å; V750-L754 HydrophobicContact CG1-CD1 3.74Å; V750-L754 HydrophobicContact CG1-CG 4.15Å; V750-L754 VanDerWaalsContact O-CB 3.29Å; V750-L754 WeakPolarHBondContact O-CB 3.49Å; V750-L754 VanDerWaalsContact O-CG 3.25Å; V750-L754 WeakPolarHBondContact O-CG 3.39Å; V750-L754 PolarHBondContact O-N 3.48Å
751E73.5Confident70.5Confident100 Ų100103.1 Ų103.147%0.46752%0.518SS..Hα-helixtrans-64.1-46.7175.7-74.8168161.100111.2L747 R748 L753 L754 E755L747-E751 HydrophobicContact CG-CG 4.36Å; L747-E751 WeakPolarHBondContact O-CB 3.26Å; L747-E751 WeakPolarHBondContact O-CG 3.46Å; L747-E751 PolarHBondContact O-N 3.31Å; R748-E751 WeakPolarHBondContact CA-OE2 3.38Å; R748-E751 PolarHBondContact O-N 3.42Å; E751-L753 VanDerWaalsContact C-N 3.32Å; E751-L753 PolarHBondContact O-N 3.25Å; E751-L754 CarbonylContact O-C 3.6Å; E751-L754 PolarHBondContact O-N 2.79Å; E751-E755 WeakPolarHBondContact O-CB 3.33Å; E751-E755 PolarHBondContact O-N 3.1Å
752E71.3Confident71.1Confident118 Ų11898.8 Ų98.855%0.55151%0.506SS*.Hα-helixtrans-60.2-38.4174.7-72.4173.6172.700112.7R748 T756R748-E752 WeakPolarHBondContact O-CG 3.31Å; R748-E752 PolarHBondContact O-N 2.84Å; E752-T756 WeakPolarHBondContact O-CB 3.41Å; E752-T756 PolarHBondContact O-N 3.01Å; E752-T756 PolarHBondContact O-OG1 3.41Å
753L71Confident71.7Confident129 Ų12996 Ų9668%0.67550%0.498SS*.Hα-helixtrans-72.9-36.3175.6-73.5172.8000112.5T749 V750 E751 G757T749-L753 WeakPolarHBondContact O-CG 3.16Å; T749-L753 PolarHBondContact O-N 3.17Å; V750-L753 PolarHBondContact O-N 3.46Å; E751-L753 VanDerWaalsContact C-N 3.32Å; E751-L753 PolarHBondContact O-N 3.25Å; L753-G757 PolarHBondContact O-N 3.39Å
754L71.7Confident72.3Confident100 Ų10096 Ų9652%0.52449%0.494SS..Hα-helixtrans-69.3-38.6173.7-78.2172.5000111.4V750 E751 G757 L758V750-L754 HydrophobicContact CG1-CD1 3.74Å; V750-L754 HydrophobicContact CG1-CG 4.15Å; V750-L754 VanDerWaalsContact O-CB 3.29Å; V750-L754 WeakPolarHBondContact O-CB 3.49Å; V750-L754 VanDerWaalsContact O-CG 3.25Å; V750-L754 WeakPolarHBondContact O-CG 3.39Å; V750-L754 PolarHBondContact O-N 3.48Å; E751-L754 CarbonylContact O-C 3.6Å; E751-L754 PolarHBondContact O-N 2.79Å; L754-G757 CarbonylContact O-C 3.55Å; L754-G757 PolarHBondContact O-N 2.7Å; L754-L758 VanDerWaalsContact O-CB 3.26Å; L754-L758 WeakPolarHBondContact O-CB 3.36Å; L754-L758 WeakPolarHBondContact O-CG 3.34Å; L754-L758 PolarHBondContact O-N 3.18Å
755E75.1Confident72.9Confident126 Ų12697.5 Ų97.559%0.58950%0.499SS*.Hα-helixtrans-64.8-44.9175.6-173166-157.400110.5E751 G757 L758 I759E751-E755 WeakPolarHBondContact O-CB 3.33Å; E751-E755 PolarHBondContact O-N 3.1Å; E755-G757 VanDerWaalsContact C-N 3.29Å; E755-G757 PolarHBondContact O-N 2.95Å; E755-L758 PolarHBondContact O-N 3.31Å; E755-I759 HydrophobicContact CG-CD1 4.3Å; E755-I759 VanDerWaalsContact O-CG1 3.28Å; E755-I759 WeakPolarHBondContact O-CG1 3.4Å; E755-I759 PolarHBondContact O-N 3Å
756T72Confident73.3Confident81 Ų8198.1 Ų98.150%0.49750%0.502SS..Hα-helixtrans-59.7-39.2171.8-53.10000112E752 Q760E752-T756 WeakPolarHBondContact O-CB 3.41Å; E752-T756 PolarHBondContact O-N 3.01Å; E752-T756 PolarHBondContact O-OG1 3.41Å; T756-Q760 PolarHBondContact O-N 2.96Å
757G75.1Confident73.9Confident31 Ų3198.3 Ų98.332%0.3250%0.504SS..Hα-helixtrans-70-40.2175.900000113.5L753 L754 E755 Q760 V761L753-G757 PolarHBondContact O-N 3.39Å; L754-G757 CarbonylContact O-C 3.55Å; L754-G757 PolarHBondContact O-N 2.7Å; E755-G757 VanDerWaalsContact C-N 3.29Å; E755-G757 PolarHBondContact O-N 2.95Å; G757-Q760 CarbonylContact O-C 3.52Å; G757-Q760 PolarHBondContact O-N 2.83Å; G757-V761 VanDerWaalsContact O-CG2 3.28Å; G757-V761 WeakPolarHBondContact O-CG2 3.5Å; G757-V761 PolarHBondContact O-N 2.92Å
758L76.5Confident74.2Confident115 Ų11598.4 Ų98.460%0.60251%0.505SS*.Hα-helixtrans-68.5-38.3178.7-77.3167.6000111.2L754 E755 V761 A762L754-L758 VanDerWaalsContact O-CB 3.26Å; L754-L758 WeakPolarHBondContact O-CB 3.36Å; L754-L758 WeakPolarHBondContact O-CG 3.34Å; L754-L758 PolarHBondContact O-N 3.18Å; E755-L758 PolarHBondContact O-N 3.31Å; L758-V761 PolarHBondContact O-N 3Å; L758-A762 VanDerWaalsContact O-CB 3.32Å; L758-A762 WeakPolarHBondContact O-CB 3.35Å; L758-A762 PolarHBondContact O-N 2.98Å
759I74.1Confident74.7Confident107 Ų10794.7 Ų94.755%0.54950%0.499SS..Hα-helixtrans-59.9-47.7170.8-68.6164.5000109.8E755 V761 A762 T763E755-I759 HydrophobicContact CG-CD1 4.3Å; E755-I759 VanDerWaalsContact O-CG1 3.28Å; E755-I759 WeakPolarHBondContact O-CG1 3.4Å; E755-I759 PolarHBondContact O-N 3Å; I759-V761 VanDerWaalsContact C-N 3.32Å; I759-V761 PolarHBondContact O-N 3.42Å; I759-A762 PolarHBondContact O-N 3.47Å; I759-T763 PolarHBondContact O-N 3.17Å; I759-T763 PolarHBondContact O-OG1 3.37Å
760Q73.6Confident75.2Confident100 Ų10093.4 Ų93.447%0.46750%0.496SS..Hα-helixtrans-65.8-29.6176.4-80.6-163.730.200114.7T756 G757 R764T756-Q760 PolarHBondContact O-N 2.96Å; G757-Q760 CarbonylContact O-C 3.52Å; G757-Q760 PolarHBondContact O-N 2.83Å; Q760-R764 WeakPolarHBondContact O-CG 3.5Å; Q760-R764 PolarHBondContact O-N 2.78Å; Q760-R764 PolarHBondContact O-NH1 3.42Å; Q760-R764 VanDerWaalsContact OE1-NH1 3.15Å
761V72.1Confident75.6Confident81 Ų8194.1 Ų94.149%0.49150%0.497SS..Hα-helixtrans-73.8-42173.5168.20000109.5G757 L758 I759 T763 R764 E765G757-V761 VanDerWaalsContact O-CG2 3.28Å; G757-V761 WeakPolarHBondContact O-CG2 3.5Å; G757-V761 PolarHBondContact O-N 2.92Å; L758-V761 PolarHBondContact O-N 3Å; I759-V761 VanDerWaalsContact C-N 3.32Å; I759-V761 PolarHBondContact O-N 3.42Å; V761-T763 PolarHBondContact O-N 2.9Å; V761-R764 CarbonylContact O-C 3.58Å; V761-R764 PolarHBondContact O-N 3.36Å; V761-E765 VanDerWaalsContact O-CB 3.27Å; V761-E765 WeakPolarHBondContact O-CB 3.31Å; V761-E765 PolarHBondContact O-N 3.11Å
762A73.6Confident76.1Confident49 Ų4996.3 Ų96.341%0.40550%0.501SS..Hα-helixtrans-60.7-43.517500000112L758 I759 R764 E765 E766L758-A762 VanDerWaalsContact O-CB 3.32Å; L758-A762 WeakPolarHBondContact O-CB 3.35Å; L758-A762 PolarHBondContact O-N 2.98Å; I759-A762 PolarHBondContact O-N 3.47Å; A762-R764 PolarHBondContact O-N 2.86Å; A762-E765 PolarHBondContact O-N 3.44Å; A762-E766 WeakPolarHBondContact O-CG 3.4Å; A762-E766 PolarHBondContact O-N 2.84Å
763T73.9Confident76.6Confident66 Ų6694.9 Ų94.941%0.40550%0.5SS..Hα-helixtrans-62.3-42.1175-35.10000111.7I759 V761 E765 E766 E767I759-T763 PolarHBondContact O-N 3.17Å; I759-T763 PolarHBondContact O-OG1 3.37Å; V761-T763 PolarHBondContact O-N 2.9Å; T763-E765 VanDerWaalsContact C-N 3.35Å; T763-E766 PolarHBondContact O-N 2.99Å; T763-E767 WeakPolarHBondContact O-CG 3.43Å; T763-E767 PolarHBondContact O-N 3.49Å
764R77.8Confident77.2Confident137 Ų13794.6 Ų94.652%0.51750%0.495SS..Hα-helixtrans-69.7-29.8175.2-73.9-176.3-178.195-3113.1Q760 V761 A762 L768Q760-R764 WeakPolarHBondContact O-CG 3.5Å; Q760-R764 PolarHBondContact O-N 2.78Å; Q760-R764 PolarHBondContact O-NH1 3.42Å; Q760-R764 VanDerWaalsContact OE1-NH1 3.15Å; V761-R764 CarbonylContact O-C 3.58Å; V761-R764 PolarHBondContact O-N 3.36Å; A762-R764 PolarHBondContact O-N 2.86Å; R764-L768 VanDerWaalsContact O-CB 3.24Å; R764-L768 WeakPolarHBondContact O-CB 3.23Å; R764-L768 WeakPolarHBondContact O-CG 3.29Å; R764-L768 PolarHBondContact O-N 2.92Å
765E78.1Confident77.1Confident102 Ų10294 Ų9448%0.47749%0.492SS..Hα-helixtrans-71.7-38.4175.1-174103.3-123.700110.3V761 A762 T763 L768 S769V761-E765 VanDerWaalsContact O-CB 3.27Å; V761-E765 WeakPolarHBondContact O-CB 3.31Å; V761-E765 PolarHBondContact O-N 3.11Å; A762-E765 PolarHBondContact O-N 3.44Å; T763-E765 VanDerWaalsContact C-N 3.35Å; E765-L768 CarbonylContact O-C 3.53Å; E765-L768 PolarHBondContact O-N 2.63Å; E765-S769 VanDerWaalsContact O-CB 3.28Å; E765-S769 WeakPolarHBondContact O-CB 3.4Å; E765-S769 PolarHBondContact O-N 3.45Å
766E78.2Confident77.5Confident135 Ų13590.7 Ų90.763%0.63148%0.483SS*.Hα-helixtrans-63.2-48.3170.4-74.7178.8166.500111.3A762 T763 L768 S769 A770A762-E766 WeakPolarHBondContact O-CG 3.4Å; A762-E766 PolarHBondContact O-N 2.84Å; T763-E766 PolarHBondContact O-N 2.99Å; E766-L768 PolarHBondContact O-N 2.79Å; E766-S769 WeakPolarHBondContact O-CA 3.29Å; E766-S769 WeakPolarHBondContact O-CB 3.5Å; E766-S769 PolarHBondContact O-N 3.4Å; E766-S769 VanDerWaalsContact O-N 3.08Å; E766-S769 PolarHBondContact O-OG 3.45Å; E766-A770 PolarHBondContact O-N 2.86Å
767E79.9Confident78.1Confident117 Ų11789.6 Ų89.655%0.54748%0.477SS..Hα-helixtrans-57.7-46.2172.9-73173.6174.700112T763 S769 A770 I771T763-E767 WeakPolarHBondContact O-CG 3.43Å; T763-E767 PolarHBondContact O-N 3.49Å; E767-S769 VanDerWaalsContact C-N 3.29Å; E767-S769 PolarHBondContact O-N 2.98Å; E767-A770 WeakPolarHBondContact O-CB 3.43Å; E767-A770 PolarHBondContact O-N 3.5Å; E767-I771 WeakPolarHBondContact O-CG1 3.24Å; E767-I771 PolarHBondContact O-N 3.22Å
768L77.8Confident78.4Confident91 Ų9192 Ų9248%0.47648%0.482SS..Hα-helixtrans-65-31.9174.5-77.1169.5000112.1R764 E765 E766 R772R764-L768 VanDerWaalsContact O-CB 3.24Å; R764-L768 WeakPolarHBondContact O-CB 3.23Å; R764-L768 WeakPolarHBondContact O-CG 3.29Å; R764-L768 PolarHBondContact O-N 2.92Å; E765-L768 CarbonylContact O-C 3.53Å; E765-L768 PolarHBondContact O-N 2.63Å; E766-L768 PolarHBondContact O-N 2.79Å; L768-R772 WeakPolarHBondContact O-CB 3.37Å; L768-R772 PolarHBondContact O-N 3.26Å
769S81.3Confident78.6Confident52 Ų5290 Ų9036%0.36447%0.474SS..Hα-helixtrans-70-36.6174.885.20000111.6E765 E766 E767 R772 T773E765-S769 VanDerWaalsContact O-CB 3.28Å; E765-S769 WeakPolarHBondContact O-CB 3.4Å; E765-S769 PolarHBondContact O-N 3.45Å; E766-S769 WeakPolarHBondContact O-CA 3.29Å; E766-S769 WeakPolarHBondContact O-CB 3.5Å; E766-S769 PolarHBondContact O-N 3.4Å; E766-S769 VanDerWaalsContact O-N 3.08Å; E766-S769 PolarHBondContact O-OG 3.45Å; E767-S769 VanDerWaalsContact C-N 3.29Å; E767-S769 PolarHBondContact O-N 2.98Å; S769-R772 PolarHBondContact O-N 3Å; S769-T773 WeakPolarHBondContact O-CB 3.31Å; S769-T773 WeakPolarHBondContact O-CG2 3.48Å; S769-T773 PolarHBondContact O-N 3.39Å; S769-T773 PolarHBondContact O-OG1 3.28Å
770A80.9Confident79Confident52 Ų5290.9 Ų90.943%0.4347%0.471SS..Hα-helixtrans-64.5-49173.100000110.4E766 E767 R772 T773 E774E766-A770 PolarHBondContact O-N 2.86Å; E767-A770 WeakPolarHBondContact O-CB 3.43Å; E767-A770 PolarHBondContact O-N 3.5Å; A770-R772 VanDerWaalsContact C-N 3.26Å; A770-R772 PolarHBondContact O-N 3.28Å; A770-T773 WeakPolarHBondContact CA-OG1 3.36Å; A770-T773 PolarHBondContact O-N 3.39Å; A770-T773 PolarHBondContact O-OG1 3.49Å; A770-E774 WeakPolarHBondContact O-CB 3.36Å; A770-E774 PolarHBondContact O-N 2.94Å
771I80.2Confident79.3Confident88 Ų8891.2 Ų91.245%0.45147%0.472SS..Hα-helixtrans-61.4-34.9175-66166.2000111.4E767 N775E767-I771 WeakPolarHBondContact O-CG1 3.24Å; E767-I771 PolarHBondContact O-N 3.22Å; I771-N775 WeakPolarHBondContact CG2-ND2 3.46Å; I771-N775 VanDerWaalsContact O-CB 3.28Å; I771-N775 WeakPolarHBondContact O-CB 3.42Å; I771-N775 PolarHBondContact O-N 2.83Å; I771-N775 PolarHBondContact O-ND2 3.22Å
772R83.3Confident79.4Confident146 Ų14691.8 Ų91.855%0.55148%0.476SS*.Hα-helixtrans-75.7-32.3179.2-164.7-176.9-60.1142.7-1112.5L768 S769 A770 S776L768-R772 WeakPolarHBondContact O-CB 3.37Å; L768-R772 PolarHBondContact O-N 3.26Å; S769-R772 PolarHBondContact O-N 3Å; A770-R772 VanDerWaalsContact C-N 3.26Å; A770-R772 PolarHBondContact O-N 3.28Å; R772-S776 VanDerWaalsContact O-CB 3.27Å; R772-S776 WeakPolarHBondContact O-CB 3.33Å; R772-S776 PolarHBondContact O-N 2.88Å
773T82.4Confident79.6Confident87 Ų8795.5 Ų95.553%0.53449%0.485SS..Hα-helixtrans-77.6-34.8173.350.50000112.2S769 A770 S776 T777S769-T773 WeakPolarHBondContact O-CB 3.31Å; S769-T773 WeakPolarHBondContact O-CG2 3.48Å; S769-T773 PolarHBondContact O-N 3.39Å; S769-T773 PolarHBondContact O-OG1 3.28Å; A770-T773 WeakPolarHBondContact CA-OG1 3.36Å; A770-T773 PolarHBondContact O-N 3.39Å; A770-T773 PolarHBondContact O-OG1 3.49Å; T773-S776 PolarHBondContact O-N 3.19Å; T773-T777 WeakPolarHBondContact O-CB 3.36Å; T773-T777 PolarHBondContact O-N 3.19Å; T773-T777 PolarHBondContact O-OG1 3.43Å
774E83.5Confident79.8Confident123 Ų12397.1 Ų97.158%0.57549%0.488SS*.Hα-helixtrans-63.2-51.2168.6-173.1175.8-160.400110.7A770 S776 T777 L778A770-E774 WeakPolarHBondContact O-CB 3.36Å; A770-E774 PolarHBondContact O-N 2.94Å; E774-S776 VanDerWaalsContact C-N 3.3Å; E774-S776 PolarHBondContact O-N 3.34Å; E774-T777 CarbonylContact O-C 3.52Å; E774-T777 WeakPolarHBondContact O-CA 3.41Å; E774-T777 PolarHBondContact O-N 2.89Å; E774-L778 HydrophobicContact CG-CD1 4.16Å; E774-L778 PolarHBondContact O-N 3.1Å
775N69.1Low79.6Confident87 Ų8796.1 Ų96.147%0.46549%0.492SS..Hα-helixtrans-59.1-38.1173.7-87.6-80.5000112.6I771 T777 T779I771-N775 WeakPolarHBondContact CG2-ND2 3.46Å; I771-N775 VanDerWaalsContact O-CB 3.28Å; I771-N775 WeakPolarHBondContact O-CB 3.42Å; I771-N775 PolarHBondContact O-N 2.83Å; I771-N775 PolarHBondContact O-ND2 3.22Å; N775-T777 VanDerWaalsContact C-N 3.28Å; N775-T777 PolarHBondContact O-N 3.45Å; N775-T779 WeakPolarHBondContact O-CB 3.43Å; N775-T779 PolarHBondContact O-N 2.84Å; N775-T779 PolarHBondContact O-OG1 2.82Å
776S84.7Confident79.1Confident57 Ų5798.2 Ų98.240%0.39950%0.499SS..Hα-helixtrans-64-35174-179.20000112R772 T773 E774 R780R772-S776 VanDerWaalsContact O-CB 3.27Å; R772-S776 WeakPolarHBondContact O-CB 3.33Å; R772-S776 PolarHBondContact O-N 2.88Å; T773-S776 PolarHBondContact O-N 3.19Å; E774-S776 VanDerWaalsContact C-N 3.3Å; E774-S776 PolarHBondContact O-N 3.34Å; S776-R780 WeakPolarHBondContact O-CB 3.28Å; S776-R780 PolarHBondContact O-N 2.8Å; S776-R780 PolarHBondContact OG-NH2 3.47Å
777T84.9Confident78.5Confident58 Ų5894 Ų9436%0.35649%0.488SS..Hα-helixtrans-77.1-44.3179.9-580000111.6T773 E774 N775 T779 R780 E781T773-T777 WeakPolarHBondContact O-CB 3.36Å; T773-T777 PolarHBondContact O-N 3.19Å; T773-T777 PolarHBondContact O-OG1 3.43Å; E774-T777 CarbonylContact O-C 3.52Å; E774-T777 WeakPolarHBondContact O-CA 3.41Å; E774-T777 PolarHBondContact O-N 2.89Å; N775-T777 VanDerWaalsContact C-N 3.28Å; N775-T777 PolarHBondContact O-N 3.45Å; T777-T779 VanDerWaalsContact C-N 3.3Å; T777-T779 PolarHBondContact O-N 2.92Å; T777-R780 WeakPolarHBondContact O-CA 3.34Å; T777-R780 WeakPolarHBondContact O-CB 3.44Å; T777-R780 PolarHBondContact O-N 3.03Å; T777-R780 VanDerWaalsContact O-N 3.07Å; T777-R780 PolarHBondContact OG1-NH1 2.9Å; T777-E781 PolarHBondContact O-N 3.13Å
778L81.4Confident78Confident83 Ų8393.8 Ų93.844%0.43549%0.485SS..Hα-helixtrans-59.9-39.3169.2-69.7169.8000111.8E774 R780 E781 V782E774-L778 HydrophobicContact CG-CD1 4.16Å; E774-L778 PolarHBondContact O-N 3.1Å; L778-R780 VanDerWaalsContact C-N 3.31Å; L778-R780 PolarHBondContact O-N 3.45Å; L778-E781 PolarHBondContact O-N 2.93Å; L778-V782 WeakPolarHBondContact O-CB 3.33Å; L778-V782 VanDerWaalsContact O-CG2 3.23Å; L778-V782 WeakPolarHBondContact O-CG2 3.5Å; L778-V782 PolarHBondContact O-N 2.94Å
779T79.6Confident77Confident71 Ų7196 Ų9644%0.43649%0.493SS..Hα-helixtrans-63.1-38.6173.6-60.90000111.3N775 T777 Q783N775-T779 WeakPolarHBondContact O-CB 3.43Å; N775-T779 PolarHBondContact O-N 2.84Å; N775-T779 PolarHBondContact O-OG1 2.82Å; T777-T779 VanDerWaalsContact C-N 3.3Å; T777-T779 PolarHBondContact O-N 2.92Å; T779-Q783 WeakPolarHBondContact O-CB 3.38Å; T779-Q783 VanDerWaalsContact O-CG 3.28Å; T779-Q783 WeakPolarHBondContact O-CG 3.34Å; T779-Q783 PolarHBondContact O-N 3.46Å
780R83.1Confident75.7Confident126 Ų12696.4 Ų96.448%0.47550%0.496SS..Hα-helixtrans-68.3-43.2176.7-164.7-176.5-53.810210.8111.6S776 T777 L778 Q783 E784S776-R780 WeakPolarHBondContact O-CB 3.28Å; S776-R780 PolarHBondContact O-N 2.8Å; S776-R780 PolarHBondContact OG-NH2 3.47Å; T777-R780 WeakPolarHBondContact O-CA 3.34Å; T777-R780 WeakPolarHBondContact O-CB 3.44Å; T777-R780 PolarHBondContact O-N 3.03Å; T777-R780 VanDerWaalsContact O-N 3.07Å; T777-R780 PolarHBondContact OG1-NH1 2.9Å; L778-R780 VanDerWaalsContact C-N 3.31Å; L778-R780 PolarHBondContact O-N 3.45Å; R780-Q783 PolarHBondContact O-N 2.96Å; R780-E784 WeakPolarHBondContact O-CB 3.38Å; R780-E784 PolarHBondContact O-N 3.05Å
781E80.1Confident74.4Confident108 Ų108100.5 Ų100.551%0.50551%0.511SS..Hα-helixtrans-64.2-42174.1-72.1-178.8168.500111.8T777 L778 Q783 E784 L785T777-E781 PolarHBondContact O-N 3.13Å; L778-E781 PolarHBondContact O-N 2.93Å; E781-Q783 VanDerWaalsContact C-N 3.35Å; E781-E784 PolarHBondContact O-N 3.05Å; E781-L785 WeakPolarHBondContact O-CB 3.43Å; E781-L785 VanDerWaalsContact O-CG 3.29Å; E781-L785 WeakPolarHBondContact O-CG 3.21Å; E781-L785 PolarHBondContact O-N 2.87Å
782V73.5Confident73.1Confident93 Ų93104.5 Ų104.556%0.56453%0.528SS*.Hα-helixtrans-63.8-39.4173.5168.10000111.2L778 K786L778-V782 WeakPolarHBondContact O-CB 3.33Å; L778-V782 VanDerWaalsContact O-CG2 3.23Å; L778-V782 WeakPolarHBondContact O-CG2 3.5Å; L778-V782 PolarHBondContact O-N 2.94Å; V782-K786 WeakPolarHBondContact O-CB 3.42Å; V782-K786 PolarHBondContact O-N 3.45Å
783Q77.4Confident71.5Confident127 Ų127100.9 Ų100.959%0.59352%0.522SS*.Hα-helixtrans-66.9-38.2173-79.2179.7-11.800112.3T779 R780 E781 K786 A787T779-Q783 WeakPolarHBondContact O-CB 3.38Å; T779-Q783 VanDerWaalsContact O-CG 3.28Å; T779-Q783 WeakPolarHBondContact O-CG 3.34Å; T779-Q783 PolarHBondContact O-N 3.46Å; R780-Q783 PolarHBondContact O-N 2.96Å; E781-Q783 VanDerWaalsContact C-N 3.35Å; Q783-K786 PolarHBondContact O-N 3.35Å; Q783-A787 WeakPolarHBondContact O-CB 3.26Å; Q783-A787 PolarHBondContact O-N 2.9Å
784E79Confident70.3Confident100 Ų100101.9 Ų101.947%0.46753%0.532SS..Hα-helixtrans-72.3-37.3178.5-161.6-173.6144.800111.8R780 E781 A787 K788R780-E784 WeakPolarHBondContact O-CB 3.38Å; R780-E784 PolarHBondContact O-N 3.05Å; E781-E784 PolarHBondContact O-N 3.05Å; E784-A787 PolarHBondContact O-N 3.4Å; E784-K788 WeakPolarHBondContact O-CB 3.22Å; E784-K788 VanDerWaalsContact O-CG 3.29Å; E784-K788 WeakPolarHBondContact O-CG 3.33Å; E784-K788 PolarHBondContact O-N 3.01Å; E784-K788 WeakPolarHBondContact OE1-CE 3.5Å; E784-K788 IonicContact OE1-NZ 3.65Å; E784-K788 PolarHBondContact OE1-NZ 3.15Å
785L72.4Confident69Low115 Ų115102.2 Ų102.260%0.60253%0.532SS*.Hα-helixtrans-65.9-39.3169.5-72.3170.6000111.5E781 K788 Q789E781-L785 WeakPolarHBondContact O-CB 3.43Å; E781-L785 VanDerWaalsContact O-CG 3.29Å; E781-L785 WeakPolarHBondContact O-CG 3.21Å; E781-L785 PolarHBondContact O-N 2.87Å; L785-K788 PolarHBondContact O-N 3.31Å; L785-Q789 WeakPolarHBondContact O-CB 3.46Å; L785-Q789 PolarHBondContact O-N 2.92Å
786K67.6Low68.9Low146 Ų146101.1 Ų101.164%0.63553%0.528SS*.Hα-helixtrans-68.2-34.3174.9-171.8174-177.1176.80112.4V782 Q783 Q789 S790V782-K786 WeakPolarHBondContact O-CB 3.42Å; V782-K786 PolarHBondContact O-N 3.45Å; Q783-K786 PolarHBondContact O-N 3.35Å; K786-Q789 PolarHBondContact O-N 2.87Å; K786-S790 WeakPolarHBondContact O-CB 3.41Å; K786-S790 PolarHBondContact O-N 3.17Å
787A65.8Low68.1Low47 Ų47101.7 Ų101.739%0.38853%0.532SS..Hα-helixtrans-66.2-48.8170.800000110.8Q783 E784 Q789 S790 D791Q783-A787 WeakPolarHBondContact O-CB 3.26Å; Q783-A787 PolarHBondContact O-N 2.9Å; E784-A787 PolarHBondContact O-N 3.4Å; A787-Q789 PolarHBondContact O-N 3.49Å; A787-S790 CarbonylContact O-C 3.59Å; A787-S790 WeakPolarHBondContact O-CA 3.42Å; A787-S790 VanDerWaalsContact O-CB 3.28Å; A787-S790 WeakPolarHBondContact O-CB 3.34Å; A787-S790 PolarHBondContact O-N 2.95Å; A787-D791 PolarHBondContact O-N 3.05Å
788K69.4Low67.4Low113 Ų113103.7 Ų103.749%0.49154%0.54SS..Hα-helixtrans-60.5-32.3174.6-71.4165.9-172.9166.90113E784 L785 Q792E784-K788 WeakPolarHBondContact O-CB 3.22Å; E784-K788 VanDerWaalsContact O-CG 3.29Å; E784-K788 WeakPolarHBondContact O-CG 3.33Å; E784-K788 PolarHBondContact O-N 3.01Å; E784-K788 WeakPolarHBondContact OE1-CE 3.5Å; E784-K788 IonicContact OE1-NZ 3.65Å; E784-K788 PolarHBondContact OE1-NZ 3.15Å; L785-K788 PolarHBondContact O-N 3.31Å; K788-Q792 WeakPolarHBondContact O-CB 3.45Å; K788-Q792 PolarHBondContact O-N 3.4Å
789Q57.1Low67Low137 Ų137103.8 Ų103.864%0.6454%0.54SS*.Hα-helixtrans-71.4-35.3172-170.8179.425.400112.3L785 K786 A787L785-Q789 WeakPolarHBondContact O-CB 3.46Å; L785-Q789 PolarHBondContact O-N 2.92Å; K786-Q789 PolarHBondContact O-N 2.87Å; A787-Q789 PolarHBondContact O-N 3.49Å
790S53.8Low66.9Low61 Ų61105.6 Ų105.643%0.42754%0.543SS..Hα-helixtrans-67.7-41.3173.8-169.60000111.9K786 A787 Q792K786-S790 WeakPolarHBondContact O-CB 3.41Å; K786-S790 PolarHBondContact O-N 3.17Å; A787-S790 CarbonylContact O-C 3.59Å; A787-S790 WeakPolarHBondContact O-CA 3.42Å; A787-S790 VanDerWaalsContact O-CB 3.28Å; A787-S790 WeakPolarHBondContact O-CB 3.34Å; A787-S790 PolarHBondContact O-N 2.95Å; S790-Q792 PolarHBondContact O-N 3.43Å
791D55.3Low66.6Low138 Ų138102.7 Ų102.774%0.73854%0.538SS*.Hα-helixtrans-72.3-16-178.8-66.5-21.6000113.3A787A787-D791 PolarHBondContact O-N 3.05Å
792Q51.2Low66.5Low172 Ų172102.2 Ų102.280%0.80454%0.538SS*.THydrogen-bonded Turntrans-95.83.5-177.8-157.4166.160.700114K788 S790K788-Q792 WeakPolarHBondContact O-CB 3.45Å; K788-Q792 PolarHBondContact O-N 3.4Å; S790-Q792 PolarHBondContact O-N 3.43Å
793V49.8Very low66.8Low70 Ų70104.4 Ų104.442%0.42454%0.54SS..  trans-136109-173-175.60000112.3F795V793-F795 HydrophobicContact CG1-CB 3.96Å; V793-F795 HydrophobicContact CG1-CD2 3.49Å; V793-F795 VanDerWaalsContact CG1-CD2 3.49Å; V793-F795 HydrophobicContact CG1-CE2 4.39Å; V793-F795 HydrophobicContact CG1-CG 4.09Å; V793-F795 PolarHBondContact O-N 3.06Å
794S58Low67.2Low107 Ų107105.5 Ų105.575%0.74854%0.538SS*.THydrogen-bonded Turntrans-64.46-178.7580000116.4
795F56.8Low67.6Low131 Ų131104.4 Ų104.458%0.57554%0.539SS*.Hα-helixtrans-78.7-22-179.2-76.4-107.9000113.2V793 L798 I799V793-F795 HydrophobicContact CG1-CB 3.96Å; V793-F795 HydrophobicContact CG1-CD2 3.49Å; V793-F795 VanDerWaalsContact CG1-CD2 3.49Å; V793-F795 HydrophobicContact CG1-CE2 4.39Å; V793-F795 HydrophobicContact CG1-CG 4.09Å; V793-F795 PolarHBondContact O-N 3.06Å; F795-L798 PolarHBondContact O-N 2.91Å; F795-I799 HydrophobicContact CB-CD1 4.47Å; F795-I799 WeakPolarHBondContact O-CB 3.34Å; F795-I799 VanDerWaalsContact O-CG1 3.26Å; F795-I799 WeakPolarHBondContact O-CG1 3.28Å; F795-I799 PolarHBondContact O-N 2.84Å
796V66Low68.1Low63 Ų63103.5 Ų103.538%0.38253%0.533SS..Hα-helixtrans-61.9-48.2179.3-178.10000110.7L798 I799 E800V796-L798 VanDerWaalsContact C-N 3.34Å; V796-L798 PolarHBondContact O-N 3.39Å; V796-I799 PolarHBondContact O-N 2.86Å; V796-E800 WeakPolarHBondContact O-CG 3.37Å; V796-E800 PolarHBondContact O-N 3.22Å
797S67.3Low68.8Low70 Ų70103.7 Ų103.749%0.4954%0.536SS..Hα-helixtrans-58.7-42.9175.3-171.40000112.3I799 E800 D801S797-I799 PolarHBondContact O-N 3.2Å; S797-E800 PolarHBondContact O-N 3.44Å; S797-D801 WeakPolarHBondContact O-CB 3.38Å; S797-D801 PolarHBondContact O-N 3.09Å
798L71.6Confident69.8Low99 Ų99106.8 Ų106.852%0.51854%0.543SS..Hα-helixtrans-67.1-36.6-180-175.463.2000112.1F795 V796 L802F795-L798 PolarHBondContact O-N 2.91Å; V796-L798 VanDerWaalsContact C-N 3.34Å; V796-L798 PolarHBondContact O-N 3.39Å; L798-L802 HydrophobicContact CG-CD1 4.35Å; L798-L802 WeakPolarHBondContact O-CB 3.3Å; L798-L802 WeakPolarHBondContact O-CG 3.49Å; L798-L802 PolarHBondContact O-N 3.37Å
799I72.4Confident70.5Confident86 Ų86106.7 Ų106.744%0.44154%0.542SS..Hα-helixtrans-70.7-37.5174.9-70.2166.2000110.8F795 V796 S797 K803F795-I799 HydrophobicContact CB-CD1 4.47Å; F795-I799 WeakPolarHBondContact O-CB 3.34Å; F795-I799 VanDerWaalsContact O-CG1 3.26Å; F795-I799 WeakPolarHBondContact O-CG1 3.28Å; F795-I799 PolarHBondContact O-N 2.84Å; V796-I799 PolarHBondContact O-N 2.86Å; S797-I799 PolarHBondContact O-N 3.2Å; I799-K803 HydrophobicContact CG2-CD 4.24Å; I799-K803 WeakPolarHBondContact O-CB 3.34Å; I799-K803 VanDerWaalsContact O-CG 3.26Å; I799-K803 WeakPolarHBondContact O-CG 3.33Å; I799-K803 PolarHBondContact O-N 2.96Å
800E77.2Confident71.7Confident108 Ų108104 Ų10451%0.50553%0.532SS..Hα-helixtrans-67.1-41.1174.7-74.9178166.700112V796 S797 K803 R804V796-E800 WeakPolarHBondContact O-CG 3.37Å; V796-E800 PolarHBondContact O-N 3.22Å; S797-E800 PolarHBondContact O-N 3.44Å; E800-K803 PolarHBondContact O-N 3.36Å; E800-R804 WeakPolarHBondContact O-CB 3.3Å; E800-R804 PolarHBondContact O-N 3.45Å
801D76.1Confident73.3Confident66 Ų66102.9 Ų102.935%0.35353%0.53SS..Hα-helixtrans-68.6-39.2174.7-72.1-34.5000112.4S797 R804 V805S797-D801 WeakPolarHBondContact O-CB 3.38Å; S797-D801 PolarHBondContact O-N 3.09Å; D801-R804 WeakPolarHBondContact O-CB 3.35Å; D801-R804 PolarHBondContact O-N 3.45Å; D801-R804 IonicContact OD1-CZ 3.02Å; D801-R804 VanDerWaalsContact OD1-CZ 3.3Å; D801-R804 IonicContact OD1-NE 2.65Å; D801-R804 PolarHBondContact OD1-NE 2.92Å; D801-R804 IonicContact OD1-NH2 2.97Å; D801-R804 PolarHBondContact OD1-NH2 2.97Å; D801-V805 WeakPolarHBondContact O-CG2 3.36Å; D801-V805 PolarHBondContact O-N 3.39Å
802L78.5Confident74.7Confident98 Ų98100.4 Ų100.451%0.51352%0.515SS..Hα-helixtrans-61.6-42.5170.8-83.9163.4000112L798 R804 V805 I806L798-L802 HydrophobicContact CG-CD1 4.35Å; L798-L802 WeakPolarHBondContact O-CB 3.3Å; L798-L802 WeakPolarHBondContact O-CG 3.49Å; L798-L802 PolarHBondContact O-N 3.37Å; L802-R804 VanDerWaalsContact C-N 3.33Å; L802-R804 PolarHBondContact O-N 2.91Å; L802-V805 PolarHBondContact O-N 3.34Å; L802-I806 WeakPolarHBondContact O-CB 3.25Å; L802-I806 WeakPolarHBondContact O-CD1 3.43Å; L802-I806 VanDerWaalsContact O-CG1 3.25Å; L802-I806 WeakPolarHBondContact O-CG1 3.49Å; L802-I806 PolarHBondContact O-N 2.97Å
803K79.4Confident76.2Confident138 Ų13896.4 Ų96.460%0.650%0.498SS*.Hα-helixtrans-63.4-38.3173.6-77.1172.9178.9179.30112.2I799 E800 I806 H807I799-K803 HydrophobicContact CG2-CD 4.24Å; I799-K803 WeakPolarHBondContact O-CB 3.34Å; I799-K803 VanDerWaalsContact O-CG 3.26Å; I799-K803 WeakPolarHBondContact O-CG 3.33Å; I799-K803 PolarHBondContact O-N 2.96Å; E800-K803 PolarHBondContact O-N 3.36Å; K803-I806 PolarHBondContact O-N 3.48Å; K803-H807 WeakPolarHBondContact O-CB 3.5Å; K803-H807 PolarHBondContact O-N 3.29Å
804R87.3Confident77.8Confident150 Ų15099.7 Ų99.757%0.56651%0.506SS*.Hα-helixtrans-62-47.3176-157.5-166.6-45-79.7-0.2110.9E800 D801 L802 H807 E808E800-R804 WeakPolarHBondContact O-CB 3.3Å; E800-R804 PolarHBondContact O-N 3.45Å; D801-R804 WeakPolarHBondContact O-CB 3.35Å; D801-R804 PolarHBondContact O-N 3.45Å; D801-R804 IonicContact OD1-CZ 3.02Å; D801-R804 VanDerWaalsContact OD1-CZ 3.3Å; D801-R804 IonicContact OD1-NE 2.65Å; D801-R804 PolarHBondContact OD1-NE 2.92Å; D801-R804 IonicContact OD1-NH2 2.97Å; D801-R804 PolarHBondContact OD1-NH2 2.97Å; L802-R804 VanDerWaalsContact C-N 3.33Å; L802-R804 PolarHBondContact O-N 2.91Å; R804-H807 PolarHBondContact O-N 3.37Å; R804-E808 WeakPolarHBondContact O-CB 3.42Å; R804-E808 PolarHBondContact O-N 2.92Å
805V87.3Confident78.9Confident78 Ų7897.5 Ų97.547%0.47349%0.491SS..Hα-helixtrans-65-41.8177171.10000111.6D801 L802 E808 K809D801-V805 WeakPolarHBondContact O-CG2 3.36Å; D801-V805 PolarHBondContact O-N 3.39Å; L802-V805 PolarHBondContact O-N 3.34Å; V805-E808 PolarHBondContact O-N 3.46Å; V805-K809 HydrophobicContact CG1-CG 4.41Å; V805-K809 WeakPolarHBondContact O-CB 3.37Å; V805-K809 VanDerWaalsContact O-CG 3.24Å; V805-K809 WeakPolarHBondContact O-CG 3.38Å; V805-K809 PolarHBondContact O-N 3.06Å
806I82.1Confident80.1Confident96 Ų9695.8 Ų95.849%0.49249%0.491SS..Hα-helixtrans-62-49.1175.5-70163.7000110.3L802 K803 E808 K809 D810L802-I806 WeakPolarHBondContact O-CB 3.25Å; L802-I806 WeakPolarHBondContact O-CD1 3.43Å; L802-I806 VanDerWaalsContact O-CG1 3.25Å; L802-I806 WeakPolarHBondContact O-CG1 3.49Å; L802-I806 PolarHBondContact O-N 2.97Å; K803-I806 PolarHBondContact O-N 3.48Å; I806-E808 VanDerWaalsContact C-N 3.31Å; I806-E808 PolarHBondContact O-N 3.4Å; I806-K809 CarbonylContact O-C 3.59Å; I806-K809 PolarHBondContact O-N 2.86Å; I806-K809 VanDerWaalsContact O-N 3.08Å; I806-D810 VanDerWaalsContact O-CG 3.32Å; I806-D810 PolarHBondContact O-N 2.88Å
807H82.8Confident80.7Confident149 Ų14998.2 Ų98.269%0.6950%0.498SS*.Hα-helixtrans-62.8-35.4178.4-172.4-68.7000112.8K803 R804 G811K803-H807 WeakPolarHBondContact O-CB 3.5Å; K803-H807 PolarHBondContact O-N 3.29Å; R804-H807 PolarHBondContact O-N 3.37Å; H807-G811 PolarHBondContact O-N 2.91Å
808E87.5Confident81.6Confident113 Ų113101.3 Ų101.353%0.52851%0.505SS..Hα-helixtrans-67.5-39173.1-175.3174.1-167.600111.9R804 V805 I806 G811 Q812R804-E808 WeakPolarHBondContact O-CB 3.42Å; R804-E808 PolarHBondContact O-N 2.92Å; V805-E808 PolarHBondContact O-N 3.46Å; I806-E808 VanDerWaalsContact C-N 3.31Å; I806-E808 PolarHBondContact O-N 3.4Å; E808-G811 PolarHBondContact O-N 3.37Å; E808-Q812 WeakPolarHBondContact O-CG 3.33Å; E808-Q812 PolarHBondContact O-N 2.84Å
809K84.1Confident82.2Confident110 Ų110102 Ų10248%0.47851%0.508SS..Hα-helixtrans-69.1-41176-70.4-72.1159-161.70112.4V805 I806 G811 Q812 I813V805-K809 HydrophobicContact CG1-CG 4.41Å; V805-K809 WeakPolarHBondContact O-CB 3.37Å; V805-K809 VanDerWaalsContact O-CG 3.24Å; V805-K809 WeakPolarHBondContact O-CG 3.38Å; V805-K809 PolarHBondContact O-N 3.06Å; I806-K809 CarbonylContact O-C 3.59Å; I806-K809 PolarHBondContact O-N 2.86Å; I806-K809 VanDerWaalsContact O-N 3.08Å; K809-G811 VanDerWaalsContact C-N 3.28Å; K809-G811 PolarHBondContact O-N 3.22Å; K809-Q812 PolarHBondContact O-N 3.02Å; K809-Q812 VanDerWaalsContact O-N 3.17Å; K809-I813 VanDerWaalsContact O-CG1 3.31Å; K809-I813 WeakPolarHBondContact O-CG1 3.34Å; K809-I813 PolarHBondContact O-N 3.1Å
810D81.8Confident82.6Confident80 Ų80103.4 Ų103.443%0.42852%0.516SS..Hα-helixtrans-62.7-36.4172.9-67.5-21000111.5I806 I813 K814I806-D810 VanDerWaalsContact O-CG 3.32Å; I806-D810 PolarHBondContact O-N 2.88Å; D810-I813 PolarHBondContact O-N 3.39Å; D810-K814 WeakPolarHBondContact O-CG 3.49Å; D810-K814 PolarHBondContact O-N 2.84Å
811G87.1Confident83Confident38 Ų38104.4 Ų104.439%0.39252%0.521SS..Hα-helixtrans-65.5-41.1171.800000113.1H807 E808 K809 S815H807-G811 PolarHBondContact O-N 2.91Å; E808-G811 PolarHBondContact O-N 3.37Å; K809-G811 VanDerWaalsContact C-N 3.28Å; K809-G811 PolarHBondContact O-N 3.22Å; G811-S815 PolarHBondContact O-N 2.92Å
812Q83.6Confident83.4Confident87 Ų87104.6 Ų104.641%0.40752%0.524SS..Hα-helixtrans-65.4-40.5174.5-73.41729.900111.8E808 K809 S815 V816E808-Q812 WeakPolarHBondContact O-CG 3.33Å; E808-Q812 PolarHBondContact O-N 2.84Å; K809-Q812 PolarHBondContact O-N 3.02Å; K809-Q812 VanDerWaalsContact O-N 3.17Å; Q812-S815 PolarHBondContact O-N 2.89Å; Q812-V816 WeakPolarHBondContact O-CG2 3.5Å; Q812-V816 PolarHBondContact O-N 3.01Å
813I83.1Confident83.4Confident87 Ų87103.7 Ų103.745%0.44652%0.518SS..Hα-helixtrans-60.5-51.8175.7-70.6163.6000110.2K809 D810 S815 V816 E817K809-I813 VanDerWaalsContact O-CG1 3.31Å; K809-I813 WeakPolarHBondContact O-CG1 3.34Å; K809-I813 PolarHBondContact O-N 3.1Å; D810-I813 PolarHBondContact O-N 3.39Å; I813-S815 VanDerWaalsContact C-N 3.31Å; I813-S815 PolarHBondContact O-N 3Å; I813-V816 WeakPolarHBondContact O-CA 3.37Å; I813-V816 PolarHBondContact O-N 3.48Å; I813-E817 HydrophobicContact CG2-CG 4.31Å; I813-E817 WeakPolarHBondContact O-CG 3.36Å; I813-E817 PolarHBondContact O-N 3.02Å
814K83.1Confident83.3Confident140 Ų140102.5 Ų102.561%0.60952%0.517SS*.Hα-helixtrans-58.1-40.8177.8-73.6173.7-179.1176.80113.1D810 V816 E817 E818D810-K814 WeakPolarHBondContact O-CG 3.49Å; D810-K814 PolarHBondContact O-N 2.84Å; K814-V816 VanDerWaalsContact C-N 3.31Å; K814-V816 PolarHBondContact O-N 3.49Å; K814-E817 PolarHBondContact O-N 3.21Å; K814-E818 WeakPolarHBondContact O-CB 3.43Å; K814-E818 PolarHBondContact O-N 3.19Å
815S82.4Confident83.1Confident61 Ų61100.3 Ų100.343%0.42752%0.516SS..Hα-helixtrans-66.3-32176.2-178.60000112.8G811 Q812 I813 L819G811-S815 PolarHBondContact O-N 2.92Å; Q812-S815 PolarHBondContact O-N 2.89Å; I813-S815 VanDerWaalsContact C-N 3.31Å; I813-S815 PolarHBondContact O-N 3Å; S815-L819 WeakPolarHBondContact O-CB 3.36Å; S815-L819 WeakPolarHBondContact O-CD1 3.39Å; S815-L819 VanDerWaalsContact O-CG 3.23Å; S815-L819 WeakPolarHBondContact O-CG 3.42Å; S815-L819 PolarHBondContact O-N 3.34Å; S815-L819 VanDerWaalsContact O-N 3.15Å
816V81.8Confident82.8Confident94 Ų94101.3 Ų101.357%0.5751%0.514SS*.Hα-helixtrans-74.5-40174.5170.30000111.1Q812 I813 K814 L819 L820Q812-V816 WeakPolarHBondContact O-CG2 3.5Å; Q812-V816 PolarHBondContact O-N 3.01Å; I813-V816 WeakPolarHBondContact O-CA 3.37Å; I813-V816 PolarHBondContact O-N 3.48Å; K814-V816 VanDerWaalsContact C-N 3.31Å; K814-V816 PolarHBondContact O-N 3.49Å; V816-L819 PolarHBondContact O-N 3.37Å; V816-L820 WeakPolarHBondContact O-CB 3.26Å; V816-L820 PolarHBondContact O-N 3.41Å
817E78.6Confident82.5Confident114 Ų114100.4 Ų100.453%0.53351%0.513SS..Hα-helixtrans-60-48.3174.1-70.1170.7155.300111.2I813 K814 L819 L820 E821I813-E817 HydrophobicContact CG2-CG 4.31Å; I813-E817 WeakPolarHBondContact O-CG 3.36Å; I813-E817 PolarHBondContact O-N 3.02Å; K814-E817 PolarHBondContact O-N 3.21Å; E817-L819 PolarHBondContact O-N 3.28Å; E817-L820 WeakPolarHBondContact O-CB 3.23Å; E817-L820 PolarHBondContact O-N 3.03Å; E817-L820 VanDerWaalsContact O-N 3.13Å; E817-E821 PolarHBondContact O-N 3.45Å
818E85.8Confident82.4Confident135 Ų13595.7 Ų95.763%0.63150%0.499SS*.Hα-helixtrans-64.3-37.9178.5-167.2171.8-149.500112.1K814 V822K814-E818 WeakPolarHBondContact O-CB 3.43Å; K814-E818 PolarHBondContact O-N 3.19Å; E818-V822 WeakPolarHBondContact O-CB 3.24Å; E818-V822 VanDerWaalsContact O-CG2 3.29Å; E818-V822 WeakPolarHBondContact O-CG2 3.42Å; E818-V822 PolarHBondContact O-N 3.38Å
819L84.6Confident81.9Confident114 Ų11494.9 Ų94.960%0.59750%0.499SS*.Hα-helixtrans-66.4-37.8171.7-77.9169.4000112.8S815 V816 E817 E823S815-L819 WeakPolarHBondContact O-CB 3.36Å; S815-L819 WeakPolarHBondContact O-CD1 3.39Å; S815-L819 VanDerWaalsContact O-CG 3.23Å; S815-L819 WeakPolarHBondContact O-CG 3.42Å; S815-L819 PolarHBondContact O-N 3.34Å; S815-L819 VanDerWaalsContact O-N 3.15Å; V816-L819 PolarHBondContact O-N 3.37Å; E817-L819 PolarHBondContact O-N 3.28Å; L819-E823 PolarHBondContact O-N 2.9Å
820L81.3Confident81.7Confident115 Ų11595.7 Ų95.760%0.60250%0.502SS*.Hα-helixtrans-67.5-41.5177.8-16180.4000111.1V816 E817 E823 L824V816-L820 WeakPolarHBondContact O-CB 3.26Å; V816-L820 PolarHBondContact O-N 3.41Å; E817-L820 WeakPolarHBondContact O-CB 3.23Å; E817-L820 PolarHBondContact O-N 3.03Å; E817-L820 VanDerWaalsContact O-N 3.13Å; L820-E823 PolarHBondContact O-N 2.81Å; L820-L824 WeakPolarHBondContact O-CB 3.32Å; L820-L824 WeakPolarHBondContact O-CG 3.39Å; L820-L824 PolarHBondContact O-N 2.91Å
821E84.1Confident81.4Confident129 Ų12998.2 Ų98.260%0.60351%0.512SS*.Hα-helixtrans-66.1-40.6177-171.1163.4-152.600111.9E817 E823 L824 L825E817-E821 PolarHBondContact O-N 3.45Å; E821-E823 PolarHBondContact O-N 2.88Å; E821-L824 PolarHBondContact O-N 3.44Å; E821-L825 PolarHBondContact O-N 3.02Å
822V85.9Confident80.8Confident70 Ų70102.7 Ų102.742%0.42452%0.52SS..Hα-helixtrans-62.4-39.6171.9167.40000112.1E818 L825 K826E818-V822 WeakPolarHBondContact O-CB 3.24Å; E818-V822 VanDerWaalsContact O-CG2 3.29Å; E818-V822 WeakPolarHBondContact O-CG2 3.42Å; E818-V822 PolarHBondContact O-N 3.38Å; V822-L825 PolarHBondContact O-N 3.37Å; V822-K826 PolarHBondContact O-N 3.45Å
823E78.2Confident80.4Confident80 Ų80103 Ų10337%0.37453%0.528SS..Hα-helixtrans-75-34.7178.7-158.160.5-141.100112.1L819 L820 E821 L825 K826 V827L819-E823 PolarHBondContact O-N 2.9Å; L820-E823 PolarHBondContact O-N 2.81Å; E821-E823 PolarHBondContact O-N 2.88Å; E823-L825 PolarHBondContact O-N 3.37Å; E823-K826 PolarHBondContact O-N 2.86Å; E823-K826 WeakPolarHBondContact OE2-CD 3.44Å; E823-K826 IonicContact OE2-NZ 2.61Å; E823-K826 PolarHBondContact OE2-NZ 2.66Å; E823-V827 WeakPolarHBondContact O-CG2 3.37Å; E823-V827 PolarHBondContact O-N 2.91Å
824L76.9Confident80.1Confident112 Ų112103.4 Ų103.459%0.58654%0.535SS*.Hα-helixtrans-59-44.4168.7-77.2169.7000111.5L820 E821 K826 V827 A828L820-L824 WeakPolarHBondContact O-CB 3.32Å; L820-L824 WeakPolarHBondContact O-CG 3.39Å; L820-L824 PolarHBondContact O-N 2.91Å; E821-L824 PolarHBondContact O-N 3.44Å; L824-K826 VanDerWaalsContact C-N 3.33Å; L824-K826 PolarHBondContact O-N 3.34Å; L824-V827 PolarHBondContact O-N 3.08Å; L824-A828 WeakPolarHBondContact O-CB 3.39Å; L824-A828 PolarHBondContact O-N 2.82Å
825L83.1Confident79.6Confident104 Ų104102.9 Ų102.955%0.54553%0.534SS..Hα-helixtrans-63.1-35.4174.3-82.5165.8000112.9E821 V822 E823 N829E821-L825 PolarHBondContact O-N 3.02Å; V822-L825 PolarHBondContact O-N 3.37Å; E823-L825 PolarHBondContact O-N 3.37Å; L825-N829 WeakPolarHBondContact O-CB 3.43Å; L825-N829 PolarHBondContact O-N 3.27Å; L825-N829 PolarHBondContact O-ND2 3.27Å
826K80.8Confident79.2Confident99 Ų99105.3 Ų105.343%0.4354%0.542SS..Hα-helixtrans-68.3-41172.4-75179-158.8153.40112.4V822 E823 L824 N829 K830V822-K826 PolarHBondContact O-N 3.45Å; E823-K826 PolarHBondContact O-N 2.86Å; E823-K826 WeakPolarHBondContact OE2-CD 3.44Å; E823-K826 IonicContact OE2-NZ 2.61Å; E823-K826 PolarHBondContact OE2-NZ 2.66Å; L824-K826 VanDerWaalsContact C-N 3.33Å; L824-K826 PolarHBondContact O-N 3.34Å; K826-N829 PolarHBondContact O-N 2.87Å; K826-K830 WeakPolarHBondContact O-CB 3.16Å; K826-K830 VanDerWaalsContact O-CG 3.28Å; K826-K830 WeakPolarHBondContact O-CG 3.12Å; K826-K830 PolarHBondContact O-N 3.44Å
827V76.6Confident78.8Confident78 Ų78103.6 Ų103.647%0.47353%0.534SS..Hα-helixtrans-63.2-48.5176.91720000109.9E823 L824 N829 K830 E831E823-V827 WeakPolarHBondContact O-CG2 3.37Å; E823-V827 PolarHBondContact O-N 2.91Å; L824-V827 PolarHBondContact O-N 3.08Å; V827-N829 VanDerWaalsContact C-N 3.33Å; V827-N829 PolarHBondContact O-N 2.89Å; V827-K830 WeakPolarHBondContact O-CB 3.42Å; V827-K830 PolarHBondContact O-N 3.29Å; V827-K830 VanDerWaalsContact O-N 3.15Å; V827-E831 WeakPolarHBondContact O-CB 3.42Å; V827-E831 PolarHBondContact O-N 2.9Å
828A79.6Confident78.6Confident49 Ų49101.9 Ų101.941%0.40553%0.531SS..Hα-helixtrans-59.2-39.9176.200000112.8L824 K832L824-A828 WeakPolarHBondContact O-CB 3.39Å; L824-A828 PolarHBondContact O-N 2.82Å; A828-K832 VanDerWaalsContact O-CB 3.3Å; A828-K832 WeakPolarHBondContact O-CB 3.44Å; A828-K832 PolarHBondContact O-N 3.48Å
829N78.4Confident77.9Confident96 Ų9699.4 Ų99.451%0.51353%0.525SS..Hα-helixtrans-70.4-36.3175.7-80.5-41.9000113.1L825 K826 V827 T833L825-N829 WeakPolarHBondContact O-CB 3.43Å; L825-N829 PolarHBondContact O-N 3.27Å; L825-N829 PolarHBondContact O-ND2 3.27Å; K826-N829 PolarHBondContact O-N 2.87Å; V827-N829 VanDerWaalsContact C-N 3.33Å; V827-N829 PolarHBondContact O-N 2.89Å; N829-T833 WeakPolarHBondContact O-CB 3.42Å; N829-T833 PolarHBondContact O-N 2.9Å; N829-T833 PolarHBondContact O-OG1 3.23Å
830K79.1Confident77.4Confident127 Ų12797.6 Ų97.655%0.55252%0.522SS*.Hα-helixtrans-63.7-46.4173.1-75.6167.1-178168.90110.4K826 V827 K832 T833 V834K826-K830 WeakPolarHBondContact O-CB 3.16Å; K826-K830 VanDerWaalsContact O-CG 3.28Å; K826-K830 WeakPolarHBondContact O-CG 3.12Å; K826-K830 PolarHBondContact O-N 3.44Å; V827-K830 WeakPolarHBondContact O-CB 3.42Å; V827-K830 PolarHBondContact O-N 3.29Å; V827-K830 VanDerWaalsContact O-N 3.15Å; K830-K832 PolarHBondContact O-N 3.47Å; K830-T833 WeakPolarHBondContact O-CB 3.35Å; K830-T833 PolarHBondContact O-N 3.49Å; K830-V834 WeakPolarHBondContact O-CG2 3.4Å; K830-V834 PolarHBondContact O-N 3.35Å
831E74.4Confident77.2Confident134 Ų13497.6 Ų97.663%0.62652%0.519SS*.Hα-helixtrans-58.6-47.6176-175172.9-165.600111.6V827 T833 V834 Q835V827-E831 WeakPolarHBondContact O-CB 3.42Å; V827-E831 PolarHBondContact O-N 2.9Å; E831-T833 VanDerWaalsContact C-N 3.28Å; E831-T833 PolarHBondContact O-N 2.85Å; E831-V834 PolarHBondContact O-N 2.92Å; E831-Q835 WeakPolarHBondContact O-CB 3.21Å; E831-Q835 PolarHBondContact O-N 2.93Å
832K76.4Confident76.8Confident132 Ų13295.2 Ų95.257%0.57451%0.513SS*.Hα-helixtrans-62.1-33.6176.3-159.8170.7-169.9173.40112.9A828 K830 L836A828-K832 VanDerWaalsContact O-CB 3.3Å; A828-K832 WeakPolarHBondContact O-CB 3.44Å; A828-K832 PolarHBondContact O-N 3.48Å; K830-K832 PolarHBondContact O-N 3.47Å; K832-L836 WeakPolarHBondContact O-CB 3.46Å; K832-L836 VanDerWaalsContact O-CG 3.28Å; K832-L836 WeakPolarHBondContact O-CG 3.29Å; K832-L836 PolarHBondContact O-N 3.45Å
833T73.9Confident76.4Confident94 Ų9496.5 Ų96.558%0.57752%0.515SS*.Hα-helixtrans-70.6-42.3175.2-55.80000111.6N829 K830 E831 L836 S837N829-T833 WeakPolarHBondContact O-CB 3.42Å; N829-T833 PolarHBondContact O-N 2.9Å; N829-T833 PolarHBondContact O-OG1 3.23Å; K830-T833 WeakPolarHBondContact O-CB 3.35Å; K830-T833 PolarHBondContact O-N 3.49Å; E831-T833 VanDerWaalsContact C-N 3.28Å; E831-T833 PolarHBondContact O-N 2.85Å; T833-L836 PolarHBondContact O-N 2.91Å; T833-S837 PolarHBondContact O-N 2.94Å
834V76.7Confident76.5Confident95 Ų9599.3 Ų99.358%0.57653%0.528SS*.Hα-helixtrans-63.1-44173.6171.90000110.5K830 E831 L836 S837 V838K830-V834 WeakPolarHBondContact O-CG2 3.4Å; K830-V834 PolarHBondContact O-N 3.35Å; E831-V834 PolarHBondContact O-N 2.92Å; V834-L836 PolarHBondContact O-N 2.91Å; V834-S837 WeakPolarHBondContact O-CB 3.35Å; V834-S837 PolarHBondContact O-N 3.4Å; V834-V838 WeakPolarHBondContact O-CG2 3.48Å; V834-V838 PolarHBondContact O-N 3.01Å
835Q72.8Confident76.5Confident129 Ų12999.6 Ų99.660%0.60353%0.529SS*.Hα-helixtrans-62-44.6178.3-164.8173.126.100111.9E831 S837 V838 T839E831-Q835 WeakPolarHBondContact O-CB 3.21Å; E831-Q835 PolarHBondContact O-N 2.93Å; Q835-S837 PolarHBondContact O-N 3.42Å; Q835-V838 PolarHBondContact O-N 2.95Å; Q835-T839 PolarHBondContact O-N 3.24Å; Q835-T839 PolarHBondContact O-OG1 2.93Å; Q835-T839 VanDerWaalsContact O-OG1 3.09Å
836L74.6Confident76.2Confident111 Ų11199.6 Ų99.658%0.58153%0.527SS*.Hα-helixtrans-60.5-43.4174.7-77.8167.4000112.4K832 T833 V834 T839 S840K832-L836 WeakPolarHBondContact O-CB 3.46Å; K832-L836 VanDerWaalsContact O-CG 3.28Å; K832-L836 WeakPolarHBondContact O-CG 3.29Å; K832-L836 PolarHBondContact O-N 3.45Å; T833-L836 PolarHBondContact O-N 2.91Å; V834-L836 PolarHBondContact O-N 2.91Å; L836-T839 WeakPolarHBondContact CA-OG1 3.49Å; L836-T839 PolarHBondContact O-N 3.48Å; L836-T839 PolarHBondContact O-OG1 2.95Å; L836-S840 PolarHBondContact O-N 2.88Å
837S72.7Confident76.1Confident58 Ų5898.7 Ų98.741%0.40653%0.526SS..Hα-helixtrans-59.5-47.4175.6-176.10000112T833 V834 Q835 T839 S840 Q841T833-S837 PolarHBondContact O-N 2.94Å; V834-S837 WeakPolarHBondContact O-CB 3.35Å; V834-S837 PolarHBondContact O-N 3.4Å; Q835-S837 PolarHBondContact O-N 3.42Å; S837-T839 PolarHBondContact O-N 2.92Å; S837-S840 WeakPolarHBondContact O-CB 3.48Å; S837-S840 PolarHBondContact O-N 3.38Å; S837-Q841 PolarHBondContact O-N 3.08Å
838V73.9Confident76.4Confident79 Ų79100.8 Ų100.848%0.47953%0.534SS..Hα-helixtrans-62.4-44.2177.2172.60000111.3V834 Q835 S840 Q841 V842V834-V838 WeakPolarHBondContact O-CG2 3.48Å; V834-V838 PolarHBondContact O-N 3.01Å; Q835-V838 PolarHBondContact O-N 2.95Å; V838-S840 VanDerWaalsContact C-N 3.3Å; V838-S840 PolarHBondContact O-N 2.86Å; V838-Q841 PolarHBondContact O-N 3.25Å; V838-V842 HydrophobicContact CG1-CG2 4.46Å; V838-V842 WeakPolarHBondContact O-CG2 3.5Å; V838-V842 PolarHBondContact O-N 3.04Å
839T72.2Confident76.3Confident82 Ų82104.3 Ų104.350%0.50355%0.546SS..Hα-helixtrans-62.8-34.9175.144.60000113Q835 L836 S837 V842 Q843Q835-T839 PolarHBondContact O-N 3.24Å; Q835-T839 PolarHBondContact O-OG1 2.93Å; Q835-T839 VanDerWaalsContact O-OG1 3.09Å; L836-T839 WeakPolarHBondContact CA-OG1 3.49Å; L836-T839 PolarHBondContact O-N 3.48Å; L836-T839 PolarHBondContact O-OG1 2.95Å; S837-T839 PolarHBondContact O-N 2.92Å; T839-V842 PolarHBondContact O-N 3.41Å; T839-Q843 WeakPolarHBondContact O-CB 3.36Å; T839-Q843 PolarHBondContact O-N 2.7Å
840S74.3Confident76.4Confident76 Ų76105.4 Ų105.453%0.53154%0.542SS..Hα-helixtrans-65.8-44.6176.2-167.10000111.8L836 S837 V838 Q843 E844L836-S840 PolarHBondContact O-N 2.88Å; S837-S840 WeakPolarHBondContact O-CB 3.48Å; S837-S840 PolarHBondContact O-N 3.38Å; V838-S840 VanDerWaalsContact C-N 3.3Å; V838-S840 PolarHBondContact O-N 2.86Å; S840-Q843 PolarHBondContact O-N 3.43Å; S840-E844 WeakPolarHBondContact O-CB 3.48Å; S840-E844 PolarHBondContact O-N 3.48Å
841Q77.4Confident76.3Confident115 Ų115101.1 Ų101.154%0.53753%0.534SS..Hα-helixtrans-64.8-40.2177.2-6817920.600111.9S837 V838 E844 L845S837-Q841 PolarHBondContact O-N 3.08Å; V838-Q841 PolarHBondContact O-N 3.25Å; Q841-E844 PolarHBondContact O-N 2.78Å; Q841-L845 WeakPolarHBondContact O-CB 3.47Å; Q841-L845 VanDerWaalsContact O-CG 3.31Å; Q841-L845 WeakPolarHBondContact O-CG 3.26Å; Q841-L845 PolarHBondContact O-N 3.03Å
842V75.6Confident76.5Confident80 Ų80100.4 Ų100.449%0.48553%0.529SS..Hα-helixtrans-62.6-42.5174.4170.90000111.2V838 T839 L845 Q846V838-V842 HydrophobicContact CG1-CG2 4.46Å; V838-V842 WeakPolarHBondContact O-CG2 3.5Å; V838-V842 PolarHBondContact O-N 3.04Å; T839-V842 PolarHBondContact O-N 3.41Å; V842-L845 PolarHBondContact O-N 2.92Å; V842-Q846 WeakPolarHBondContact O-CB 3.39Å; V842-Q846 PolarHBondContact O-N 3.49Å
843Q75.8Confident76.3Confident97 Ų97100.1 Ų100.145%0.45353%0.53SS..Hα-helixtrans-65.6-39.9178.3-165.570.13400112.3T839 S840 Q846 N847T839-Q843 WeakPolarHBondContact O-CB 3.36Å; T839-Q843 PolarHBondContact O-N 2.7Å; S840-Q843 PolarHBondContact O-N 3.43Å; Q843-Q846 PolarHBondContact O-N 2.93Å; Q843-N847 VanDerWaalsContact O-CG 3.31Å; Q843-N847 PolarHBondContact O-N 3.46Å; Q843-N847 PolarHBondContact O-ND2 3.4Å
844E80.8Confident76.5Confident139 Ų139101.3 Ų101.365%0.6553%0.529SS*.Hα-helixtrans-65.7-45.4177.1-171.4168.4-151.700111.4S840 Q841 Q846 N847 L848S840-E844 WeakPolarHBondContact O-CB 3.48Å; S840-E844 PolarHBondContact O-N 3.48Å; Q841-E844 PolarHBondContact O-N 2.78Å; E844-Q846 VanDerWaalsContact C-N 3.34Å; E844-Q846 PolarHBondContact O-N 3.44Å; E844-N847 PolarHBondContact O-N 3.48Å; E844-L848 WeakPolarHBondContact O-CB 3.26Å; E844-L848 PolarHBondContact O-N 3.42Å
845L77.9Confident76.5Confident118 Ų118101.8 Ų101.862%0.61853%0.525SS*.Hα-helixtrans-61.2-39.7172.9-71.4170.7000112.3Q841 V842 L848 L849Q841-L845 WeakPolarHBondContact O-CB 3.47Å; Q841-L845 VanDerWaalsContact O-CG 3.31Å; Q841-L845 WeakPolarHBondContact O-CG 3.26Å; Q841-L845 PolarHBondContact O-N 3.03Å; V842-L845 PolarHBondContact O-N 2.92Å; L845-L848 PolarHBondContact O-N 2.81Å; L845-L849 WeakPolarHBondContact O-CB 3.43Å; L845-L849 PolarHBondContact O-N 2.85Å
846Q75.6Confident76.6Confident104 Ų10499.6 Ų99.649%0.48652%0.52SS..Hα-helixtrans-63.4-40.1174.9-112.4-175.93.700112.5V842 Q843 E844 R850V842-Q846 WeakPolarHBondContact O-CB 3.39Å; V842-Q846 PolarHBondContact O-N 3.49Å; Q843-Q846 PolarHBondContact O-N 2.93Å; E844-Q846 VanDerWaalsContact C-N 3.34Å; E844-Q846 PolarHBondContact O-N 3.44Å; Q846-R850 WeakPolarHBondContact O-CB 3.35Å; Q846-R850 PolarHBondContact O-N 3.28Å
847N79.2Confident76.6Confident80 Ų8098.9 Ų98.943%0.42852%0.517SS..Hα-helixtrans-71.1-37177.7-71.7-20.9000112Q843 E844 R850 G851Q843-N847 VanDerWaalsContact O-CG 3.31Å; Q843-N847 PolarHBondContact O-N 3.46Å; Q843-N847 PolarHBondContact O-ND2 3.4Å; E844-N847 PolarHBondContact O-N 3.48Å; N847-R850 PolarHBondContact O-N 2.83Å; N847-R850 PolarHBondContact OD1-NH2 2.92Å; N847-G851 PolarHBondContact O-N 2.84Å
848L83.1Confident76.8Confident122 Ų122100 Ų10064%0.63953%0.525SS*.Hα-helixtrans-65.5-41174.5-16174.8000111.6E844 L845 G851 K852E844-L848 WeakPolarHBondContact O-CB 3.26Å; E844-L848 PolarHBondContact O-N 3.42Å; L845-L848 PolarHBondContact O-N 2.81Å; L848-G851 PolarHBondContact O-N 2.62Å; L848-K852 WeakPolarHBondContact O-CG 3.44Å; L848-K852 PolarHBondContact O-N 2.91Å
849L76.9Confident76.7Confident123 Ų123101.5 Ų101.564%0.64453%0.528SS*.Hα-helixtrans-63.6-45.8175.4-169.968.8000111.3L845 G851 K852 E853L845-L849 WeakPolarHBondContact O-CB 3.43Å; L845-L849 PolarHBondContact O-N 2.85Å; L849-G851 PolarHBondContact O-N 3.42Å; L849-K852 WeakPolarHBondContact O-CB 3.4Å; L849-K852 PolarHBondContact O-N 3.04Å; L849-K852 VanDerWaalsContact O-N 3.14Å; L849-E853 PolarHBondContact O-N 2.8Å
850R80.5Confident77Confident118 Ų118103.4 Ų103.445%0.44553%0.529SS..Hα-helixtrans-58.2-46.9175.8-164-162.2-39.1-90.2-3.2112.1Q846 N847 K852 E853 E854Q846-R850 WeakPolarHBondContact O-CB 3.35Å; Q846-R850 PolarHBondContact O-N 3.28Å; N847-R850 PolarHBondContact O-N 2.83Å; N847-R850 PolarHBondContact OD1-NH2 2.92Å; R850-K852 VanDerWaalsContact C-N 3.27Å; R850-K852 PolarHBondContact O-N 3.36Å; R850-E853 WeakPolarHBondContact O-CB 3.31Å; R850-E853 PolarHBondContact O-N 3Å; R850-E853 VanDerWaalsContact O-N 3.16Å; R850-E854 WeakPolarHBondContact O-CG 3.45Å; R850-E854 PolarHBondContact O-N 3.32Å
851G78.4Confident76.9Confident37 Ų37102.4 Ų102.438%0.38153%0.526SS..Hα-helixtrans-64.1-30.1176.700000113.3N847 L848 L849 Q855N847-G851 PolarHBondContact O-N 2.84Å; L848-G851 PolarHBondContact O-N 2.62Å; L849-G851 PolarHBondContact O-N 3.42Å; G851-Q855 WeakPolarHBondContact O-CB 3.4Å; G851-Q855 PolarHBondContact O-N 3.46Å; G851-Q855 VanDerWaalsContact O-N 3.13Å
852K77.1Confident76.7Confident119 Ų11999.8 Ų99.852%0.51752%0.524SS..Hα-helixtrans-73.7-38.6171.8-74-73.5165.7-1670112.5L848 L849 R850 Q855 V856L848-K852 WeakPolarHBondContact O-CG 3.44Å; L848-K852 PolarHBondContact O-N 2.91Å; L849-K852 WeakPolarHBondContact O-CB 3.4Å; L849-K852 PolarHBondContact O-N 3.04Å; L849-K852 VanDerWaalsContact O-N 3.14Å; R850-K852 VanDerWaalsContact C-N 3.27Å; R850-K852 PolarHBondContact O-N 3.36Å; K852-Q855 PolarHBondContact O-N 3.27Å; K852-V856 WeakPolarHBondContact O-CG2 3.21Å; K852-V856 PolarHBondContact O-N 2.96Å
853E73.9Confident76.4Confident126 Ų126101.1 Ų101.159%0.58953%0.528SS*.Hα-helixtrans-64.9-42.9175.7-167.8168.5-15100111.7L849 R850 Q855 V856 N857L849-E853 PolarHBondContact O-N 2.8Å; R850-E853 WeakPolarHBondContact O-CB 3.31Å; R850-E853 PolarHBondContact O-N 3Å; R850-E853 VanDerWaalsContact O-N 3.16Å; E853-Q855 PolarHBondContact O-N 3.45Å; E853-V856 PolarHBondContact O-N 2.9Å; E853-N857 WeakPolarHBondContact O-CB 3.39Å; E853-N857 VanDerWaalsContact O-CG 3.3Å; E853-N857 PolarHBondContact O-N 3.08Å; E853-N857 PolarHBondContact O-ND2 2.99Å; E853-N857 VanDerWaalsContact O-ND2 3.1Å
854E77.4Confident76.3Confident119 Ų119101.2 Ų101.256%0.55653%0.528SS*.Hα-helixtrans-61.1-41.6171.6-72.1169.2-166.300112.2R850 N857 S858R850-E854 WeakPolarHBondContact O-CG 3.45Å; R850-E854 PolarHBondContact O-N 3.32Å; E854-N857 PolarHBondContact O-N 3.46Å; E854-S858 WeakPolarHBondContact O-CB 3.42Å; E854-S858 PolarHBondContact O-N 3.01Å
855Q76.6Confident75.6Confident105 Ų10599 Ų9949%0.49152%0.521SS..Hα-helixtrans-65.1-39.3176.3-174.61667300112.2G851 K852 E853 M859G851-Q855 WeakPolarHBondContact O-CB 3.4Å; G851-Q855 PolarHBondContact O-N 3.46Å; G851-Q855 VanDerWaalsContact O-N 3.13Å; K852-Q855 PolarHBondContact O-N 3.27Å; E853-Q855 PolarHBondContact O-N 3.45Å; Q855-M859 WeakPolarHBondContact O-CG 3.35Å; Q855-M859 PolarHBondContact O-N 3.46Å; Q855-M859 VanDerWaalsContact O-N 3.08Å
856V74.6Confident75Confident84 Ų84101.3 Ų101.351%0.50952%0.522SS..Hα-helixtrans-66.8-43.4173.9168.50000111.5K852 E853 S858 M859 K860K852-V856 WeakPolarHBondContact O-CG2 3.21Å; K852-V856 PolarHBondContact O-N 2.96Å; E853-V856 PolarHBondContact O-N 2.9Å; V856-S858 VanDerWaalsContact C-N 3.33Å; V856-S858 PolarHBondContact O-N 2.88Å; V856-M859 HydrophobicContact CG2-CE 4.32Å; V856-M859 PolarHBondContact O-N 3.46Å; V856-K860 WeakPolarHBondContact O-CB 3.35Å; V856-K860 PolarHBondContact O-N 2.88Å
857N75.3Confident74Confident95 Ų95100.5 Ų100.551%0.50852%0.52SS..Hα-helixtrans-64.3-37.6177.5-73.3-36.4000112.2E853 E854 K860 A861E853-N857 WeakPolarHBondContact O-CB 3.39Å; E853-N857 VanDerWaalsContact O-CG 3.3Å; E853-N857 PolarHBondContact O-N 3.08Å; E853-N857 PolarHBondContact O-ND2 2.99Å; E853-N857 VanDerWaalsContact O-ND2 3.1Å; E854-N857 PolarHBondContact O-N 3.46Å; N857-K860 PolarHBondContact O-N 3.38Å; N857-A861 PolarHBondContact O-N 3.34Å
858S76Confident73.2Confident83 Ų83103.9 Ų103.958%0.5853%0.527SS*.Hα-helixtrans-64-45.9173.4-174.90000112.5E854 V856 K860 A861 A862E854-S858 WeakPolarHBondContact O-CB 3.42Å; E854-S858 PolarHBondContact O-N 3.01Å; V856-S858 VanDerWaalsContact C-N 3.33Å; V856-S858 PolarHBondContact O-N 2.88Å; S858-K860 VanDerWaalsContact C-N 3.33Å; S858-K860 PolarHBondContact O-N 3.48Å; S858-A861 PolarHBondContact O-N 3.03Å; S858-A862 PolarHBondContact O-N 3.45Å
859M72.5Confident71.7Confident110 Ų110102.2 Ų102.254%0.54252%0.519SS..Hα-helixtrans-61.6-39.8174-72.5-168.4-56.800112.4Q855 V856 A862 L863Q855-M859 WeakPolarHBondContact O-CG 3.35Å; Q855-M859 PolarHBondContact O-N 3.46Å; Q855-M859 VanDerWaalsContact O-N 3.08Å; V856-M859 HydrophobicContact CG2-CE 4.32Å; V856-M859 PolarHBondContact O-N 3.46Å; M859-A862 PolarHBondContact O-N 2.89Å; M859-L863 WeakPolarHBondContact O-CG 3.45Å; M859-L863 PolarHBondContact O-N 2.87Å
860K77.4Confident70.6Confident121 Ų121101.6 Ų101.653%0.52652%0.516SS..Hα-helixtrans-62.6-45.2178-172.3178.4177.2-174.40111.7V856 N857 S858 A862 L863 E864V856-K860 WeakPolarHBondContact O-CB 3.35Å; V856-K860 PolarHBondContact O-N 2.88Å; N857-K860 PolarHBondContact O-N 3.38Å; S858-K860 VanDerWaalsContact C-N 3.33Å; S858-K860 PolarHBondContact O-N 3.48Å; K860-A862 PolarHBondContact O-N 2.98Å; K860-L863 PolarHBondContact O-N 3.46Å; K860-E864 WeakPolarHBondContact CE-OE1 3.49Å; K860-E864 WeakPolarHBondContact O-CG 3.36Å; K860-E864 PolarHBondContact O-N 2.91Å
861A73.1Confident69.1Low55 Ų55105.5 Ų105.546%0.45553%0.53SS..Hα-helixtrans-61.3-41.5175.400000112.3N857 S858 L863 E864 D865N857-A861 PolarHBondContact O-N 3.34Å; S858-A861 PolarHBondContact O-N 3.03Å; A861-L863 VanDerWaalsContact C-N 3.34Å; A861-L863 PolarHBondContact O-N 3.25Å; A861-E864 PolarHBondContact O-N 3.24Å; A861-D865 PolarHBondContact O-N 2.95Å
862A73.1Confident67.7Low61 Ų61107 Ų10750%0.50455%0.546SS..Hα-helixtrans-66.1-33.4177.500000113.3S858 M859 K860 R866S858-A862 PolarHBondContact O-N 3.45Å; M859-A862 PolarHBondContact O-N 2.89Å; K860-A862 PolarHBondContact O-N 2.98Å; A862-R866 PolarHBondContact O-N 3.33Å; A862-R866 VanDerWaalsContact O-N 3.13Å
863L70.3Confident66.3Low108 Ų108110.2 Ų110.257%0.56556%0.555SS**Hα-helixtrans-71.1-44.7173.2-72.5169.3000111.7M859 K860 A861 D865 R866 D867M859-L863 WeakPolarHBondContact O-CG 3.45Å; M859-L863 PolarHBondContact O-N 2.87Å; K860-L863 PolarHBondContact O-N 3.46Å; A861-L863 VanDerWaalsContact C-N 3.34Å; A861-L863 PolarHBondContact O-N 3.25Å; L863-D865 PolarHBondContact O-N 3.43Å; L863-R866 PolarHBondContact O-N 2.9Å; L863-D867 WeakPolarHBondContact O-CB 3.37Å; L863-D867 PolarHBondContact O-N 3.16Å
864E71.8Confident64.6Low98 Ų98107.3 Ų107.346%0.45856%0.559SS.*Hα-helixtrans-61.6-30.2175.9-73.5177.5-167.500112.6K860 A861 R868K860-E864 WeakPolarHBondContact CE-OE1 3.49Å; K860-E864 WeakPolarHBondContact O-CG 3.36Å; K860-E864 PolarHBondContact O-N 2.91Å; A861-E864 PolarHBondContact O-N 3.24Å; E864-R868 PolarHBondContact O-N 2.9Å; E864-R868 VanDerWaalsContact O-N 3.14Å
865D66.8Low62.6Low94 Ų94108.1 Ų108.150%0.50357%0.572SS.*Hα-helixtrans-78.1-38.2175.1-132.741.5000113A861 L863 D867 R868 D869A861-D865 PolarHBondContact O-N 2.95Å; L863-D865 PolarHBondContact O-N 3.43Å; D865-D867 VanDerWaalsContact C-N 3.29Å; D865-D867 PolarHBondContact O-N 2.91Å; D865-R868 WeakPolarHBondContact O-CB 3.35Å; D865-R868 PolarHBondContact O-N 3.41Å; D865-R868 VanDerWaalsContact O-N 3.15Å; D865-R868 IonicContact OD1-CZ 2.66Å; D865-R868 IonicContact OD1-NE 2.66Å; D865-R868 PolarHBondContact OD1-NE 3.49Å; D865-R868 IonicContact OD1-NH2 2.84Å; D865-R868 PolarHBondContact OD1-NH2 3.29Å; D865-D869 WeakPolarHBondContact O-CB 3.27Å; D865-D869 PolarHBondContact O-N 3.23Å
866R66.2Low60.3Low166 Ų166109.6 Ų109.663%0.62659%0.593SS**Hα-helixtrans-58.6-40.5167.8-100.2177.462.3102.9-3.6112.1A862 L863 R868 D869 L870A862-R866 PolarHBondContact O-N 3.33Å; A862-R866 VanDerWaalsContact O-N 3.13Å; L863-R866 PolarHBondContact O-N 2.9Å; R866-R868 VanDerWaalsContact C-N 3.28Å; R866-R868 PolarHBondContact O-N 2.88Å; R866-D869 PolarHBondContact O-N 3.39Å; R866-L870 WeakPolarHBondContact O-CB 3.42Å; R866-L870 VanDerWaalsContact O-CG 3.3Å; R866-L870 WeakPolarHBondContact O-CG 3.15Å; R866-L870 PolarHBondContact O-N 2.91Å
867D54.8Low58.1Low86 Ų86110.1 Ų110.146%0.4661%0.606SS.*Hα-helixtrans-76.1-12.2178.2-84.10.9000114L863 D865 R871L863-D867 WeakPolarHBondContact O-CB 3.37Å; L863-D867 PolarHBondContact O-N 3.16Å; D865-D867 VanDerWaalsContact C-N 3.29Å; D865-D867 PolarHBondContact O-N 2.91Å; D867-R871 PolarHBondContact O-NE 2.78Å; D867-R871 PolarHBondContact O-NH2 3.29Å
868R61.4Low56.2Low152 Ų152114.3 Ų114.357%0.57462%0.622SS**Hα-helixtrans-79.6-49.7162.2-106.5-173-66.1-86.2-5.1110.6E864 D865 R866 L870 R871 G872E864-R868 PolarHBondContact O-N 2.9Å; E864-R868 VanDerWaalsContact O-N 3.14Å; D865-R868 WeakPolarHBondContact O-CB 3.35Å; D865-R868 PolarHBondContact O-N 3.41Å; D865-R868 VanDerWaalsContact O-N 3.15Å; D865-R868 IonicContact OD1-CZ 2.66Å; D865-R868 IonicContact OD1-NE 2.66Å; D865-R868 PolarHBondContact OD1-NE 3.49Å; D865-R868 IonicContact OD1-NH2 2.84Å; D865-R868 PolarHBondContact OD1-NH2 3.29Å; R866-R868 VanDerWaalsContact C-N 3.28Å; R866-R868 PolarHBondContact O-N 2.88Å; R868-L870 PolarHBondContact O-N 3.47Å; R868-R871 WeakPolarHBondContact O-CB 3.18Å; R868-R871 PolarHBondContact O-N 3.27Å; R868-G872 PolarHBondContact O-N 2.85Å
869D52.4Low54.2Low87 Ų87115.9 Ų115.947%0.46563%0.628SS.*Hα-helixtrans-70-33.5-172.1-164.553.3000113D865 R866 R871 G872 R873D865-D869 WeakPolarHBondContact O-CB 3.27Å; D865-D869 PolarHBondContact O-N 3.23Å; R866-D869 PolarHBondContact O-N 3.39Å; D869-R871 VanDerWaalsContact C-N 3.3Å; D869-R871 PolarHBondContact O-N 2.96Å; D869-G872 PolarHBondContact O-N 2.88Å; D869-R873 IonicContact OD1-CZ 3.29Å; D869-R873 IonicContact OD1-NH2 3.65Å; D869-R873 PolarHBondContact OD1-NH2 3.39Å; D869-R873 IonicContact OD2-CZ 2.84Å; D869-R873 IonicContact OD2-NE 3.69Å; D869-R873 IonicContact OD2-NH2 2.6Å; D869-R873 PolarHBondContact OD2-NH2 2.93Å
870L52.4Low52Low110 Ų110116.2 Ų116.258%0.57664%0.64SS**Hα-helixtrans-67.5-28.8169.7-72170.7000112.8R866 R868R866-L870 WeakPolarHBondContact O-CB 3.42Å; R866-L870 VanDerWaalsContact O-CG 3.3Å; R866-L870 WeakPolarHBondContact O-CG 3.15Å; R866-L870 PolarHBondContact O-N 2.91Å; R868-L870 PolarHBondContact O-N 3.47Å
871R49.9Very low50.2Low199 Ų199115.4 Ų115.475%0.75165%0.649SS**Hα-helixtrans-78.7-24.2179.5-137.3174.4-56.8-113.2-5.6112.8D867 R868 D869D867-R871 PolarHBondContact O-NE 2.78Å; D867-R871 PolarHBondContact O-NH2 3.29Å; R868-R871 WeakPolarHBondContact O-CB 3.18Å; R868-R871 PolarHBondContact O-N 3.27Å; D869-R871 VanDerWaalsContact C-N 3.3Å; D869-R871 PolarHBondContact O-N 2.96Å
872G49.4Very low48.5Very low69 Ų69118.2 Ų118.271%0.71166%0.661SS**Hα-helixtrans-83.5-14.417700000114.8R868 D869R868-G872 PolarHBondContact O-N 2.85Å; D869-G872 PolarHBondContact O-N 2.88Å
873R46.7Very low47.5Very low186 Ų186121.1 Ų121.170%0.70268%0.675SS**  trans-103.727.6-166.3-136.1175.1-75.8-106.56.6114.2D869D869-R873 IonicContact OD1-CZ 3.29Å; D869-R873 IonicContact OD1-NH2 3.65Å; D869-R873 PolarHBondContact OD1-NH2 3.39Å; D869-R873 IonicContact OD2-CZ 2.84Å; D869-R873 IonicContact OD2-NE 3.69Å; D869-R873 IonicContact OD2-NH2 2.6Å; D869-R873 PolarHBondContact OD2-NH2 2.93Å
874G39.3Very low46.2Very low65 Ų65121.4 Ų121.467%0.6767%0.673SS**  trans-101.29-165.200000118.7
875T34.9Very low44.9Very low136 Ų136124 Ų12483%0.83468%0.684SS**  trans-151.987.3179.147.10000114.5
876C27.7Very low44Very low137 Ų137127.8 Ų127.893%0.92670%0.698SS**  trans173.3146.7152.7-117.20000107.8
877A28.7Very low43.4Very low95 Ų95125.9 Ų125.979%0.78570%0.696SS**  cis-151.7178.4-200000109.3
878Q34.7Very low43.3Very low182 Ų182125.2 Ų125.285%0.8569%0.692SS**  trans-122.3174.1-17997.1-173.453.200112.3
879V34Very low43.4Very low117 Ų117122.4 Ų122.471%0.70969%0.686SS**  trans100.7121.1163.8-1660000119.1
880C28Very low44Very low116 Ų116121.5 Ų121.578%0.78469%0.686SS**  trans55.2153.4151.4-68.50000122
881S37.8Very low45Very low104 Ų104118.8 Ų118.873%0.72767%0.674SS**  cis-161.3160.8-10.2-105.20000110.8
882T38.7Very low46.2Very low114 Ų114114.6 Ų114.670%0.69967%0.666SS**  trans-52.8147.1171.937.70000113.9
883P52.2Low47.6Very low122 Ų122117 Ų11779%0.79266%0.657SS**  -136.4111.450.935.9-17000115
884Q43.3Very low49.2Very low115 Ų115114.2 Ų114.254%0.53765%0.652SS.*  trans-142.316175.2-74.9-172.4-56.200113E886 E887 L888Q884-E886 PolarHBondContact O-N 3.14Å; Q884-E887 PolarHBondContact O-N 3.29Å; Q884-L888 HydrophobicContact CB-CD1 3.6Å; Q884-L888 HydrophobicContact CB-CG 3.82Å; Q884-L888 WeakPolarHBondContact O-CB 3.47Å; Q884-L888 WeakPolarHBondContact O-CG 3.43Å; Q884-L888 PolarHBondContact O-N 3.39Å
885F43.8Very low51.1Low153 Ų153117 Ų11767%0.67165%0.646SS**Hα-helixtrans-63.8-33.2-158.7-149.3-94.6000115.5E889F885-E889 WeakPolarHBondContact O-CB 3.38Å; F885-E889 PolarHBondContact O-N 3.38Å
886E47.3Very low53.4Low172 Ų172114.1 Ų114.180%0.80463%0.625SS**Hα-helixtrans-80.1-38.1178.1-67.9177.7151.400112.9Q884 E889 S890Q884-E886 PolarHBondContact O-N 3.14Å; E886-E889 PolarHBondContact O-N 3.35Å; E886-S890 PolarHBondContact O-N 2.92Å; E886-S890 VanDerWaalsContact O-N 3.08Å
887E53.5Low55.9Low126 Ų126111.7 Ų111.759%0.58960%0.603SS**Hα-helixtrans-68.8-37.8171.4-170.7175.2-158.400110.6Q884 E889 S890 V891Q884-E887 PolarHBondContact O-N 3.29Å; E887-E889 VanDerWaalsContact C-N 3.31Å; E887-E889 PolarHBondContact O-N 3.13Å; E887-S890 PolarHBondContact O-N 2.94Å; E887-S890 PolarHBondContact O-OG 2.87Å; E887-V891 HydrophobicContact CG-CG2 4.46Å; E887-V891 WeakPolarHBondContact O-CB 3.5Å; E887-V891 WeakPolarHBondContact O-CG2 3.35Å; E887-V891 PolarHBondContact O-N 3.48Å
888L53.9Low58.6Low73 Ų73110.4 Ų110.438%0.38258%0.581SS.*Hα-helixtrans-65.7-28.5168.5-81166.9000112.1Q884 L892Q884-L888 HydrophobicContact CB-CD1 3.6Å; Q884-L888 HydrophobicContact CB-CG 3.82Å; Q884-L888 WeakPolarHBondContact O-CB 3.47Å; Q884-L888 WeakPolarHBondContact O-CG 3.43Å; Q884-L888 PolarHBondContact O-N 3.39Å; L888-L892 WeakPolarHBondContact O-CA 3.4Å; L888-L892 WeakPolarHBondContact O-CB 3.48Å; L888-L892 VanDerWaalsContact O-CD1 3.31Å; L888-L892 WeakPolarHBondContact O-CD1 3.44Å; L888-L892 WeakPolarHBondContact O-CG 3.31Å; L888-L892 PolarHBondContact O-N 3.49Å
889E63.6Low60.7Low92 Ų92105.7 Ų105.743%0.4356%0.56SS.*Hα-helixtrans-75.5-37176-159.8-173.2146.300111.6F885 E886 E887 K893F885-E889 WeakPolarHBondContact O-CB 3.38Å; F885-E889 PolarHBondContact O-N 3.38Å; E886-E889 PolarHBondContact O-N 3.35Å; E887-E889 VanDerWaalsContact C-N 3.31Å; E887-E889 PolarHBondContact O-N 3.13Å; E889-K893 WeakPolarHBondContact O-CB 3.49Å; E889-K893 WeakPolarHBondContact O-CG 3.43Å; E889-K893 PolarHBondContact O-N 2.83Å; E889-K893 IonicContact OE1-NZ 2.78Å; E889-K893 PolarHBondContact OE1-NZ 2.99Å
890S64.1Low63.3Low68 Ų68104.6 Ų104.648%0.47655%0.546SS..Hα-helixtrans-68.9-45.4172.373.40000111.4E886 E887 K893 E894E886-S890 PolarHBondContact O-N 2.92Å; E886-S890 VanDerWaalsContact O-N 3.08Å; E887-S890 PolarHBondContact O-N 2.94Å; E887-S890 PolarHBondContact O-OG 2.87Å; S890-K893 PolarHBondContact O-N 3.34Å; S890-E894 WeakPolarHBondContact O-CB 3.46Å; S890-E894 PolarHBondContact O-N 3.23Å
891V73.7Confident66Low53 Ų53105.6 Ų105.632%0.32153%0.533SS..Hα-helixtrans-67.2-34.9175172.90000111E887 E894 K895E887-V891 HydrophobicContact CG-CG2 4.46Å; E887-V891 WeakPolarHBondContact O-CB 3.5Å; E887-V891 WeakPolarHBondContact O-CG2 3.35Å; E887-V891 PolarHBondContact O-N 3.48Å; V891-E894 PolarHBondContact O-N 2.95Å; V891-K895 HydrophobicContact CG1-CG 3.93Å; V891-K895 WeakPolarHBondContact O-CB 3.36Å; V891-K895 WeakPolarHBondContact O-CG 3.37Å; V891-K895 PolarHBondContact O-N 2.76Å
892L74.7Confident68.1Low111 Ų111104.8 Ų104.858%0.58152%0.52SS*.Hα-helixtrans-66.8-43.4171.9-80.9164.4000110.4L888 E894 K895 D896L888-L892 WeakPolarHBondContact O-CA 3.4Å; L888-L892 WeakPolarHBondContact O-CB 3.48Å; L888-L892 VanDerWaalsContact O-CD1 3.31Å; L888-L892 WeakPolarHBondContact O-CD1 3.44Å; L888-L892 WeakPolarHBondContact O-CG 3.31Å; L888-L892 PolarHBondContact O-N 3.49Å; L892-E894 VanDerWaalsContact C-N 3.34Å; L892-E894 PolarHBondContact O-N 2.87Å; L892-K895 CarbonylContact O-C 3.49Å; L892-K895 PolarHBondContact O-N 3.14Å; L892-D896 WeakPolarHBondContact O-CA 3.4Å; L892-D896 WeakPolarHBondContact O-CB 3.45Å; L892-D896 PolarHBondContact O-N 3.45Å
893K79.8Confident70.3Confident120 Ų120105 Ų10552%0.52251%0.513SS..Hα-helixtrans-62.2-40.3173.9-83.5166.2173.7149.10112.2E889 S890 N897E889-K893 WeakPolarHBondContact O-CB 3.49Å; E889-K893 WeakPolarHBondContact O-CG 3.43Å; E889-K893 PolarHBondContact O-N 2.83Å; E889-K893 IonicContact OE1-NZ 2.78Å; E889-K893 PolarHBondContact OE1-NZ 2.99Å; S890-K893 PolarHBondContact O-N 3.34Å; K893-N897 WeakPolarHBondContact O-CB 3.33Å; K893-N897 PolarHBondContact O-N 3.47Å; K893-N897 PolarHBondContact O-ND2 3.39Å
894E79.5Confident71.9Confident127 Ų127103.3 Ų103.359%0.59350%0.5SS*.Hα-helixtrans-68.3-43.3175.6-172.8172.1-165.500111.8S890 V891 L892 N897 E898S890-E894 WeakPolarHBondContact O-CB 3.46Å; S890-E894 PolarHBondContact O-N 3.23Å; V891-E894 PolarHBondContact O-N 2.95Å; L892-E894 VanDerWaalsContact C-N 3.34Å; L892-E894 PolarHBondContact O-N 2.87Å; E894-N897 PolarHBondContact O-N 3.26Å; E894-E898 WeakPolarHBondContact O-CB 3.49Å; E894-E898 PolarHBondContact O-N 2.93Å
895K80.3Confident73.9Confident125 Ų125104.2 Ų104.254%0.54350%0.502SS..Hα-helixtrans-68.3-31.7175.2-68-68.5176.2-169.60112.5V891 L892 E898 I899V891-K895 HydrophobicContact CG1-CG 3.93Å; V891-K895 WeakPolarHBondContact O-CB 3.36Å; V891-K895 WeakPolarHBondContact O-CG 3.37Å; V891-K895 PolarHBondContact O-N 2.76Å; L892-K895 CarbonylContact O-C 3.49Å; L892-K895 PolarHBondContact O-N 3.14Å; K895-E898 CarbonylContact O-C 3.57Å; K895-E898 PolarHBondContact O-N 3.43Å; K895-I899 VanDerWaalsContact O-CB 3.27Å; K895-I899 WeakPolarHBondContact O-CB 3.44Å; K895-I899 WeakPolarHBondContact O-CD1 3.28Å; K895-I899 WeakPolarHBondContact O-CG1 3.48Å; K895-I899 PolarHBondContact O-N 2.59Å
896D81.4Confident75.6Confident75 Ų75102.1 Ų102.140%0.40150%0.497SS..Hα-helixtrans-75.7-33.1176.7-170.155.9000110.9L892 K900L892-D896 WeakPolarHBondContact O-CA 3.4Å; L892-D896 WeakPolarHBondContact O-CB 3.45Å; L892-D896 PolarHBondContact O-N 3.45Å; D896-K900 WeakPolarHBondContact O-CD 3.49Å; D896-K900 VanDerWaalsContact O-CG 3.27Å; D896-K900 WeakPolarHBondContact O-CG 3.41Å; D896-K900 PolarHBondContact O-N 3.35Å; D896-K900 WeakPolarHBondContact OD2-CE 3.31Å; D896-K900 IonicContact OD2-NZ 3.17Å; D896-K900 PolarHBondContact OD2-NZ 3.48Å
897N81Confident77.5Confident86 Ų86101 Ų10146%0.4649%0.49SS..Hα-helixtrans-70.9-37.4166.7-71.1-25.5000112.1K893 E894 K900 R901K893-N897 WeakPolarHBondContact O-CB 3.33Å; K893-N897 PolarHBondContact O-N 3.47Å; K893-N897 PolarHBondContact O-ND2 3.39Å; E894-N897 PolarHBondContact O-N 3.26Å; N897-K900 PolarHBondContact O-N 2.86Å; N897-R901 WeakPolarHBondContact O-CG 3.28Å; N897-R901 PolarHBondContact O-N 3.2Å
898E84.4Confident79Confident68 Ų6899.2 Ų99.232%0.31849%0.485SS..Hα-helixtrans-68.5-37.9173.5-165.260.7-160.900111.4E894 K895 R901 I902E894-E898 WeakPolarHBondContact O-CB 3.49Å; E894-E898 PolarHBondContact O-N 2.93Å; K895-E898 CarbonylContact O-C 3.57Å; K895-E898 PolarHBondContact O-N 3.43Å; E898-R901 CarbonylContact O-C 3.57Å; E898-R901 PolarHBondContact O-N 2.9Å; E898-R901 IonicContact OE2-CZ 2.78Å; E898-R901 IonicContact OE2-NE 2.6Å; E898-R901 PolarHBondContact OE2-NE 2.99Å; E898-R901 IonicContact OE2-NH2 2.74Å; E898-R901 PolarHBondContact OE2-NH2 3.28Å; E898-I902 HydrophobicContact CG-CD1 4.08Å; E898-I902 WeakPolarHBondContact O-CB 3.39Å; E898-I902 VanDerWaalsContact O-CG1 3.22Å; E898-I902 WeakPolarHBondContact O-CG1 3.44Å; E898-I902 PolarHBondContact O-N 2.91Å
899I80.9Confident80.1Confident82 Ų8299.5 Ų99.542%0.42149%0.489SS..Hα-helixtrans-60.9-47.5171.1-76.1160.7000109.2K895 R901 I902 E903K895-I899 VanDerWaalsContact O-CB 3.27Å; K895-I899 WeakPolarHBondContact O-CB 3.44Å; K895-I899 WeakPolarHBondContact O-CD1 3.28Å; K895-I899 WeakPolarHBondContact O-CG1 3.48Å; K895-I899 PolarHBondContact O-N 2.59Å; I899-R901 VanDerWaalsContact C-N 3.33Å; I899-R901 PolarHBondContact O-N 3.22Å; I899-I902 CarbonylContact O-C 3.6Å; I899-I902 WeakPolarHBondContact O-CA 3.41Å; I899-I902 PolarHBondContact O-N 2.9Å; I899-E903 HydrophobicContact CG2-CG 4.15Å; I899-E903 WeakPolarHBondContact O-CB 3.5Å; I899-E903 WeakPolarHBondContact O-CG 3.49Å; I899-E903 PolarHBondContact O-N 3.47Å
900K87Confident80.9Confident95 Ų95101.1 Ų101.141%0.41350%0.497SS..Hα-helixtrans-61.6-38.1174.8-71.7160.2-160.2157.40112.9D896 N897 I902 E903 V904D896-K900 WeakPolarHBondContact O-CD 3.49Å; D896-K900 VanDerWaalsContact O-CG 3.27Å; D896-K900 WeakPolarHBondContact O-CG 3.41Å; D896-K900 PolarHBondContact O-N 3.35Å; D896-K900 WeakPolarHBondContact OD2-CE 3.31Å; D896-K900 IonicContact OD2-NZ 3.17Å; D896-K900 PolarHBondContact OD2-NZ 3.48Å; N897-K900 PolarHBondContact O-N 2.86Å; K900-I902 VanDerWaalsContact C-N 3.35Å; K900-E903 PolarHBondContact O-N 2.88Å; K900-V904 WeakPolarHBondContact O-CG2 3.37Å; K900-V904 PolarHBondContact O-N 2.97Å
901R84.4Confident81.8Confident137 Ų13799.9 Ų99.952%0.51749%0.488SS..Hα-helixtrans-65-38.1172.4-75.6-165.6-74.5-128.22.1112N897 E898 I899 K905N897-R901 WeakPolarHBondContact O-CG 3.28Å; N897-R901 PolarHBondContact O-N 3.2Å; E898-R901 CarbonylContact O-C 3.57Å; E898-R901 PolarHBondContact O-N 2.9Å; E898-R901 IonicContact OE2-CZ 2.78Å; E898-R901 IonicContact OE2-NE 2.6Å; E898-R901 PolarHBondContact OE2-NE 2.99Å; E898-R901 IonicContact OE2-NH2 2.74Å; E898-R901 PolarHBondContact OE2-NH2 3.28Å; I899-R901 VanDerWaalsContact C-N 3.33Å; I899-R901 PolarHBondContact O-N 3.22Å; R901-K905 WeakPolarHBondContact O-CB 3.42Å; R901-K905 VanDerWaalsContact O-CG 3.31Å; R901-K905 WeakPolarHBondContact O-CG 3.21Å; R901-K905 PolarHBondContact O-N 2.74Å; R901-K905 VanDerWaalsContact O-N 3.15Å
902I83.5Confident82.4Confident87 Ų87101.3 Ų101.345%0.44649%0.494SS..Hα-helixtrans-71-41.3175.7-71.3165.7000110.4E898 I899 K900 K905 L906E898-I902 HydrophobicContact CG-CD1 4.08Å; E898-I902 WeakPolarHBondContact O-CB 3.39Å; E898-I902 VanDerWaalsContact O-CG1 3.22Å; E898-I902 WeakPolarHBondContact O-CG1 3.44Å; E898-I902 PolarHBondContact O-N 2.91Å; I899-I902 CarbonylContact O-C 3.6Å; I899-I902 WeakPolarHBondContact O-CA 3.41Å; I899-I902 PolarHBondContact O-N 2.9Å; K900-I902 VanDerWaalsContact C-N 3.35Å; I902-K905 CarbonylContact O-C 3.33Å; I902-K905 PolarHBondContact O-N 3.23Å; I902-L906 VanDerWaalsContact O-CB 3.25Å; I902-L906 WeakPolarHBondContact O-CB 3.32Å; I902-L906 PolarHBondContact O-N 3.46Å
903E83.8Confident82.6Confident117 Ų117100.9 Ų100.955%0.54750%0.496SS..Hα-helixtrans-63-44177.1-77178.7151.200111.8I899 K900 L906 K907I899-E903 HydrophobicContact CG2-CG 4.15Å; I899-E903 WeakPolarHBondContact O-CB 3.5Å; I899-E903 WeakPolarHBondContact O-CG 3.49Å; I899-E903 PolarHBondContact O-N 3.47Å; K900-E903 PolarHBondContact O-N 2.88Å; E903-L906 PolarHBondContact O-N 3.48Å; E903-K907 WeakPolarHBondContact O-CB 3.46Å; E903-K907 PolarHBondContact O-N 3.25Å
904V86.3Confident82.8Confident88 Ų8898.2 Ų98.253%0.53349%0.493SS..Hα-helixtrans-61.6-48.6173.5171.80000110.1K900 L906 K907 D908K900-V904 WeakPolarHBondContact O-CG2 3.37Å; K900-V904 PolarHBondContact O-N 2.97Å; V904-L906 VanDerWaalsContact C-N 3.32Å; V904-L906 PolarHBondContact O-N 3.5Å; V904-K907 PolarHBondContact O-N 2.78Å; V904-D908 VanDerWaalsContact O-CG 3.26Å; V904-D908 PolarHBondContact O-N 2.81Å
905K84.7Confident83.2Confident134 Ų13497.3 Ų97.358%0.58349%0.487SS*.Hα-helixtrans-60.7-39.4175-74.9174.4179.6176.80112.7R901 I902 K907 D908 T909R901-K905 WeakPolarHBondContact O-CB 3.42Å; R901-K905 VanDerWaalsContact O-CG 3.31Å; R901-K905 WeakPolarHBondContact O-CG 3.21Å; R901-K905 PolarHBondContact O-N 2.74Å; R901-K905 VanDerWaalsContact O-N 3.15Å; I902-K905 CarbonylContact O-C 3.33Å; I902-K905 PolarHBondContact O-N 3.23Å; K905-K907 VanDerWaalsContact C-N 3.32Å; K905-D908 PolarHBondContact O-N 3.44Å; K905-T909 WeakPolarHBondContact O-CG2 3.44Å; K905-T909 PolarHBondContact O-N 2.86Å; K905-T909 PolarHBondContact O-OG1 2.71Å; K905-T909 VanDerWaalsContact O-OG1 3.09Å
906L80Confident83.3Confident108 Ų10897.7 Ų97.757%0.56549%0.492SS*.Hα-helixtrans-64.6-43.5179.4-152.193.7000109.2I902 E903 V904 T909 E910I902-L906 VanDerWaalsContact O-CB 3.25Å; I902-L906 WeakPolarHBondContact O-CB 3.32Å; I902-L906 PolarHBondContact O-N 3.46Å; E903-L906 PolarHBondContact O-N 3.48Å; V904-L906 VanDerWaalsContact C-N 3.32Å; V904-L906 PolarHBondContact O-N 3.5Å; L906-T909 WeakPolarHBondContact CA-OG1 3.29Å; L906-T909 CarbonylContact O-C 3.58Å; L906-T909 PolarHBondContact O-N 2.68Å; L906-T909 PolarHBondContact O-OG1 3.05Å; L906-E910 VanDerWaalsContact O-CB 3.23Å; L906-E910 WeakPolarHBondContact O-CB 3.48Å; L906-E910 PolarHBondContact O-N 3.14Å
907K87.3Confident83.2Confident149 Ų14997 Ų9765%0.64849%0.493SS*.Hα-helixtrans-68.4-38178-168.7167.9-171.9169.10112.8E903 V904 K905 E910 S911E903-K907 WeakPolarHBondContact O-CB 3.46Å; E903-K907 PolarHBondContact O-N 3.25Å; V904-K907 PolarHBondContact O-N 2.78Å; K905-K907 VanDerWaalsContact C-N 3.32Å; K907-E910 PolarHBondContact O-N 2.64Å; K907-S911 WeakPolarHBondContact O-CB 3.23Å; K907-S911 PolarHBondContact O-N 3.4Å
908D84.9Confident83.4Confident89 Ų8999.1 Ų99.148%0.47650%0.5SS..Hα-helixtrans-63.1-46.8170.9-68.7-23.8000110V904 K905 E910 S911 D912V904-D908 VanDerWaalsContact O-CG 3.26Å; V904-D908 PolarHBondContact O-N 2.81Å; K905-D908 PolarHBondContact O-N 3.44Å; D908-E910 VanDerWaalsContact C-N 3.34Å; D908-E910 PolarHBondContact O-N 3.16Å; D908-S911 WeakPolarHBondContact O-CB 3.29Å; D908-S911 PolarHBondContact O-N 3.42Å; D908-S911 PolarHBondContact O-OG 2.93Å; D908-D912 WeakPolarHBondContact O-CB 3.31Å; D908-D912 PolarHBondContact O-N 3.27Å
909T77.7Confident83.5Confident79 Ų79100.6 Ų100.649%0.48551%0.509SS..Hα-helixtrans-66.6-30.5174.857.80000113.5K905 L906 D912 V913K905-T909 WeakPolarHBondContact O-CG2 3.44Å; K905-T909 PolarHBondContact O-N 2.86Å; K905-T909 PolarHBondContact O-OG1 2.71Å; K905-T909 VanDerWaalsContact O-OG1 3.09Å; L906-T909 WeakPolarHBondContact CA-OG1 3.29Å; L906-T909 CarbonylContact O-C 3.58Å; L906-T909 PolarHBondContact O-N 2.68Å; L906-T909 PolarHBondContact O-OG1 3.05Å; T909-D912 PolarHBondContact O-N 3.46Å; T909-V913 VanDerWaalsContact O-CB 3.22Å; T909-V913 WeakPolarHBondContact O-CB 3.15Å; T909-V913 WeakPolarHBondContact O-CG2 3.34Å; T909-V913 PolarHBondContact O-N 3.05Å
910E79.7Confident83.6Confident125 Ų125101.6 Ų101.658%0.58452%0.515SS*.Hα-helixtrans-73.4-36.8175.9-176.2175.7-143.300110.7L906 K907 D908 S914L906-E910 VanDerWaalsContact O-CB 3.23Å; L906-E910 WeakPolarHBondContact O-CB 3.48Å; L906-E910 PolarHBondContact O-N 3.14Å; K907-E910 PolarHBondContact O-N 2.64Å; D908-E910 VanDerWaalsContact C-N 3.34Å; D908-E910 PolarHBondContact O-N 3.16Å; E910-S914 WeakPolarHBondContact O-CB 3.49Å; E910-S914 PolarHBondContact O-N 3.41Å; E910-S914 PolarHBondContact O-OG 2.94Å
911S83.5Confident83.4Confident43 Ų43103.5 Ų103.530%0.30152%0.524SS..Hα-helixtrans-59.7-47.5166.5132.40000110.9K907 D908 S914 K915K907-S911 WeakPolarHBondContact O-CB 3.23Å; K907-S911 PolarHBondContact O-N 3.4Å; D908-S911 WeakPolarHBondContact O-CB 3.29Å; D908-S911 PolarHBondContact O-N 3.42Å; D908-S911 PolarHBondContact O-OG 2.93Å; S911-S914 WeakPolarHBondContact O-CB 3.47Å; S911-S914 PolarHBondContact O-N 3.47Å; S911-K915 WeakPolarHBondContact O-CG 3.45Å; S911-K915 PolarHBondContact O-N 3.18Å; S911-K915 VanDerWaalsContact OG-CE 3.25Å; S911-K915 WeakPolarHBondContact OG-CE 3.43Å; S911-K915 PolarHBondContact OG-NZ 2.94Å
912D85.8Confident83.3Confident83 Ų83103.3 Ų103.344%0.44453%0.528SS..Hα-helixtrans-74.9-32-176.3-69.7-10.8000112.2D908 T909 K915 M916D908-D912 WeakPolarHBondContact O-CB 3.31Å; D908-D912 PolarHBondContact O-N 3.27Å; T909-D912 PolarHBondContact O-N 3.46Å; D912-K915 PolarHBondContact O-N 2.85Å; D912-K915 IonicContact OD1-NZ 2.73Å; D912-K915 PolarHBondContact OD1-NZ 2.6Å; D912-M916 WeakPolarHBondContact O-CB 3.4Å; D912-M916 PolarHBondContact O-N 3.31Å
913V78.3Confident83.3Confident101 Ų101102.3 Ų102.361%0.61253%0.526SS*.Hα-helixtrans-67.1-35.9168166.10000111T909 M916 S917T909-V913 VanDerWaalsContact O-CB 3.22Å; T909-V913 WeakPolarHBondContact O-CB 3.15Å; T909-V913 WeakPolarHBondContact O-CG2 3.34Å; T909-V913 PolarHBondContact O-N 3.05Å; V913-M916 PolarHBondContact O-N 3.03Å; V913-S917 VanDerWaalsContact O-CB 3.31Å; V913-S917 WeakPolarHBondContact O-CB 3.32Å; V913-S917 PolarHBondContact O-N 3Å
914S84.3Confident82.9Confident65 Ų65102.4 Ų102.446%0.45553%0.527SS..Hα-helixtrans-65.1-47.6173.3-62.30000111.4E910 S911 M916 S917 E918E910-S914 WeakPolarHBondContact O-CB 3.49Å; E910-S914 PolarHBondContact O-N 3.41Å; E910-S914 PolarHBondContact O-OG 2.94Å; S911-S914 WeakPolarHBondContact O-CB 3.47Å; S911-S914 PolarHBondContact O-N 3.47Å; S914-M916 VanDerWaalsContact C-N 3.33Å; S914-M916 PolarHBondContact O-N 3.37Å; S914-S917 CarbonylContact O-C 3.58Å; S914-S917 WeakPolarHBondContact O-CA 3.43Å; S914-S917 WeakPolarHBondContact O-CB 3.17Å; S914-S917 PolarHBondContact O-N 3.35Å; S914-S917 VanDerWaalsContact O-N 3.09Å; S914-E918 PolarHBondContact O-N 2.9Å
915K87.9Confident82.7Confident108 Ų108103.4 Ų103.447%0.4753%0.526SS..Hα-helixtrans-60.2-42173.6-65166.3-155.2158.70111.8S911 D912 S917 E918 L919S911-K915 WeakPolarHBondContact O-CG 3.45Å; S911-K915 PolarHBondContact O-N 3.18Å; S911-K915 VanDerWaalsContact OG-CE 3.25Å; S911-K915 WeakPolarHBondContact OG-CE 3.43Å; S911-K915 PolarHBondContact OG-NZ 2.94Å; D912-K915 PolarHBondContact O-N 2.85Å; D912-K915 IonicContact OD1-NZ 2.73Å; D912-K915 PolarHBondContact OD1-NZ 2.6Å; K915-S917 VanDerWaalsContact C-N 3.28Å; K915-S917 PolarHBondContact O-N 3.31Å; K915-E918 PolarHBondContact O-N 2.88Å; K915-L919 WeakPolarHBondContact O-CB 3.38Å; K915-L919 PolarHBondContact O-N 3.48Å
916M82.4Confident82.4Confident133 Ų133102.7 Ų102.766%0.65552%0.524SS*.Hα-helixtrans-62.8-36.4175-165.878.47000111.3D912 V913 S914 L920D912-M916 WeakPolarHBondContact O-CB 3.4Å; D912-M916 PolarHBondContact O-N 3.31Å; V913-M916 PolarHBondContact O-N 3.03Å; S914-M916 VanDerWaalsContact C-N 3.33Å; S914-M916 PolarHBondContact O-N 3.37Å; M916-L920 WeakPolarHBondContact O-CB 3.49Å; M916-L920 PolarHBondContact O-N 2.92Å
917S80.2Confident82.1Confident59 Ų59102.1 Ų102.141%0.41352%0.522SS..Hα-helixtrans-73-27.9175-177.70000113.4V913 S914 K915 K921V913-S917 VanDerWaalsContact O-CB 3.31Å; V913-S917 WeakPolarHBondContact O-CB 3.32Å; V913-S917 PolarHBondContact O-N 3Å; S914-S917 CarbonylContact O-C 3.58Å; S914-S917 WeakPolarHBondContact O-CA 3.43Å; S914-S917 WeakPolarHBondContact O-CB 3.17Å; S914-S917 PolarHBondContact O-N 3.35Å; S914-S917 VanDerWaalsContact O-N 3.09Å; K915-S917 VanDerWaalsContact C-N 3.28Å; K915-S917 PolarHBondContact O-N 3.31Å; S917-K921 PolarHBondContact O-N 3.36Å; S917-K921 VanDerWaalsContact O-N 3.12Å
918E85.3Confident82Confident132 Ų132100.4 Ų100.462%0.61751%0.514SS*.Hα-helixtrans-74.4-47.2171.3-76.7-177.1143.200111S914 K915 L920 K921 E922S914-E918 PolarHBondContact O-N 2.9Å; K915-E918 PolarHBondContact O-N 2.88Å; E918-L920 VanDerWaalsContact C-N 3.28Å; E918-L920 PolarHBondContact O-N 3.42Å; E918-K921 CarbonylContact O-C 3.46Å; E918-K921 WeakPolarHBondContact O-CA 3.14Å; E918-K921 WeakPolarHBondContact O-CB 3.45Å; E918-K921 PolarHBondContact O-N 3.18Å; E918-E922 PolarHBondContact O-N 3Å
919L86.3Confident81.7Confident98 Ų98102.7 Ų102.751%0.51352%0.52SS..Hα-helixtrans-58-39.2170.7-80.2163.8000112.1K915 K921 E922 V923K915-L919 WeakPolarHBondContact O-CB 3.38Å; K915-L919 PolarHBondContact O-N 3.48Å; L919-K921 VanDerWaalsContact C-N 3.32Å; L919-K921 PolarHBondContact O-N 2.95Å; L919-E922 PolarHBondContact O-N 3.43Å; L919-V923 WeakPolarHBondContact O-CB 3.38Å; L919-V923 VanDerWaalsContact O-CG2 3.28Å; L919-V923 WeakPolarHBondContact O-CG2 3.49Å; L919-V923 PolarHBondContact O-N 3.04Å
920L82.8Confident81.7Confident104 Ų104102.3 Ų102.355%0.54552%0.515SS..Hα-helixtrans-66.5-34.1174.9-170.869.9000111.9M916 E918 Q924M916-L920 WeakPolarHBondContact O-CB 3.49Å; M916-L920 PolarHBondContact O-N 2.92Å; E918-L920 VanDerWaalsContact C-N 3.28Å; E918-L920 PolarHBondContact O-N 3.42Å; L920-Q924 VanDerWaalsContact O-CB 3.27Å; L920-Q924 WeakPolarHBondContact O-CB 3.27Å; L920-Q924 VanDerWaalsContact O-CG 3.29Å; L920-Q924 WeakPolarHBondContact O-CG 3.37Å; L920-Q924 PolarHBondContact O-N 3.37Å
921K83.1Confident81.7Confident135 Ų135104 Ų10459%0.58752%0.52SS*.Hα-helixtrans-68.9-43.6172.3-88.9178.8176.6173.40112S917 E918 L919 Q924 E925S917-K921 PolarHBondContact O-N 3.36Å; S917-K921 VanDerWaalsContact O-N 3.12Å; E918-K921 CarbonylContact O-C 3.46Å; E918-K921 WeakPolarHBondContact O-CA 3.14Å; E918-K921 WeakPolarHBondContact O-CB 3.45Å; E918-K921 PolarHBondContact O-N 3.18Å; L919-K921 VanDerWaalsContact C-N 3.32Å; L919-K921 PolarHBondContact O-N 2.95Å; K921-Q924 PolarHBondContact O-N 3.5Å; K921-E925 PolarHBondContact O-N 3.05Å
922E82.5Confident81.3Confident133 Ų133105.9 Ų105.962%0.62153%0.533SS*.Hα-helixtrans-60.2-49.5174.2-73.5-173.5143.300110.4E918 L919 Q924 E925 E926E918-E922 PolarHBondContact O-N 3Å; L919-E922 PolarHBondContact O-N 3.43Å; E922-Q924 VanDerWaalsContact C-N 3.26Å; E922-Q924 PolarHBondContact O-N 2.91Å; E922-E925 PolarHBondContact O-N 2.9Å; E922-E926 VanDerWaalsContact O-CB 3.25Å; E922-E926 WeakPolarHBondContact O-CB 3.45Å; E922-E926 PolarHBondContact O-N 3.5Å
923V81.9Confident80.7Confident66 Ų66107 Ų10740%0.454%0.535SS..Hα-helixtrans-62.6-31.2175.2171.50000112L919 N927L919-V923 WeakPolarHBondContact O-CB 3.38Å; L919-V923 VanDerWaalsContact O-CG2 3.28Å; L919-V923 WeakPolarHBondContact O-CG2 3.49Å; L919-V923 PolarHBondContact O-N 3.04Å; V923-N927 VanDerWaalsContact O-CB 3.23Å; V923-N927 WeakPolarHBondContact O-CB 3.48Å; V923-N927 PolarHBondContact O-N 3.48Å; V923-N927 PolarHBondContact O-ND2 2.86Å
924Q76Confident80.1Confident118 Ų118107.3 Ų107.355%0.55153%0.533SS*.Hα-helixtrans-70.6-45.6172.9-87.2-174.1-3600112.6L920 K921 E922 N927 K928L920-Q924 VanDerWaalsContact O-CB 3.27Å; L920-Q924 WeakPolarHBondContact O-CB 3.27Å; L920-Q924 VanDerWaalsContact O-CG 3.29Å; L920-Q924 WeakPolarHBondContact O-CG 3.37Å; L920-Q924 PolarHBondContact O-N 3.37Å; K921-Q924 PolarHBondContact O-N 3.5Å; E922-Q924 VanDerWaalsContact C-N 3.26Å; E922-Q924 PolarHBondContact O-N 2.91Å; Q924-N927 PolarHBondContact O-N 2.94Å; Q924-K928 VanDerWaalsContact O-CB 3.27Å; Q924-K928 WeakPolarHBondContact O-CB 3.36Å; Q924-K928 PolarHBondContact O-N 3.34Å
925E81.6Confident79.1Confident110 Ų110107.4 Ų107.451%0.51453%0.534SS..Hα-helixtrans-70.8-31.9177-67.7-61.8137.700111.6K921 E922 K928 F929K921-E925 PolarHBondContact O-N 3.05Å; E922-E925 PolarHBondContact O-N 2.9Å; E925-K928 CarbonylContact O-C 3.58Å; E925-K928 WeakPolarHBondContact O-CB 3.25Å; E925-K928 PolarHBondContact O-N 2.99Å; E925-K928 IonicContact OE1-NZ 2.7Å; E925-K928 PolarHBondContact OE1-NZ 2.87Å; E925-K928 WeakPolarHBondContact OE2-CD 3.26Å; E925-K928 IonicContact OE2-NZ 3.13Å; E925-K928 PolarHBondContact OE2-NZ 3.49Å; E925-F929 WeakPolarHBondContact O-CB 3.28Å; E925-F929 PolarHBondContact O-N 2.86Å
926E79.3Confident77.7Confident119 Ų119108.1 Ų108.156%0.55654%0.538SS*.Hα-helixtrans-67.9-42.1170.1-168.7177.2-138.300111.2E922 K928 F929 L930E922-E926 VanDerWaalsContact O-CB 3.25Å; E922-E926 WeakPolarHBondContact O-CB 3.45Å; E922-E926 PolarHBondContact O-N 3.5Å; E926-K928 VanDerWaalsContact C-N 3.27Å; E926-K928 PolarHBondContact O-N 3.07Å; E926-F929 PolarHBondContact O-N 3.18Å; E926-L930 HydrophobicContact CG-CD1 4.25Å; E926-L930 WeakPolarHBondContact O-CB 3.37Å; E926-L930 VanDerWaalsContact O-CG 3.28Å; E926-L930 WeakPolarHBondContact O-CG 3.34Å; E926-L930 PolarHBondContact O-N 2.91Å
927N72.5Confident76.5Confident95 Ų95106.9 Ų106.951%0.50853%0.531SS..Hα-helixtrans-61.7-35.5169.5-94-85.8000112.3V923 Q924 K931V923-N927 VanDerWaalsContact O-CB 3.23Å; V923-N927 WeakPolarHBondContact O-CB 3.48Å; V923-N927 PolarHBondContact O-N 3.48Å; V923-N927 PolarHBondContact O-ND2 2.86Å; Q924-N927 PolarHBondContact O-N 2.94Å; N927-K931 WeakPolarHBondContact O-CB 3.26Å; N927-K931 PolarHBondContact O-N 2.96Å
928K85.1Confident75.2Confident114 Ų114111.3 Ų111.350%0.49654%0.543SS..Hα-helixtrans-70.9-39.6177.9-160.3-171.4-169.2-177.60110.5Q924 E925 E926 K931 C932Q924-K928 VanDerWaalsContact O-CB 3.27Å; Q924-K928 WeakPolarHBondContact O-CB 3.36Å; Q924-K928 PolarHBondContact O-N 3.34Å; E925-K928 CarbonylContact O-C 3.58Å; E925-K928 WeakPolarHBondContact O-CB 3.25Å; E925-K928 PolarHBondContact O-N 2.99Å; E925-K928 IonicContact OE1-NZ 2.7Å; E925-K928 PolarHBondContact OE1-NZ 2.87Å; E925-K928 WeakPolarHBondContact OE2-CD 3.26Å; E925-K928 IonicContact OE2-NZ 3.13Å; E925-K928 PolarHBondContact OE2-NZ 3.49Å; E926-K928 VanDerWaalsContact C-N 3.27Å; E926-K928 PolarHBondContact O-N 3.07Å; K928-K931 PolarHBondContact O-N 3.38Å; K928-C932 WeakPolarHBondContact O-CB 3.32Å; K928-C932 PolarHBondContact O-N 3.31Å; K928-C932 PolarHBondContact O-SG 2.77Å; K928-C932 VanDerWaalsContact O-SG 3.35Å
929F78.8Confident73.7Confident136 Ų136112 Ų11260%0.59655%0.546SS*.Hα-helixtrans-63.5-50.2171.3-179.8-99000111.5E925 E926 K931 C932 Q933E925-F929 WeakPolarHBondContact O-CB 3.28Å; E925-F929 PolarHBondContact O-N 2.86Å; E926-F929 PolarHBondContact O-N 3.18Å; F929-K931 VanDerWaalsContact C-N 3.28Å; F929-K931 PolarHBondContact O-N 3.4Å; F929-C932 CarbonylContact O-C 3.59Å; F929-C932 WeakPolarHBondContact O-CB 3.34Å; F929-C932 PolarHBondContact O-N 2.92Å; F929-C932 VanDerWaalsContact O-N 3.15Å; F929-Q933 WeakPolarHBondContact O-CB 3.45Å; F929-Q933 PolarHBondContact O-N 2.88Å
930L78.4Confident71.9Confident71 Ų71113 Ų11337%0.37255%0.548SS..Hα-helixtrans-60.8-34.7174.1-72.7167.7000112.1E926 Q933 L934E926-L930 HydrophobicContact CG-CD1 4.25Å; E926-L930 WeakPolarHBondContact O-CB 3.37Å; E926-L930 VanDerWaalsContact O-CG 3.28Å; E926-L930 WeakPolarHBondContact O-CG 3.34Å; E926-L930 PolarHBondContact O-N 2.91Å; L930-Q933 PolarHBondContact O-N 2.71Å; L930-L934 VanDerWaalsContact O-CB 3.3Å; L930-L934 WeakPolarHBondContact O-CB 3.45Å; L930-L934 WeakPolarHBondContact O-CG 3.45Å; L930-L934 PolarHBondContact O-N 3.31Å
931K80Confident70.2Confident160 Ų160114.5 Ų114.570%0.69655%0.552SS**Hα-helixtrans-73-35175-170171.3-173.5174.30112.3N927 K928 F929 S935N927-K931 WeakPolarHBondContact O-CB 3.26Å; N927-K931 PolarHBondContact O-N 2.96Å; K928-K931 PolarHBondContact O-N 3.38Å; F929-K931 VanDerWaalsContact C-N 3.28Å; F929-K931 PolarHBondContact O-N 3.4Å; K931-S935 WeakPolarHBondContact O-CB 3.42Å; K931-S935 PolarHBondContact O-N 2.93Å
932C74.2Confident68.3Low84 Ų84112 Ų11257%0.56856%0.556SS**Hα-helixtrans-66.3-41.4168-75.40000111.5K928 F929 S935 H936K928-C932 WeakPolarHBondContact O-CB 3.32Å; K928-C932 PolarHBondContact O-N 3.31Å; K928-C932 PolarHBondContact O-SG 2.77Å; K928-C932 VanDerWaalsContact O-SG 3.35Å; F929-C932 CarbonylContact O-C 3.59Å; F929-C932 WeakPolarHBondContact O-CB 3.34Å; F929-C932 PolarHBondContact O-N 2.92Å; F929-C932 VanDerWaalsContact O-N 3.15Å; C932-S935 WeakPolarHBondContact O-CB 3.43Å; C932-S935 PolarHBondContact O-N 3.3Å; C932-H936 WeakPolarHBondContact O-CB 3.34Å; C932-H936 PolarHBondContact O-N 3.47Å
933Q74.3Confident66.5Low106 Ų106110.3 Ų110.350%0.49556%0.56SS.*Hα-helixtrans-65.2-43.9176.5-168.4179.665.200111.4F929 L930 S935 H936 Q937F929-Q933 WeakPolarHBondContact O-CB 3.45Å; F929-Q933 PolarHBondContact O-N 2.88Å; L930-Q933 PolarHBondContact O-N 2.71Å; Q933-S935 PolarHBondContact O-N 3.25Å; Q933-H936 PolarHBondContact O-N 2.92Å; Q933-Q937 WeakPolarHBondContact O-CB 3.21Å; Q933-Q937 PolarHBondContact O-N 3.26Å
934L66.1Low64.9Low107 Ų107115 Ų11556%0.5658%0.575SS**Hα-helixtrans-61.8-39.8170.8-85.3163.4000112L930 H936 Q937 K938L930-L934 VanDerWaalsContact O-CB 3.3Å; L930-L934 WeakPolarHBondContact O-CB 3.45Å; L930-L934 WeakPolarHBondContact O-CG 3.45Å; L930-L934 PolarHBondContact O-N 3.31Å; L934-H936 VanDerWaalsContact C-N 3.34Å; L934-Q937 PolarHBondContact O-N 3.29Å; L934-K938 VanDerWaalsContact O-CB 3.3Å; L934-K938 WeakPolarHBondContact O-CB 3.29Å; L934-K938 PolarHBondContact O-N 3.47Å
935S62.4Low63.5Low68 Ų68113.6 Ų113.648%0.47658%0.576SS.*Hα-helixtrans-65.8-37.9175.1-166.50000112K931 C932 Q933 K938 H939K931-S935 WeakPolarHBondContact O-CB 3.42Å; K931-S935 PolarHBondContact O-N 2.93Å; C932-S935 WeakPolarHBondContact O-CB 3.43Å; C932-S935 PolarHBondContact O-N 3.3Å; Q933-S935 PolarHBondContact O-N 3.25Å; S935-K938 PolarHBondContact O-N 2.77Å; S935-H939 PolarHBondContact O-N 3.03Å
936H59.5Low62.1Low123 Ų123110.8 Ų110.857%0.56957%0.568SS**Hα-helixtrans-68.5-42.1175-160.782.1000111.4C932 Q933 L934 K938 H939 Q940C932-H936 WeakPolarHBondContact O-CB 3.34Å; C932-H936 PolarHBondContact O-N 3.47Å; Q933-H936 PolarHBondContact O-N 2.92Å; L934-H936 VanDerWaalsContact C-N 3.34Å; H936-K938 VanDerWaalsContact C-N 3.31Å; H936-K938 PolarHBondContact O-N 3.38Å; H936-H939 PolarHBondContact O-N 3.5Å; H936-Q940 PolarHBondContact CD2-NE2 3.47Å; H936-Q940 VanDerWaalsContact CD2-NE2 3.28Å; H936-Q940 PolarHBondContact NE2-NE2 2.74Å; H936-Q940 WeakPolarHBondContact O-CG 3.5Å; H936-Q940 PolarHBondContact O-N 2.87Å
937Q56.9Low60.9Low106 Ų106112.8 Ų112.850%0.49558%0.578SS.*Hα-helixtrans-64.5-34.1172.8-166.1177.622.700111.8Q933 L934 Q940 Q941Q933-Q937 WeakPolarHBondContact O-CB 3.21Å; Q933-Q937 PolarHBondContact O-N 3.26Å; L934-Q937 PolarHBondContact O-N 3.29Å; Q937-Q940 PolarHBondContact O-N 3.25Å; Q937-Q941 PolarHBondContact O-N 3.28Å
938K52.7Low60.2Low152 Ų152115.2 Ų115.266%0.66159%0.586SS**Hα-helixtrans-71.4-34.2174.2-142.5176.2-171.3-176.60112.5L934 S935 H936 Q941 A942L934-K938 VanDerWaalsContact O-CB 3.3Å; L934-K938 WeakPolarHBondContact O-CB 3.29Å; L934-K938 PolarHBondContact O-N 3.47Å; S935-K938 PolarHBondContact O-N 2.77Å; H936-K938 VanDerWaalsContact C-N 3.31Å; H936-K938 PolarHBondContact O-N 3.38Å; K938-Q941 PolarHBondContact O-N 3.07Å; K938-A942 WeakPolarHBondContact O-CB 3.45Å; K938-A942 PolarHBondContact O-N 3.03Å
939H52.7Low59.2Low147 Ų147114.6 Ų114.668%0.68159%0.585SS**Hα-helixtrans-68.5-36.1168.8-97.769.7000112.2S935 H936 A942 S943S935-H939 PolarHBondContact O-N 3.03Å; H936-H939 PolarHBondContact O-N 3.5Å; H939-A942 PolarHBondContact O-N 3.03Å; H939-S943 PolarHBondContact O-N 2.99Å
940Q49.4Very low58.9Low119 Ų119113.4 Ų113.456%0.55658%0.584SS**Hα-helixtrans-70.1-33.2172.3-70.5178.95.500112.5H936 Q937 S943H936-Q940 PolarHBondContact CD2-NE2 3.47Å; H936-Q940 VanDerWaalsContact CD2-NE2 3.28Å; H936-Q940 PolarHBondContact NE2-NE2 2.74Å; H936-Q940 WeakPolarHBondContact O-CG 3.5Å; H936-Q940 PolarHBondContact O-N 2.87Å; Q937-Q940 PolarHBondContact O-N 3.25Å; Q940-S943 VanDerWaalsContact O-CB 3.31Å; Q940-S943 WeakPolarHBondContact O-CB 3.32Å; Q940-S943 PolarHBondContact O-N 3.07Å
941Q45.8Very low58.6Low135 Ų135116 Ų11663%0.63160%0.595SS**Hα-helixtrans-73.8-26.1171.4-86.8-175.3-28.800113.7Q937 K938 S943 F944Q937-Q941 PolarHBondContact O-N 3.28Å; K938-Q941 PolarHBondContact O-N 3.07Å; Q941-S943 PolarHBondContact O-N 3.03Å; Q941-F944 PolarHBondContact O-N 3.37Å
942A43.5Very low58.4Low82 Ų82112 Ų11268%0.67858%0.583SS**THydrogen-bonded Turntrans-74.82.916900000113.4K938 H939K938-A942 WeakPolarHBondContact O-CB 3.45Å; K938-A942 PolarHBondContact O-N 3.03Å; H939-A942 PolarHBondContact O-N 3.03Å
943S45.8Very low58.7Low99 Ų99111.4 Ų111.469%0.69258%0.577SS**THydrogen-bonded Turntrans-98.16173.1-169.70000113.4H939 Q940 Q941H939-S943 PolarHBondContact O-N 2.99Å; Q940-S943 VanDerWaalsContact O-CB 3.31Å; Q940-S943 WeakPolarHBondContact O-CB 3.32Å; Q940-S943 PolarHBondContact O-N 3.07Å; Q941-S943 PolarHBondContact O-N 3.03Å
944F47.5Very low58.9Low163 Ų163110.4 Ų110.472%0.71557%0.574SS**SBendtrans-78.6140163-84-88.4000109.5Q941Q941-F944 PolarHBondContact O-N 3.37Å
945P46.7Very low59.7Low89 Ų89108.6 Ų108.658%0.57857%0.571SS**PPolyproline II helixtrans-56.8143.3-177.624.6-34.5000110.2E949P945-E949 WeakPolarHBondContact CA-OE2 3.28Å; P945-E949 HydrophobicContact CB-CB 4.13Å; P945-E949 WeakPolarHBondContact CB-OE2 3.5Å
946S52.3Low60.9Low51 Ų51111.7 Ų111.736%0.35758%0.577SS.*PPolyproline II helixtrans-62.1154.3-175.870.10000110.7E948 E949 L950S946-E948 PolarHBondContact O-N 3.09Å; S946-E948 WeakPolarHBondContact OG-CB 3.36Å; S946-E949 PolarHBondContact N-OE2 3.45Å; S946-E949 WeakPolarHBondContact O-CB 3.42Å; S946-E949 PolarHBondContact O-N 2.92Å; S946-E949 PolarHBondContact OG-N 3.01Å; S946-L950 PolarHBondContact O-N 3.01Å
947Q53.3Low62.2Low161 Ų161110.9 Ų110.975%0.75257%0.573SS**Hα-helixtrans-56-23.9174-174.6173.8-17.500112.3Q951Q947-Q951 PolarHBondContact O-N 3.41Å; Q947-Q951 VanDerWaalsContact O-N 3.11Å
948E59Low63.6Low146 Ų146111.6 Ų111.668%0.68258%0.576SS**Hα-helixtrans-72.5-38.2175.2-157.8165.5-153.800112.4S946 Q951 T952S946-E948 PolarHBondContact O-N 3.09Å; S946-E948 WeakPolarHBondContact OG-CB 3.36Å; E948-Q951 PolarHBondContact O-N 3.47Å; E948-T952 PolarHBondContact O-N 3.36Å; E948-T952 PolarHBondContact O-OG1 2.9Å
949E64.4Low65.6Low102 Ų102110.7 Ų110.748%0.47757%0.572SS.*Hα-helixtrans-67.2-38.8173.1-73.7170.2145.900111.7P945 S946 T952 V953P945-E949 WeakPolarHBondContact CA-OE2 3.28Å; P945-E949 HydrophobicContact CB-CB 4.13Å; P945-E949 WeakPolarHBondContact CB-OE2 3.5Å; S946-E949 PolarHBondContact N-OE2 3.45Å; S946-E949 WeakPolarHBondContact O-CB 3.42Å; S946-E949 PolarHBondContact O-N 2.92Å; S946-E949 PolarHBondContact OG-N 3.01Å; E949-T952 VanDerWaalsContact CA-OG1 3.27Å; E949-T952 WeakPolarHBondContact CA-OG1 3.18Å; E949-T952 PolarHBondContact O-N 2.91Å; E949-T952 PolarHBondContact O-OG1 2.74Å; E949-V953 WeakPolarHBondContact O-CG2 3.48Å; E949-V953 PolarHBondContact O-N 2.87Å
950L71.9Confident67.5Low110 Ų110108.2 Ų108.258%0.57656%0.561SS**Hα-helixtrans-67.9-37.7174.3-163.671.9000111.8S946 V953 I954S946-L950 PolarHBondContact O-N 3.01Å; L950-V953 PolarHBondContact O-N 2.84Å; L950-I954 HydrophobicContact CG-CD1 4.27Å; L950-I954 WeakPolarHBondContact O-CD1 3.41Å; L950-I954 VanDerWaalsContact O-CG1 3.26Å; L950-I954 WeakPolarHBondContact O-CG1 3.49Å; L950-I954 PolarHBondContact O-N 3.4Å
951Q72.8Confident69.3Low127 Ų127107.7 Ų107.759%0.59356%0.56SS**Hα-helixtrans-68.3-35.7174.7-83.5-176.9-70.400113.1Q947 E948 I954 S955Q947-Q951 PolarHBondContact O-N 3.41Å; Q947-Q951 VanDerWaalsContact O-N 3.11Å; E948-Q951 PolarHBondContact O-N 3.47Å; Q951-I954 PolarHBondContact O-N 2.86Å; Q951-S955 WeakPolarHBondContact O-CB 3.45Å; Q951-S955 PolarHBondContact O-N 3.27Å
952T76.1Confident71.5Confident75 Ų75104.9 Ų104.946%0.4655%0.553SS.*Hα-helixtrans-67.8-42.3173.844.10000111.6E948 E949 I954 S955 E956E948-T952 PolarHBondContact O-N 3.36Å; E948-T952 PolarHBondContact O-OG1 2.9Å; E949-T952 VanDerWaalsContact CA-OG1 3.27Å; E949-T952 WeakPolarHBondContact CA-OG1 3.18Å; E949-T952 PolarHBondContact O-N 2.91Å; E949-T952 PolarHBondContact O-OG1 2.74Å; T952-I954 PolarHBondContact O-N 3.4Å; T952-S955 PolarHBondContact O-N 3.05Å; T952-E956 WeakPolarHBondContact O-CG 3.36Å; T952-E956 PolarHBondContact O-N 2.95Å
953V79.1Confident73.7Confident72 Ų72105.1 Ų105.144%0.43654%0.542SS..Hα-helixtrans-62.7-40.4174172.10000112.1E949 L950 E956 K957E949-V953 WeakPolarHBondContact O-CG2 3.48Å; E949-V953 PolarHBondContact O-N 2.87Å; L950-V953 PolarHBondContact O-N 2.84Å; V953-E956 PolarHBondContact O-N 3.42Å; V953-K957 WeakPolarHBondContact O-CB 3.38Å; V953-K957 VanDerWaalsContact O-CG 3.26Å; V953-K957 WeakPolarHBondContact O-CG 3.4Å; V953-K957 PolarHBondContact O-N 2.95Å
954I79.1Confident75.9Confident84 Ų84104.7 Ų104.743%0.43153%0.532SS..Hα-helixtrans-63-46.2174-70164.7000110.4L950 Q951 T952 E956 K957 E958L950-I954 HydrophobicContact CG-CD1 4.27Å; L950-I954 WeakPolarHBondContact O-CD1 3.41Å; L950-I954 VanDerWaalsContact O-CG1 3.26Å; L950-I954 WeakPolarHBondContact O-CG1 3.49Å; L950-I954 PolarHBondContact O-N 3.4Å; Q951-I954 PolarHBondContact O-N 2.86Å; T952-I954 PolarHBondContact O-N 3.4Å; I954-E956 VanDerWaalsContact C-N 3.35Å; I954-E956 PolarHBondContact O-N 2.94Å; I954-K957 PolarHBondContact O-N 2.86Å; I954-K957 VanDerWaalsContact O-N 3.17Å; I954-E958 HydrophobicContact CG2-CG 4.34Å; I954-E958 WeakPolarHBondContact O-CG 3.3Å; I954-E958 PolarHBondContact O-N 3.38Å
955S82.9Confident77.7Confident70 Ų70100.2 Ų100.249%0.4952%0.52SS..Hα-helixtrans-61.1-39.6177.1178.30000112.9Q951 T952 K959Q951-S955 WeakPolarHBondContact O-CB 3.45Å; Q951-S955 PolarHBondContact O-N 3.27Å; T952-S955 PolarHBondContact O-N 3.05Å; S955-K959 WeakPolarHBondContact O-CB 3.48Å; S955-K959 PolarHBondContact O-N 2.91Å
956E86.8Confident79.8Confident132 Ų132101 Ų10162%0.61752%0.52SS*.Hα-helixtrans-66.1-39.5174.6-75.4-175.9158.800111.7T952 V953 I954 K959 E960T952-E956 WeakPolarHBondContact O-CG 3.36Å; T952-E956 PolarHBondContact O-N 2.95Å; V953-E956 PolarHBondContact O-N 3.42Å; I954-E956 VanDerWaalsContact C-N 3.35Å; I954-E956 PolarHBondContact O-N 2.94Å; E956-K959 PolarHBondContact O-N 3.39Å; E956-E960 WeakPolarHBondContact O-CB 3.32Å; E956-E960 PolarHBondContact O-N 3.18Å
957K88Confident81.7Confident107 Ų107104.1 Ų104.147%0.46553%0.529SS..Hα-helixtrans-71.1-37.6176.7-67.5-70.7154.7-161.50112.7V953 I954 K959 E960 I961V953-K957 WeakPolarHBondContact O-CB 3.38Å; V953-K957 VanDerWaalsContact O-CG 3.26Å; V953-K957 WeakPolarHBondContact O-CG 3.4Å; V953-K957 PolarHBondContact O-N 2.95Å; I954-K957 PolarHBondContact O-N 2.86Å; I954-K957 VanDerWaalsContact O-N 3.17Å; K957-K959 VanDerWaalsContact C-N 3.3Å; K957-K959 PolarHBondContact O-N 2.98Å; K957-E960 WeakPolarHBondContact CD-OE2 3.34Å; K957-E960 WeakPolarHBondContact CE-OE2 3.39Å; K957-E960 IonicContact NZ-OE1 3.87Å; K957-E960 IonicContact NZ-OE2 3.22Å; K957-E960 PolarHBondContact NZ-OE2 3.37Å; K957-E960 PolarHBondContact O-N 2.89Å; K957-I961 WeakPolarHBondContact O-CB 3.29Å; K957-I961 WeakPolarHBondContact O-CD1 3.37Å; K957-I961 WeakPolarHBondContact O-CG1 3.48Å; K957-I961 PolarHBondContact O-N 3.22Å
958E86.9Confident83.3Confident121 Ų121102.1 Ų102.157%0.56552%0.522SS*.Hα-helixtrans-62.2-38.7171.4-73.9176.516400111.7I954 T962I954-E958 HydrophobicContact CG2-CG 4.34Å; I954-E958 WeakPolarHBondContact O-CG 3.3Å; I954-E958 PolarHBondContact O-N 3.38Å; E958-T962 PolarHBondContact O-N 3.29Å; E958-T962 PolarHBondContact O-OG1 2.92Å
959K93Very high84.8Confident132 Ų13299.2 Ų99.257%0.57451%0.509SS*.Hα-helixtrans-66.8-46.6173.9-170.7-175172.6-166.60112S955 E956 K957 I961 T962 D963S955-K959 WeakPolarHBondContact O-CB 3.48Å; S955-K959 PolarHBondContact O-N 2.91Å; E956-K959 PolarHBondContact O-N 3.39Å; K957-K959 VanDerWaalsContact C-N 3.3Å; K957-K959 PolarHBondContact O-N 2.98Å; K959-I961 VanDerWaalsContact C-N 3.3Å; K959-I961 PolarHBondContact O-N 3.34Å; K959-T962 WeakPolarHBondContact CA-OG1 3.5Å; K959-T962 PolarHBondContact O-N 3.39Å; K959-T962 VanDerWaalsContact O-N 3.1Å; K959-T962 PolarHBondContact O-OG1 3.33Å; K959-D963 WeakPolarHBondContact O-CB 3.39Å; K959-D963 PolarHBondContact O-N 3.45Å
960E93.7Very high86Confident96 Ų9698 Ų9845%0.44951%0.512SS..Hα-helixtrans-60.9-39.1176.8-167.7175.5-149.500111.4E956 K957 L964E956-E960 WeakPolarHBondContact O-CB 3.32Å; E956-E960 PolarHBondContact O-N 3.18Å; K957-E960 WeakPolarHBondContact CD-OE2 3.34Å; K957-E960 WeakPolarHBondContact CE-OE2 3.39Å; K957-E960 IonicContact NZ-OE1 3.87Å; K957-E960 IonicContact NZ-OE2 3.22Å; K957-E960 PolarHBondContact NZ-OE2 3.37Å; K957-E960 PolarHBondContact O-N 2.89Å; E960-L964 HydrophobicContact CG-CD1 4.34Å; E960-L964 WeakPolarHBondContact O-CB 3.41Å; E960-L964 VanDerWaalsContact O-CG 3.22Å; E960-L964 WeakPolarHBondContact O-CG 3.28Å; E960-L964 PolarHBondContact O-N 2.89Å
961I87.8Confident86.9Confident107 Ų10797.5 Ų97.555%0.54951%0.509SS..Hα-helixtrans-63.5-42.2172.6-70.8163.7000111.3K957 K959 L964 C965K957-I961 WeakPolarHBondContact O-CB 3.29Å; K957-I961 WeakPolarHBondContact O-CD1 3.37Å; K957-I961 WeakPolarHBondContact O-CG1 3.48Å; K957-I961 PolarHBondContact O-N 3.22Å; K959-I961 VanDerWaalsContact C-N 3.3Å; K959-I961 PolarHBondContact O-N 3.34Å; I961-L964 PolarHBondContact O-N 2.88Å; I961-C965 WeakPolarHBondContact O-CB 3.33Å; I961-C965 PolarHBondContact O-N 3.23Å; I961-C965 PolarHBondContact O-SG 2.79Å
962T91.1Very high87.8Confident77 Ų7797 Ų9747%0.47251%0.505SS..Hα-helixtrans-70.8-38.4178.629.70000112.4E958 K959 C965 N966E958-T962 PolarHBondContact O-N 3.29Å; E958-T962 PolarHBondContact O-OG1 2.92Å; K959-T962 WeakPolarHBondContact CA-OG1 3.5Å; K959-T962 PolarHBondContact O-N 3.39Å; K959-T962 VanDerWaalsContact O-N 3.1Å; K959-T962 PolarHBondContact O-OG1 3.33Å; T962-C965 PolarHBondContact O-N 3.25Å; T962-N966 VanDerWaalsContact O-CG 3.23Å; T962-N966 PolarHBondContact O-N 3.26Å; T962-N966 PolarHBondContact O-ND2 2.8Å
963D90.4Very high88.6Confident86 Ų8697.8 Ų97.846%0.4651%0.506SS..Hα-helixtrans-63.1-43.6173.5-72.6-26000111K959 N966 E967K959-D963 WeakPolarHBondContact O-CB 3.39Å; K959-D963 PolarHBondContact O-N 3.45Å; D963-N966 PolarHBondContact O-N 3.39Å; D963-E967 PolarHBondContact O-N 3.36Å
964L90.4Very high89.1Confident90 Ų9097.1 Ų97.147%0.47151%0.508SS..Hα-helixtrans-64.6-38.1173.1-73169.4000113.2E960 I961 N966 E967 L968E960-L964 HydrophobicContact CG-CD1 4.34Å; E960-L964 WeakPolarHBondContact O-CB 3.41Å; E960-L964 VanDerWaalsContact O-CG 3.22Å; E960-L964 WeakPolarHBondContact O-CG 3.28Å; E960-L964 PolarHBondContact O-N 2.89Å; I961-L964 PolarHBondContact O-N 2.88Å; L964-N966 VanDerWaalsContact C-N 3.34Å; L964-E967 PolarHBondContact O-N 2.82Å; L964-L968 WeakPolarHBondContact O-CB 3.23Å; L964-L968 WeakPolarHBondContact O-CG 3.32Å; L964-L968 PolarHBondContact O-N 2.6Å
965C85.8Confident89.5Confident70 Ų7097.7 Ų97.747%0.47352%0.515SS..Hα-helixtrans-62.4-41.8173.4-71.10000111.7I961 T962 L968 E969I961-C965 WeakPolarHBondContact O-CB 3.33Å; I961-C965 PolarHBondContact O-N 3.23Å; I961-C965 PolarHBondContact O-SG 2.79Å; T962-C965 PolarHBondContact O-N 3.25Å; C965-L968 PolarHBondContact O-N 3.49Å; C965-E969 PolarHBondContact O-N 2.84Å
966N90.5Very high89.6Confident105 Ų10598.4 Ų98.456%0.56151%0.511SS*.Hα-helixtrans-66.2-39.3176.5-70.4-37.7000111.7T962 D963 L964 E969 S970T962-N966 VanDerWaalsContact O-CG 3.23Å; T962-N966 PolarHBondContact O-N 3.26Å; T962-N966 PolarHBondContact O-ND2 2.8Å; D963-N966 PolarHBondContact O-N 3.39Å; L964-N966 VanDerWaalsContact C-N 3.34Å; N966-E969 PolarHBondContact O-N 2.91Å; N966-S970 VanDerWaalsContact O-CB 3.32Å; N966-S970 WeakPolarHBondContact O-CB 3.46Å; N966-S970 PolarHBondContact O-N 3.43Å
967E93.3Very high89.8Confident117 Ų11798 Ų9855%0.54751%0.509SS..Hα-helixtrans-66.9-40.8175.7-170.4168.8-152.400111.9D963 L964 S970 L971D963-E967 PolarHBondContact O-N 3.36Å; L964-E967 PolarHBondContact O-N 2.82Å; E967-S970 WeakPolarHBondContact O-CB 3.36Å; E967-S970 PolarHBondContact O-N 3.23Å; E967-L971 HydrophobicContact CG-CD1 4.11Å; E967-L971 WeakPolarHBondContact O-CB 3.29Å; E967-L971 WeakPolarHBondContact O-CG 3.36Å; E967-L971 PolarHBondContact O-N 3.49Å
968L86.5Confident89.5Confident118 Ų11896.7 Ų96.762%0.61850%0.504SS*.Hα-helixtrans-61.3-44.1172.8-78.4170.5000112.5L964 C965 S970 L971 K972L964-L968 WeakPolarHBondContact O-CB 3.23Å; L964-L968 WeakPolarHBondContact O-CG 3.32Å; L964-L968 PolarHBondContact O-N 2.6Å; C965-L968 PolarHBondContact O-N 3.49Å; L968-S970 VanDerWaalsContact C-N 3.34Å; L968-L971 PolarHBondContact O-N 3.39Å; L968-K972 WeakPolarHBondContact O-CB 3.29Å; L968-K972 PolarHBondContact O-N 3.37Å
969E89.8Confident89.6Confident85 Ų8595.6 Ų95.640%0.39750%0.495SS..Hα-helixtrans-67.8-35.6176.7-165.462.6-133.200111.1C965 N966 K972 N973C965-E969 PolarHBondContact O-N 2.84Å; N966-E969 PolarHBondContact O-N 2.91Å; E969-K972 IonicContact OE1-NZ 3.95Å; E969-K972 PolarHBondContact OE1-NZ 3.29Å; E969-K972 IonicContact OE2-NZ 2.66Å; E969-K972 PolarHBondContact OE2-NZ 2.88Å; E969-N973 WeakPolarHBondContact O-CB 3.4Å; E969-N973 PolarHBondContact O-N 3.3Å; E969-N973 PolarHBondContact O-ND2 3.19Å
970S91Very high89.5Confident78 Ų7895.2 Ų95.255%0.54549%0.493SS..Hα-helixtrans-63.2-49.3172.8-173.50000112.2N966 E967 L968 K972 N973 A974N966-S970 VanDerWaalsContact O-CB 3.32Å; N966-S970 WeakPolarHBondContact O-CB 3.46Å; N966-S970 PolarHBondContact O-N 3.43Å; E967-S970 WeakPolarHBondContact O-CB 3.36Å; E967-S970 PolarHBondContact O-N 3.23Å; L968-S970 VanDerWaalsContact C-N 3.34Å; S970-K972 PolarHBondContact O-N 3.49Å; S970-N973 PolarHBondContact O-N 3.31Å; S970-A974 PolarHBondContact O-N 3.42Å
971L89.4Confident89.5Confident99 Ų9995.4 Ų95.452%0.51849%0.493SS..Hα-helixtrans-61.5-43.9176.6-78.7165.3000111.9E967 L968 N973 A974 V975E967-L971 HydrophobicContact CG-CD1 4.11Å; E967-L971 WeakPolarHBondContact O-CB 3.29Å; E967-L971 WeakPolarHBondContact O-CG 3.36Å; E967-L971 PolarHBondContact O-N 3.49Å; L968-L971 PolarHBondContact O-N 3.39Å; L971-N973 PolarHBondContact O-N 2.87Å; L971-A974 WeakPolarHBondContact O-CB 3.36Å; L971-A974 PolarHBondContact O-N 3.36Å; L971-V975 WeakPolarHBondContact O-CG2 3.34Å; L971-V975 PolarHBondContact O-N 2.77Å
972K92.8Very high89.4Confident117 Ų11793.6 Ų93.651%0.50948%0.484SS..Hα-helixtrans-58-45.8174.1174.4-176.9164.6-143.50111.5L968 E969 S970 V975 E976L968-K972 WeakPolarHBondContact O-CB 3.29Å; L968-K972 PolarHBondContact O-N 3.37Å; E969-K972 IonicContact OE1-NZ 3.95Å; E969-K972 PolarHBondContact OE1-NZ 3.29Å; E969-K972 IonicContact OE2-NZ 2.66Å; E969-K972 PolarHBondContact OE2-NZ 2.88Å; S970-K972 PolarHBondContact O-N 3.49Å; K972-V975 PolarHBondContact O-N 2.89Å; K972-E976 WeakPolarHBondContact O-CB 3.3Å; K972-E976 PolarHBondContact O-N 3Å
973N92.6Very high89.3Confident91 Ų9194.1 Ų94.149%0.48748%0.484SS..Hα-helixtrans-65.2-37.7175.4-78.9-60.2000112.7E969 S970 L971 E976 H977E969-N973 WeakPolarHBondContact O-CB 3.4Å; E969-N973 PolarHBondContact O-N 3.3Å; E969-N973 PolarHBondContact O-ND2 3.19Å; S970-N973 PolarHBondContact O-N 3.31Å; L971-N973 PolarHBondContact O-N 2.87Å; N973-E976 PolarHBondContact O-N 3.29Å; N973-H977 VanDerWaalsContact O-CB 3.27Å; N973-H977 WeakPolarHBondContact O-CB 3.42Å; N973-H977 PolarHBondContact O-N 3.05Å
974A90.2Very high89.4Confident58 Ų5893.6 Ų93.648%0.47948%0.481SS..Hα-helixtrans-64.8-41.8174.200000112.3S970 L971 H977 Q978S970-A974 PolarHBondContact O-N 3.42Å; L971-A974 WeakPolarHBondContact O-CB 3.36Å; L971-A974 PolarHBondContact O-N 3.36Å; A974-H977 PolarHBondContact O-N 3.39Å; A974-Q978 WeakPolarHBondContact O-CB 3.42Å; A974-Q978 PolarHBondContact O-N 3.39Å
975V85.8Confident89.4Confident95 Ų9593.2 Ų93.258%0.57648%0.479SS*.Hα-helixtrans-65.1-44.5174.51700000111.2L971 K972 H977 Q978 R979L971-V975 WeakPolarHBondContact O-CG2 3.34Å; L971-V975 PolarHBondContact O-N 2.77Å; K972-V975 PolarHBondContact O-N 2.89Å; V975-H977 VanDerWaalsContact C-N 3.34Å; V975-H977 PolarHBondContact O-N 3.5Å; V975-Q978 PolarHBondContact O-N 3.44Å; V975-R979 WeakPolarHBondContact O-CB 3.47Å; V975-R979 PolarHBondContact O-N 3.14Å
976E86.8Confident89.5Confident86 Ų8698 Ų9840%0.40249%0.487SS..Hα-helixtrans-63.2-40.6177.6-163.464-135.900111.5K972 N973 R979 K980K972-E976 WeakPolarHBondContact O-CB 3.3Å; K972-E976 PolarHBondContact O-N 3Å; N973-E976 PolarHBondContact O-N 3.29Å; E976-R979 PolarHBondContact O-N 2.85Å; E976-K980 WeakPolarHBondContact O-CG 3.44Å; E976-K980 PolarHBondContact O-N 2.82Å
977H89.3Confident89.6Confident123 Ų12398.6 Ų98.657%0.56949%0.487SS*.Hα-helixtrans-64.3-42.8173.1-178.5-88.8000112N973 A974 V975 R979 K980 K981N973-H977 VanDerWaalsContact O-CB 3.27Å; N973-H977 WeakPolarHBondContact O-CB 3.42Å; N973-H977 PolarHBondContact O-N 3.05Å; A974-H977 PolarHBondContact O-N 3.39Å; V975-H977 VanDerWaalsContact C-N 3.34Å; V975-H977 PolarHBondContact O-N 3.5Å; H977-R979 VanDerWaalsContact C-N 3.34Å; H977-R979 PolarHBondContact O-N 3.4Å; H977-K980 PolarHBondContact O-N 3.15Å; H977-K981 WeakPolarHBondContact O-CB 3.44Å; H977-K981 PolarHBondContact O-N 2.97Å
978Q83.2Confident89.5Confident79 Ų7998.6 Ų98.637%0.36949%0.485SS..Hα-helixtrans-68.4-32.7177.1-169.366.3-2.200112.2A974 V975 K981 N982A974-Q978 WeakPolarHBondContact O-CB 3.42Å; A974-Q978 PolarHBondContact O-N 3.39Å; V975-Q978 PolarHBondContact O-N 3.44Å; Q978-K981 PolarHBondContact O-N 2.86Å; Q978-N982 WeakPolarHBondContact O-CB 3.49Å; Q978-N982 PolarHBondContact O-N 2.83Å
979R88.9Confident89.6Confident99 Ų9998.2 Ų98.237%0.37448%0.484SS..Hα-helixtrans-64-46.4172.5-168.1-178.7-165.4138.82.4111.4V975 E976 H977 N982 N983V975-R979 WeakPolarHBondContact O-CB 3.47Å; V975-R979 PolarHBondContact O-N 3.14Å; E976-R979 PolarHBondContact O-N 2.85Å; H977-R979 VanDerWaalsContact C-N 3.34Å; H977-R979 PolarHBondContact O-N 3.4Å; R979-N982 PolarHBondContact O-N 3.34Å; R979-N983 PolarHBondContact O-N 2.9Å
980K90.8Very high89.8Confident123 Ų123101.7 Ų101.754%0.53549%0.493SS..Hα-helixtrans-58.9-50.3172.3-72.2172.4-177.6172.40111.1E976 H977 N982 N983 D984E976-K980 WeakPolarHBondContact O-CG 3.44Å; E976-K980 PolarHBondContact O-N 2.82Å; H977-K980 PolarHBondContact O-N 3.15Å; K980-N982 VanDerWaalsContact C-N 3.27Å; K980-N982 PolarHBondContact O-N 3.01Å; K980-N983 WeakPolarHBondContact O-CA 3.27Å; K980-N983 WeakPolarHBondContact O-CB 3.33Å; K980-N983 PolarHBondContact O-N 3.17Å; K980-D984 PolarHBondContact O-N 2.92Å; K980-D984 VanDerWaalsContact O-OD1 3.11Å
981K92.2Very high89.8Confident100 Ų100103 Ų10344%0.43549%0.491SS..Hα-helixtrans-59-34.7177.1-168.5176.7179.1-177.20113.1H977 Q978 L985H977-K981 WeakPolarHBondContact O-CB 3.44Å; H977-K981 PolarHBondContact O-N 2.97Å; Q978-K981 PolarHBondContact O-N 2.86Å; K981-L985 HydrophobicContact CG-CD1 4.48Å; K981-L985 WeakPolarHBondContact O-CB 3.31Å; K981-L985 WeakPolarHBondContact O-CD1 3.2Å; K981-L985 WeakPolarHBondContact O-CG 3.44Å; K981-L985 PolarHBondContact O-N 2.82Å; K981-L985 VanDerWaalsContact O-N 3.07Å
982N85.8Confident89.8Confident70 Ų70100.4 Ų100.437%0.37448%0.484SS..Hα-helixtrans-69.9-40.5173.8-163.6-95000111.8Q978 R979 K980 L985 R986Q978-N982 WeakPolarHBondContact O-CB 3.49Å; Q978-N982 PolarHBondContact O-N 2.83Å; R979-N982 PolarHBondContact O-N 3.34Å; K980-N982 VanDerWaalsContact C-N 3.27Å; K980-N982 PolarHBondContact O-N 3.01Å; N982-L985 PolarHBondContact O-N 3.27Å; N982-R986 WeakPolarHBondContact O-CG 3.4Å; N982-R986 PolarHBondContact O-N 2.69Å; N982-R986 PolarHBondContact OD1-NE 3.16Å; N982-R986 PolarHBondContact OD1-NH2 3.33Å
983N89.8Confident89.6Confident88 Ų88101 Ų10147%0.47149%0.489SS..Hα-helixtrans-62.8-48.1174.1-69.7-9.9000111.6R979 K980 L985 R986 E987R979-N983 PolarHBondContact O-N 2.9Å; K980-N983 WeakPolarHBondContact O-CA 3.27Å; K980-N983 WeakPolarHBondContact O-CB 3.33Å; K980-N983 PolarHBondContact O-N 3.17Å; N983-L985 PolarHBondContact O-N 3.48Å; N983-R986 WeakPolarHBondContact O-CB 3.31Å; N983-R986 PolarHBondContact O-N 3.21Å; N983-E987 PolarHBondContact O-N 3.49Å
984D92.8Very high89.5Confident74 Ų74102 Ų10240%0.39649%0.492SS..Hα-helixtrans-57.6-35.4174.8-67.413.6000112.2K980 K988K980-D984 PolarHBondContact O-N 2.92Å; K980-D984 VanDerWaalsContact O-OD1 3.11Å; D984-K988 WeakPolarHBondContact O-CB 3.43Å; D984-K988 WeakPolarHBondContact O-CD 3.29Å; D984-K988 VanDerWaalsContact O-CG 3.26Å; D984-K988 WeakPolarHBondContact O-CG 3.3Å; D984-K988 PolarHBondContact O-N 3.46Å
985L90.6Very high89.5Confident82 Ų82101.9 Ų101.943%0.42949%0.49SS..Hα-helixtrans-72.5-39.1175.3-77.3169.2000111.7K981 N982 N983 N989K981-L985 HydrophobicContact CG-CD1 4.48Å; K981-L985 WeakPolarHBondContact O-CB 3.31Å; K981-L985 WeakPolarHBondContact O-CD1 3.2Å; K981-L985 WeakPolarHBondContact O-CG 3.44Å; K981-L985 PolarHBondContact O-N 2.82Å; K981-L985 VanDerWaalsContact O-N 3.07Å; N982-L985 PolarHBondContact O-N 3.27Å; N983-L985 PolarHBondContact O-N 3.48Å; L985-N989 WeakPolarHBondContact O-CB 3.44Å; L985-N989 PolarHBondContact O-N 3.45Å
986R88.6Confident89.5Confident171 Ų171103 Ų10365%0.64549%0.493SS*.Hα-helixtrans-62.2-44.9173.6-71.3172.3-171.3-142-1111.2N982 N983 N989 W990N982-R986 WeakPolarHBondContact O-CG 3.4Å; N982-R986 PolarHBondContact O-N 2.69Å; N982-R986 PolarHBondContact OD1-NE 3.16Å; N982-R986 PolarHBondContact OD1-NH2 3.33Å; N983-R986 WeakPolarHBondContact O-CB 3.31Å; N983-R986 PolarHBondContact O-N 3.21Å; R986-N989 PolarHBondContact O-N 2.92Å; R986-W990 VanDerWaalsContact O-CB 3.32Å; R986-W990 WeakPolarHBondContact O-CB 3.34Å; R986-W990 PolarHBondContact O-N 2.77Å
987E90.9Very high89.4Confident118 Ų118101.3 Ų101.355%0.55149%0.493SS*.Hα-helixtrans-60.9-52.4176.8-173.1172.3-142.200110.9N983 N989 W990 E991N983-E987 PolarHBondContact O-N 3.49Å; E987-N989 VanDerWaalsContact C-N 3.28Å; E987-N989 PolarHBondContact O-N 3.15Å; E987-W990 WeakPolarHBondContact O-CB 3.5Å; E987-W990 PolarHBondContact O-N 3.04Å; E987-W990 VanDerWaalsContact O-N 3.14Å; E987-E991 WeakPolarHBondContact O-CG 3.29Å; E987-E991 PolarHBondContact O-N 3.29Å
988K92Very high89.5Confident116 Ų11699.1 Ų99.150%0.50449%0.492SS..Hα-helixtrans-62.8-30.5177.2-73.4165.2-174.5147.20113.9D984 A992D984-K988 WeakPolarHBondContact O-CB 3.43Å; D984-K988 WeakPolarHBondContact O-CD 3.29Å; D984-K988 VanDerWaalsContact O-CG 3.26Å; D984-K988 WeakPolarHBondContact O-CG 3.3Å; D984-K988 PolarHBondContact O-N 3.46Å; K988-A992 VanDerWaalsContact O-CB 3.25Å; K988-A992 WeakPolarHBondContact O-CB 3.47Å; K988-A992 PolarHBondContact O-N 2.82Å
989N88.3Confident89.7Confident110 Ų11098.5 Ų98.559%0.58849%0.493SS*.Hα-helixtrans-79.1-32.8177-156.1-1.4000111.2L985 R986 E987 A992 M993L985-N989 WeakPolarHBondContact O-CB 3.44Å; L985-N989 PolarHBondContact O-N 3.45Å; R986-N989 PolarHBondContact O-N 2.92Å; E987-N989 VanDerWaalsContact C-N 3.28Å; E987-N989 PolarHBondContact O-N 3.15Å; N989-A992 PolarHBondContact O-N 3.49Å; N989-M993 VanDerWaalsContact O-CB 3.31Å; N989-M993 WeakPolarHBondContact O-CB 3.18Å; N989-M993 PolarHBondContact O-N 3.36Å
990W94.2Very high89.6Confident159 Ų159100.4 Ų100.460%0.60251%0.506SS*.Hα-helixtrans-65.6-47.3168.9178.777.7000111.5R986 E987 A992 M993 E994R986-W990 VanDerWaalsContact O-CB 3.32Å; R986-W990 WeakPolarHBondContact O-CB 3.34Å; R986-W990 PolarHBondContact O-N 2.77Å; E987-W990 WeakPolarHBondContact O-CB 3.5Å; E987-W990 PolarHBondContact O-N 3.04Å; E987-W990 VanDerWaalsContact O-N 3.14Å; W990-A992 VanDerWaalsContact C-N 3.31Å; W990-A992 PolarHBondContact O-N 2.78Å; W990-M993 PolarHBondContact O-N 2.62Å; W990-M993 VanDerWaalsContact O-N 3.15Å; W990-E994 PolarHBondContact O-N 2.94Å
991E90.1Very high89.6Confident106 Ų106101.2 Ų101.250%0.49551%0.51SS..Hα-helixtrans-57.8-41.8171.8-71.3-178.4152.700111.9E987 E994 A995E987-E991 WeakPolarHBondContact O-CG 3.29Å; E987-E991 PolarHBondContact O-N 3.29Å; E991-E994 PolarHBondContact O-N 2.86Å; E991-A995 VanDerWaalsContact O-CB 3.28Å; E991-A995 WeakPolarHBondContact O-CB 3.39Å; E991-A995 PolarHBondContact O-N 3.4Å
992A89.9Confident89.6Confident44 Ų44101.1 Ų101.136%0.36451%0.512SS..Hα-helixtrans-66.2-38.2176.300000112.1K988 N989 W990 L996K988-A992 VanDerWaalsContact O-CB 3.25Å; K988-A992 WeakPolarHBondContact O-CB 3.47Å; K988-A992 PolarHBondContact O-N 2.82Å; N989-A992 PolarHBondContact O-N 3.49Å; W990-A992 VanDerWaalsContact C-N 3.31Å; W990-A992 PolarHBondContact O-N 2.78Å; A992-L996 WeakPolarHBondContact O-CB 3.24Å; A992-L996 VanDerWaalsContact O-CG 3.26Å; A992-L996 WeakPolarHBondContact O-CG 3.31Å; A992-L996 PolarHBondContact O-N 3.18Å
993M88.9Confident89.8Confident128 Ų128102.6 Ų102.663%0.63152%0.519SS*.Hα-helixtrans-69-38.8175.4-173.7172.4-75.100111.8N989 W990 L996 A997N989-M993 VanDerWaalsContact O-CB 3.31Å; N989-M993 WeakPolarHBondContact O-CB 3.18Å; N989-M993 PolarHBondContact O-N 3.36Å; W990-M993 PolarHBondContact O-N 2.62Å; W990-M993 VanDerWaalsContact O-N 3.15Å; M993-L996 PolarHBondContact O-N 3.13Å; M993-A997 WeakPolarHBondContact O-CB 3.39Å; M993-A997 PolarHBondContact O-N 3.44Å
994E90.1Very high89.7Confident114 Ų114103.6 Ų103.653%0.53352%0.521SS..Hα-helixtrans-66.9-42.4174-172.3175.9-13800111.5W990 E991 L996 A997 S998W990-E994 PolarHBondContact O-N 2.94Å; E991-E994 PolarHBondContact O-N 2.86Å; E994-L996 PolarHBondContact O-N 3.46Å; E994-A997 PolarHBondContact O-N 2.79Å; E994-S998 VanDerWaalsContact O-CB 3.3Å; E994-S998 WeakPolarHBondContact O-CB 3.22Å; E994-S998 PolarHBondContact O-N 3.48Å
995A89.9Confident89.5Confident55 Ų55104.4 Ų104.446%0.45553%0.526SS..Hα-helixtrans-61.6-43.117300000111.7E991 S998 T999E991-A995 VanDerWaalsContact O-CB 3.28Å; E991-A995 WeakPolarHBondContact O-CB 3.39Å; E991-A995 PolarHBondContact O-N 3.4Å; A995-S998 PolarHBondContact O-N 3.44Å; A995-T999 WeakPolarHBondContact O-CG2 3.31Å; A995-T999 PolarHBondContact O-N 2.81Å; A995-T999 PolarHBondContact O-OG1 2.86Å
996L85.8Confident89.5Confident119 Ų119107.6 Ų107.662%0.62353%0.532SS*.Hα-helixtrans-62.3-50.2174.8-78.4170.6000111.4A992 M993 E994 S998 T999 E1000A992-L996 WeakPolarHBondContact O-CB 3.24Å; A992-L996 VanDerWaalsContact O-CG 3.26Å; A992-L996 WeakPolarHBondContact O-CG 3.31Å; A992-L996 PolarHBondContact O-N 3.18Å; M993-L996 PolarHBondContact O-N 3.13Å; E994-L996 PolarHBondContact O-N 3.46Å; L996-S998 VanDerWaalsContact C-N 3.25Å; L996-S998 PolarHBondContact O-N 2.79Å; L996-T999 WeakPolarHBondContact CA-OG1 3.38Å; L996-T999 CarbonylContact O-C 3.54Å; L996-T999 PolarHBondContact O-N 2.95Å; L996-T999 PolarHBondContact O-OG1 2.91Å; L996-E1000 WeakPolarHBondContact O-CB 3.36Å; L996-E1000 PolarHBondContact O-N 3.45Å
997A85.9Confident89.5Confident50 Ų50103.5 Ų103.541%0.41353%0.526SS..Hα-helixtrans-58.9-36.2176.900000112.4M993 E994 K1001M993-A997 WeakPolarHBondContact O-CB 3.39Å; M993-A997 PolarHBondContact O-N 3.44Å; E994-A997 PolarHBondContact O-N 2.79Å; A997-K1001 VanDerWaalsContact O-CB 3.29Å; A997-K1001 WeakPolarHBondContact O-CB 3.22Å; A997-K1001 PolarHBondContact O-N 2.86Å
998S90.3Very high89.4Confident77 Ų77102.1 Ų102.154%0.53852%0.522SS..Hα-helixtrans-66.1-43.1173-173.30000112.2E994 A995 L996 M1002E994-S998 VanDerWaalsContact O-CB 3.3Å; E994-S998 WeakPolarHBondContact O-CB 3.22Å; E994-S998 PolarHBondContact O-N 3.48Å; A995-S998 PolarHBondContact O-N 3.44Å; L996-S998 VanDerWaalsContact C-N 3.25Å; L996-S998 PolarHBondContact O-N 2.79Å; S998-M1002 WeakPolarHBondContact O-CB 3.47Å; S998-M1002 PolarHBondContact O-N 3.3Å
999T87.9Confident89.3Confident65 Ų65102.8 Ų102.840%0.39953%0.525SS..Hα-helixtrans-69-37.2174.459.10000113.2A995 L996 M1002 L1003A995-T999 WeakPolarHBondContact O-CG2 3.31Å; A995-T999 PolarHBondContact O-N 2.81Å; A995-T999 PolarHBondContact O-OG1 2.86Å; L996-T999 WeakPolarHBondContact CA-OG1 3.38Å; L996-T999 CarbonylContact O-C 3.54Å; L996-T999 PolarHBondContact O-N 2.95Å; L996-T999 PolarHBondContact O-OG1 2.91Å; T999-M1002 PolarHBondContact O-N 2.77Å; T999-L1003 WeakPolarHBondContact O-CB 3.22Å; T999-L1003 VanDerWaalsContact O-CG 3.29Å; T999-L1003 WeakPolarHBondContact O-CG 3.07Å; T999-L1003 PolarHBondContact O-N 3.42Å
1000E87.2Confident89.2Confident139 Ų13999.8 Ų99.865%0.6551%0.511SS*.Hα-helixtrans-62.4-48.4174.6-178.5176-163.500110.1L996 M1002 L1003 Q1004L996-E1000 WeakPolarHBondContact O-CB 3.36Å; L996-E1000 PolarHBondContact O-N 3.45Å; E1000-M1002 PolarHBondContact O-N 3.25Å; E1000-L1003 PolarHBondContact O-N 3.32Å; E1000-Q1004 VanDerWaalsContact O-CB 3.32Å; E1000-Q1004 WeakPolarHBondContact O-CB 3.23Å; E1000-Q1004 PolarHBondContact O-N 3.38Å
1001K91.2Very high88.6Confident141 Ų14195.1 Ų95.161%0.61350%0.503SS*.Hα-helixtrans-58.3-45.3173.4-175176.6179.6179.10112.1A997 L1003 Q1004 D1005A997-K1001 VanDerWaalsContact O-CB 3.29Å; A997-K1001 WeakPolarHBondContact O-CB 3.22Å; A997-K1001 PolarHBondContact O-N 2.86Å; K1001-L1003 VanDerWaalsContact C-N 3.33Å; K1001-L1003 PolarHBondContact O-N 2.83Å; K1001-Q1004 PolarHBondContact O-N 3.21Å; K1001-D1005 WeakPolarHBondContact O-CB 3.43Å; K1001-D1005 PolarHBondContact O-N 3.09Å
1002M92.4Very high88.5Confident97 Ų9796.6 Ų96.648%0.47851%0.507SS..Hα-helixtrans-62.1-39.5176.9-169.3-139.7-59.200112.4S998 T999 E1000 R1006S998-M1002 WeakPolarHBondContact O-CB 3.47Å; S998-M1002 PolarHBondContact O-N 3.3Å; T999-M1002 PolarHBondContact O-N 2.77Å; E1000-M1002 PolarHBondContact O-N 3.25Å; M1002-R1006 VanDerWaalsContact O-CB 3.29Å; M1002-R1006 WeakPolarHBondContact O-CB 3.45Å; M1002-R1006 PolarHBondContact O-N 3.28Å
1003L90.1Very high88.4Confident101 Ų10198.8 Ų98.853%0.52951%0.51SS..Hα-helixtrans-69.5-41.7176-73.4172.9000111.1T999 E1000 K1001 R1006 V1007T999-L1003 WeakPolarHBondContact O-CB 3.22Å; T999-L1003 VanDerWaalsContact O-CG 3.29Å; T999-L1003 WeakPolarHBondContact O-CG 3.07Å; T999-L1003 PolarHBondContact O-N 3.42Å; E1000-L1003 PolarHBondContact O-N 3.32Å; K1001-L1003 VanDerWaalsContact C-N 3.33Å; K1001-L1003 PolarHBondContact O-N 2.83Å; L1003-R1006 CarbonylContact O-C 3.59Å; L1003-R1006 PolarHBondContact O-N 3.14Å; L1003-V1007 WeakPolarHBondContact O-CB 3.37Å; L1003-V1007 VanDerWaalsContact O-CG2 3.3Å; L1003-V1007 WeakPolarHBondContact O-CG2 3.4Å; L1003-V1007 PolarHBondContact O-N 2.89Å
1004Q86.1Confident88.1Confident109 Ų109101.2 Ų101.251%0.50951%0.512SS..Hα-helixtrans-63.2-44.7176.5-169.268-12.100111.4E1000 K1001 R1006 V1007 N1008E1000-Q1004 VanDerWaalsContact O-CB 3.32Å; E1000-Q1004 WeakPolarHBondContact O-CB 3.23Å; E1000-Q1004 PolarHBondContact O-N 3.38Å; K1001-Q1004 PolarHBondContact O-N 3.21Å; Q1004-R1006 VanDerWaalsContact C-N 3.32Å; Q1004-R1006 PolarHBondContact O-N 3.31Å; Q1004-V1007 PolarHBondContact O-N 3.25Å; Q1004-N1008 VanDerWaalsContact O-CB 3.31Å; Q1004-N1008 WeakPolarHBondContact O-CB 3.25Å; Q1004-N1008 PolarHBondContact O-N 2.99Å; Q1004-N1008 PolarHBondContact O-ND2 3.2Å
1005D89.8Confident87.8Confident91 Ų91103.5 Ų103.549%0.48752%0.516SS..Hα-helixtrans-62.4-38.5173.4-74.4-22.6000111.6K1001 K1009K1001-D1005 WeakPolarHBondContact O-CB 3.43Å; K1001-D1005 PolarHBondContact O-N 3.09Å; D1005-K1009 VanDerWaalsContact O-CB 3.22Å; D1005-K1009 WeakPolarHBondContact O-CB 3.18Å; D1005-K1009 PolarHBondContact O-N 3.19Å
1006R90.8Very high87.7Confident149 Ų149105.9 Ų105.956%0.56252%0.518SS*.Hα-helixtrans-68.3-42.2175.2-169.1-179.9-62.4-167.12.1112.1M1002 L1003 Q1004 K1009 T1010M1002-R1006 VanDerWaalsContact O-CB 3.29Å; M1002-R1006 WeakPolarHBondContact O-CB 3.45Å; M1002-R1006 PolarHBondContact O-N 3.28Å; L1003-R1006 CarbonylContact O-C 3.59Å; L1003-R1006 PolarHBondContact O-N 3.14Å; Q1004-R1006 VanDerWaalsContact C-N 3.32Å; Q1004-R1006 PolarHBondContact O-N 3.31Å; R1006-K1009 PolarHBondContact O-N 2.85Å; R1006-T1010 WeakPolarHBondContact O-CB 3.44Å; R1006-T1010 PolarHBondContact O-N 2.8Å; R1006-T1010 PolarHBondContact O-OG1 2.8Å
1007V87.8Confident87.6Confident86 Ų86106.1 Ų106.152%0.52152%0.515SS..Hα-helixtrans-63.2-45.4175.4167.10000110.3L1003 Q1004 K1009 T1010 S1011L1003-V1007 WeakPolarHBondContact O-CB 3.37Å; L1003-V1007 VanDerWaalsContact O-CG2 3.3Å; L1003-V1007 WeakPolarHBondContact O-CG2 3.4Å; L1003-V1007 PolarHBondContact O-N 2.89Å; Q1004-V1007 PolarHBondContact O-N 3.25Å; V1007-K1009 PolarHBondContact O-N 2.81Å; V1007-T1010 PolarHBondContact O-N 3.25Å; V1007-S1011 WeakPolarHBondContact O-CB 3.4Å; V1007-S1011 PolarHBondContact O-N 2.61Å
1008N88.3Confident87.5Confident88 Ų88107.4 Ų107.447%0.47152%0.518SS..Hα-helixtrans-61.3-43.9175.3-73.6-28.2000111.8Q1004 S1011 K1012Q1004-N1008 VanDerWaalsContact O-CB 3.31Å; Q1004-N1008 WeakPolarHBondContact O-CB 3.25Å; Q1004-N1008 PolarHBondContact O-N 2.99Å; Q1004-N1008 PolarHBondContact O-ND2 3.2Å; N1008-S1011 PolarHBondContact O-N 3.2Å; N1008-K1012 WeakPolarHBondContact O-CB 3.29Å; N1008-K1012 PolarHBondContact O-N 2.97Å
1009K91.4Very high87.4Confident131 Ų131108.9 Ų108.957%0.5752%0.516SS*.Hα-helixtrans-62.4-50.6175179.5171173.8174.80111.9D1005 R1006 V1007 S1011 K1012 E1013D1005-K1009 VanDerWaalsContact O-CB 3.22Å; D1005-K1009 WeakPolarHBondContact O-CB 3.18Å; D1005-K1009 PolarHBondContact O-N 3.19Å; R1006-K1009 PolarHBondContact O-N 2.85Å; V1007-K1009 PolarHBondContact O-N 2.81Å; K1009-S1011 VanDerWaalsContact C-N 3.3Å; K1009-S1011 PolarHBondContact O-N 2.67Å; K1009-K1012 PolarHBondContact O-N 3.29Å; K1009-K1012 VanDerWaalsContact O-N 3.15Å; K1009-E1013 WeakPolarHBondContact CE-OE1 3.38Å; K1009-E1013 HydrophobicContact CG-CG 4.4Å; K1009-E1013 WeakPolarHBondContact CG-OE1 3.2Å; K1009-E1013 IonicContact NZ-OE1 2.71Å; K1009-E1013 WeakPolarHBondContact O-CB 3.38Å; K1009-E1013 WeakPolarHBondContact O-CG 3.29Å; K1009-E1013 PolarHBondContact O-N 2.88Å
1010T85.4Confident87.3Confident47 Ų47108.2 Ų108.229%0.28852%0.518SS..Hα-helixtrans-62.5-35.7177.6-59.80000112R1006 V1007 R1014R1006-T1010 WeakPolarHBondContact O-CB 3.44Å; R1006-T1010 PolarHBondContact O-N 2.8Å; R1006-T1010 PolarHBondContact O-OG1 2.8Å; V1007-T1010 PolarHBondContact O-N 3.25Å; T1010-R1014 HydrophobicContact CG2-CG 4.43Å; T1010-R1014 VanDerWaalsContact O-CB 3.31Å; T1010-R1014 WeakPolarHBondContact O-CB 3.35Å; T1010-R1014 VanDerWaalsContact O-CG 3.24Å; T1010-R1014 WeakPolarHBondContact O-CG 3.49Å; T1010-R1014 PolarHBondContact O-N 3.42Å
1011S81.5Confident87.1Confident61 Ų61105.3 Ų105.343%0.42751%0.505SS..Hα-helixtrans-64.3-43.2173.7-176.10000111.7V1007 N1008 K1009 R1015V1007-S1011 WeakPolarHBondContact O-CB 3.4Å; V1007-S1011 PolarHBondContact O-N 2.61Å; N1008-S1011 PolarHBondContact O-N 3.2Å; K1009-S1011 VanDerWaalsContact C-N 3.3Å; K1009-S1011 PolarHBondContact O-N 2.67Å; S1011-R1015 WeakPolarHBondContact O-CB 3.48Å; S1011-R1015 PolarHBondContact O-N 2.94Å
1012K87.8Confident87Confident136 Ų136101.5 Ų101.559%0.59149%0.49SS*.Hα-helixtrans-66.4-44.6175.5-171.6176-179.1178.50112.4N1008 K1009 R1015 Q1016N1008-K1012 WeakPolarHBondContact O-CB 3.29Å; N1008-K1012 PolarHBondContact O-N 2.97Å; K1009-K1012 PolarHBondContact O-N 3.29Å; K1009-K1012 VanDerWaalsContact O-N 3.15Å; K1012-R1015 PolarHBondContact O-N 3.41Å; K1012-Q1016 WeakPolarHBondContact O-CG 3.34Å; K1012-Q1016 PolarHBondContact O-N 2.97Å
1013E87Confident86.7Confident91 Ų91102.1 Ų102.143%0.42550%0.495SS..Hα-helixtrans-63.3-43.3176.7-72.9169.516900111.5K1009 R1015 Q1016 H1017K1009-E1013 WeakPolarHBondContact CE-OE1 3.38Å; K1009-E1013 HydrophobicContact CG-CG 4.4Å; K1009-E1013 WeakPolarHBondContact CG-OE1 3.2Å; K1009-E1013 IonicContact NZ-OE1 2.71Å; K1009-E1013 WeakPolarHBondContact O-CB 3.38Å; K1009-E1013 WeakPolarHBondContact O-CG 3.29Å; K1009-E1013 PolarHBondContact O-N 2.88Å; E1013-R1015 PolarHBondContact O-N 3.03Å; E1013-Q1016 PolarHBondContact O-N 2.9Å; E1013-H1017 WeakPolarHBondContact O-CB 3.09Å; E1013-H1017 PolarHBondContact O-N 2.89Å
1014R82.4Confident86.5Confident179 Ų179104 Ų10468%0.67550%0.501SS*.Hα-helixtrans-60.9-43.1172.6-76.7177.2-173.2174.64.2112T1010 H1017 V1018T1010-R1014 HydrophobicContact CG2-CG 4.43Å; T1010-R1014 VanDerWaalsContact O-CB 3.31Å; T1010-R1014 WeakPolarHBondContact O-CB 3.35Å; T1010-R1014 VanDerWaalsContact O-CG 3.24Å; T1010-R1014 WeakPolarHBondContact O-CG 3.49Å; T1010-R1014 PolarHBondContact O-N 3.42Å; R1014-H1017 PolarHBondContact O-N 3.4Å; R1014-V1018 WeakPolarHBondContact O-CG2 3.38Å; R1014-V1018 PolarHBondContact O-N 2.94Å
1015R85.5Confident86.4Confident162 Ų162100.3 Ų100.361%0.61149%0.487SS*.Hα-helixtrans-61-47.5177.1-170.2-175.6-58-173.60.9111.4S1011 K1012 E1013 H1017 V1018 E1019S1011-R1015 WeakPolarHBondContact O-CB 3.48Å; S1011-R1015 PolarHBondContact O-N 2.94Å; K1012-R1015 PolarHBondContact O-N 3.41Å; E1013-R1015 PolarHBondContact O-N 3.03Å; R1015-H1017 VanDerWaalsContact C-N 3.31Å; R1015-H1017 PolarHBondContact O-N 3.35Å; R1015-V1018 PolarHBondContact O-N 3.38Å; R1015-E1019 WeakPolarHBondContact CG-OE1 3.32Å; R1015-E1019 WeakPolarHBondContact O-CB 3.37Å; R1015-E1019 WeakPolarHBondContact O-CG 3.5Å; R1015-E1019 PolarHBondContact O-N 2.83Å
1016Q87.1Confident86.3Confident105 Ų10597.6 Ų97.649%0.49147%0.471SS..Hα-helixtrans-62.2-37.1176-72.3178-33.300112.4K1012 E1013 A1020K1012-Q1016 WeakPolarHBondContact O-CG 3.34Å; K1012-Q1016 PolarHBondContact O-N 2.97Å; E1013-Q1016 PolarHBondContact O-N 2.9Å; Q1016-A1020 VanDerWaalsContact O-CB 3.31Å; Q1016-A1020 WeakPolarHBondContact O-CB 2.79Å; Q1016-A1020 PolarHBondContact O-N 2.95Å
1017H83.2Confident86Confident123 Ų12394.4 Ų94.457%0.56947%0.465SS*.Hα-helixtrans-70.1-38.9176.9-164.149.6000112.2E1013 R1014 R1015 A1020 I1021E1013-H1017 WeakPolarHBondContact O-CB 3.09Å; E1013-H1017 PolarHBondContact O-N 2.89Å; R1014-H1017 PolarHBondContact O-N 3.4Å; R1015-H1017 VanDerWaalsContact C-N 3.31Å; R1015-H1017 PolarHBondContact O-N 3.35Å; H1017-A1020 PolarHBondContact O-N 3.48Å; H1017-I1021 WeakPolarHBondContact O-CB 3.49Å; H1017-I1021 VanDerWaalsContact O-CG1 3.27Å; H1017-I1021 WeakPolarHBondContact O-CG1 3.21Å; H1017-I1021 PolarHBondContact O-N 2.83Å
1018V84.7Confident85.9Confident77 Ų7793.9 Ų93.947%0.46746%0.459SS..Hα-helixtrans-61.1-53170.4170.90000110R1014 R1015 A1020 I1021 E1022R1014-V1018 WeakPolarHBondContact O-CG2 3.38Å; R1014-V1018 PolarHBondContact O-N 2.94Å; R1015-V1018 PolarHBondContact O-N 3.38Å; V1018-A1020 VanDerWaalsContact C-N 3.25Å; V1018-A1020 PolarHBondContact O-N 3.35Å; V1018-I1021 PolarHBondContact O-N 2.76Å; V1018-I1021 VanDerWaalsContact O-N 3.1Å; V1018-E1022 HydrophobicContact CG1-CG 4.12Å; V1018-E1022 WeakPolarHBondContact O-CB 3.19Å; V1018-E1022 VanDerWaalsContact O-CG 3.29Å; V1018-E1022 WeakPolarHBondContact O-CG 3.14Å; V1018-E1022 PolarHBondContact O-N 3.07Å
1019E87Confident85.7Confident108 Ų10891.6 Ų91.651%0.50545%0.446SS..Hα-helixtrans-55.4-38.3177.8-72.7167.3-171.500112.5R1015 L1023R1015-E1019 WeakPolarHBondContact CG-OE1 3.32Å; R1015-E1019 WeakPolarHBondContact O-CB 3.37Å; R1015-E1019 WeakPolarHBondContact O-CG 3.5Å; R1015-E1019 PolarHBondContact O-N 2.83Å; E1019-L1023 WeakPolarHBondContact O-CB 3.49Å; E1019-L1023 PolarHBondContact O-N 3.35Å
1020A87.3Confident85.3Confident52 Ų5289.6 Ų89.643%0.4344%0.437SS..Hα-helixtrans-67.9-45.7175.100000112.8Q1016 H1017 V1018 E1022 L1023 E1024Q1016-A1020 VanDerWaalsContact O-CB 3.31Å; Q1016-A1020 WeakPolarHBondContact O-CB 2.79Å; Q1016-A1020 PolarHBondContact O-N 2.95Å; H1017-A1020 PolarHBondContact O-N 3.48Å; V1018-A1020 VanDerWaalsContact C-N 3.25Å; V1018-A1020 PolarHBondContact O-N 3.35Å; A1020-E1022 VanDerWaalsContact C-N 3.31Å; A1020-E1022 PolarHBondContact O-N 3.37Å; A1020-L1023 PolarHBondContact O-N 2.74Å; A1020-E1024 WeakPolarHBondContact O-CB 3.29Å; A1020-E1024 PolarHBondContact O-N 2.76Å
1021I82.6Confident85.2Confident77 Ų7795.4 Ų95.440%0.39545%0.454SS..Hα-helixtrans-64-37.9175.8-69.7165.2000110.8H1017 V1018 L1023 S1025H1017-I1021 WeakPolarHBondContact O-CB 3.49Å; H1017-I1021 VanDerWaalsContact O-CG1 3.27Å; H1017-I1021 WeakPolarHBondContact O-CG1 3.21Å; H1017-I1021 PolarHBondContact O-N 2.83Å; V1018-I1021 PolarHBondContact O-N 2.76Å; V1018-I1021 VanDerWaalsContact O-N 3.1Å; I1021-L1023 VanDerWaalsContact C-N 3.35Å; I1021-S1025 WeakPolarHBondContact O-CB 3.38Å; I1021-S1025 PolarHBondContact O-N 3.23Å; I1021-S1025 PolarHBondContact O-OG 3.21Å
1022E88.2Confident85.1Confident62 Ų6297 Ų9729%0.2946%0.458SS..Hα-helixtrans-63.8-39.6175.1-71.7-167.6164.600111.8V1018 A1020 K1026 Y1044V1018-E1022 HydrophobicContact CG1-CG 4.12Å; V1018-E1022 WeakPolarHBondContact O-CB 3.19Å; V1018-E1022 VanDerWaalsContact O-CG 3.29Å; V1018-E1022 WeakPolarHBondContact O-CG 3.14Å; V1018-E1022 PolarHBondContact O-N 3.07Å; A1020-E1022 VanDerWaalsContact C-N 3.31Å; A1020-E1022 PolarHBondContact O-N 3.37Å; E1022-K1026 VanDerWaalsContact O-CB 3.32Å; E1022-K1026 WeakPolarHBondContact O-CB 3.46Å; E1022-K1026 WeakPolarHBondContact O-CG 3.27Å; E1022-K1026 PolarHBondContact O-N 3.32Å; E1022-Y1044 HydrophobicContact CB-CD1 4.18Å; E1022-Y1044 HydrophobicContact CB-CD2 3.56Å; E1022-Y1044 HydrophobicContact CB-CE1 4.38Å; E1022-Y1044 HydrophobicContact CB-CE2 3.82Å; E1022-Y1044 HydrophobicContact CB-CG 3.76Å; E1022-Y1044 VanDerWaalsContact CD-CD1 3.43Å; E1022-Y1044 HydrophobicContact CG-CD1 3.45Å; E1022-Y1044 VanDerWaalsContact CG-CD1 3.45Å; E1022-Y1044 HydrophobicContact CG-CD2 3.81Å; E1022-Y1044 HydrophobicContact CG-CE1 3.72Å; E1022-Y1044 HydrophobicContact CG-CE2 4.09Å; E1022-Y1044 HydrophobicContact CG-CG 3.49Å; E1022-Y1044 VanDerWaalsContact CG-CG 3.49Å; E1022-Y1044 VanDerWaalsContact O-CE2 3.23Å; E1022-Y1044 WeakPolarHBondContact O-CE2 3.32Å; E1022-Y1044 WeakPolarHBondContact OE1-CB 3.16Å; E1022-Y1044 VanDerWaalsContact OE1-CD1 3.25Å; E1022-Y1044 WeakPolarHBondContact OE1-CD1 3.38Å; E1022-Y1044 WeakPolarHBondContact OE2-CB 3.49Å
1023L86.1Confident84.6Confident110 Ų11093.7 Ų93.758%0.57644%0.443SS*.Hα-helixtrans-68.5-48.4175.5-162.685.3000111.7E1019 A1020 I1021 S1025 K1026 D1027E1019-L1023 WeakPolarHBondContact O-CB 3.49Å; E1019-L1023 PolarHBondContact O-N 3.35Å; A1020-L1023 PolarHBondContact O-N 2.74Å; I1021-L1023 VanDerWaalsContact C-N 3.35Å; L1023-S1025 VanDerWaalsContact C-N 3.32Å; L1023-S1025 PolarHBondContact O-N 3.43Å; L1023-K1026 WeakPolarHBondContact O-CB 3.46Å; L1023-K1026 PolarHBondContact O-N 3.43Å; L1023-D1027 PolarHBondContact O-N 2.87Å
1024E86.4Confident84.1Confident140 Ų14094.7 Ų94.765%0.65446%0.457SS*.Hα-helixtrans-61.7-41.2178.2-175.3174.9-162.200111.3A1020 D1027 L1028A1020-E1024 WeakPolarHBondContact O-CB 3.29Å; A1020-E1024 PolarHBondContact O-N 2.76Å; E1024-D1027 PolarHBondContact O-N 2.9Å; E1024-L1028 WeakPolarHBondContact O-CB 3.49Å; E1024-L1028 PolarHBondContact O-N 2.87Å
1025S84.1Confident83.4Confident31 Ų3192 Ų9222%0.21746%0.461CS..Hα-helixtrans-64.9-41.2174.8-60.70000111.9I1021 L1023 D1027 L1029 Y1044I1021-S1025 WeakPolarHBondContact O-CB 3.38Å; I1021-S1025 PolarHBondContact O-N 3.23Å; I1021-S1025 PolarHBondContact O-OG 3.21Å; L1023-S1025 VanDerWaalsContact C-N 3.32Å; L1023-S1025 PolarHBondContact O-N 3.43Å; S1025-D1027 VanDerWaalsContact C-N 3.35Å; S1025-D1027 PolarHBondContact O-N 2.89Å; S1025-L1029 VanDerWaalsContact O-CB 3.29Å; S1025-L1029 WeakPolarHBondContact O-CB 3.38Å; S1025-L1029 WeakPolarHBondContact O-CG 3.31Å; S1025-L1029 PolarHBondContact O-N 3.37Å; S1025-Y1044 WeakPolarHBondContact CB-OH 3.48Å; S1025-Y1044 PolarHBondContact OG-OH 2.97Å
1026K86.9Confident83Confident34 Ų3484.9 Ų84.915%0.14844%0.436CS..Hα-helixtrans-57.7-45.6173-91.7165.7165.6173.70111.4E1022 L1023 K1030 L1042 Y1044 W1047E1022-K1026 VanDerWaalsContact O-CB 3.32Å; E1022-K1026 WeakPolarHBondContact O-CB 3.46Å; E1022-K1026 WeakPolarHBondContact O-CG 3.27Å; E1022-K1026 PolarHBondContact O-N 3.32Å; L1023-K1026 WeakPolarHBondContact O-CB 3.46Å; L1023-K1026 PolarHBondContact O-N 3.43Å; K1026-K1030 VanDerWaalsContact O-CG 3.24Å; K1026-K1030 WeakPolarHBondContact O-CG 3.31Å; K1026-K1030 PolarHBondContact O-N 3Å; K1026-K1030 VanDerWaalsContact O-N 3.11Å; K1026-L1042 PolarHBondContact NZ-O 2.94Å; K1026-Y1044 HydrophobicContact CD-CD2 4.01Å; K1026-Y1044 HydrophobicContact CG-CD2 4.08Å; K1026-Y1044 HydrophobicContact CG-CE2 4.15Å; K1026-W1047 HydrophobicContact CB-CH2 4.13Å; K1026-W1047 HydrophobicContact CB-CZ2 4.43Å; K1026-W1047 HydrophobicContact CB-CZ3 4.19Å; K1026-W1047 HydrophobicContact CD-CD2 4.24Å; K1026-W1047 HydrophobicContact CD-CE3 4.35Å; K1026-W1047 VanDerWaalsContact CE-CG 3.45Å; K1026-W1047 HydrophobicContact CG-CD2 3.71Å; K1026-W1047 HydrophobicContact CG-CE3 3.47Å; K1026-W1047 VanDerWaalsContact CG-CE3 3.47Å; K1026-W1047 HydrophobicContact CG-CG 4.48Å; K1026-W1047 HydrophobicContact CG-CH2 3.85Å; K1026-W1047 HydrophobicContact CG-CZ2 4.07Å; K1026-W1047 HydrophobicContact CG-CZ3 3.55Å; K1026-W1047 WeakPolarHBondContact O-CH2 3.35Å
1027D85Confident82.5Confident82 Ų8284.4 Ų84.444%0.43944%0.444SS..Hα-helixtrans-77.7-35.7-177.7-74.9-8.6000113.1L1023 E1024 S1025 K1030 R1031L1023-D1027 PolarHBondContact O-N 2.87Å; E1024-D1027 PolarHBondContact O-N 2.9Å; S1025-D1027 VanDerWaalsContact C-N 3.35Å; S1025-D1027 PolarHBondContact O-N 2.89Å; D1027-K1030 PolarHBondContact O-N 3.41Å; D1027-K1030 IonicContact OD1-NZ 2.7Å; D1027-K1030 PolarHBondContact OD1-NZ 2.82Å; D1027-R1031 WeakPolarHBondContact O-CB 3.29Å; D1027-R1031 PolarHBondContact O-N 3.5Å
1028L85.9Confident82.5Confident75 Ų7579.3 Ų79.339%0.39342%0.422SS..Hα-helixtrans-58.9-46.6170.4178.361.1000111.2E1024 R1031 L1032E1024-L1028 WeakPolarHBondContact O-CB 3.49Å; E1024-L1028 PolarHBondContact O-N 2.87Å; L1028-R1031 PolarHBondContact O-N 2.82Å; L1028-L1032 HydrophobicContact CD1-CD1 4.06Å; L1028-L1032 HydrophobicContact CD1-CG 4.26Å; L1028-L1032 HydrophobicContact CG-CD1 4.01Å; L1028-L1032 VanDerWaalsContact O-CG 3.31Å; L1028-L1032 WeakPolarHBondContact O-CG 3.24Å; L1028-L1032 PolarHBondContact O-N 3.36Å
1029L83.9Confident82.1Confident41 Ų4179 Ų7922%0.21542%0.421CS..Hα-helixtrans-66.1-43.1179.3-74.1171.4000112.2S1025 R1031 L1032 F1033 W1047 L1048 F1051S1025-L1029 VanDerWaalsContact O-CB 3.29Å; S1025-L1029 WeakPolarHBondContact O-CB 3.38Å; S1025-L1029 WeakPolarHBondContact O-CG 3.31Å; S1025-L1029 PolarHBondContact O-N 3.37Å; L1029-R1031 VanDerWaalsContact C-N 3.28Å; L1029-R1031 PolarHBondContact O-N 3.43Å; L1029-L1032 PolarHBondContact O-N 2.87Å; L1029-F1033 PolarHBondContact O-N 2.85Å; L1029-W1047 HydrophobicContact CB-CH2 4.2Å; L1029-W1047 HydrophobicContact CB-CZ3 4.41Å; L1029-W1047 HydrophobicContact CD1-CZ3 4.04Å; L1029-L1048 HydrophobicContact CD1-CD2 3.47Å; L1029-L1048 VanDerWaalsContact CD1-CD2 3.47Å; L1029-F1051 HydrophobicContact CB-CD1 4.35Å; L1029-F1051 HydrophobicContact CB-CE1 3.8Å; L1029-F1051 HydrophobicContact CB-CE2 4.17Å; L1029-F1051 HydrophobicContact CB-CZ 3.69Å; L1029-F1051 HydrophobicContact CD1-CD1 4.36Å; L1029-F1051 HydrophobicContact CD1-CE1 4.43Å; L1029-F1051 HydrophobicContact CD2-CE1 3.91Å; L1029-F1051 HydrophobicContact CG-CE1 4.26Å; L1029-F1051 VanDerWaalsContact O-CZ 3.31Å; L1029-F1051 WeakPolarHBondContact O-CZ 3.31Å
1030K82.8Confident81.5Confident88 Ų8879.1 Ų79.138%0.38343%0.434SS..Hα-helixtrans-57.4-40.1171.2-69.7167-157.9162.90112.1K1026 D1027 F1033 P1034 W1047K1026-K1030 VanDerWaalsContact O-CG 3.24Å; K1026-K1030 WeakPolarHBondContact O-CG 3.31Å; K1026-K1030 PolarHBondContact O-N 3Å; K1026-K1030 VanDerWaalsContact O-N 3.11Å; D1027-K1030 PolarHBondContact O-N 3.41Å; D1027-K1030 IonicContact OD1-NZ 2.7Å; D1027-K1030 PolarHBondContact OD1-NZ 2.82Å; K1030-F1033 CarbonylContact O-C 3.47Å; K1030-P1034 WeakPolarHBondContact O-CA 3.49Å; K1030-W1047 HydrophobicContact CG-CH2 4.43Å; K1030-W1047 HydrophobicContact CG-CZ2 4.19Å
1031R83.9Confident81Confident170 Ų17083.3 Ų83.364%0.64245%0.449SS*.Hα-helixtrans-69.9-35.5179-173.4177.564.578-5.6112.6D1027 L1028 L1029D1027-R1031 WeakPolarHBondContact O-CB 3.29Å; D1027-R1031 PolarHBondContact O-N 3.5Å; L1028-R1031 PolarHBondContact O-N 2.82Å; L1029-R1031 VanDerWaalsContact C-N 3.28Å; L1029-R1031 PolarHBondContact O-N 3.43Å
1032L79.8Confident81Confident95 Ų9582.2 Ų82.250%0.49744%0.444SS..Hα-helixtrans-76-30.1177.6-70.1172.1000112.8L1028 L1029L1028-L1032 HydrophobicContact CD1-CD1 4.06Å; L1028-L1032 HydrophobicContact CD1-CG 4.26Å; L1028-L1032 HydrophobicContact CG-CD1 4.01Å; L1028-L1032 VanDerWaalsContact O-CG 3.31Å; L1028-L1032 WeakPolarHBondContact O-CG 3.24Å; L1028-L1032 PolarHBondContact O-N 3.36Å; L1029-L1032 PolarHBondContact O-N 2.87Å
1033F77.2Confident80.8Confident65 Ų6583 Ų8329%0.28545%0.45SS..  trans-130.974.5176.3-55.3-88.1000112.1L1029 K1030 T1035 V1036 F1051 V1059L1029-F1033 PolarHBondContact O-N 2.85Å; K1030-F1033 CarbonylContact O-C 3.47Å; F1033-T1035 PolarHBondContact O-N 3.32Å; F1033-T1035 VanDerWaalsContact O-N 3.09Å; F1033-V1036 HydrophobicContact CB-CB 4.13Å; F1033-V1036 HydrophobicContact CB-CG2 3.84Å; F1033-V1036 PolarHBondContact O-N 2.77Å; F1033-F1051 HydrophobicContact CB-CZ 3.92Å; F1033-F1051 AromaticContact CD2-CE1 3.98Å; F1033-F1051 HydrophobicContact CD2-CE1 3.98Å; F1033-F1051 AromaticContact CD2-CZ 3.82Å; F1033-F1051 HydrophobicContact CD2-CZ 3.82Å; F1033-F1051 HydrophobicContact CG-CZ 4.24Å; F1033-V1059 HydrophobicContact CD1-CG2 4.47Å; F1033-V1059 HydrophobicContact CE1-CG2 3.57Å; F1033-V1059 HydrophobicContact CZ-CG2 4.13Å
1034P77.1Confident80.7Confident112 Ų11280 Ų8073%0.72743%0.431SS*.THydrogen-bonded Turntrans-61-23.6-174.1-24.835.4000114.9K1030 V1036K1030-P1034 WeakPolarHBondContact O-CA 3.49Å; P1034-V1036 VanDerWaalsContact C-N 3.33Å
1035T66.1Low80.6Confident123 Ų12376.2 Ų76.276%0.75542%0.42SS*.THydrogen-bonded Turntrans-78.8-9.4176.734.60000114F1033F1033-T1035 PolarHBondContact O-N 3.32Å; F1033-T1035 VanDerWaalsContact O-N 3.09Å
1036V77.8Confident80.7Confident12 Ų1279.1 Ų79.17%0.07343%0.431CS..  trans-95.797.5-177.8177.30000111F1033 P1034 V1038 F1051 K1054 A1055F1033-V1036 HydrophobicContact CB-CB 4.13Å; F1033-V1036 HydrophobicContact CB-CG2 3.84Å; F1033-V1036 PolarHBondContact O-N 2.77Å; P1034-V1036 VanDerWaalsContact C-N 3.33Å; V1036-V1038 HydrophobicContact CG1-CG2 4.3Å; V1036-F1051 HydrophobicContact CB-CD2 4.43Å; V1036-F1051 HydrophobicContact CB-CE2 3.92Å; V1036-F1051 HydrophobicContact CB-CZ 4.32Å; V1036-F1051 HydrophobicContact CG1-CD2 3.64Å; V1036-F1051 HydrophobicContact CG1-CE2 3.62Å; V1036-F1051 HydrophobicContact CG1-CG 4.24Å; V1036-F1051 HydrophobicContact CG1-CZ 4.2Å; V1036-K1054 HydrophobicContact CG1-CB 3.59Å; V1036-K1054 HydrophobicContact CG1-CD 4.43Å; V1036-A1055 HydrophobicContact CG2-CB 4.4Å
1037S77.4Confident81Confident95 Ų9577.8 Ų77.866%0.66443%0.425SS*.  trans-91.7130.5176.2-1800000112.8K1054S1037-K1054 WeakPolarHBondContact O-CD 3.27Å; S1037-K1054 PolarHBondContact O-NZ 3.45Å
1038V81.5Confident81Confident17 Ų1776.5 Ų76.510%0.10342%0.417CS..  trans-137.4136.4178.8-178.90000109.8V1036 S1040 L1042 W1047 F1051 K1054V1036-V1038 HydrophobicContact CG1-CG2 4.3Å; V1038-S1040 PolarHBondContact O-N 3.18Å; V1038-L1042 HydrophobicContact CG1-CD1 4.3Å; V1038-W1047 HydrophobicContact CG1-CG 4.21Å; V1038-F1051 HydrophobicContact CG2-CB 4.01Å; V1038-F1051 HydrophobicContact CG2-CD2 4.09Å; V1038-K1054 HydrophobicContact CG2-CD 4.14Å
1039P77.9Confident80.9Confident71 Ų7180.5 Ų80.546%0.46143%0.427SS..  trans-56133.2-179.7-26.435.4000114.1N1041 L1042 W1047P1039-N1041 VanDerWaalsContact C-N 3.31Å; P1039-N1041 WeakPolarHBondContact CB-OD1 3.35Å; P1039-N1041 PolarHBondContact O-N 3.2Å; P1039-L1042 HydrophobicContact CB-CD1 4.43Å; P1039-W1047 VanDerWaalsContact O-CD1 3.32Å
1040S73.6Confident80.9Confident109 Ų10979.9 Ų79.976%0.76243%0.431SS*.THydrogen-bonded Turntrans-73.4-17.2-172.4-450000115V1038 L1042V1038-S1040 PolarHBondContact O-N 3.18Å; S1040-L1042 VanDerWaalsContact C-N 3.31Å; S1040-L1042 PolarHBondContact O-N 2.83Å
1041N77.6Confident81Confident140 Ų14076 Ų7675%0.74941%0.414SS*.THydrogen-bonded Turntrans-86.46.8-172.564.3-43000114.4P1039P1039-N1041 VanDerWaalsContact C-N 3.31Å; P1039-N1041 WeakPolarHBondContact CB-OD1 3.35Å; P1039-N1041 PolarHBondContact O-N 3.2Å
1042L81.2Confident81Confident55 Ų5572.4 Ų72.429%0.28840%0.404SS..SBendtrans-90.5145.7-179.2-61.2174.7000111.8K1026 V1038 P1039 S1040 E1046 W1047K1026-L1042 PolarHBondContact NZ-O 2.94Å; V1038-L1042 HydrophobicContact CG1-CD1 4.3Å; P1039-L1042 HydrophobicContact CB-CD1 4.43Å; S1040-L1042 VanDerWaalsContact C-N 3.31Å; S1040-L1042 PolarHBondContact O-N 2.83Å; L1042-E1046 HydrophobicContact CB-CB 4.29Å; L1042-W1047 HydrophobicContact CB-CB 4.09Å
1043N84.4Confident81.1Confident78 Ų7876 Ų7642%0.41742%0.416SS..  trans-60156.8171.274.454.6000110.4S1045 E1046 W1047N1043-S1045 VanDerWaalsContact C-N 3.28Å; N1043-S1045 PolarHBondContact O-N 3.41Å; N1043-S1045 PolarHBondContact OD1-N 2.7Å; N1043-S1045 PolarHBondContact OD1-OG 2.89Å; N1043-E1046 PolarHBondContact ND2-OE1 2.96Å; N1043-E1046 PolarHBondContact ND2-OE2 3.49Å; N1043-E1046 PolarHBondContact O-N 3.29Å; N1043-E1046 PolarHBondContact OD1-N 3.27Å; N1043-W1047 VanDerWaalsContact O-CB 3.29Å; N1043-W1047 WeakPolarHBondContact O-CB 3.28Å; N1043-W1047 PolarHBondContact O-N 3.27Å
1044Y84.8Confident81.2Confident46 Ų4677.7 Ų77.718%0.1842%0.423CS..Hα-helixtrans-58-38.5-170.8-179.2-110.7000113.5E1022 S1025 K1026 W1047 L1048E1022-Y1044 HydrophobicContact CB-CD1 4.18Å; E1022-Y1044 HydrophobicContact CB-CD2 3.56Å; E1022-Y1044 HydrophobicContact CB-CE1 4.38Å; E1022-Y1044 HydrophobicContact CB-CE2 3.82Å; E1022-Y1044 HydrophobicContact CB-CG 3.76Å; E1022-Y1044 VanDerWaalsContact CD-CD1 3.43Å; E1022-Y1044 HydrophobicContact CG-CD1 3.45Å; E1022-Y1044 VanDerWaalsContact CG-CD1 3.45Å; E1022-Y1044 HydrophobicContact CG-CD2 3.81Å; E1022-Y1044 HydrophobicContact CG-CE1 3.72Å; E1022-Y1044 HydrophobicContact CG-CE2 4.09Å; E1022-Y1044 HydrophobicContact CG-CG 3.49Å; E1022-Y1044 VanDerWaalsContact CG-CG 3.49Å; E1022-Y1044 VanDerWaalsContact O-CE2 3.23Å; E1022-Y1044 WeakPolarHBondContact O-CE2 3.32Å; E1022-Y1044 WeakPolarHBondContact OE1-CB 3.16Å; E1022-Y1044 VanDerWaalsContact OE1-CD1 3.25Å; E1022-Y1044 WeakPolarHBondContact OE1-CD1 3.38Å; E1022-Y1044 WeakPolarHBondContact OE2-CB 3.49Å; S1025-Y1044 WeakPolarHBondContact CB-OH 3.48Å; S1025-Y1044 PolarHBondContact OG-OH 2.97Å; K1026-Y1044 HydrophobicContact CD-CD2 4.01Å; K1026-Y1044 HydrophobicContact CG-CD2 4.08Å; K1026-Y1044 HydrophobicContact CG-CE2 4.15Å; Y1044-W1047 PolarHBondContact O-N 3.29Å; Y1044-L1048 HydrophobicContact CD1-CD1 3.88Å; Y1044-L1048 HydrophobicContact CD1-CG 4.48Å; Y1044-L1048 HydrophobicContact CD2-CG 4.39Å; Y1044-L1048 HydrophobicContact CE1-CD1 3.33Å; Y1044-L1048 HydrophobicContact CE1-CG 4.14Å; Y1044-L1048 HydrophobicContact CE2-CD1 4.08Å; Y1044-L1048 HydrophobicContact CE2-CD2 4.38Å; Y1044-L1048 HydrophobicContact CE2-CG 4Å; Y1044-L1048 HydrophobicContact CG-CD1 4.47Å; Y1044-L1048 VanDerWaalsContact CZ-CD1 3.45Å; Y1044-L1048 WeakPolarHBondContact O-CB 3.48Å; Y1044-L1048 WeakPolarHBondContact O-CG 3.27Å; Y1044-L1048 PolarHBondContact O-N 2.97Å
1045S84.8Confident81Confident62 Ų6272.9 Ų72.943%0.43439%0.393SS..Hα-helixtrans-69.2-35.2179.783.30000113.9N1043 R1049N1043-S1045 VanDerWaalsContact C-N 3.28Å; N1043-S1045 PolarHBondContact O-N 3.41Å; N1043-S1045 PolarHBondContact OD1-N 2.7Å; N1043-S1045 PolarHBondContact OD1-OG 2.89Å; S1045-R1049 WeakPolarHBondContact O-CB 3.49Å; S1045-R1049 PolarHBondContact O-N 3.23Å
1046E85.3Confident81.3Confident92 Ų9273.4 Ų73.443%0.4339%0.385SS..Hα-helixtrans-77.7-40.2175.6-76.9164.8-15800111.4L1042 N1043 R1049 G1050L1042-E1046 HydrophobicContact CB-CB 4.29Å; N1043-E1046 PolarHBondContact ND2-OE1 2.96Å; N1043-E1046 PolarHBondContact ND2-OE2 3.49Å; N1043-E1046 PolarHBondContact O-N 3.29Å; N1043-E1046 PolarHBondContact OD1-N 3.27Å; E1046-R1049 PolarHBondContact O-N 2.78Å; E1046-G1050 PolarHBondContact O-N 3.33Å
1047W92.2Very high80.7Confident6 Ų676.6 Ų76.62%0.02341%0.412CS..Hα-helixtrans-59.8-49.2175-173.191.8000110.9K1026 L1029 K1030 V1038 P1039 L1042 N1043 Y1044 R1049 G1050 F1051K1026-W1047 HydrophobicContact CB-CH2 4.13Å; K1026-W1047 HydrophobicContact CB-CZ2 4.43Å; K1026-W1047 HydrophobicContact CB-CZ3 4.19Å; K1026-W1047 HydrophobicContact CD-CD2 4.24Å; K1026-W1047 HydrophobicContact CD-CE3 4.35Å; K1026-W1047 VanDerWaalsContact CE-CG 3.45Å; K1026-W1047 HydrophobicContact CG-CD2 3.71Å; K1026-W1047 HydrophobicContact CG-CE3 3.47Å; K1026-W1047 VanDerWaalsContact CG-CE3 3.47Å; K1026-W1047 HydrophobicContact CG-CG 4.48Å; K1026-W1047 HydrophobicContact CG-CH2 3.85Å; K1026-W1047 HydrophobicContact CG-CZ2 4.07Å; K1026-W1047 HydrophobicContact CG-CZ3 3.55Å; K1026-W1047 WeakPolarHBondContact O-CH2 3.35Å; L1029-W1047 HydrophobicContact CB-CH2 4.2Å; L1029-W1047 HydrophobicContact CB-CZ3 4.41Å; L1029-W1047 HydrophobicContact CD1-CZ3 4.04Å; K1030-W1047 HydrophobicContact CG-CH2 4.43Å; K1030-W1047 HydrophobicContact CG-CZ2 4.19Å; V1038-W1047 HydrophobicContact CG1-CG 4.21Å; P1039-W1047 VanDerWaalsContact O-CD1 3.32Å; L1042-W1047 HydrophobicContact CB-CB 4.09Å; N1043-W1047 VanDerWaalsContact O-CB 3.29Å; N1043-W1047 WeakPolarHBondContact O-CB 3.28Å; N1043-W1047 PolarHBondContact O-N 3.27Å; Y1044-W1047 PolarHBondContact O-N 3.29Å; W1047-R1049 VanDerWaalsContact C-N 3.34Å; W1047-R1049 PolarHBondContact O-N 3.05Å; W1047-G1050 PolarHBondContact O-N 2.89Å; W1047-F1051 HydrophobicContact CE3-CB 4.31Å; W1047-F1051 HydrophobicContact CH2-CB 4.34Å; W1047-F1051 AromaticContact CH2-CD2 3.64Å; W1047-F1051 HydrophobicContact CH2-CD2 3.64Å; W1047-F1051 HydrophobicContact CH2-CE2 4.18Å; W1047-F1051 HydrophobicContact CH2-CG 4.05Å; W1047-F1051 AromaticContact CZ2-CD2 4Å; W1047-F1051 HydrophobicContact CZ2-CD2 4Å; W1047-F1051 HydrophobicContact CZ3-CB 4.11Å; W1047-F1051 HydrophobicContact CZ3-CD2 4.2Å; W1047-F1051 HydrophobicContact CZ3-CG 4.13Å; W1047-F1051 VanDerWaalsContact O-CB 3.29Å; W1047-F1051 WeakPolarHBondContact O-CB 3.33Å; W1047-F1051 PolarHBondContact O-N 3.49Å
1048L85.7Confident79.9Confident54 Ų5475.3 Ų75.328%0.28340%0.402SS..Hα-helixtrans-58.3-44.2175.8-85.9179.2000112L1029 Y1044 F1051 E1052L1029-L1048 HydrophobicContact CD1-CD2 3.47Å; L1029-L1048 VanDerWaalsContact CD1-CD2 3.47Å; Y1044-L1048 HydrophobicContact CD1-CD1 3.88Å; Y1044-L1048 HydrophobicContact CD1-CG 4.48Å; Y1044-L1048 HydrophobicContact CD2-CG 4.39Å; Y1044-L1048 HydrophobicContact CE1-CD1 3.33Å; Y1044-L1048 HydrophobicContact CE1-CG 4.14Å; Y1044-L1048 HydrophobicContact CE2-CD1 4.08Å; Y1044-L1048 HydrophobicContact CE2-CD2 4.38Å; Y1044-L1048 HydrophobicContact CE2-CG 4Å; Y1044-L1048 HydrophobicContact CG-CD1 4.47Å; Y1044-L1048 VanDerWaalsContact CZ-CD1 3.45Å; Y1044-L1048 WeakPolarHBondContact O-CB 3.48Å; Y1044-L1048 WeakPolarHBondContact O-CG 3.27Å; Y1044-L1048 PolarHBondContact O-N 2.97Å; L1048-F1051 WeakPolarHBondContact O-CB 3.41Å; L1048-F1051 PolarHBondContact O-N 2.96Å; L1048-E1052 VanDerWaalsContact O-CB 3.29Å; L1048-E1052 WeakPolarHBondContact O-CB 3.39Å; L1048-E1052 PolarHBondContact O-N 2.97Å
1049R84.7Confident78.8Confident159 Ų15978 Ų7860%0.642%0.419SS*.Hα-helixtrans-67.1-38.4-179.4-159.8-175.6-42.7-166.38112.2S1045 E1046 W1047 K1053S1045-R1049 WeakPolarHBondContact O-CB 3.49Å; S1045-R1049 PolarHBondContact O-N 3.23Å; E1046-R1049 PolarHBondContact O-N 2.78Å; W1047-R1049 VanDerWaalsContact C-N 3.34Å; W1047-R1049 PolarHBondContact O-N 3.05Å; R1049-K1053 WeakPolarHBondContact O-CB 3.48Å; R1049-K1053 PolarHBondContact O-N 2.83Å; R1049-K1053 VanDerWaalsContact O-N 3.14Å
1050G82.6Confident77.6Confident28 Ų2879.2 Ų79.229%0.28944%0.435SS..Hα-helixtrans-67.3-36.5172.400000112.8E1046 W1047 K1054E1046-G1050 PolarHBondContact O-N 3.33Å; W1047-G1050 PolarHBondContact O-N 2.89Å; G1050-K1054 PolarHBondContact O-N 3.45Å
1051F86.3Confident76.7Confident7 Ų777.1 Ų77.13%0.03143%0.43CS..Hα-helixtrans-68.3-52.2174.9-173.3-85.9000111.5L1029 F1033 V1036 V1038 W1047 L1048 K1053 K1054 A1055L1029-F1051 HydrophobicContact CB-CD1 4.35Å; L1029-F1051 HydrophobicContact CB-CE1 3.8Å; L1029-F1051 HydrophobicContact CB-CE2 4.17Å; L1029-F1051 HydrophobicContact CB-CZ 3.69Å; L1029-F1051 HydrophobicContact CD1-CD1 4.36Å; L1029-F1051 HydrophobicContact CD1-CE1 4.43Å; L1029-F1051 HydrophobicContact CD2-CE1 3.91Å; L1029-F1051 HydrophobicContact CG-CE1 4.26Å; L1029-F1051 VanDerWaalsContact O-CZ 3.31Å; L1029-F1051 WeakPolarHBondContact O-CZ 3.31Å; F1033-F1051 HydrophobicContact CB-CZ 3.92Å; F1033-F1051 AromaticContact CD2-CE1 3.98Å; F1033-F1051 HydrophobicContact CD2-CE1 3.98Å; F1033-F1051 AromaticContact CD2-CZ 3.82Å; F1033-F1051 HydrophobicContact CD2-CZ 3.82Å; F1033-F1051 HydrophobicContact CG-CZ 4.24Å; V1036-F1051 HydrophobicContact CB-CD2 4.43Å; V1036-F1051 HydrophobicContact CB-CE2 3.92Å; V1036-F1051 HydrophobicContact CB-CZ 4.32Å; V1036-F1051 HydrophobicContact CG1-CD2 3.64Å; V1036-F1051 HydrophobicContact CG1-CE2 3.62Å; V1036-F1051 HydrophobicContact CG1-CG 4.24Å; V1036-F1051 HydrophobicContact CG1-CZ 4.2Å; V1038-F1051 HydrophobicContact CG2-CB 4.01Å; V1038-F1051 HydrophobicContact CG2-CD2 4.09Å; W1047-F1051 HydrophobicContact CE3-CB 4.31Å; W1047-F1051 HydrophobicContact CH2-CB 4.34Å; W1047-F1051 AromaticContact CH2-CD2 3.64Å; W1047-F1051 HydrophobicContact CH2-CD2 3.64Å; W1047-F1051 HydrophobicContact CH2-CE2 4.18Å; W1047-F1051 HydrophobicContact CH2-CG 4.05Å; W1047-F1051 AromaticContact CZ2-CD2 4Å; W1047-F1051 HydrophobicContact CZ2-CD2 4Å; W1047-F1051 HydrophobicContact CZ3-CB 4.11Å; W1047-F1051 HydrophobicContact CZ3-CD2 4.2Å; W1047-F1051 HydrophobicContact CZ3-CG 4.13Å; W1047-F1051 VanDerWaalsContact O-CB 3.29Å; W1047-F1051 WeakPolarHBondContact O-CB 3.33Å; W1047-F1051 PolarHBondContact O-N 3.49Å; L1048-F1051 WeakPolarHBondContact O-CB 3.41Å; L1048-F1051 PolarHBondContact O-N 2.96Å; F1051-K1053 VanDerWaalsContact C-N 3.32Å; F1051-K1053 PolarHBondContact O-N 3.38Å; F1051-K1054 PolarHBondContact O-N 3.43Å; F1051-A1055 HydrophobicContact CD1-CB 4.24Å; F1051-A1055 HydrophobicContact CE1-CB 3.97Å; F1051-A1055 WeakPolarHBondContact O-CB 3.44Å; F1051-A1055 PolarHBondContact O-N 2.84Å
1052E83.2Confident75.3Confident95 Ų9576.4 Ų76.444%0.44443%0.431SS..Hα-helixtrans-53.4-47.2177.5-176.5-168.1-171.700111.5L1048 K1054 A1055 K1056L1048-E1052 VanDerWaalsContact O-CB 3.29Å; L1048-E1052 WeakPolarHBondContact O-CB 3.39Å; L1048-E1052 PolarHBondContact O-N 2.97Å; E1052-K1054 VanDerWaalsContact C-N 3.26Å; E1052-K1054 PolarHBondContact O-N 2.85Å; E1052-A1055 PolarHBondContact O-N 3.39Å; E1052-K1056 HydrophobicContact CG-CD 4.15Å; E1052-K1056 HydrophobicContact CG-CG 4.5Å; E1052-K1056 WeakPolarHBondContact O-CB 3.26Å; E1052-K1056 WeakPolarHBondContact O-CG 3.32Å; E1052-K1056 PolarHBondContact O-N 2.68Å; E1052-K1056 WeakPolarHBondContact OE1-CE 3.39Å; E1052-K1056 IonicContact OE1-NZ 3.56Å; E1052-K1056 PolarHBondContact OE1-NZ 3.41Å
1053K82.1Confident73.5Confident171 Ų17179.8 Ų79.874%0.74346%0.459SS*.Hα-helixtrans-61.2-33.4179.2-171.5174.5-178.9179.10112.8R1049 F1051R1049-K1053 WeakPolarHBondContact O-CB 3.48Å; R1049-K1053 PolarHBondContact O-N 2.83Å; R1049-K1053 VanDerWaalsContact O-N 3.14Å; F1051-K1053 VanDerWaalsContact C-N 3.32Å; F1051-K1053 PolarHBondContact O-N 3.38Å
1054K78.6Confident71.6Confident99 Ų9982.8 Ų82.843%0.4348%0.475SS..Hα-helixtrans-83.7-40.9176.8-74.4175.4171.6173.20112.5V1036 S1037 V1038 G1050 F1051 E1052 K1056 A1057 C1058V1036-K1054 HydrophobicContact CG1-CB 3.59Å; V1036-K1054 HydrophobicContact CG1-CD 4.43Å; S1037-K1054 WeakPolarHBondContact O-CD 3.27Å; S1037-K1054 PolarHBondContact O-NZ 3.45Å; V1038-K1054 HydrophobicContact CG2-CD 4.14Å; G1050-K1054 PolarHBondContact O-N 3.45Å; F1051-K1054 PolarHBondContact O-N 3.43Å; E1052-K1054 VanDerWaalsContact C-N 3.26Å; E1052-K1054 PolarHBondContact O-N 2.85Å; K1054-K1056 VanDerWaalsContact C-N 3.34Å; K1054-K1056 PolarHBondContact O-N 2.82Å; K1054-A1057 WeakPolarHBondContact O-CB 3.42Å; K1054-A1057 PolarHBondContact O-N 2.86Å; K1054-A1057 VanDerWaalsContact O-N 3.09Å; K1054-C1058 PolarHBondContact O-N 3.27Å
1055A74.4Confident70Confident11 Ų1183.4 Ų83.49%0.09149%0.49CS..Hα-helixtrans-62.4-39.7176.700000111.9V1036 F1051 E1052 A1057 C1058 V1059V1036-A1055 HydrophobicContact CG2-CB 4.4Å; F1051-A1055 HydrophobicContact CD1-CB 4.24Å; F1051-A1055 HydrophobicContact CE1-CB 3.97Å; F1051-A1055 WeakPolarHBondContact O-CB 3.44Å; F1051-A1055 PolarHBondContact O-N 2.84Å; E1052-A1055 PolarHBondContact O-N 3.39Å; A1055-A1057 PolarHBondContact O-N 2.99Å; A1055-C1058 PolarHBondContact O-N 3.07Å; A1055-V1059 WeakPolarHBondContact O-CG2 3.36Å; A1055-V1059 PolarHBondContact O-N 2.86Å
1056K70.8Confident68.5Low135 Ų13586.4 Ų86.459%0.58750%0.497SS*.Hα-helixtrans-59.7-28.3173.3-76.8179.5-178.51740113.6E1052 K1054E1052-K1056 HydrophobicContact CG-CD 4.15Å; E1052-K1056 HydrophobicContact CG-CG 4.5Å; E1052-K1056 WeakPolarHBondContact O-CB 3.26Å; E1052-K1056 WeakPolarHBondContact O-CG 3.32Å; E1052-K1056 PolarHBondContact O-N 2.68Å; E1052-K1056 WeakPolarHBondContact OE1-CE 3.39Å; E1052-K1056 IonicContact OE1-NZ 3.56Å; E1052-K1056 PolarHBondContact OE1-NZ 3.41Å; K1054-K1056 VanDerWaalsContact C-N 3.34Å; K1054-K1056 PolarHBondContact O-N 2.82Å
1057A65.8Low67.2Low79 Ų7985.3 Ų85.365%0.65350%0.504SS*.Hα-helixtrans-75.5-27.1173.700000112.8K1054 A1055K1054-A1057 WeakPolarHBondContact O-CB 3.42Å; K1054-A1057 PolarHBondContact O-N 2.86Å; K1054-A1057 VanDerWaalsContact O-N 3.09Å; A1055-A1057 PolarHBondContact O-N 2.99Å
1058C60.4Low65.6Low67 Ų6788.5 Ų88.545%0.45352%0.524SS..Hα-helixtrans-84.3-31.3176.3-64.40000113.6K1054 A1055 A1060K1054-C1058 PolarHBondContact O-N 3.27Å; A1055-C1058 PolarHBondContact O-N 3.07Å; C1058-A1060 VanDerWaalsContact C-N 3.32Å; C1058-A1060 PolarHBondContact O-N 3.22Å
1059V58.7Low64.5Low75 Ų7591.8 Ų91.846%0.45554%0.536SS..Hα-helixtrans-80.3-10.1-175.3174.10000113.3F1033 A1055 G1061F1033-V1059 HydrophobicContact CD1-CG2 4.47Å; F1033-V1059 HydrophobicContact CE1-CG2 3.57Å; F1033-V1059 HydrophobicContact CZ-CG2 4.13Å; A1055-V1059 WeakPolarHBondContact O-CG2 3.36Å; A1055-V1059 PolarHBondContact O-N 2.86Å; V1059-G1061 PolarHBondContact O-N 3.42Å
1060A51.9Low63.7Low96 Ų9688.9 Ų88.979%0.79354%0.536SS*.THydrogen-bonded Turntrans-6712.5177.400000115.3C1058C1058-A1060 VanDerWaalsContact C-N 3.32Å; C1058-A1060 PolarHBondContact O-N 3.22Å
1061G55.1Low63.1Low64 Ų6493.2 Ų93.266%0.6655%0.552SS**THydrogen-bonded Turntrans-125.1-10.9-172.700000117.3V1059V1059-G1061 PolarHBondContact O-N 3.42Å
1062T49.3Very low62.1Low126 Ų12698.5 Ų98.577%0.77358%0.576SS**  trans-145.5138.9-17748.80000113.4
1063S43.4Very low61.5Low125 Ų12599.7 Ų99.787%0.87458%0.581SS**  trans-137.6130.5173.6-178.50000108.5
1064D44Very low61.1Low141 Ų141100.1 Ų100.175%0.75458%0.579SS**  trans-135.2136.4175.8-166-0.9000109
1065A51.8Low60.9Low60 Ų60101.3 Ų101.350%0.49659%0.589SS.*SBendtrans-99.5-17.3-152.400000114.9V1068A1065-V1068 PolarHBondContact O-N 2.87Å
1066E52Low61.2Low125 Ų125106.8 Ų106.858%0.58461%0.611SS**Hα-helixtrans-76.7-27.8-171.3-139.261.7-123.100113.1V1068 K1069E1066-V1068 PolarHBondContact O-N 2.97Å; E1066-K1069 IonicContact OE1-NZ 3.32Å; E1066-K1069 PolarHBondContact OE1-NZ 2.89Å; E1066-K1069 IonicContact OE2-NZ 2.84Å
1067A58Low61.6Low68 Ų68105.4 Ų105.456%0.56261%0.606SS**Hα-helixtrans-68.4-22.4176.500000113.4L1071A1067-L1071 WeakPolarHBondContact O-CG 3.34Å; A1067-L1071 PolarHBondContact O-N 3.49Å
1068V58.9Low62.1Low74 Ų74104 Ų10445%0.44859%0.594SS.*Hα-helixtrans-67.4-44.2-176.4-178.50000111.2A1065 E1066 V1070 L1071 E1072A1065-V1068 PolarHBondContact O-N 2.87Å; E1066-V1068 PolarHBondContact O-N 2.97Å; V1068-V1070 PolarHBondContact O-N 3.3Å; V1068-L1071 PolarHBondContact O-N 3.31Å; V1068-L1071 VanDerWaalsContact O-N 3.15Å; V1068-E1072 HydrophobicContact CG1-CG 4.36Å; V1068-E1072 WeakPolarHBondContact O-CG 3.44Å; V1068-E1072 PolarHBondContact O-N 2.79Å
1069K63.5Low62.8Low123 Ų123103.5 Ų103.554%0.53559%0.592SS.*Hα-helixtrans-64-36.4-175.6-61.6173.3-169.7159.10113.4E1066 E1072 H1073E1066-K1069 IonicContact OE1-NZ 3.32Å; E1066-K1069 PolarHBondContact OE1-NZ 2.89Å; E1066-K1069 IonicContact OE2-NZ 2.84Å; K1069-E1072 PolarHBondContact O-N 3.36Å; K1069-H1073 PolarHBondContact O-N 3.39Å
1070V67.3Low64.1Low98 Ų98104.7 Ų104.759%0.59459%0.593SS**Hα-helixtrans-70.9-34.8177.6178.80000111V1068 R1074V1068-V1070 PolarHBondContact O-N 3.3Å; V1070-R1074 PolarHBondContact O-N 2.84Å
1071L68.9Low65.6Low119 Ų119106 Ų10662%0.62358%0.584SS**Hα-helixtrans-71.1-37.7174.1-68.8171.4000111.7A1067 V1068 H1073 R1074 L1075A1067-L1071 WeakPolarHBondContact O-CG 3.34Å; A1067-L1071 PolarHBondContact O-N 3.49Å; V1068-L1071 PolarHBondContact O-N 3.31Å; V1068-L1071 VanDerWaalsContact O-N 3.15Å; L1071-H1073 PolarHBondContact O-N 3.41Å; L1071-R1074 PolarHBondContact O-N 3.39Å; L1071-L1075 VanDerWaalsContact O-CB 3.23Å; L1071-L1075 WeakPolarHBondContact O-CB 3.15Å; L1071-L1075 PolarHBondContact O-N 3.24Å
1072E65.5Low67Low118 Ų118108.3 Ų108.355%0.55158%0.577SS**Hα-helixtrans-60.2-42.3174.4-74.7176.514500112.6V1068 K1069 L1075 K1076V1068-E1072 HydrophobicContact CG1-CG 4.36Å; V1068-E1072 WeakPolarHBondContact O-CG 3.44Å; V1068-E1072 PolarHBondContact O-N 2.79Å; K1069-E1072 PolarHBondContact O-N 3.36Å; E1072-L1075 PolarHBondContact O-N 2.79Å; E1072-K1076 PolarHBondContact O-N 3.48Å
1073H71.7Confident69Low119 Ų119106.3 Ų106.355%0.55157%0.565SS**Hα-helixtrans-62.7-49.3176.6-168.8-78.6000112.2K1069 L1071 L1075 K1076 E1077K1069-H1073 PolarHBondContact O-N 3.39Å; L1071-H1073 PolarHBondContact O-N 3.41Å; H1073-L1075 VanDerWaalsContact C-N 3.3Å; H1073-L1075 PolarHBondContact O-N 2.74Å; H1073-K1076 WeakPolarHBondContact O-CB 3.5Å; H1073-K1076 PolarHBondContact O-N 2.97Å; H1073-K1076 VanDerWaalsContact O-N 3.09Å; H1073-E1077 VanDerWaalsContact CE1-CD 3.4Å; H1073-E1077 IonicContact CE1-OE1 3.03Å; H1073-E1077 PolarHBondContact CE1-OE1 3.39Å; H1073-E1077 VanDerWaalsContact CE1-OE1 3.29Å; H1073-E1077 IonicContact CE1-OE2 3.24Å; H1073-E1077 VanDerWaalsContact ND1-CD 3.35Å; H1073-E1077 IonicContact ND1-OE1 2.67Å; H1073-E1077 IonicContact ND1-OE2 3.49Å; H1073-E1077 PolarHBondContact ND1-OE2 2.84Å; H1073-E1077 PolarHBondContact O-N 3.1Å; H1073-E1077 VanDerWaalsContact O-N 3.07Å
1074R73.8Confident71.1Confident181 Ų181106.2 Ų106.268%0.68355%0.554SS**Hα-helixtrans-65-33.4178-80.3-173.7163.8-161.6-4.2112.9V1070 L1071 K1076 A1078V1070-R1074 PolarHBondContact O-N 2.84Å; L1071-R1074 PolarHBondContact O-N 3.39Å; R1074-K1076 VanDerWaalsContact C-N 3.3Å; R1074-A1078 VanDerWaalsContact O-CB 3.29Å; R1074-A1078 WeakPolarHBondContact O-CB 3.1Å; R1074-A1078 PolarHBondContact O-N 2.95Å
1075L73.6Confident73.4Confident124 Ų124104 Ų10465%0.64954%0.541SS*.Hα-helixtrans-63.9-38.4173-177.364.1000111L1071 E1072 H1073 S1079L1071-L1075 VanDerWaalsContact O-CB 3.23Å; L1071-L1075 WeakPolarHBondContact O-CB 3.15Å; L1071-L1075 PolarHBondContact O-N 3.24Å; E1072-L1075 PolarHBondContact O-N 2.79Å; H1073-L1075 VanDerWaalsContact C-N 3.3Å; H1073-L1075 PolarHBondContact O-N 2.74Å; L1075-S1079 WeakPolarHBondContact O-CB 3.37Å; L1075-S1079 PolarHBondContact O-N 3.24Å
1076K81.1Confident75.1Confident126 Ų126105.6 Ų105.655%0.54854%0.539SS..Hα-helixtrans-65.7-50.8176.4-160.8-173.1-177.5-119.80112.1E1072 H1073 R1074 A1078 S1079 E1080E1072-K1076 PolarHBondContact O-N 3.48Å; H1073-K1076 WeakPolarHBondContact O-CB 3.5Å; H1073-K1076 PolarHBondContact O-N 2.97Å; H1073-K1076 VanDerWaalsContact O-N 3.09Å; R1074-K1076 VanDerWaalsContact C-N 3.3Å; K1076-A1078 VanDerWaalsContact C-N 3.31Å; K1076-A1078 PolarHBondContact O-N 3.15Å; K1076-S1079 WeakPolarHBondContact O-CA 3.15Å; K1076-S1079 WeakPolarHBondContact O-CB 3.19Å; K1076-S1079 PolarHBondContact O-N 2.85Å; K1076-S1079 PolarHBondContact O-OG 3.22Å; K1076-E1080 WeakPolarHBondContact CE-OE1 3.36Å; K1076-E1080 IonicContact NZ-OE1 3.6Å; K1076-E1080 PolarHBondContact NZ-OE1 2.85Å; K1076-E1080 PolarHBondContact O-N 3.43Å
1077E79.5Confident77.1Confident105 Ų105105.6 Ų105.649%0.49154%0.542SS..Hα-helixtrans-57.9-43.1176.6-67.2171.313100111.8H1073 S1079 E1080 M1081H1073-E1077 VanDerWaalsContact CE1-CD 3.4Å; H1073-E1077 IonicContact CE1-OE1 3.03Å; H1073-E1077 PolarHBondContact CE1-OE1 3.39Å; H1073-E1077 VanDerWaalsContact CE1-OE1 3.29Å; H1073-E1077 IonicContact CE1-OE2 3.24Å; H1073-E1077 VanDerWaalsContact ND1-CD 3.35Å; H1073-E1077 IonicContact ND1-OE1 2.67Å; H1073-E1077 IonicContact ND1-OE2 3.49Å; H1073-E1077 PolarHBondContact ND1-OE2 2.84Å; H1073-E1077 PolarHBondContact O-N 3.1Å; H1073-E1077 VanDerWaalsContact O-N 3.07Å; E1077-S1079 VanDerWaalsContact C-N 3.33Å; E1077-S1079 PolarHBondContact O-N 3.48Å; E1077-E1080 PolarHBondContact O-N 2.92Å; E1077-M1081 PolarHBondContact O-N 3.39Å
1078A75.4Confident78.5Confident49 Ų49106.5 Ų106.541%0.40554%0.535SS..Hα-helixtrans-64.3-36.1174.800000112.6R1074 K1076 H1082R1074-A1078 VanDerWaalsContact O-CB 3.29Å; R1074-A1078 WeakPolarHBondContact O-CB 3.1Å; R1074-A1078 PolarHBondContact O-N 2.95Å; K1076-A1078 VanDerWaalsContact C-N 3.31Å; K1076-A1078 PolarHBondContact O-N 3.15Å; A1078-H1082 VanDerWaalsContact O-CB 3.32Å; A1078-H1082 WeakPolarHBondContact O-CB 3.12Å; A1078-H1082 PolarHBondContact O-N 2.94Å
1079S74.8Confident80.1Confident58 Ų58106.1 Ų106.141%0.40653%0.534SS..Hα-helixtrans-69.1-40.6176.576.90000112.5L1075 K1076 E1077 H1082 T1083L1075-S1079 WeakPolarHBondContact O-CB 3.37Å; L1075-S1079 PolarHBondContact O-N 3.24Å; K1076-S1079 WeakPolarHBondContact O-CA 3.15Å; K1076-S1079 WeakPolarHBondContact O-CB 3.19Å; K1076-S1079 PolarHBondContact O-N 2.85Å; K1076-S1079 PolarHBondContact O-OG 3.22Å; E1077-S1079 VanDerWaalsContact C-N 3.33Å; E1077-S1079 PolarHBondContact O-N 3.48Å; S1079-H1082 WeakPolarHBondContact O-CB 3.35Å; S1079-H1082 PolarHBondContact O-N 2.89Å; S1079-T1083 WeakPolarHBondContact O-CG2 3.39Å; S1079-T1083 PolarHBondContact O-N 2.81Å
1080E86.6Confident81.5Confident100 Ų100104.3 Ų104.347%0.46753%0.528SS..Hα-helixtrans-65.6-45177.5-69.6172.8-171.100110K1076 E1077 H1082 T1083 L1084K1076-E1080 WeakPolarHBondContact CE-OE1 3.36Å; K1076-E1080 IonicContact NZ-OE1 3.6Å; K1076-E1080 PolarHBondContact NZ-OE1 2.85Å; K1076-E1080 PolarHBondContact O-N 3.43Å; E1077-E1080 PolarHBondContact O-N 2.92Å; E1080-H1082 VanDerWaalsContact C-N 3.35Å; E1080-H1082 PolarHBondContact O-N 3.42Å; E1080-T1083 PolarHBondContact O-N 2.89Å; E1080-T1083 VanDerWaalsContact O-N 3.16Å; E1080-T1083 PolarHBondContact O-OG1 2.97Å; E1080-L1084 PolarHBondContact O-N 2.88Å; E1080-L1084 VanDerWaalsContact O-N 3.14Å
1081M83.3Confident82.8Confident122 Ų122106.7 Ų106.760%0.60153%0.53SS*.Hα-helixtrans-61.2-39.3172.6-174.8174.463.600112.9E1077 L1084 L1085E1077-M1081 PolarHBondContact O-N 3.39Å; M1081-L1084 PolarHBondContact O-N 3.25Å; M1081-L1085 HydrophobicContact CG-CD1 4.19Å; M1081-L1085 PolarHBondContact O-N 3.45Å
1082H84.7Confident84Confident113 Ų113107.5 Ų107.552%0.52353%0.526SS..Hα-helixtrans-61.9-41.4173.9-177.6-73.1000111.6A1078 S1079 E1080 L1084 L1085 Q1086A1078-H1082 VanDerWaalsContact O-CB 3.32Å; A1078-H1082 WeakPolarHBondContact O-CB 3.12Å; A1078-H1082 PolarHBondContact O-N 2.94Å; S1079-H1082 WeakPolarHBondContact O-CB 3.35Å; S1079-H1082 PolarHBondContact O-N 2.89Å; E1080-H1082 VanDerWaalsContact C-N 3.35Å; E1080-H1082 PolarHBondContact O-N 3.42Å; H1082-L1084 PolarHBondContact O-N 2.92Å; H1082-L1085 PolarHBondContact O-N 2.97Å; H1082-Q1086 PolarHBondContact CE1-OE1 3.31Å; H1082-Q1086 VanDerWaalsContact O-CB 3.29Å; H1082-Q1086 WeakPolarHBondContact O-CB 3.08Å; H1082-Q1086 PolarHBondContact O-N 3.23Å
1083T90.6Very high85.5Confident85 Ų85107.3 Ų107.352%0.52152%0.523SS..Hα-helixtrans-64.6-36.9176.960.20000113.1S1079 E1080 Q1086 L1087S1079-T1083 WeakPolarHBondContact O-CG2 3.39Å; S1079-T1083 PolarHBondContact O-N 2.81Å; E1080-T1083 PolarHBondContact O-N 2.89Å; E1080-T1083 VanDerWaalsContact O-N 3.16Å; E1080-T1083 PolarHBondContact O-OG1 2.97Å; T1083-Q1086 PolarHBondContact O-N 3.48Å; T1083-L1087 PolarHBondContact O-N 2.96Å
1084L89Confident86.6Confident122 Ų122105.4 Ų105.464%0.63952%0.524SS*.Hα-helixtrans-68.4-44.8176.9-173.665000111.8E1080 M1081 H1082 Q1086 L1087 E1088E1080-L1084 PolarHBondContact O-N 2.88Å; E1080-L1084 VanDerWaalsContact O-N 3.14Å; M1081-L1084 PolarHBondContact O-N 3.25Å; H1082-L1084 PolarHBondContact O-N 2.92Å; L1084-Q1086 VanDerWaalsContact C-N 3.31Å; L1084-Q1086 PolarHBondContact O-N 3.37Å; L1084-L1087 WeakPolarHBondContact O-CB 3.37Å; L1084-L1087 PolarHBondContact O-N 3.11Å; L1084-E1088 PolarHBondContact O-N 3Å
1085L91.3Very high87.7Confident94 Ų94100.4 Ų100.449%0.49251%0.513SS..Hα-helixtrans-63.8-36.2174.9-75.5167.6000112.2M1081 H1082 E1088 C1089M1081-L1085 HydrophobicContact CG-CD1 4.19Å; M1081-L1085 PolarHBondContact O-N 3.45Å; H1082-L1085 PolarHBondContact O-N 2.97Å; L1085-E1088 PolarHBondContact O-N 3.44Å; L1085-C1089 WeakPolarHBondContact O-CB 3.47Å; L1085-C1089 PolarHBondContact O-N 3.04Å; L1085-C1089 PolarHBondContact O-SG 2.98Å
1086Q88.5Confident88.5Confident94 Ų94100 Ų10044%0.43951%0.511SS..Hα-helixtrans-61.6-46.2173.4-172.3105.915.400110.8H1082 T1083 L1084 E1088 C1089 E1090H1082-Q1086 PolarHBondContact CE1-OE1 3.31Å; H1082-Q1086 VanDerWaalsContact O-CB 3.29Å; H1082-Q1086 WeakPolarHBondContact O-CB 3.08Å; H1082-Q1086 PolarHBondContact O-N 3.23Å; T1083-Q1086 PolarHBondContact O-N 3.48Å; L1084-Q1086 VanDerWaalsContact C-N 3.31Å; L1084-Q1086 PolarHBondContact O-N 3.37Å; Q1086-E1088 PolarHBondContact O-N 2.8Å; Q1086-C1089 PolarHBondContact O-N 3.09Å; Q1086-E1090 WeakPolarHBondContact O-CG 3.37Å; Q1086-E1090 PolarHBondContact O-N 3.43Å
1087L93.1Very high89.1Confident125 Ų12596.8 Ų96.865%0.65451%0.508SS*.Hα-helixtrans-60.2-41.9175.5-100154.8000112.5T1083 L1084 E1090 K1091T1083-L1087 PolarHBondContact O-N 2.96Å; L1084-L1087 WeakPolarHBondContact O-CB 3.37Å; L1084-L1087 PolarHBondContact O-N 3.11Å; L1087-E1090 PolarHBondContact O-N 3.19Å; L1087-K1091 PolarHBondContact O-N 2.82Å
1088E88.6Confident89.8Confident88 Ų8898 Ų9841%0.41151%0.513SS..Hα-helixtrans-65.5-42.2175.2-149-169.1154.400111.5L1084 L1085 Q1086 K1091 Y1092L1084-E1088 PolarHBondContact O-N 3Å; L1085-E1088 PolarHBondContact O-N 3.44Å; Q1086-E1088 PolarHBondContact O-N 2.8Å; E1088-K1091 WeakPolarHBondContact O-CB 3.47Å; E1088-K1091 PolarHBondContact O-N 2.7Å; E1088-Y1092 HydrophobicContact CB-CE2 4.42Å; E1088-Y1092 HydrophobicContact CG-CD2 4.24Å; E1088-Y1092 HydrophobicContact CG-CE2 3.58Å; E1088-Y1092 WeakPolarHBondContact O-CD2 3.5Å; E1088-Y1092 PolarHBondContact O-N 3.44Å; E1088-Y1092 WeakPolarHBondContact OE1-CE2 3.43Å; E1088-Y1092 VanDerWaalsContact OE1-CZ 3.3Å; E1088-Y1092 PolarHBondContact OE1-OH 2.99Å
1089C91.4Very high90.7Very high65 Ų6598.6 Ų98.644%0.43951%0.512SS..Hα-helixtrans-63-40.9175-700000112.9L1085 Q1086 K1091 Y1092 K1093L1085-C1089 WeakPolarHBondContact O-CB 3.47Å; L1085-C1089 PolarHBondContact O-N 3.04Å; L1085-C1089 PolarHBondContact O-SG 2.98Å; Q1086-C1089 PolarHBondContact O-N 3.09Å; C1089-K1091 VanDerWaalsContact C-N 3.32Å; C1089-Y1092 PolarHBondContact O-N 2.82Å; C1089-K1093 WeakPolarHBondContact O-CG 3.37Å; C1089-K1093 PolarHBondContact O-N 3.32Å
1090E92.9Very high91.6Very high85 Ų85101.1 Ų101.140%0.39752%0.518SS..Hα-helixtrans-65.3-36.2173.9-66.2-48.7137.100111.7Q1086 L1087 K1093 S1094Q1086-E1090 WeakPolarHBondContact O-CG 3.37Å; Q1086-E1090 PolarHBondContact O-N 3.43Å; L1087-E1090 PolarHBondContact O-N 3.19Å; E1090-K1093 PolarHBondContact O-N 3.45Å; E1090-K1093 IonicContact OE1-NZ 2.86Å; E1090-K1093 PolarHBondContact OE1-NZ 2.95Å; E1090-K1093 WeakPolarHBondContact OE2-CD 3.41Å; E1090-K1093 IonicContact OE2-NZ 2.67Å; E1090-S1094 WeakPolarHBondContact O-CB 3.37Å; E1090-S1094 PolarHBondContact O-N 3.41Å
1091K93.6Very high92Very high148 Ų14897.6 Ų97.664%0.64351%0.508SS*.Hα-helixtrans-63.1-45.2172.4-171.5-179.4179-176.50111.8L1087 E1088 C1089 S1094 V1095L1087-K1091 PolarHBondContact O-N 2.82Å; E1088-K1091 WeakPolarHBondContact O-CB 3.47Å; E1088-K1091 PolarHBondContact O-N 2.7Å; C1089-K1091 VanDerWaalsContact C-N 3.32Å; K1091-S1094 PolarHBondContact O-N 3.46Å; K1091-V1095 WeakPolarHBondContact O-CG2 3.13Å; K1091-V1095 PolarHBondContact O-N 3.37Å
1092Y95.3Very high92.6Very high137 Ų13796.3 Ų96.354%0.53750%0.503SS..Hα-helixtrans-63.2-41.3174.8-70.5-58.3000112.2E1088 C1089 S1094 V1095 L1096E1088-Y1092 HydrophobicContact CB-CE2 4.42Å; E1088-Y1092 HydrophobicContact CG-CD2 4.24Å; E1088-Y1092 HydrophobicContact CG-CE2 3.58Å; E1088-Y1092 WeakPolarHBondContact O-CD2 3.5Å; E1088-Y1092 PolarHBondContact O-N 3.44Å; E1088-Y1092 WeakPolarHBondContact OE1-CE2 3.43Å; E1088-Y1092 VanDerWaalsContact OE1-CZ 3.3Å; E1088-Y1092 PolarHBondContact OE1-OH 2.99Å; C1089-Y1092 PolarHBondContact O-N 2.82Å; Y1092-S1094 VanDerWaalsContact C-N 3.33Å; Y1092-S1094 PolarHBondContact O-N 2.92Å; Y1092-V1095 PolarHBondContact O-N 3.28Å; Y1092-L1096 WeakPolarHBondContact O-CB 3.29Å; Y1092-L1096 VanDerWaalsContact O-CG 3.28Å; Y1092-L1096 WeakPolarHBondContact O-CG 3.37Å; Y1092-L1096 PolarHBondContact O-N 2.86Å
1093K96.3Very high93.1Very high113 Ų11396.3 Ų96.349%0.49151%0.506SS..Hα-helixtrans-59.1-42.6173.2-73.6170.2-174.8174.80112.1C1089 E1090 L1096 A1097C1089-K1093 WeakPolarHBondContact O-CG 3.37Å; C1089-K1093 PolarHBondContact O-N 3.32Å; E1090-K1093 PolarHBondContact O-N 3.45Å; E1090-K1093 IonicContact OE1-NZ 2.86Å; E1090-K1093 PolarHBondContact OE1-NZ 2.95Å; E1090-K1093 WeakPolarHBondContact OE2-CD 3.41Å; E1090-K1093 IonicContact OE2-NZ 2.67Å; K1093-L1096 PolarHBondContact O-N 3.49Å; K1093-A1097 WeakPolarHBondContact O-CB 3.26Å; K1093-A1097 PolarHBondContact O-N 3.07Å
1094S95.1Very high93.3Very high80 Ų8095.6 Ų95.656%0.55950%0.497SS*.Hα-helixtrans-63.1-44.8177.7-170.70000112E1090 K1091 Y1092 A1097 E1098E1090-S1094 WeakPolarHBondContact O-CB 3.37Å; E1090-S1094 PolarHBondContact O-N 3.41Å; K1091-S1094 PolarHBondContact O-N 3.46Å; Y1092-S1094 VanDerWaalsContact C-N 3.33Å; Y1092-S1094 PolarHBondContact O-N 2.92Å; S1094-A1097 PolarHBondContact O-N 3.28Å; S1094-E1098 PolarHBondContact O-N 3.01Å
1095V96.4Very high93.6Very high76 Ų7696.7 Ų96.746%0.46150%0.497SS..Hα-helixtrans-65.4-41.6176.31740000110.8K1091 Y1092 E1098 T1099K1091-V1095 WeakPolarHBondContact O-CG2 3.13Å; K1091-V1095 PolarHBondContact O-N 3.37Å; Y1092-V1095 PolarHBondContact O-N 3.28Å; V1095-E1098 PolarHBondContact O-N 3.42Å; V1095-T1099 HydrophobicContact CG1-CG2 4.43Å; V1095-T1099 WeakPolarHBondContact O-CG2 3.29Å; V1095-T1099 PolarHBondContact O-N 3.4Å; V1095-T1099 PolarHBondContact O-OG1 3.17Å
1096L91.9Very high93.8Very high114 Ų11497.4 Ų97.460%0.59750%0.5SS*.Hα-helixtrans-60-47.8175.5-75.8169.3000111.3Y1092 K1093 E1098 T1099 E1100Y1092-L1096 WeakPolarHBondContact O-CB 3.29Å; Y1092-L1096 VanDerWaalsContact O-CG 3.28Å; Y1092-L1096 WeakPolarHBondContact O-CG 3.37Å; Y1092-L1096 PolarHBondContact O-N 2.86Å; K1093-L1096 PolarHBondContact O-N 3.49Å; L1096-E1098 VanDerWaalsContact C-N 3.32Å; L1096-E1098 PolarHBondContact O-N 2.96Å; L1096-T1099 WeakPolarHBondContact CA-OG1 3.42Å; L1096-T1099 PolarHBondContact O-N 2.82Å; L1096-T1099 PolarHBondContact O-OG1 2.76Å; L1096-E1100 WeakPolarHBondContact O-CB 3.49Å; L1096-E1100 PolarHBondContact O-N 2.92Å
1097A93.4Very high94.1Very high59 Ų5998.2 Ų98.249%0.48850%0.504SS..Hα-helixtrans-61.7-36.6176.700000112.9K1093 S1094 G1101K1093-A1097 WeakPolarHBondContact O-CB 3.26Å; K1093-A1097 PolarHBondContact O-N 3.07Å; S1094-A1097 PolarHBondContact O-N 3.28Å; A1097-G1101 PolarHBondContact O-N 3.37Å
1098E92.6Very high94.2Very high130 Ų13098.4 Ų98.461%0.60750%0.496SS*.Hα-helixtrans-67.2-45.8173.5-174.3173.2-166.500111.7S1094 V1095 L1096 E1100 G1101 I1102S1094-E1098 PolarHBondContact O-N 3.01Å; V1095-E1098 PolarHBondContact O-N 3.42Å; L1096-E1098 VanDerWaalsContact C-N 3.32Å; L1096-E1098 PolarHBondContact O-N 2.96Å; E1098-E1100 PolarHBondContact O-N 3.47Å; E1098-G1101 PolarHBondContact O-N 2.89Å; E1098-I1102 HydrophobicContact CG-CD1 4.35Å; E1098-I1102 WeakPolarHBondContact O-CG1 3.2Å; E1098-I1102 PolarHBondContact O-N 2.72Å
1099T94.8Very high94.3Very high63 Ų6397.5 Ų97.539%0.38750%0.499SS..Hα-helixtrans-63.9-38.7176.156.60000112.4V1095 L1096 I1102 L1103V1095-T1099 HydrophobicContact CG1-CG2 4.43Å; V1095-T1099 WeakPolarHBondContact O-CG2 3.29Å; V1095-T1099 PolarHBondContact O-N 3.4Å; V1095-T1099 PolarHBondContact O-OG1 3.17Å; L1096-T1099 WeakPolarHBondContact CA-OG1 3.42Å; L1096-T1099 PolarHBondContact O-N 2.82Å; L1096-T1099 PolarHBondContact O-OG1 2.76Å; T1099-I1102 PolarHBondContact O-N 2.76Å; T1099-L1103 WeakPolarHBondContact O-CB 3.19Å; T1099-L1103 VanDerWaalsContact O-CG 3.31Å; T1099-L1103 WeakPolarHBondContact O-CG 3.45Å; T1099-L1103 PolarHBondContact O-N 3.02Å
1100E94.4Very high94.4Very high110 Ų11097.6 Ų97.651%0.51450%0.498SS..Hα-helixtrans-63.1-43.8172.6-166.2-168152.200110.6L1096 E1098 I1102 L1103 Q1104L1096-E1100 WeakPolarHBondContact O-CB 3.49Å; L1096-E1100 PolarHBondContact O-N 2.92Å; E1098-E1100 PolarHBondContact O-N 3.47Å; E1100-I1102 VanDerWaalsContact C-N 3.29Å; E1100-I1102 PolarHBondContact O-N 2.78Å; E1100-L1103 PolarHBondContact O-N 2.95Å; E1100-Q1104 HydrophobicContact CG-CG 4.46Å; E1100-Q1104 WeakPolarHBondContact O-CB 3.48Å; E1100-Q1104 WeakPolarHBondContact O-CG 3.24Å; E1100-Q1104 PolarHBondContact O-N 3.2Å; E1100-Q1104 PolarHBondContact OE1-NE2 2.88Å
1101G95.6Very high94.5Very high26 Ų2698.1 Ų98.127%0.26850%0.5SS..Hα-helixtrans-60.5-35.117500000113.6A1097 E1098 K1105A1097-G1101 PolarHBondContact O-N 3.37Å; E1098-G1101 PolarHBondContact O-N 2.89Å; G1101-K1105 VanDerWaalsContact O-CG 3.3Å; G1101-K1105 WeakPolarHBondContact O-CG 3.1Å; G1101-K1105 PolarHBondContact O-N 3.48Å
1102I95.4Very high94.5Very high96 Ų9696.9 Ų96.949%0.49250%0.497SS..Hα-helixtrans-70.7-46.8172.8-67.3166.8000110.6E1098 T1099 E1100 Q1104 K1105 L1106E1098-I1102 HydrophobicContact CG-CD1 4.35Å; E1098-I1102 WeakPolarHBondContact O-CG1 3.2Å; E1098-I1102 PolarHBondContact O-N 2.72Å; T1099-I1102 PolarHBondContact O-N 2.76Å; E1100-I1102 VanDerWaalsContact C-N 3.29Å; E1100-I1102 PolarHBondContact O-N 2.78Å; I1102-Q1104 PolarHBondContact O-N 2.92Å; I1102-K1105 WeakPolarHBondContact O-CB 3.45Å; I1102-K1105 PolarHBondContact O-N 3.37Å; I1102-K1105 VanDerWaalsContact O-N 3.1Å; I1102-L1106 PolarHBondContact O-N 3.3Å
1103L95.1Very high94.3Very high113 Ų11393.9 Ų93.959%0.59249%0.487SS*.Hα-helixtrans-60-44177.8-73170.4000111.8T1099 E1100 K1105 L1106 Q1107T1099-L1103 WeakPolarHBondContact O-CB 3.19Å; T1099-L1103 VanDerWaalsContact O-CG 3.31Å; T1099-L1103 WeakPolarHBondContact O-CG 3.45Å; T1099-L1103 PolarHBondContact O-N 3.02Å; E1100-L1103 PolarHBondContact O-N 2.95Å; L1103-K1105 VanDerWaalsContact C-N 3.3Å; L1103-K1105 PolarHBondContact O-N 2.85Å; L1103-L1106 PolarHBondContact O-N 2.87Å; L1103-Q1107 WeakPolarHBondContact O-CB 3.44Å; L1103-Q1107 PolarHBondContact O-N 3.24Å
1104Q95.2Very high94Very high69 Ų6994.4 Ų94.432%0.32249%0.492SS..Hα-helixtrans-64.1-32.4174.9-68.4-178.415.200112.6E1100 I1102 R1108E1100-Q1104 HydrophobicContact CG-CG 4.46Å; E1100-Q1104 WeakPolarHBondContact O-CB 3.48Å; E1100-Q1104 WeakPolarHBondContact O-CG 3.24Å; E1100-Q1104 PolarHBondContact O-N 3.2Å; E1100-Q1104 PolarHBondContact OE1-NE2 2.88Å; I1102-Q1104 PolarHBondContact O-N 2.92Å; Q1104-R1108 VanDerWaalsContact O-CG 3.29Å; Q1104-R1108 WeakPolarHBondContact O-CG 3.12Å; Q1104-R1108 PolarHBondContact O-N 2.66Å; Q1104-R1108 VanDerWaalsContact O-N 3.13Å; Q1104-R1108 PolarHBondContact O-NH1 3.49Å
1105K94.6Very high93.8Very high146 Ų14693.7 Ų93.764%0.63549%0.487SS*.Hα-helixtrans-69.6-42.9173.7-76.7169.5-176.9173.50111.1G1101 I1102 L1103 S1109G1101-K1105 VanDerWaalsContact O-CG 3.3Å; G1101-K1105 WeakPolarHBondContact O-CG 3.1Å; G1101-K1105 PolarHBondContact O-N 3.48Å; I1102-K1105 WeakPolarHBondContact O-CB 3.45Å; I1102-K1105 PolarHBondContact O-N 3.37Å; I1102-K1105 VanDerWaalsContact O-N 3.1Å; L1103-K1105 VanDerWaalsContact C-N 3.3Å; L1103-K1105 PolarHBondContact O-N 2.85Å; K1105-S1109 WeakPolarHBondContact O-CB 3.48Å; K1105-S1109 PolarHBondContact O-N 3.32Å
1106L95.1Very high93.8Very high108 Ų10894.9 Ų94.957%0.56549%0.486SS*.Hα-helixtrans-62.6-46.7176-175.363.3000111I1102 L1103 R1108 S1109 V1110I1102-L1106 PolarHBondContact O-N 3.3Å; L1103-L1106 PolarHBondContact O-N 2.87Å; L1106-R1108 PolarHBondContact O-N 2.83Å; L1106-S1109 WeakPolarHBondContact O-CB 3.4Å; L1106-S1109 PolarHBondContact O-N 2.87Å; L1106-S1109 VanDerWaalsContact O-N 3.13Å; L1106-V1110 WeakPolarHBondContact O-CG2 3.49Å; L1106-V1110 PolarHBondContact O-N 2.95Å
1107Q94.3Very high93.8Very high112 Ų11296.6 Ų96.652%0.52348%0.484SS..Hα-helixtrans-55.2-53.9175.6179.4179.5-1100111.5L1103 S1109 V1110 E1111L1103-Q1107 WeakPolarHBondContact O-CB 3.44Å; L1103-Q1107 PolarHBondContact O-N 3.24Å; Q1107-S1109 PolarHBondContact O-N 3.43Å; Q1107-V1110 PolarHBondContact O-N 2.92Å; Q1107-V1110 VanDerWaalsContact O-N 3.08Å; Q1107-E1111 HydrophobicContact CG-CG 4.32Å; Q1107-E1111 VanDerWaalsContact CG-OE1 3.29Å; Q1107-E1111 WeakPolarHBondContact CG-OE1 3.28Å; Q1107-E1111 PolarHBondContact NE2-OE1 2.95Å; Q1107-E1111 WeakPolarHBondContact O-CG 3.49Å; Q1107-E1111 PolarHBondContact O-N 2.84Å
1108R95.4Very high93.9Very high129 Ų129100.7 Ų100.749%0.48749%0.491SS..Hα-helixtrans-58.9-35.6177.2-69.7178.3-156.999.3-2.3112.6Q1104 L1106 Q1112Q1104-R1108 VanDerWaalsContact O-CG 3.29Å; Q1104-R1108 WeakPolarHBondContact O-CG 3.12Å; Q1104-R1108 PolarHBondContact O-N 2.66Å; Q1104-R1108 VanDerWaalsContact O-N 3.13Å; Q1104-R1108 PolarHBondContact O-NH1 3.49Å; L1106-R1108 PolarHBondContact O-N 2.83Å; R1108-Q1112 VanDerWaalsContact O-CB 3.26Å; R1108-Q1112 WeakPolarHBondContact O-CB 3.32Å; R1108-Q1112 PolarHBondContact O-N 2.6Å
1109S92.4Very high94Very high68 Ų6898.7 Ų98.748%0.47648%0.484SS..Hα-helixtrans-68-38.8176.6-168.80000112.2K1105 L1106 Q1107 E1113K1105-S1109 WeakPolarHBondContact O-CB 3.48Å; K1105-S1109 PolarHBondContact O-N 3.32Å; L1106-S1109 WeakPolarHBondContact O-CB 3.4Å; L1106-S1109 PolarHBondContact O-N 2.87Å; L1106-S1109 VanDerWaalsContact O-N 3.13Å; Q1107-S1109 PolarHBondContact O-N 3.43Å; S1109-E1113 WeakPolarHBondContact O-CB 3.5Å; S1109-E1113 PolarHBondContact O-N 2.88Å; S1109-E1113 VanDerWaalsContact O-N 3.11Å
1110V91.8Very high93.9Very high68 Ų68101.1 Ų101.141%0.41249%0.489SS..Hα-helixtrans-68.8-49.6175.5172.40000110.2L1106 Q1107 Q1112 E1113 E1114L1106-V1110 WeakPolarHBondContact O-CG2 3.49Å; L1106-V1110 PolarHBondContact O-N 2.95Å; Q1107-V1110 PolarHBondContact O-N 2.92Å; Q1107-V1110 VanDerWaalsContact O-N 3.08Å; V1110-Q1112 VanDerWaalsContact C-N 3.28Å; V1110-Q1112 PolarHBondContact O-N 3.49Å; V1110-E1113 PolarHBondContact O-N 2.69Å; V1110-E1114 HydrophobicContact CG1-CG 4.25Å; V1110-E1114 WeakPolarHBondContact O-CG 3.27Å; V1110-E1114 PolarHBondContact O-N 2.85Å
1111E95.5Very high93.4Very high95 Ų9598.5 Ų98.544%0.44449%0.486SS..Hα-helixtrans-56.2-40.8176.5-70.7168.9173.900112.2Q1107 S1115Q1107-E1111 HydrophobicContact CG-CG 4.32Å; Q1107-E1111 VanDerWaalsContact CG-OE1 3.29Å; Q1107-E1111 WeakPolarHBondContact CG-OE1 3.28Å; Q1107-E1111 PolarHBondContact NE2-OE1 2.95Å; Q1107-E1111 WeakPolarHBondContact O-CG 3.49Å; Q1107-E1111 PolarHBondContact O-N 2.84Å; E1111-S1115 WeakPolarHBondContact O-CB 3.39Å; E1111-S1115 PolarHBondContact O-N 3.29Å
1112Q94.7Very high93.2Very high123 Ų123100.7 Ų100.758%0.57549%0.492SS*.Hα-helixtrans-67.4-38.7176-169.3-178.11800112.1R1108 V1110 S1115 K1116R1108-Q1112 VanDerWaalsContact O-CB 3.26Å; R1108-Q1112 WeakPolarHBondContact O-CB 3.32Å; R1108-Q1112 PolarHBondContact O-N 2.6Å; V1110-Q1112 VanDerWaalsContact C-N 3.28Å; V1110-Q1112 PolarHBondContact O-N 3.49Å; Q1112-S1115 WeakPolarHBondContact O-CB 3.37Å; Q1112-S1115 PolarHBondContact O-N 3.36Å; Q1112-K1116 WeakPolarHBondContact O-CG 3.35Å; Q1112-K1116 PolarHBondContact O-N 3.46Å; Q1112-K1116 VanDerWaalsContact O-N 3.14Å
1113E89.8Confident93.1Very high73 Ų73100.9 Ų100.934%0.34149%0.49SS..Hα-helixtrans-71.9-43.7179-161.356.8-148.200111.1S1109 V1110 S1115 K1116 W1117S1109-E1113 WeakPolarHBondContact O-CB 3.5Å; S1109-E1113 PolarHBondContact O-N 2.88Å; S1109-E1113 VanDerWaalsContact O-N 3.11Å; V1110-E1113 PolarHBondContact O-N 2.69Å; E1113-S1115 VanDerWaalsContact C-N 3.27Å; E1113-S1115 PolarHBondContact O-N 2.8Å; E1113-K1116 WeakPolarHBondContact O-CB 3.37Å; E1113-K1116 PolarHBondContact O-N 3.43Å; E1113-K1116 VanDerWaalsContact O-N 3.11Å; E1113-K1116 WeakPolarHBondContact OE2-CD 3.48Å; E1113-K1116 WeakPolarHBondContact OE2-CE 3.26Å; E1113-K1116 IonicContact OE2-NZ 3.15Å; E1113-K1116 PolarHBondContact OE2-NZ 2.95Å; E1113-W1117 PolarHBondContact O-N 3.14Å; E1113-W1117 PolarHBondContact OE1-NE1 2.84Å
1114E89.9Confident92.7Very high125 Ų12598.5 Ų98.558%0.58448%0.483SS*.Hα-helixtrans-54.5-42.5169.8-73.1-177.9172.200111.8V1110 K1116 W1117 K1118V1110-E1114 HydrophobicContact CG1-CG 4.25Å; V1110-E1114 WeakPolarHBondContact O-CG 3.27Å; V1110-E1114 PolarHBondContact O-N 2.85Å; E1114-K1116 PolarHBondContact O-N 2.8Å; E1114-W1117 PolarHBondContact O-N 2.78Å; E1114-K1118 VanDerWaalsContact O-CB 3.26Å; E1114-K1118 WeakPolarHBondContact O-CB 3.41Å; E1114-K1118 PolarHBondContact O-N 2.67Å
1115S92.5Very high92.4Very high64 Ų64100.4 Ų100.445%0.44849%0.492SS..Hα-helixtrans-60.4-44.2175.3-171.30000112.4E1111 Q1112 E1113 K1118 I1119E1111-S1115 WeakPolarHBondContact O-CB 3.39Å; E1111-S1115 PolarHBondContact O-N 3.29Å; Q1112-S1115 WeakPolarHBondContact O-CB 3.37Å; Q1112-S1115 PolarHBondContact O-N 3.36Å; E1113-S1115 VanDerWaalsContact C-N 3.27Å; E1113-S1115 PolarHBondContact O-N 2.8Å; S1115-K1118 PolarHBondContact O-N 2.73Å; S1115-I1119 WeakPolarHBondContact O-CG1 3.35Å; S1115-I1119 PolarHBondContact O-N 3.49Å
1116K95.5Very high92.5Very high102 Ų102100.1 Ų100.144%0.44349%0.487SS..Hα-helixtrans-62.3-47.3174.9-65.8172.6-155.81610111.8Q1112 E1113 E1114 K1118 I1119 K1120Q1112-K1116 WeakPolarHBondContact O-CG 3.35Å; Q1112-K1116 PolarHBondContact O-N 3.46Å; Q1112-K1116 VanDerWaalsContact O-N 3.14Å; E1113-K1116 WeakPolarHBondContact O-CB 3.37Å; E1113-K1116 PolarHBondContact O-N 3.43Å; E1113-K1116 VanDerWaalsContact O-N 3.11Å; E1113-K1116 WeakPolarHBondContact OE2-CD 3.48Å; E1113-K1116 WeakPolarHBondContact OE2-CE 3.26Å; E1113-K1116 IonicContact OE2-NZ 3.15Å; E1113-K1116 PolarHBondContact OE2-NZ 2.95Å; E1114-K1116 PolarHBondContact O-N 2.8Å; K1116-K1118 VanDerWaalsContact C-N 3.3Å; K1116-K1118 PolarHBondContact O-N 3.33Å; K1116-I1119 PolarHBondContact O-N 3.41Å; K1116-K1120 WeakPolarHBondContact O-CB 3.28Å; K1116-K1120 PolarHBondContact O-N 3.45Å
1117W91.4Very high92.4Very high149 Ų149101.2 Ų101.256%0.56449%0.491SS*.Hα-helixtrans-64.9-35.4179.8-72.7109.1000112.2E1113 E1114 K1120 A1121E1113-W1117 PolarHBondContact O-N 3.14Å; E1113-W1117 PolarHBondContact OE1-NE1 2.84Å; E1114-W1117 PolarHBondContact O-N 2.78Å; W1117-K1120 HydrophobicContact CE3-CD 4.29Å; W1117-K1120 HydrophobicContact CZ3-CD 4.04Å; W1117-K1120 PolarHBondContact O-N 2.97Å; W1117-A1121 WeakPolarHBondContact O-CB 3.18Å; W1117-A1121 PolarHBondContact O-N 2.76Å
1118K95.2Very high92.2Very high145 Ų145100 Ų10063%0.6349%0.487SS*.Hα-helixtrans-63-48.5172.7-172.2173.2-177175.50112E1114 S1115 K1116 K1120 A1121 D1122E1114-K1118 VanDerWaalsContact O-CB 3.26Å; E1114-K1118 WeakPolarHBondContact O-CB 3.41Å; E1114-K1118 PolarHBondContact O-N 2.67Å; S1115-K1118 PolarHBondContact O-N 2.73Å; K1116-K1118 VanDerWaalsContact C-N 3.3Å; K1116-K1118 PolarHBondContact O-N 3.33Å; K1118-K1120 VanDerWaalsContact C-N 3.33Å; K1118-K1120 PolarHBondContact O-N 3.42Å; K1118-A1121 PolarHBondContact O-N 3.08Å; K1118-D1122 PolarHBondContact O-N 3.47Å
1119I95Very high92.2Very high88 Ų8899.1 Ų99.145%0.45149%0.486SS..Hα-helixtrans-58.4-45.9175.7-67.9164.4000110.7S1115 K1116 A1121 D1122 E1123S1115-I1119 WeakPolarHBondContact O-CG1 3.35Å; S1115-I1119 PolarHBondContact O-N 3.49Å; K1116-I1119 PolarHBondContact O-N 3.41Å; I1119-A1121 VanDerWaalsContact C-N 3.33Å; I1119-A1121 PolarHBondContact O-N 2.9Å; I1119-D1122 PolarHBondContact O-N 3.45Å; I1119-E1123 HydrophobicContact CG2-CG 4.49Å; I1119-E1123 WeakPolarHBondContact O-CG 3.46Å; I1119-E1123 PolarHBondContact O-N 3.25Å
1120K92.9Very high92.3Very high115 Ų115100 Ų10050%0.548%0.483SS..Hα-helixtrans-66.2-33.8179.9-167.4171.4-177.31780112.7K1116 W1117 K1118 S1124K1116-K1120 WeakPolarHBondContact O-CB 3.28Å; K1116-K1120 PolarHBondContact O-N 3.45Å; W1117-K1120 HydrophobicContact CE3-CD 4.29Å; W1117-K1120 HydrophobicContact CZ3-CD 4.04Å; W1117-K1120 PolarHBondContact O-N 2.97Å; K1118-K1120 VanDerWaalsContact C-N 3.33Å; K1118-K1120 PolarHBondContact O-N 3.42Å; K1120-S1124 WeakPolarHBondContact O-CB 3.49Å; K1120-S1124 PolarHBondContact O-N 3.27Å; K1120-S1124 PolarHBondContact O-OG 2.83Å
1121A83.8Confident92.3Very high54 Ų54101.6 Ų101.645%0.44649%0.489SS..Hα-helixtrans-67.4-45.617200000111.6W1117 K1118 I1119 E1123 S1124 Q1125W1117-A1121 WeakPolarHBondContact O-CB 3.18Å; W1117-A1121 PolarHBondContact O-N 2.76Å; K1118-A1121 PolarHBondContact O-N 3.08Å; I1119-A1121 VanDerWaalsContact C-N 3.33Å; I1119-A1121 PolarHBondContact O-N 2.9Å; A1121-E1123 VanDerWaalsContact C-N 3.32Å; A1121-E1123 PolarHBondContact O-N 3.4Å; A1121-S1124 PolarHBondContact O-N 2.9Å; A1121-Q1125 WeakPolarHBondContact O-CB 3.28Å; A1121-Q1125 PolarHBondContact O-N 2.7Å
1122D92.3Very high92.2Very high73 Ų73104 Ų10439%0.3949%0.494SS..Hα-helixtrans-63-36.1176.5-72.6-28.2000112.3K1118 I1119 R1126K1118-D1122 PolarHBondContact O-N 3.47Å; I1119-D1122 PolarHBondContact O-N 3.45Å; D1122-R1126 WeakPolarHBondContact O-CB 3.32Å; D1122-R1126 WeakPolarHBondContact O-CG 3.45Å; D1122-R1126 PolarHBondContact O-N 2.9Å; D1122-R1126 PolarHBondContact O-NE 2.95Å; D1122-R1126 VanDerWaalsContact O-NE 3.1Å
1123E93.6Very high92.2Very high100 Ų100104.7 Ų104.747%0.46749%0.491SS..Hα-helixtrans-65.7-49.4173.2-76176.9170.400111.7I1119 A1121 Q1125 R1126 M1127I1119-E1123 HydrophobicContact CG2-CG 4.49Å; I1119-E1123 WeakPolarHBondContact O-CG 3.46Å; I1119-E1123 PolarHBondContact O-N 3.25Å; A1121-E1123 VanDerWaalsContact C-N 3.32Å; A1121-E1123 PolarHBondContact O-N 3.4Å; E1123-Q1125 VanDerWaalsContact C-N 3.29Å; E1123-Q1125 PolarHBondContact O-N 2.93Å; E1123-R1126 WeakPolarHBondContact O-CB 3.32Å; E1123-R1126 PolarHBondContact O-N 3.28Å; E1123-R1126 VanDerWaalsContact O-N 3.14Å; E1123-M1127 PolarHBondContact O-N 3.47Å
1124S85.9Confident92.3Very high63 Ų63105.3 Ų105.344%0.44149%0.494SS..Hα-helixtrans-59.1-41.7176.2-57.10000111.3K1120 A1121 M1127 I1128K1120-S1124 WeakPolarHBondContact O-CB 3.49Å; K1120-S1124 PolarHBondContact O-N 3.27Å; K1120-S1124 PolarHBondContact O-OG 2.83Å; A1121-S1124 PolarHBondContact O-N 2.9Å; S1124-M1127 PolarHBondContact O-N 3.32Å; S1124-I1128 VanDerWaalsContact O-CG1 3.32Å; S1124-I1128 WeakPolarHBondContact O-CG1 3.41Å; S1124-I1128 PolarHBondContact O-N 3.03Å
1125Q89.9Confident92.3Very high108 Ų108105.7 Ų105.751%0.50549%0.49SS..Hα-helixtrans-70.7-31.6177.3-167.1169.47.700112.8A1121 E1123 K1129A1121-Q1125 WeakPolarHBondContact O-CB 3.28Å; A1121-Q1125 PolarHBondContact O-N 2.7Å; E1123-Q1125 VanDerWaalsContact C-N 3.29Å; E1123-Q1125 PolarHBondContact O-N 2.93Å; Q1125-K1129 WeakPolarHBondContact O-CB 3.49Å; Q1125-K1129 VanDerWaalsContact O-CG 3.32Å; Q1125-K1129 WeakPolarHBondContact O-CG 3.48Å; Q1125-K1129 PolarHBondContact O-N 3.4Å
1126R95.2Very high92.3Very high140 Ų140107.6 Ų107.653%0.52849%0.492SS..Hα-helixtrans-65.8-42.9169.8-85175.9-84.7127.4-7.5111.7D1122 E1123 K1129 Q1130D1122-R1126 WeakPolarHBondContact O-CB 3.32Å; D1122-R1126 WeakPolarHBondContact O-CG 3.45Å; D1122-R1126 PolarHBondContact O-N 2.9Å; D1122-R1126 PolarHBondContact O-NE 2.95Å; D1122-R1126 VanDerWaalsContact O-NE 3.1Å; E1123-R1126 WeakPolarHBondContact O-CB 3.32Å; E1123-R1126 PolarHBondContact O-N 3.28Å; E1123-R1126 VanDerWaalsContact O-N 3.14Å; R1126-K1129 PolarHBondContact O-N 3.43Å; R1126-Q1130 PolarHBondContact O-N 2.88Å
1127M93.7Very high92.2Very high132 Ų132107.4 Ų107.465%0.6549%0.492SS*.Hα-helixtrans-65.6-42.4176.2-176.3159.7-87.300112.1E1123 S1124 K1129 Q1130 L1131E1123-M1127 PolarHBondContact O-N 3.47Å; S1124-M1127 PolarHBondContact O-N 3.32Å; M1127-K1129 VanDerWaalsContact C-N 3.32Å; M1127-K1129 PolarHBondContact O-N 3.36Å; M1127-Q1130 WeakPolarHBondContact O-CB 3.42Å; M1127-Q1130 PolarHBondContact O-N 2.76Å; M1127-Q1130 VanDerWaalsContact O-N 3.07Å; M1127-L1131 HydrophobicContact CG-CD1 4.2Å; M1127-L1131 WeakPolarHBondContact O-CG 3.3Å; M1127-L1131 PolarHBondContact O-N 3.31Å
1128I90.9Very high92.2Very high86 Ų86105.5 Ų105.544%0.44149%0.493SS..Hα-helixtrans-59.7-41.9172.5-69.7164.9000111.4S1124 Q1130 R1132S1124-I1128 VanDerWaalsContact O-CG1 3.32Å; S1124-I1128 WeakPolarHBondContact O-CG1 3.41Å; S1124-I1128 PolarHBondContact O-N 3.03Å; I1128-Q1130 VanDerWaalsContact C-N 3.28Å; I1128-Q1130 PolarHBondContact O-N 2.74Å; I1128-R1132 WeakPolarHBondContact O-CG 3.36Å; I1128-R1132 PolarHBondContact O-N 2.98Å
1129K94.4Very high92Very high110 Ų110103 Ų10348%0.47848%0.483SS..Hα-helixtrans-64-32.7174.9-77.2174.2179.4178.10112.5Q1125 R1126 M1127 R1133Q1125-K1129 WeakPolarHBondContact O-CB 3.49Å; Q1125-K1129 VanDerWaalsContact O-CG 3.32Å; Q1125-K1129 WeakPolarHBondContact O-CG 3.48Å; Q1125-K1129 PolarHBondContact O-N 3.4Å; R1126-K1129 PolarHBondContact O-N 3.43Å; M1127-K1129 VanDerWaalsContact C-N 3.32Å; M1127-K1129 PolarHBondContact O-N 3.36Å; K1129-R1133 PolarHBondContact O-N 2.88Å; K1129-R1133 PolarHBondContact O-NH1 2.88Å
1130Q94.3Very high91.9Very high87 Ų87104.4 Ų104.441%0.40749%0.489SS..Hα-helixtrans-71.2-50.5176.4-17758.119.700111.5R1126 M1127 I1128 R1132 R1133 E1134R1126-Q1130 PolarHBondContact O-N 2.88Å; M1127-Q1130 WeakPolarHBondContact O-CB 3.42Å; M1127-Q1130 PolarHBondContact O-N 2.76Å; M1127-Q1130 VanDerWaalsContact O-N 3.07Å; I1128-Q1130 VanDerWaalsContact C-N 3.28Å; I1128-Q1130 PolarHBondContact O-N 2.74Å; Q1130-R1132 PolarHBondContact O-N 3.45Å; Q1130-R1133 PolarHBondContact O-N 3.49Å; Q1130-E1134 WeakPolarHBondContact CG-OE1 3.14Å; Q1130-E1134 PolarHBondContact NE2-OE1 3.11Å; Q1130-E1134 PolarHBondContact O-N 3.22Å
1131L92.6Very high91.9Very high101 Ų101103.9 Ų103.953%0.52949%0.489SS..Hα-helixtrans-59-33177.2-68.8170.2000112.7M1127 E1134 R1135M1127-L1131 HydrophobicContact CG-CD1 4.2Å; M1127-L1131 WeakPolarHBondContact O-CG 3.3Å; M1127-L1131 PolarHBondContact O-N 3.31Å; L1131-E1134 PolarHBondContact O-N 3.19Å; L1131-R1135 WeakPolarHBondContact O-CB 3.34Å; L1131-R1135 PolarHBondContact O-N 3.36Å
1132R92.1Very high92.1Very high147 Ų147106.3 Ų106.356%0.55549%0.494SS*.Hα-helixtrans-62.8-44.6172-75.6-178-161.7-163.43.4112.7I1128 Q1130 E1134 R1135 E1136I1128-R1132 WeakPolarHBondContact O-CG 3.36Å; I1128-R1132 PolarHBondContact O-N 2.98Å; Q1130-R1132 PolarHBondContact O-N 3.45Å; R1132-E1134 VanDerWaalsContact C-N 3.33Å; R1132-E1134 PolarHBondContact O-N 2.92Å; R1132-R1135 PolarHBondContact O-N 2.92Å; R1132-E1136 WeakPolarHBondContact O-CB 3.34Å; R1132-E1136 VanDerWaalsContact O-CG 3.25Å; R1132-E1136 WeakPolarHBondContact O-CG 3.32Å; R1132-E1136 PolarHBondContact O-N 3.41Å
1133R95.5Very high92.1Very high136 Ų136108.9 Ų108.951%0.51350%0.503SS..Hα-helixtrans-66.1-37.4177.7-65.5-177.8-161.4103.60112.1K1129 Q1130 E1136 H1137K1129-R1133 PolarHBondContact O-N 2.88Å; K1129-R1133 PolarHBondContact O-NH1 2.88Å; Q1130-R1133 PolarHBondContact O-N 3.49Å; R1133-E1136 PolarHBondContact O-N 2.85Å; R1133-H1137 WeakPolarHBondContact O-CB 3.39Å; R1133-H1137 PolarHBondContact O-N 2.8Å
1134E92.9Very high92.1Very high87 Ų87110.1 Ų110.141%0.40751%0.507SS..Hα-helixtrans-66.1-40.6175.2-72.4165.3-168.300110.9Q1130 L1131 R1132 H1137 L1138Q1130-E1134 WeakPolarHBondContact CG-OE1 3.14Å; Q1130-E1134 PolarHBondContact NE2-OE1 3.11Å; Q1130-E1134 PolarHBondContact O-N 3.22Å; L1131-E1134 PolarHBondContact O-N 3.19Å; R1132-E1134 VanDerWaalsContact C-N 3.33Å; R1132-E1134 PolarHBondContact O-N 2.92Å; E1134-H1137 PolarHBondContact O-N 3.13Å; E1134-L1138 VanDerWaalsContact O-CG 3.31Å; E1134-L1138 WeakPolarHBondContact O-CG 3.25Å; E1134-L1138 PolarHBondContact O-N 3.44Å
1135R89.5Confident92.3Very high133 Ų133109.4 Ų109.450%0.50251%0.505SS..Hα-helixtrans-63-48.4171.8-164.7-156.571.7-164.90.2112.1L1131 R1132 H1137 L1138 E1139L1131-R1135 WeakPolarHBondContact O-CB 3.34Å; L1131-R1135 PolarHBondContact O-N 3.36Å; R1132-R1135 PolarHBondContact O-N 2.92Å; R1135-H1137 VanDerWaalsContact C-N 3.27Å; R1135-H1137 PolarHBondContact O-N 3.22Å; R1135-L1138 PolarHBondContact O-N 2.73Å; R1135-E1139 VanDerWaalsContact CD-OE1 3.28Å; R1135-E1139 WeakPolarHBondContact CD-OE1 3.28Å; R1135-E1139 HydrophobicContact CG-CG 4.36Å; R1135-E1139 IonicContact CZ-OE1 2.69Å; R1135-E1139 IonicContact CZ-OE2 3.19Å; R1135-E1139 VanDerWaalsContact NE-CD 3.25Å; R1135-E1139 IonicContact NE-OE1 2.62Å; R1135-E1139 PolarHBondContact NE-OE1 2.63Å; R1135-E1139 IonicContact NE-OE2 3.89Å; R1135-E1139 PolarHBondContact NE-OE2 3.28Å; R1135-E1139 IonicContact NH2-OE1 2.78Å; R1135-E1139 IonicContact NH2-OE2 3.17Å; R1135-E1139 PolarHBondContact NH2-OE2 3.14Å; R1135-E1139 WeakPolarHBondContact O-CB 3.18Å; R1135-E1139 VanDerWaalsContact O-CG 3.27Å; R1135-E1139 WeakPolarHBondContact O-CG 3.26Å; R1135-E1139 PolarHBondContact O-N 3.26Å
1136E92.3Very high92.2Very high103 Ų103109.6 Ų109.648%0.48151%0.506SS..Hα-helixtrans-58.6-38.1177.1-73.1158.4-16700111.7R1132 R1133 M1140R1132-E1136 WeakPolarHBondContact O-CB 3.34Å; R1132-E1136 VanDerWaalsContact O-CG 3.25Å; R1132-E1136 WeakPolarHBondContact O-CG 3.32Å; R1132-E1136 PolarHBondContact O-N 3.41Å; R1133-E1136 PolarHBondContact O-N 2.85Å; E1136-M1140 PolarHBondContact O-N 3.22Å; E1136-M1140 VanDerWaalsContact O-N 3.14Å
1137H92.4Very high92.1Very high98 Ų98108.9 Ų108.945%0.45451%0.51SS..Hα-helixtrans-66.5-45.6174.6-177.97.1000112.2R1133 E1134 R1135 M1140 E1141R1133-H1137 WeakPolarHBondContact O-CB 3.39Å; R1133-H1137 PolarHBondContact O-N 2.8Å; E1134-H1137 PolarHBondContact O-N 3.13Å; R1135-H1137 VanDerWaalsContact C-N 3.27Å; R1135-H1137 PolarHBondContact O-N 3.22Å; H1137-M1140 PolarHBondContact O-N 3.38Å; H1137-E1141 IonicContact CE1-OE1 2.74Å; H1137-E1141 PolarHBondContact CE1-OE1 3.28Å; H1137-E1141 PolarHBondContact O-N 3.1Å
1138L92.3Very high92Very high110 Ų110106.7 Ų106.758%0.57650%0.499SS*.Hα-helixtrans-68.2-35178-70.6169.9000112.4E1134 R1135 M1140 E1141 L1142E1134-L1138 VanDerWaalsContact O-CG 3.31Å; E1134-L1138 WeakPolarHBondContact O-CG 3.25Å; E1134-L1138 PolarHBondContact O-N 3.44Å; R1135-L1138 PolarHBondContact O-N 2.73Å; L1138-M1140 VanDerWaalsContact C-N 3.35Å; L1138-E1141 PolarHBondContact O-N 3.42Å; L1138-L1142 WeakPolarHBondContact O-CB 3.14Å; L1138-L1142 PolarHBondContact O-N 3.27Å
1139E89.7Confident92Very high92 Ų92110.5 Ų110.543%0.4351%0.507SS..Hα-helixtrans-60.4-44.4172.6-76.7166.7164.600110.4R1135 L1142 E1143R1135-E1139 VanDerWaalsContact CD-OE1 3.28Å; R1135-E1139 WeakPolarHBondContact CD-OE1 3.28Å; R1135-E1139 HydrophobicContact CG-CG 4.36Å; R1135-E1139 IonicContact CZ-OE1 2.69Å; R1135-E1139 IonicContact CZ-OE2 3.19Å; R1135-E1139 VanDerWaalsContact NE-CD 3.25Å; R1135-E1139 IonicContact NE-OE1 2.62Å; R1135-E1139 PolarHBondContact NE-OE1 2.63Å; R1135-E1139 IonicContact NE-OE2 3.89Å; R1135-E1139 PolarHBondContact NE-OE2 3.28Å; R1135-E1139 IonicContact NH2-OE1 2.78Å; R1135-E1139 IonicContact NH2-OE2 3.17Å; R1135-E1139 PolarHBondContact NH2-OE2 3.14Å; R1135-E1139 WeakPolarHBondContact O-CB 3.18Å; R1135-E1139 VanDerWaalsContact O-CG 3.27Å; R1135-E1139 WeakPolarHBondContact O-CG 3.26Å; R1135-E1139 PolarHBondContact O-N 3.26Å; E1139-L1142 PolarHBondContact O-N 3.27Å; E1139-E1143 PolarHBondContact O-N 2.79Å
1140M93.8Very high91.8Very high117 Ų117108.8 Ų108.858%0.57651%0.51SS*.Hα-helixtrans-67.6-37175.5-176.7-177.763.200113.2E1136 H1137 L1138 K1144E1136-M1140 PolarHBondContact O-N 3.22Å; E1136-M1140 VanDerWaalsContact O-N 3.14Å; H1137-M1140 PolarHBondContact O-N 3.38Å; L1138-M1140 VanDerWaalsContact C-N 3.35Å; M1140-K1144 WeakPolarHBondContact O-CB 3.44Å; M1140-K1144 PolarHBondContact O-N 2.74Å; M1140-K1144 VanDerWaalsContact O-N 3.08Å
1141E92.2Very high91.8Very high104 Ų104107.6 Ų107.649%0.48651%0.508SS..Hα-helixtrans-68.1-36.9174.1-72.4-165.5146.200112.2H1137 L1138 K1144 A1145H1137-E1141 IonicContact CE1-OE1 2.74Å; H1137-E1141 PolarHBondContact CE1-OE1 3.28Å; H1137-E1141 PolarHBondContact O-N 3.1Å; L1138-E1141 PolarHBondContact O-N 3.42Å; E1141-K1144 PolarHBondContact O-N 2.84Å; E1141-A1145 WeakPolarHBondContact O-CB 3.32Å; E1141-A1145 PolarHBondContact O-N 3.4Å
1142L89.2Confident91.7Very high105 Ų105109.8 Ų109.855%0.5551%0.51SS..Hα-helixtrans-64.7-48.3174.1-176.464.6000111.3L1138 E1139 K1144 A1145 E1146L1138-L1142 WeakPolarHBondContact O-CB 3.14Å; L1138-L1142 PolarHBondContact O-N 3.27Å; E1139-L1142 PolarHBondContact O-N 3.27Å; L1142-K1144 VanDerWaalsContact C-N 3.28Å; L1142-K1144 PolarHBondContact O-N 3.25Å; L1142-A1145 PolarHBondContact O-N 3.29Å; L1142-A1145 VanDerWaalsContact O-N 3.09Å; L1142-E1146 WeakPolarHBondContact O-CG 3.44Å; L1142-E1146 PolarHBondContact O-N 2.89Å
1143E91.3Very high91.8Very high128 Ų128106 Ų10660%0.59850%0.503SS*.Hα-helixtrans-58.4-40.6177.1-175.8175.6-153.100111.6E1139 E1146 M1147E1139-E1143 PolarHBondContact O-N 2.79Å; E1143-E1146 PolarHBondContact O-N 2.85Å; E1143-M1147 WeakPolarHBondContact O-CB 3.36Å; E1143-M1147 PolarHBondContact O-N 2.9Å
1144K93.8Very high91.5Very high125 Ų125105.2 Ų105.254%0.54351%0.507SS..Hα-helixtrans-62-46.1173-177.1176.8178.7-76.80112.1M1140 E1141 L1142 E1146 M1147 E1148M1140-K1144 WeakPolarHBondContact O-CB 3.44Å; M1140-K1144 PolarHBondContact O-N 2.74Å; M1140-K1144 VanDerWaalsContact O-N 3.08Å; E1141-K1144 PolarHBondContact O-N 2.84Å; L1142-K1144 VanDerWaalsContact C-N 3.28Å; L1142-K1144 PolarHBondContact O-N 3.25Å; K1144-E1146 VanDerWaalsContact C-N 3.33Å; K1144-E1146 PolarHBondContact O-N 3.48Å; K1144-M1147 PolarHBondContact O-N 2.94Å; K1144-E1148 WeakPolarHBondContact CE-OE1 3.42Å; K1144-E1148 IonicContact NZ-OE1 2.74Å; K1144-E1148 PolarHBondContact NZ-OE1 3.01Å; K1144-E1148 WeakPolarHBondContact O-CG 3.47Å; K1144-E1148 PolarHBondContact O-N 3.25Å
1145A90.6Very high91.5Very high49 Ų49105.9 Ų105.941%0.40551%0.51SS..Hα-helixtrans-65.7-34.617800000112.5E1141 L1142 R1149E1141-A1145 WeakPolarHBondContact O-CB 3.32Å; E1141-A1145 PolarHBondContact O-N 3.4Å; L1142-A1145 PolarHBondContact O-N 3.29Å; L1142-A1145 VanDerWaalsContact O-N 3.09Å; A1145-R1149 VanDerWaalsContact O-CB 3.24Å; A1145-R1149 WeakPolarHBondContact O-CB 3.47Å; A1145-R1149 PolarHBondContact O-N 2.67Å
1146E88.6Confident91.6Very high111 Ų111104.1 Ų104.152%0.51951%0.514SS..Hα-helixtrans-68.5-38.1173-71.7-164.5148.800112.3L1142 E1143 K1144 R1149 S1150L1142-E1146 WeakPolarHBondContact O-CG 3.44Å; L1142-E1146 PolarHBondContact O-N 2.89Å; E1143-E1146 PolarHBondContact O-N 2.85Å; K1144-E1146 VanDerWaalsContact C-N 3.33Å; K1144-E1146 PolarHBondContact O-N 3.48Å; E1146-R1149 PolarHBondContact O-N 3.39Å; E1146-S1150 WeakPolarHBondContact O-CB 3.43Å; E1146-S1150 PolarHBondContact O-N 3.23Å
1147M92Very high91.5Very high126 Ų126107 Ų10762%0.62152%0.52SS*.Hα-helixtrans-64.9-44.3174-169-178.7-62.400112E1143 K1144 S1150 T1151E1143-M1147 WeakPolarHBondContact O-CB 3.36Å; E1143-M1147 PolarHBondContact O-N 2.9Å; K1144-M1147 PolarHBondContact O-N 2.94Å; M1147-S1150 WeakPolarHBondContact O-CB 3.08Å; M1147-S1150 PolarHBondContact O-N 2.7Å; M1147-T1151 PolarHBondContact O-N 3.5Å; M1147-T1151 PolarHBondContact O-OG1 3.42Å
1148E92.3Very high91.5Very high86 Ų86107 Ų10740%0.40252%0.521SS..Hα-helixtrans-61.2-47173.6-73.1173.7-168.900110.8K1144 S1150 T1151 Y1152K1144-E1148 WeakPolarHBondContact CE-OE1 3.42Å; K1144-E1148 IonicContact NZ-OE1 2.74Å; K1144-E1148 PolarHBondContact NZ-OE1 3.01Å; K1144-E1148 WeakPolarHBondContact O-CG 3.47Å; K1144-E1148 PolarHBondContact O-N 3.25Å; E1148-S1150 VanDerWaalsContact C-N 3.34Å; E1148-S1150 PolarHBondContact O-N 3.22Å; E1148-T1151 WeakPolarHBondContact O-CB 3.28Å; E1148-T1151 PolarHBondContact O-N 3.3Å; E1148-Y1152 HydrophobicContact CB-CE2 4.44Å; E1148-Y1152 WeakPolarHBondContact O-CD2 3.48Å; E1148-Y1152 PolarHBondContact O-N 3.41Å
1149R90.9Very high91.6Very high165 Ų165106.9 Ų106.962%0.62352%0.52SS*.Hα-helixtrans-58.9-41.2174.5179.8-177.2173.8-147.32.2112.6A1145 E1146 T1151 Y1152 V1153A1145-R1149 VanDerWaalsContact O-CB 3.24Å; A1145-R1149 WeakPolarHBondContact O-CB 3.47Å; A1145-R1149 PolarHBondContact O-N 2.67Å; E1146-R1149 PolarHBondContact O-N 3.39Å; R1149-T1151 VanDerWaalsContact C-N 3.33Å; R1149-Y1152 PolarHBondContact O-N 3.03Å; R1149-V1153 WeakPolarHBondContact O-CB 3.49Å; R1149-V1153 VanDerWaalsContact O-CG2 3.29Å; R1149-V1153 WeakPolarHBondContact O-CG2 3.26Å; R1149-V1153 PolarHBondContact O-N 2.93Å
1150S90.2Very high91.7Very high75 Ų75109 Ų10952%0.52453%0.528SS..Hα-helixtrans-62-42.7176.9-169.40000111.3E1146 M1147 E1148 V1153 M1154E1146-S1150 WeakPolarHBondContact O-CB 3.43Å; E1146-S1150 PolarHBondContact O-N 3.23Å; M1147-S1150 WeakPolarHBondContact O-CB 3.08Å; M1147-S1150 PolarHBondContact O-N 2.7Å; E1148-S1150 VanDerWaalsContact C-N 3.34Å; E1148-S1150 PolarHBondContact O-N 3.22Å; S1150-V1153 PolarHBondContact O-N 2.71Å; S1150-M1154 PolarHBondContact O-N 2.82Å
1151T93.2Very high91.5Very high61 Ų61106.7 Ų106.737%0.37452%0.521SS..Hα-helixtrans-59.4-51174.3-52.60000111.3M1147 E1148 R1149 V1153 M1154 E1155M1147-T1151 PolarHBondContact O-N 3.5Å; M1147-T1151 PolarHBondContact O-OG1 3.42Å; E1148-T1151 WeakPolarHBondContact O-CB 3.28Å; E1148-T1151 PolarHBondContact O-N 3.3Å; R1149-T1151 VanDerWaalsContact C-N 3.33Å; T1151-V1153 VanDerWaalsContact C-N 3.33Å; T1151-V1153 PolarHBondContact O-N 3.22Å; T1151-M1154 WeakPolarHBondContact O-CA 3.29Å; T1151-M1154 WeakPolarHBondContact O-CB 3.35Å; T1151-M1154 PolarHBondContact O-N 2.91Å; T1151-E1155 PolarHBondContact O-N 2.93Å
1152Y91.3Very high91.6Very high147 Ų147106.2 Ų106.258%0.57652%0.518SS*.Hα-helixtrans-60.7-38.5177-70-55000113.2E1148 R1149 M1154 E1155 V1156E1148-Y1152 HydrophobicContact CB-CE2 4.44Å; E1148-Y1152 WeakPolarHBondContact O-CD2 3.48Å; E1148-Y1152 PolarHBondContact O-N 3.41Å; R1149-Y1152 PolarHBondContact O-N 3.03Å; Y1152-M1154 VanDerWaalsContact C-N 3.28Å; Y1152-M1154 PolarHBondContact O-N 3.19Å; Y1152-E1155 PolarHBondContact O-N 2.93Å; Y1152-V1156 WeakPolarHBondContact O-CB 3.48Å; Y1152-V1156 VanDerWaalsContact O-CG2 3.29Å; Y1152-V1156 WeakPolarHBondContact O-CG2 3.47Å; Y1152-V1156 PolarHBondContact O-N 3.47Å
1153V93.1Very high91.7Very high67 Ų67106.6 Ų106.641%0.40652%0.52SS..Hα-helixtrans-67.2-29.6176170.10000111.9R1149 S1150 T1151 R1157R1149-V1153 WeakPolarHBondContact O-CB 3.49Å; R1149-V1153 VanDerWaalsContact O-CG2 3.29Å; R1149-V1153 WeakPolarHBondContact O-CG2 3.26Å; R1149-V1153 PolarHBondContact O-N 2.93Å; S1150-V1153 PolarHBondContact O-N 2.71Å; T1151-V1153 VanDerWaalsContact C-N 3.33Å; T1151-V1153 PolarHBondContact O-N 3.22Å; V1153-R1157 WeakPolarHBondContact O-CB 3.45Å; V1153-R1157 PolarHBondContact O-N 3.36Å; V1153-R1157 VanDerWaalsContact O-N 3.17Å
1154M90.7Very high91.6Very high120 Ų120105.1 Ų105.159%0.59152%0.517SS*.Hα-helixtrans-72.4-46.2173.4-173.9173.364.100111.4S1150 T1151 Y1152 V1156 R1157 E1158S1150-M1154 PolarHBondContact O-N 2.82Å; T1151-M1154 WeakPolarHBondContact O-CA 3.29Å; T1151-M1154 WeakPolarHBondContact O-CB 3.35Å; T1151-M1154 PolarHBondContact O-N 2.91Å; Y1152-M1154 VanDerWaalsContact C-N 3.28Å; Y1152-M1154 PolarHBondContact O-N 3.19Å; M1154-V1156 PolarHBondContact O-N 3.35Å; M1154-R1157 WeakPolarHBondContact O-CB 3.4Å; M1154-R1157 PolarHBondContact O-N 3.28Å; M1154-R1157 VanDerWaalsContact O-N 3.15Å; M1154-E1158 PolarHBondContact O-N 3.37Å
1155E93.2Very high91.6Very high102 Ų102104 Ų10448%0.47751%0.513SS..Hα-helixtrans-59.3-44.9174.9-70.1178.4176.200112.2T1151 Y1152 R1157 E1158 L1159T1151-E1155 PolarHBondContact O-N 2.93Å; Y1152-E1155 PolarHBondContact O-N 2.93Å; E1155-R1157 VanDerWaalsContact C-N 3.29Å; E1155-R1157 PolarHBondContact O-N 3.27Å; E1155-E1158 PolarHBondContact O-N 3.4Å; E1155-L1159 WeakPolarHBondContact O-CG 3.48Å; E1155-L1159 PolarHBondContact O-N 2.86Å
1156V91.1Very high91.6Very high96 Ų96105.4 Ų105.458%0.58252%0.517SS*.Hα-helixtrans-63.6-34.5175.9169.60000111.8Y1152 M1154 K1160Y1152-V1156 WeakPolarHBondContact O-CB 3.48Å; Y1152-V1156 VanDerWaalsContact O-CG2 3.29Å; Y1152-V1156 WeakPolarHBondContact O-CG2 3.47Å; Y1152-V1156 PolarHBondContact O-N 3.47Å; M1154-V1156 PolarHBondContact O-N 3.35Å; V1156-K1160 WeakPolarHBondContact O-CB 3.37Å; V1156-K1160 PolarHBondContact O-N 2.92Å
1157R90.4Very high91.6Very high162 Ų162105.9 Ų105.961%0.61152%0.519SS*.Hα-helixtrans-65.7-45.4173.3-105.2-177.3-80172.3-8.9111.6V1153 M1154 E1155 K1160 T1161V1153-R1157 WeakPolarHBondContact O-CB 3.45Å; V1153-R1157 PolarHBondContact O-N 3.36Å; V1153-R1157 VanDerWaalsContact O-N 3.17Å; M1154-R1157 WeakPolarHBondContact O-CB 3.4Å; M1154-R1157 PolarHBondContact O-N 3.28Å; M1154-R1157 VanDerWaalsContact O-N 3.15Å; E1155-R1157 VanDerWaalsContact C-N 3.29Å; E1155-R1157 PolarHBondContact O-N 3.27Å; R1157-K1160 PolarHBondContact O-N 3.37Å; R1157-T1161 PolarHBondContact O-N 3.16Å; R1157-T1161 PolarHBondContact O-OG1 2.92Å; R1157-T1161 VanDerWaalsContact O-OG1 3.12Å
1158E92.6Very high91.6Very high99 Ų99102.7 Ų102.746%0.46351%0.509SS..Hα-helixtrans-62.3-48.6178.6-179.552.5-146.800111.6M1154 E1155 K1160 T1161 Q1162M1154-E1158 PolarHBondContact O-N 3.37Å; E1155-E1158 PolarHBondContact O-N 3.4Å; E1158-K1160 VanDerWaalsContact C-N 3.25Å; E1158-K1160 PolarHBondContact O-N 3.14Å; E1158-T1161 WeakPolarHBondContact O-CB 3.4Å; E1158-T1161 PolarHBondContact O-N 2.94Å; E1158-Q1162 WeakPolarHBondContact O-CG 3.32Å; E1158-Q1162 PolarHBondContact O-N 3.39Å; E1158-Q1162 PolarHBondContact OE1-NE2 3.32Å
1159L93.3Very high91.6Very high108 Ų108104.2 Ų104.257%0.56551%0.514SS*.Hα-helixtrans-58.7-36.2174.6-70.2172.7000112.5E1155 Q1162 L1163E1155-L1159 WeakPolarHBondContact O-CG 3.48Å; E1155-L1159 PolarHBondContact O-N 2.86Å; L1159-Q1162 PolarHBondContact O-N 2.75Å; L1159-L1163 WeakPolarHBondContact O-CB 3.5Å; L1159-L1163 PolarHBondContact O-N 3.37Å
1160K91.3Very high91.6Very high136 Ų136101.3 Ų101.359%0.59151%0.51SS*.Hα-helixtrans-68.8-36.9175.4-173.6170.2-177.2173.40112.4V1156 R1157 E1158 N1164V1156-K1160 WeakPolarHBondContact O-CB 3.37Å; V1156-K1160 PolarHBondContact O-N 2.92Å; R1157-K1160 PolarHBondContact O-N 3.37Å; E1158-K1160 VanDerWaalsContact C-N 3.25Å; E1158-K1160 PolarHBondContact O-N 3.14Å; K1160-N1164 VanDerWaalsContact O-CG 3.28Å; K1160-N1164 PolarHBondContact O-N 2.91Å; K1160-N1164 PolarHBondContact O-ND2 3.07Å
1161T91.4Very high91.6Very high69 Ų69103.1 Ų103.142%0.42351%0.511SS..Hα-helixtrans-62.6-48.9172.6-55.60000110.7R1157 E1158 L1163 N1164 E1165R1157-T1161 PolarHBondContact O-N 3.16Å; R1157-T1161 PolarHBondContact O-OG1 2.92Å; R1157-T1161 VanDerWaalsContact O-OG1 3.12Å; E1158-T1161 WeakPolarHBondContact O-CB 3.4Å; E1158-T1161 PolarHBondContact O-N 2.94Å; T1161-L1163 VanDerWaalsContact C-N 3.34Å; T1161-L1163 PolarHBondContact O-N 3.39Å; T1161-N1164 PolarHBondContact O-N 3.29Å; T1161-E1165 PolarHBondContact O-N 3.16Å
1162Q92.8Very high91.4Very high93 Ų93104.6 Ų104.644%0.43552%0.517SS..Hα-helixtrans-60.7-41.2177.7-65.9177.116.800112.1E1158 L1159 E1165 T1166E1158-Q1162 WeakPolarHBondContact O-CG 3.32Å; E1158-Q1162 PolarHBondContact O-N 3.39Å; E1158-Q1162 PolarHBondContact OE1-NE2 3.32Å; L1159-Q1162 PolarHBondContact O-N 2.75Å; Q1162-E1165 PolarHBondContact O-N 3.2Å; Q1162-T1166 WeakPolarHBondContact O-CG2 3.47Å; Q1162-T1166 PolarHBondContact O-N 2.76Å; Q1162-T1166 PolarHBondContact O-OG1 3.44Å
1163L92.3Very high91.3Very high113 Ų113102.5 Ų102.559%0.59251%0.512SS*.Hα-helixtrans-61.6-45.9174.5-175.763.5000111.9L1159 T1161 E1165 T1166 H1167L1159-L1163 WeakPolarHBondContact O-CB 3.5Å; L1159-L1163 PolarHBondContact O-N 3.37Å; T1161-L1163 VanDerWaalsContact C-N 3.34Å; T1161-L1163 PolarHBondContact O-N 3.39Å; L1163-E1165 VanDerWaalsContact C-N 3.34Å; L1163-E1165 PolarHBondContact O-N 2.8Å; L1163-T1166 PolarHBondContact O-N 3.39Å; L1163-T1166 PolarHBondContact O-OG1 3.13Å; L1163-H1167 WeakPolarHBondContact O-CB 3.48Å; L1163-H1167 PolarHBondContact O-N 3.31Å
1164N88.4Confident90.8Very high98 Ų98105.3 Ų105.352%0.52452%0.52SS..Hα-helixtrans-62.5-39.4176.8-73.3-15.2000112.2K1160 T1161 H1167 S1168K1160-N1164 VanDerWaalsContact O-CG 3.28Å; K1160-N1164 PolarHBondContact O-N 2.91Å; K1160-N1164 PolarHBondContact O-ND2 3.07Å; T1161-N1164 PolarHBondContact O-N 3.29Å; N1164-H1167 PolarHBondContact O-N 3.48Å; N1164-S1168 WeakPolarHBondContact O-CB 3.46Å; N1164-S1168 PolarHBondContact O-N 2.78Å
1165E93.1Very high90.7Very high100 Ų100103.1 Ų103.147%0.46751%0.514SS..Hα-helixtrans-63.4-45.5174.5-79-164.7-162.900112.7T1161 Q1162 L1163 H1167 S1168 K1169T1161-E1165 PolarHBondContact O-N 3.16Å; Q1162-E1165 PolarHBondContact O-N 3.2Å; L1163-E1165 VanDerWaalsContact C-N 3.34Å; L1163-E1165 PolarHBondContact O-N 2.8Å; E1165-H1167 VanDerWaalsContact C-N 3.34Å; E1165-S1168 PolarHBondContact O-N 3.4Å; E1165-K1169 WeakPolarHBondContact O-CB 3.43Å; E1165-K1169 WeakPolarHBondContact O-CG 3.48Å; E1165-K1169 PolarHBondContact O-N 2.95Å; E1165-K1169 IonicContact OE2-NZ 3.72Å; E1165-K1169 PolarHBondContact OE2-NZ 3.22Å
1166T92.2Very high90.5Very high79 Ų79102.9 Ų102.949%0.48551%0.513SS..Hα-helixtrans-64.4-39.617856.20000111.6Q1162 L1163 K1169 L1170Q1162-T1166 WeakPolarHBondContact O-CG2 3.47Å; Q1162-T1166 PolarHBondContact O-N 2.76Å; Q1162-T1166 PolarHBondContact O-OG1 3.44Å; L1163-T1166 PolarHBondContact O-N 3.39Å; L1163-T1166 PolarHBondContact O-OG1 3.13Å; T1166-K1169 PolarHBondContact O-N 2.99Å; T1166-L1170 WeakPolarHBondContact O-CB 3.39Å; T1166-L1170 PolarHBondContact O-N 3.48Å
1167H88.5Confident90.1Very high121 Ų121104.8 Ų104.856%0.5651%0.51SS*.Hα-helixtrans-63.1-41.2173.7-169.2-42.9000112L1163 N1164 E1165 L1170 Q1171L1163-H1167 WeakPolarHBondContact O-CB 3.48Å; L1163-H1167 PolarHBondContact O-N 3.31Å; N1164-H1167 PolarHBondContact O-N 3.48Å; E1165-H1167 VanDerWaalsContact C-N 3.34Å; H1167-L1170 PolarHBondContact O-N 3.02Å; H1167-Q1171 WeakPolarHBondContact O-CB 3.38Å; H1167-Q1171 PolarHBondContact O-N 2.88Å
1168S90.8Very high89.7Confident60 Ų60103.9 Ų103.942%0.4251%0.51SS..Hα-helixtrans-65.3-43.6176.8-175.80000111.9N1164 E1165 Q1171 N1172N1164-S1168 WeakPolarHBondContact O-CB 3.46Å; N1164-S1168 PolarHBondContact O-N 2.78Å; E1165-S1168 PolarHBondContact O-N 3.4Å; S1168-Q1171 PolarHBondContact O-N 3.31Å; S1168-N1172 VanDerWaalsContact O-CG 3.23Å; S1168-N1172 PolarHBondContact O-N 2.86Å; S1168-N1172 PolarHBondContact O-ND2 3.27Å
1169K92.4Very high89.5Confident117 Ų117104 Ų10451%0.50951%0.509SS..Hα-helixtrans-59.4-47.9174-72.6161.8-177.8155.70111.5E1165 T1166 Q1171 N1172 E1173E1165-K1169 WeakPolarHBondContact O-CB 3.43Å; E1165-K1169 WeakPolarHBondContact O-CG 3.48Å; E1165-K1169 PolarHBondContact O-N 2.95Å; E1165-K1169 IonicContact OE2-NZ 3.72Å; E1165-K1169 PolarHBondContact OE2-NZ 3.22Å; T1166-K1169 PolarHBondContact O-N 2.99Å; K1169-Q1171 PolarHBondContact O-N 3.11Å; K1169-N1172 PolarHBondContact O-N 2.91Å; K1169-E1173 PolarHBondContact O-N 3.19Å
1170L90.4Very high89.2Confident104 Ų104102.5 Ų102.555%0.54551%0.505SS..Hα-helixtrans-62.5-41177.7-174.666.3000112.2T1166 H1167 E1173 Q1174T1166-L1170 WeakPolarHBondContact O-CB 3.39Å; T1166-L1170 PolarHBondContact O-N 3.48Å; H1167-L1170 PolarHBondContact O-N 3.02Å; L1170-E1173 PolarHBondContact O-N 3.11Å; L1170-Q1174 WeakPolarHBondContact O-CB 3.41Å; L1170-Q1174 PolarHBondContact O-N 3.48Å
1171Q91.1Very high88.8Confident113 Ų11398.1 Ų98.153%0.52849%0.494SS..Hα-helixtrans-63.9-41.2176.1-178.4174.9-15.600111.9H1167 S1168 K1169 Q1174 T1175H1167-Q1171 WeakPolarHBondContact O-CB 3.38Å; H1167-Q1171 PolarHBondContact O-N 2.88Å; S1168-Q1171 PolarHBondContact O-N 3.31Å; K1169-Q1171 PolarHBondContact O-N 3.11Å; Q1171-Q1174 WeakPolarHBondContact O-CB 3.39Å; Q1171-Q1174 PolarHBondContact O-N 3.41Å; Q1171-T1175 WeakPolarHBondContact O-CG2 3.31Å; Q1171-T1175 PolarHBondContact O-N 3.02Å; Q1171-T1175 PolarHBondContact O-OG1 2.99Å
1172N88.4Confident88.3Confident93 Ų9398.8 Ų98.850%0.49749%0.494SS..Hα-helixtrans-63.7-44.9175.8-68.3-22.8000111.3S1168 K1169 Q1174 T1175 E1176S1168-N1172 VanDerWaalsContact O-CG 3.23Å; S1168-N1172 PolarHBondContact O-N 2.86Å; S1168-N1172 PolarHBondContact O-ND2 3.27Å; K1169-N1172 PolarHBondContact O-N 2.91Å; N1172-Q1174 VanDerWaalsContact C-N 3.34Å; N1172-Q1174 PolarHBondContact O-N 3.28Å; N1172-T1175 WeakPolarHBondContact CA-OG1 3.36Å; N1172-T1175 PolarHBondContact O-N 2.73Å; N1172-T1175 PolarHBondContact O-OG1 3.31Å; N1172-E1176 PolarHBondContact O-N 3.1Å
1173E88.8Confident87.9Confident102 Ų10298 Ų9848%0.47749%0.494SS..Hα-helixtrans-58.5-43.7172-77.7-170.2-156.600112.2K1169 L1170 T1175 E1176 R1177K1169-E1173 PolarHBondContact O-N 3.19Å; L1170-E1173 PolarHBondContact O-N 3.11Å; E1173-T1175 VanDerWaalsContact C-N 3.29Å; E1173-T1175 PolarHBondContact O-N 2.74Å; E1173-E1176 PolarHBondContact O-N 3.08Å; E1173-R1177 WeakPolarHBondContact O-CB 3.25Å; E1173-R1177 VanDerWaalsContact O-CG 3.27Å; E1173-R1177 WeakPolarHBondContact O-CG 3.34Å; E1173-R1177 PolarHBondContact O-N 2.92Å; E1173-R1177 IonicContact OE2-NH2 2.6Å; E1173-R1177 PolarHBondContact OE2-NH2 3.32Å
1174Q83.9Confident87.6Confident126 Ų12694.1 Ų94.159%0.58947%0.473SS*.Hα-helixtrans-58.1-41.5176.4-164.180.29.100111.4L1170 Q1171 N1172 K1178L1170-Q1174 WeakPolarHBondContact O-CB 3.41Å; L1170-Q1174 PolarHBondContact O-N 3.48Å; Q1171-Q1174 WeakPolarHBondContact O-CB 3.39Å; Q1171-Q1174 PolarHBondContact O-N 3.41Å; N1172-Q1174 VanDerWaalsContact C-N 3.34Å; N1172-Q1174 PolarHBondContact O-N 3.28Å; Q1174-K1178 PolarHBondContact O-N 3.1Å; Q1174-K1178 VanDerWaalsContact O-N 3.08Å
1175T87.4Confident87.2Confident75 Ų7594.8 Ų94.846%0.4647%0.473SS..Hα-helixtrans-70.1-39.917854.10000113.3Q1171 N1172 E1173 K1178 K1179Q1171-T1175 WeakPolarHBondContact O-CG2 3.31Å; Q1171-T1175 PolarHBondContact O-N 3.02Å; Q1171-T1175 PolarHBondContact O-OG1 2.99Å; N1172-T1175 WeakPolarHBondContact CA-OG1 3.36Å; N1172-T1175 PolarHBondContact O-N 2.73Å; N1172-T1175 PolarHBondContact O-OG1 3.31Å; E1173-T1175 VanDerWaalsContact C-N 3.29Å; E1173-T1175 PolarHBondContact O-N 2.74Å; T1175-K1178 PolarHBondContact O-N 3Å; T1175-K1179 WeakPolarHBondContact O-CB 3.49Å; T1175-K1179 PolarHBondContact O-N 3.49Å
1176E88.8Confident86.9Confident96 Ų9695.3 Ų95.345%0.44947%0.473SS..Hα-helixtrans-70.2-39.2175.8-75.1-63.9143.300111.6N1172 E1173 K1178 K1179 V1180N1172-E1176 PolarHBondContact O-N 3.1Å; E1173-E1176 PolarHBondContact O-N 3.08Å; E1176-K1178 VanDerWaalsContact C-N 3.31Å; E1176-K1178 PolarHBondContact O-N 3.49Å; E1176-K1179 PolarHBondContact O-N 3.37Å; E1176-K1179 IonicContact OE1-NZ 3.26Å; E1176-K1179 PolarHBondContact OE1-NZ 3.42Å; E1176-K1179 IonicContact OE2-NZ 3.07Å; E1176-K1179 PolarHBondContact OE2-NZ 3.07Å; E1176-V1180 WeakPolarHBondContact O-CG2 3.49Å; E1176-V1180 PolarHBondContact O-N 2.96Å
1177R82.8Confident86.3Confident137 Ų13793.8 Ų93.852%0.51747%0.469SS..Hα-helixtrans-56.4-44.3171-73178.1-163.6-145.27.1111.5E1173 V1180 A1181E1173-R1177 WeakPolarHBondContact O-CB 3.25Å; E1173-R1177 VanDerWaalsContact O-CG 3.27Å; E1173-R1177 WeakPolarHBondContact O-CG 3.34Å; E1173-R1177 PolarHBondContact O-N 2.92Å; E1173-R1177 IonicContact OE2-NH2 2.6Å; E1173-R1177 PolarHBondContact OE2-NH2 3.32Å; R1177-V1180 PolarHBondContact O-N 3.3Å; R1177-A1181 PolarHBondContact O-N 3.39Å
1178K82.1Confident85.7Confident142 Ų14290.6 Ų90.662%0.61745%0.454SS*.Hα-helixtrans-62.9-44.8176.6-174.3173.8-179.1176.40112Q1174 T1175 E1176 A1181 D1182Q1174-K1178 PolarHBondContact O-N 3.1Å; Q1174-K1178 VanDerWaalsContact O-N 3.08Å; T1175-K1178 PolarHBondContact O-N 3Å; E1176-K1178 VanDerWaalsContact C-N 3.31Å; E1176-K1178 PolarHBondContact O-N 3.49Å; K1178-A1181 WeakPolarHBondContact O-CB 3.5Å; K1178-A1181 PolarHBondContact O-N 3.36Å; K1178-D1182 PolarHBondContact O-N 2.84Å
1179K88.9Confident85.3Confident101 Ų10193.1 Ų93.144%0.43946%0.459SS..Hα-helixtrans-62.8-42.1177.4175.6173.3151.7-130.40112.6T1175 E1176 A1181 D1182 D1183T1175-K1179 WeakPolarHBondContact O-CB 3.49Å; T1175-K1179 PolarHBondContact O-N 3.49Å; E1176-K1179 PolarHBondContact O-N 3.37Å; E1176-K1179 IonicContact OE1-NZ 3.26Å; E1176-K1179 PolarHBondContact OE1-NZ 3.42Å; E1176-K1179 IonicContact OE2-NZ 3.07Å; E1176-K1179 PolarHBondContact OE2-NZ 3.07Å; K1179-A1181 VanDerWaalsContact C-N 3.34Å; K1179-A1181 PolarHBondContact O-N 3.43Å; K1179-D1182 PolarHBondContact O-N 3.43Å; K1179-D1183 WeakPolarHBondContact O-CB 3.4Å; K1179-D1183 PolarHBondContact O-N 3.39Å
1180V87.2Confident84.8Confident78 Ų7890.8 Ų90.847%0.47346%0.458SS..Hα-helixtrans-61.8-41.1173.4171.10000111.2E1176 R1177 D1183 L1184E1176-V1180 WeakPolarHBondContact O-CG2 3.49Å; E1176-V1180 PolarHBondContact O-N 2.96Å; R1177-V1180 PolarHBondContact O-N 3.3Å; V1180-D1183 PolarHBondContact O-N 3.11Å; V1180-L1184 VanDerWaalsContact O-CB 3.25Å; V1180-L1184 WeakPolarHBondContact O-CB 3.42Å; V1180-L1184 PolarHBondContact O-N 3.21Å
1181A82.1Confident84.3Confident44 Ų4487 Ų8736%0.36444%0.438SS..Hα-helixtrans-64.6-42.4174.900000112.6R1177 K1178 K1179 L1184 H1185R1177-A1181 PolarHBondContact O-N 3.39Å; K1178-A1181 WeakPolarHBondContact O-CB 3.5Å; K1178-A1181 PolarHBondContact O-N 3.36Å; K1179-A1181 VanDerWaalsContact C-N 3.34Å; K1179-A1181 PolarHBondContact O-N 3.43Å; A1181-L1184 PolarHBondContact O-N 2.96Å; A1181-H1185 PolarHBondContact O-N 2.96Å
1182D81.4Confident83.6Confident82 Ų8285.4 Ų85.444%0.43943%0.433SS..Hα-helixtrans-63.4-41.7176.2-71.9-24000111.9K1178 K1179 H1185 K1186K1178-D1182 PolarHBondContact O-N 2.84Å; K1179-D1182 PolarHBondContact O-N 3.43Å; D1182-H1185 PolarHBondContact O-N 3.45Å; D1182-K1186 WeakPolarHBondContact O-CG 3.4Å; D1182-K1186 PolarHBondContact O-N 3.16Å; D1182-K1186 VanDerWaalsContact O-N 3.1Å
1183D85.8Confident83.2Confident78 Ų7883.8 Ų83.842%0.41743%0.429SS..Hα-helixtrans-71.8-36.1178-73.2-22.2000112.4K1179 V1180 H1185 K1186 A1187K1179-D1183 WeakPolarHBondContact O-CB 3.4Å; K1179-D1183 PolarHBondContact O-N 3.39Å; V1180-D1183 PolarHBondContact O-N 3.11Å; D1183-H1185 VanDerWaalsContact C-N 3.31Å; D1183-H1185 PolarHBondContact O-N 3.16Å; D1183-K1186 PolarHBondContact O-N 3.04Å; D1183-K1186 IonicContact OD1-NZ 2.86Å; D1183-K1186 PolarHBondContact OD1-NZ 2.91Å; D1183-A1187 PolarHBondContact O-N 3.21Å
1184L84.9Confident82.7Confident30 Ų3083 Ų8316%0.15743%0.427CS..Hα-helixtrans-60.7-40.8170.5-17565.1000111.3V1180 A1181 A1187 Q1188 L1241 N1245 L1248V1180-L1184 VanDerWaalsContact O-CB 3.25Å; V1180-L1184 WeakPolarHBondContact O-CB 3.42Å; V1180-L1184 PolarHBondContact O-N 3.21Å; A1181-L1184 PolarHBondContact O-N 2.96Å; L1184-A1187 PolarHBondContact O-N 3.37Å; L1184-Q1188 PolarHBondContact O-N 2.67Å; L1184-L1241 HydrophobicContact CD1-CD1 3.53Å; L1184-N1245 WeakPolarHBondContact CD2-OD1 3.42Å; L1184-L1248 HydrophobicContact CD2-CD2 4.3Å
1185H80.8Confident82Confident112 Ų11280.4 Ų80.452%0.51942%0.415SS..Hα-helixtrans-65.2-41176.1-166.777.5000112.2A1181 D1182 D1183 A1187 Q1188 Q1189A1181-H1185 PolarHBondContact O-N 2.96Å; D1182-H1185 PolarHBondContact O-N 3.45Å; D1183-H1185 VanDerWaalsContact C-N 3.31Å; D1183-H1185 PolarHBondContact O-N 3.16Å; H1185-A1187 VanDerWaalsContact C-N 3.35Å; H1185-A1187 PolarHBondContact O-N 3.35Å; H1185-Q1188 WeakPolarHBondContact O-CB 3.48Å; H1185-Q1188 PolarHBondContact O-N 3.33Å; H1185-Q1189 PolarHBondContact CD2-NE2 3.06Å; H1185-Q1189 PolarHBondContact NE2-NE2 2.98Å; H1185-Q1189 WeakPolarHBondContact O-CG 3.48Å; H1185-Q1189 PolarHBondContact O-N 3.49Å
1186K86.4Confident81.3Confident111 Ų11180 Ų8048%0.48342%0.415SS..Hα-helixtrans-63.1-39173.3-65.6164.9-153.1158.90112.2D1182 D1183 Q1189 S1190D1182-K1186 WeakPolarHBondContact O-CG 3.4Å; D1182-K1186 PolarHBondContact O-N 3.16Å; D1182-K1186 VanDerWaalsContact O-N 3.1Å; D1183-K1186 PolarHBondContact O-N 3.04Å; D1183-K1186 IonicContact OD1-NZ 2.86Å; D1183-K1186 PolarHBondContact OD1-NZ 2.91Å; K1186-Q1189 PolarHBondContact O-N 3.31Å; K1186-S1190 WeakPolarHBondContact O-CB 3.35Å; K1186-S1190 PolarHBondContact O-N 2.94Å; K1186-S1190 PolarHBondContact O-OG 3.09Å
1187A80.1Confident80.6Confident47 Ų4782.1 Ų82.139%0.38842%0.423SS..Hα-helixtrans-63.5-44.117500000111.4D1183 L1184 H1185 Q1189 S1190 L1191D1183-A1187 PolarHBondContact O-N 3.21Å; L1184-A1187 PolarHBondContact O-N 3.37Å; H1185-A1187 VanDerWaalsContact C-N 3.35Å; H1185-A1187 PolarHBondContact O-N 3.35Å; A1187-Q1189 PolarHBondContact O-N 2.9Å; A1187-S1190 PolarHBondContact O-N 2.76Å; A1187-L1191 WeakPolarHBondContact O-CB 3.36Å; A1187-L1191 PolarHBondContact O-N 3.08Å
1188Q75.4Confident79.8Confident55 Ų5577.5 Ų77.526%0.25741%0.408SS..Hα-helixtrans-59.2-46.2174.6-170.976.26100112.1L1184 H1185 S1190 L1191 N1192 L1241L1184-Q1188 PolarHBondContact O-N 2.67Å; H1185-Q1188 WeakPolarHBondContact O-CB 3.48Å; H1185-Q1188 PolarHBondContact O-N 3.33Å; Q1188-S1190 VanDerWaalsContact C-N 3.33Å; Q1188-S1190 PolarHBondContact O-N 3.44Å; Q1188-L1191 PolarHBondContact O-N 3.33Å; Q1188-N1192 PolarHBondContact O-N 2.83Å; Q1188-N1192 PolarHBondContact O-ND2 3.33Å; Q1188-N1192 PolarHBondContact O-OD1 3.35Å; Q1188-L1241 HydrophobicContact CB-CD2 4.44Å
1189Q82.8Confident78.8Confident112 Ų11273.8 Ų73.852%0.52340%0.4SS..Hα-helixtrans-61.3-41.2175.9-70.9-178.86.300112.1H1185 K1186 A1187 N1192 S1193H1185-Q1189 PolarHBondContact CD2-NE2 3.06Å; H1185-Q1189 PolarHBondContact NE2-NE2 2.98Å; H1185-Q1189 WeakPolarHBondContact O-CG 3.48Å; H1185-Q1189 PolarHBondContact O-N 3.49Å; K1186-Q1189 PolarHBondContact O-N 3.31Å; A1187-Q1189 PolarHBondContact O-N 2.9Å; Q1189-N1192 PolarHBondContact O-N 3.31Å; Q1189-S1193 PolarHBondContact O-N 3.45Å
1190S81.8Confident77.3Confident69 Ų6975 Ų7548%0.48341%0.41SS..Hα-helixtrans-64.7-43.9178.4-58.70000111.8K1186 A1187 Q1188 S1193 I1194K1186-S1190 WeakPolarHBondContact O-CB 3.35Å; K1186-S1190 PolarHBondContact O-N 2.94Å; K1186-S1190 PolarHBondContact O-OG 3.09Å; A1187-S1190 PolarHBondContact O-N 2.76Å; Q1188-S1190 VanDerWaalsContact C-N 3.33Å; Q1188-S1190 PolarHBondContact O-N 3.44Å; S1190-S1193 WeakPolarHBondContact O-CB 3.42Å; S1190-S1193 PolarHBondContact O-N 2.62Å; S1190-I1194 WeakPolarHBondContact O-CG1 3.44Å; S1190-I1194 PolarHBondContact O-N 3.35Å
1191L78.6Confident75.9Confident23 Ų2378.6 Ų78.612%0.1242%0.42CS..Hα-helixtrans-61.9-43.4175.9-173.163.6000111.7A1187 Q1188 S1193 I1194 H1195 V1234 Q1238 L1241A1187-L1191 WeakPolarHBondContact O-CB 3.36Å; A1187-L1191 PolarHBondContact O-N 3.08Å; Q1188-L1191 PolarHBondContact O-N 3.33Å; L1191-S1193 VanDerWaalsContact C-N 3.33Å; L1191-S1193 PolarHBondContact O-N 2.98Å; L1191-I1194 PolarHBondContact O-N 3.44Å; L1191-H1195 PolarHBondContact O-N 2.93Å; L1191-V1234 HydrophobicContact CD1-CG1 4.47Å; L1191-Q1238 HydrophobicContact CD2-CG 3.69Å; L1191-Q1238 HydrophobicContact CG-CG 4.39Å; L1191-L1241 HydrophobicContact CD2-CD2 3.73Å
1192N77.9Confident74.5Confident81 Ų8179.7 Ų79.743%0.43343%0.429SS..Hα-helixtrans-63-37.8175.5-68.2-10000112.1Q1188 Q1189 H1195 S1196Q1188-N1192 PolarHBondContact O-N 2.83Å; Q1188-N1192 PolarHBondContact O-ND2 3.33Å; Q1188-N1192 PolarHBondContact O-OD1 3.35Å; Q1189-N1192 PolarHBondContact O-N 3.31Å; N1192-H1195 PolarHBondContact O-N 3.4Å; N1192-S1196 WeakPolarHBondContact O-CB 3.48Å; N1192-S1196 PolarHBondContact O-N 3.29Å
1193S79.1Confident73.1Confident58 Ų5878.9 Ų78.941%0.40643%0.434SS..Hα-helixtrans-65.3-39.9174.7-168.70000112.4Q1189 S1190 L1191 K1197Q1189-S1193 PolarHBondContact O-N 3.45Å; S1190-S1193 WeakPolarHBondContact O-CB 3.42Å; S1190-S1193 PolarHBondContact O-N 2.62Å; L1191-S1193 VanDerWaalsContact C-N 3.33Å; L1191-S1193 PolarHBondContact O-N 2.98Å; S1193-K1197 WeakPolarHBondContact O-CG 3.41Å; S1193-K1197 PolarHBondContact O-N 3.35Å; S1193-K1197 VanDerWaalsContact O-N 3.14Å
1194I77.8Confident71.4Confident86 Ų8677.7 Ų77.744%0.44144%0.44SS..Hα-helixtrans-63.7-47.5174.4-68.3164.8000110.3S1190 L1191 S1196 K1197 I1198S1190-I1194 WeakPolarHBondContact O-CG1 3.44Å; S1190-I1194 PolarHBondContact O-N 3.35Å; L1191-I1194 PolarHBondContact O-N 3.44Å; I1194-S1196 VanDerWaalsContact C-N 3.35Å; I1194-S1196 PolarHBondContact O-N 2.95Å; I1194-K1197 PolarHBondContact O-N 2.83Å; I1194-I1198 HydrophobicContact CG2-CD1 3.8Å; I1194-I1198 HydrophobicContact CG2-CG1 4.5Å; I1194-I1198 WeakPolarHBondContact O-CG1 3.38Å; I1194-I1198 PolarHBondContact O-N 3.1Å
1195H69.8Low69.6Low72 Ų7283 Ų8333%0.33347%0.468SS..Hα-helixtrans-59.5-43.6178.3-171.4-16.4000112.1L1191 N1192 K1197 I1198 S1199L1191-H1195 PolarHBondContact O-N 2.93Å; N1192-H1195 PolarHBondContact O-N 3.4Å; H1195-K1197 PolarHBondContact O-N 3.48Å; H1195-I1198 PolarHBondContact O-N 3.38Å; H1195-S1199 PolarHBondContact O-N 2.88Å
1196S73.5Confident68Low66 Ų6682.8 Ų82.846%0.46248%0.475SS..Hα-helixtrans-59.9-42.8176.6-178.20000112.3N1192 I1194 I1198 S1199 L1200N1192-S1196 WeakPolarHBondContact O-CB 3.48Å; N1192-S1196 PolarHBondContact O-N 3.29Å; I1194-S1196 VanDerWaalsContact C-N 3.35Å; I1194-S1196 PolarHBondContact O-N 2.95Å; S1196-I1198 PolarHBondContact O-N 3.46Å; S1196-S1199 PolarHBondContact O-N 3.47Å; S1196-L1200 WeakPolarHBondContact O-CB 3.36Å; S1196-L1200 PolarHBondContact O-N 2.92Å
1197K74.4Confident66.1Low141 Ų14183.5 Ų83.561%0.61349%0.489SS*.Hα-helixtrans-64.4-36.7175.3-72.3170.6-178.7172.80113S1193 I1194 H1195 K1201S1193-K1197 WeakPolarHBondContact O-CG 3.41Å; S1193-K1197 PolarHBondContact O-N 3.35Å; S1193-K1197 VanDerWaalsContact O-N 3.14Å; I1194-K1197 PolarHBondContact O-N 2.83Å; H1195-K1197 PolarHBondContact O-N 3.48Å; K1197-K1201 PolarHBondContact O-N 3.28Å; K1197-K1201 VanDerWaalsContact O-N 3.16Å
1198I66.1Low64.4Low40 Ų4087.5 Ų87.521%0.20551%0.508CS..Hα-helixtrans-69.1-44176.9-66.2168.2000110.6I1194 H1195 S1196 L1200 K1201 A1202 L1230 N1231 V1234I1194-I1198 HydrophobicContact CG2-CD1 3.8Å; I1194-I1198 HydrophobicContact CG2-CG1 4.5Å; I1194-I1198 WeakPolarHBondContact O-CG1 3.38Å; I1194-I1198 PolarHBondContact O-N 3.1Å; H1195-I1198 PolarHBondContact O-N 3.38Å; S1196-I1198 PolarHBondContact O-N 3.46Å; I1198-L1200 PolarHBondContact O-N 3.12Å; I1198-K1201 PolarHBondContact O-N 2.98Å; I1198-A1202 PolarHBondContact O-N 3.11Å; I1198-L1230 HydrophobicContact CD1-CD2 4.36Å; I1198-N1231 WeakPolarHBondContact CG2-OD1 3.4Å; I1198-V1234 HydrophobicContact CD1-CG2 4.31Å
1199S59.3Low62.8Low63 Ų6393 Ų9344%0.44154%0.537SS..Hα-helixtrans-63.4-39.8175.6-71.20000113.1H1195 S1196 K1201 A1202 A1203H1195-S1199 PolarHBondContact O-N 2.88Å; S1196-S1199 PolarHBondContact O-N 3.47Å; S1199-K1201 VanDerWaalsContact C-N 3.29Å; S1199-K1201 PolarHBondContact O-N 2.91Å; S1199-A1202 PolarHBondContact O-N 3.35Å; S1199-A1203 PolarHBondContact O-N 3.37Å; S1199-A1203 VanDerWaalsContact O-N 3.13Å
1200L59Low60.5Low126 Ų12695.9 Ų95.966%0.6655%0.551SS**Hα-helixtrans-62.8-35.1174.3-90.3158.3000112.6S1196 I1198 G1204S1196-L1200 WeakPolarHBondContact O-CB 3.36Å; S1196-L1200 PolarHBondContact O-N 2.92Å; I1198-L1200 PolarHBondContact O-N 3.12Å; L1200-G1204 PolarHBondContact O-N 2.84Å
1201K57.1Low58.1Low154 Ų15499.2 Ų99.267%0.6756%0.563SS**Hα-helixtrans-73.1-41.2176.2-164.5171.2-176.9-1790112K1197 I1198 S1199 A1203 G1204K1197-K1201 PolarHBondContact O-N 3.28Å; K1197-K1201 VanDerWaalsContact O-N 3.16Å; I1198-K1201 PolarHBondContact O-N 2.98Å; S1199-K1201 VanDerWaalsContact C-N 3.29Å; S1199-K1201 PolarHBondContact O-N 2.91Å; K1201-A1203 VanDerWaalsContact C-N 3.25Å; K1201-A1203 PolarHBondContact O-N 3.05Å; K1201-G1204 PolarHBondContact O-N 3.44Å; K1201-G1204 VanDerWaalsContact O-N 3.17Å
1202A53.5Low56Low67 Ų67103 Ų10355%0.55459%0.592SS**Hα-helixtrans-63.3-28.3176.600000113.7I1198 S1199I1198-A1202 PolarHBondContact O-N 3.11Å; S1199-A1202 PolarHBondContact O-N 3.35Å
1203A50.7Low53.8Low66 Ų66105.6 Ų105.655%0.54561%0.606SS.*Hα-helixtrans-85.2-15.6176.200000114.2S1199 K1201S1199-A1203 PolarHBondContact O-N 3.37Å; S1199-A1203 VanDerWaalsContact O-N 3.13Å; K1201-A1203 VanDerWaalsContact C-N 3.25Å; K1201-A1203 PolarHBondContact O-N 3.05Å
1204G50.7Low51.7Low53 Ų53110.5 Ų110.555%0.54663%0.626SS.*Hα-helixtrans-76.4-32.3-179.600000113.7L1200 K1201 T1206L1200-G1204 PolarHBondContact O-N 2.84Å; K1201-G1204 PolarHBondContact O-N 3.44Å; K1201-G1204 VanDerWaalsContact O-N 3.17Å; G1204-T1206 VanDerWaalsContact C-N 3.29Å; G1204-T1206 PolarHBondContact O-N 2.95Å
1205D47.7Very low49.6Very low140 Ų140111.5 Ų111.575%0.74964%0.64SS**THydrogen-bonded Turntrans-85.610-172.4-66-25000113.8
1206T46.9Very low49Very low109 Ų109113.4 Ų113.467%0.66966%0.659SS**THydrogen-bonded Turntrans-104.5-4.1-172.4-27.70000115.6G1204G1204-T1206 VanDerWaalsContact C-N 3.29Å; G1204-T1206 PolarHBondContact O-N 2.95Å
1207V45.4Very low47Very low126 Ų126118.9 Ų118.976%0.76468%0.677SS**SBendtrans-127.48.6-165-1690000115.1
1208V46.1Very low45.5Very low131 Ų131120.2 Ų120.279%0.79469%0.688SS**  trans-139.2105.7173-170.70000111.8
1209I40.2Very low44.2Very low170 Ų170126 Ų12687%0.87271%0.714SS**  trans175.2116.1135.1-86148.6000107.3
1210E34.3Very low43.2Very low172 Ų172126 Ų12680%0.80471%0.714SS**  trans-144.9133.7158.2-159.9175.5-133.900108.9
1211N32.2Very low42.6Very low139 Ų139125.5 Ų125.574%0.74372%0.718SS**  trans92.1107.7175.8-51.2-63.3000119.4
1212S33.7Very low42.4Very low104 Ų104124.3 Ų124.373%0.72772%0.715SS**  trans63.8134.7145.3-72.80000120.8
1213D33.1Very low42.3Very low135 Ų135127.1 Ų127.172%0.72271%0.714SS**  cis-150.4150.75.1-87.5-34.8000112.4
1214I33.5Very low42.4Very low161 Ų161131.7 Ų131.783%0.82673%0.725SS**  trans21.7129.9137-55.5171.4000117.3
1215S34.5Very low42.5Very low106 Ų106133.8 Ų133.874%0.74173%0.727SS**  cis-170.6-167.9-4.1-157.90000107.8
1216P57.2Low42.8Very low113 Ų113133.4 Ų133.473%0.73472%0.722SS**  -121.2150.2-104.738.3-21.5000116.1
1217E30.9Very low43.4Very low180 Ų180131.2 Ų131.284%0.84171%0.711SS**  trans-158.4133.1148-126.2171.9178.600113.8
1218M43.2Very low44.2Very low169 Ų169129.6 Ų129.683%0.83370%0.701SS**  trans23.3107.6165.4-62.7-166.3-73.500121.4
1219E38.1Very low45Very low163 Ų163126.4 Ų126.476%0.76269%0.685SS**  trans-134.3155.5138-93.4-147.8159.600111.4K1223E1219-K1223 VanDerWaalsContact CD-NZ 3.26Å; E1219-K1223 IonicContact OE1-NZ 2.63Å; E1219-K1223 PolarHBondContact OE1-NZ 2.87Å; E1219-K1223 VanDerWaalsContact OE1-NZ 3.13Å; E1219-K1223 IonicContact OE2-NZ 3.3Å; E1219-K1223 PolarHBondContact OE2-NZ 3.31Å
1220S39.6Very low46.2Very low63 Ų63123.1 Ų123.144%0.44167%0.669SS.*  trans-90.4156.4-161.759.20000115.5E1222S1220-E1222 PolarHBondContact O-N 2.95Å; S1220-E1222 VanDerWaalsContact O-N 3.15Å
1221P47.1Very low47.9Very low114 Ų114118.2 Ų118.274%0.7465%0.648SS**THydrogen-bonded Turntrans-77.410.6179.133.6-37.8000115T1225P1221-T1225 PolarHBondContact O-OG1 3.26Å
1222E52.4Low49.9Very low129 Ų129117.3 Ų117.360%0.60364%0.639SS**Hα-helixtrans-80.9-20-170.8-64.9-177.1147.400114S1220 T1225 M1226S1220-E1222 PolarHBondContact O-N 2.95Å; S1220-E1222 VanDerWaalsContact O-N 3.15Å; E1222-T1225 PolarHBondContact O-OG1 3.44Å; E1222-M1226 PolarHBondContact O-N 2.96Å
1223K51Low51.8Low126 Ų126115.4 Ų115.455%0.54862%0.623SS.*Hα-helixtrans-72.4-39.5-174.3-71.1175.2-174.6165.60113.6E1219 S1227E1219-K1223 VanDerWaalsContact CD-NZ 3.26Å; E1219-K1223 IonicContact OE1-NZ 2.63Å; E1219-K1223 PolarHBondContact OE1-NZ 2.87Å; E1219-K1223 VanDerWaalsContact OE1-NZ 3.13Å; E1219-K1223 IonicContact OE2-NZ 3.3Å; E1219-K1223 PolarHBondContact OE2-NZ 3.31Å; K1223-S1227 PolarHBondContact O-N 3.19Å
1224E52.4Low53.7Low163 Ų163109.7 Ų109.776%0.76259%0.593SS**Hα-helixtrans-72.8-40177.4-80.8-171.7132.300112.6M1226 S1227 V1228E1224-M1226 VanDerWaalsContact C-N 3.29Å; E1224-M1226 PolarHBondContact O-N 3.25Å; E1224-S1227 PolarHBondContact O-N 3.45Å; E1224-S1227 PolarHBondContact O-OG 2.86Å; E1224-V1228 PolarHBondContact O-N 3.36Å
1225T53.8Low55.5Low96 Ų96105.7 Ų105.759%0.58958%0.577SS**Hα-helixtrans-64.2-34.3177.740.10000112.3P1221 E1222 S1229P1221-T1225 PolarHBondContact O-OG1 3.26Å; E1222-T1225 PolarHBondContact O-OG1 3.44Å; T1225-S1229 VanDerWaalsContact O-CB 3.28Å; T1225-S1229 WeakPolarHBondContact O-CB 3.28Å; T1225-S1229 PolarHBondContact O-N 3.35Å; T1225-S1229 VanDerWaalsContact O-N 3.09Å
1226M53.9Low57.5Low132 Ų132106 Ų10665%0.6557%0.566SS**Hα-helixtrans-68.3-35.1172.9-78.3-148.1-72.800113.8E1222 E1224 L1230E1222-M1226 PolarHBondContact O-N 2.96Å; E1224-M1226 VanDerWaalsContact C-N 3.29Å; E1224-M1226 PolarHBondContact O-N 3.25Å; M1226-L1230 WeakPolarHBondContact O-CB 3.49Å; M1226-L1230 PolarHBondContact O-N 3.47Å
1227S58Low58.5Low63 Ų63105 Ų10544%0.44155%0.554SS.*Hα-helixtrans-70-39.3179.9750000112.3K1223 E1224 L1230 N1231K1223-S1227 PolarHBondContact O-N 3.19Å; E1224-S1227 PolarHBondContact O-N 3.45Å; E1224-S1227 PolarHBondContact O-OG 2.86Å; S1227-L1230 PolarHBondContact O-N 3.37Å; S1227-N1231 PolarHBondContact O-N 2.92Å; S1227-N1231 VanDerWaalsContact O-N 3.1Å; S1227-N1231 PolarHBondContact O-ND2 3Å
1228V62.3Low60.5Low92 Ų9299.1 Ų99.156%0.55853%0.527SS*.Hα-helixtrans-66.5-45.8174.9178.20000110.8E1224 L1230 N1231 Q1232E1224-V1228 PolarHBondContact O-N 3.36Å; V1228-L1230 VanDerWaalsContact C-N 3.34Å; V1228-L1230 PolarHBondContact O-N 3.16Å; V1228-N1231 PolarHBondContact O-N 3.12Å; V1228-Q1232 WeakPolarHBondContact O-CB 3.43Å; V1228-Q1232 PolarHBondContact O-N 2.85Å
1229S63.2Low62.1Low65 Ų6597 Ų9746%0.45552%0.515SS..Hα-helixtrans-56.4-45.1174.7177.60000112.3T1225 Q1232 T1233T1225-S1229 VanDerWaalsContact O-CB 3.28Å; T1225-S1229 WeakPolarHBondContact O-CB 3.28Å; T1225-S1229 PolarHBondContact O-N 3.35Å; T1225-S1229 VanDerWaalsContact O-N 3.09Å; S1229-Q1232 PolarHBondContact O-N 3.33Å; S1229-T1233 WeakPolarHBondContact O-CB 3.38Å; S1229-T1233 PolarHBondContact O-N 2.95Å; S1229-T1233 PolarHBondContact O-OG1 2.83Å
1230L66.9Low64Low101 Ų10194 Ų9453%0.52950%0.503SS..Hα-helixtrans-65.6-44.5-179.4-15678.2000111.9I1198 M1226 S1227 V1228 Q1232 T1233 V1234I1198-L1230 HydrophobicContact CD1-CD2 4.36Å; M1226-L1230 WeakPolarHBondContact O-CB 3.49Å; M1226-L1230 PolarHBondContact O-N 3.47Å; S1227-L1230 PolarHBondContact O-N 3.37Å; V1228-L1230 VanDerWaalsContact C-N 3.34Å; V1228-L1230 PolarHBondContact O-N 3.16Å; L1230-Q1232 VanDerWaalsContact C-N 3.35Å; L1230-Q1232 PolarHBondContact O-N 3.46Å; L1230-T1233 PolarHBondContact O-N 3.49Å; L1230-V1234 WeakPolarHBondContact O-CG2 3.48Å; L1230-V1234 PolarHBondContact O-N 3.3Å
1231N68.6Low65.7Low68 Ų6892.4 Ų92.436%0.36449%0.49SS..Hα-helixtrans-61.7-42.7175.6-79.2-35.7000111.7I1198 S1227 V1228 T1233 V1234 T1235I1198-N1231 WeakPolarHBondContact CG2-OD1 3.4Å; S1227-N1231 PolarHBondContact O-N 2.92Å; S1227-N1231 VanDerWaalsContact O-N 3.1Å; S1227-N1231 PolarHBondContact O-ND2 3Å; V1228-N1231 PolarHBondContact O-N 3.12Å; N1231-T1233 VanDerWaalsContact C-N 3.31Å; N1231-T1233 PolarHBondContact O-N 2.87Å; N1231-V1234 PolarHBondContact O-N 3.31Å; N1231-T1235 PolarHBondContact O-N 3.26Å; N1231-T1235 PolarHBondContact O-OG1 3.21Å
1232Q74Confident67.1Low121 Ų12193 Ų9357%0.56548%0.483SS*.Hα-helixtrans-64.3-36.6177.9-159.5167.221.800111.9V1228 S1229 L1230 T1235 Q1236V1228-Q1232 WeakPolarHBondContact O-CB 3.43Å; V1228-Q1232 PolarHBondContact O-N 2.85Å; S1229-Q1232 PolarHBondContact O-N 3.33Å; L1230-Q1232 VanDerWaalsContact C-N 3.35Å; L1230-Q1232 PolarHBondContact O-N 3.46Å; Q1232-T1235 PolarHBondContact O-N 3.01Å; Q1232-Q1236 WeakPolarHBondContact O-CG 3.39Å; Q1232-Q1236 PolarHBondContact O-N 3.17Å; Q1232-Q1236 VanDerWaalsContact O-N 3.08Å
1233T73.4Confident68.2Low63 Ų6392.7 Ų92.739%0.38748%0.481SS..Hα-helixtrans-66.4-40.9173.7-50.70000111.8S1229 L1230 N1231 Q1236 L1237S1229-T1233 WeakPolarHBondContact O-CB 3.38Å; S1229-T1233 PolarHBondContact O-N 2.95Å; S1229-T1233 PolarHBondContact O-OG1 2.83Å; L1230-T1233 PolarHBondContact O-N 3.49Å; N1231-T1233 VanDerWaalsContact C-N 3.31Å; N1231-T1233 PolarHBondContact O-N 2.87Å; T1233-Q1236 PolarHBondContact O-N 3.1Å; T1233-L1237 HydrophobicContact CG2-CD1 4.45Å; T1233-L1237 WeakPolarHBondContact O-CG 3.46Å; T1233-L1237 PolarHBondContact O-N 3.46Å
1234V72.8Confident69.4Low16 Ų1689.9 Ų89.910%0.09747%0.474CS..Hα-helixtrans-64.2-40.1175.2170.70000111.6L1191 I1198 L1230 N1231 L1237 Q1238L1191-V1234 HydrophobicContact CD1-CG1 4.47Å; I1198-V1234 HydrophobicContact CD1-CG2 4.31Å; L1230-V1234 WeakPolarHBondContact O-CG2 3.48Å; L1230-V1234 PolarHBondContact O-N 3.3Å; N1231-V1234 PolarHBondContact O-N 3.31Å; V1234-L1237 PolarHBondContact O-N 3Å; V1234-Q1238 PolarHBondContact O-N 3.32Å
1235T73.2Confident70.1Confident77 Ų7785 Ų8547%0.47245%0.454SS..Hα-helixtrans-63.9-42.4175.5-49.40000111.9N1231 Q1232 L1237 Q1238 Q1239N1231-T1235 PolarHBondContact O-N 3.26Å; N1231-T1235 PolarHBondContact O-OG1 3.21Å; Q1232-T1235 PolarHBondContact O-N 3.01Å; T1235-L1237 VanDerWaalsContact C-N 3.34Å; T1235-L1237 PolarHBondContact O-N 2.62Å; T1235-Q1238 PolarHBondContact O-N 3.4Å; T1235-Q1239 PolarHBondContact O-N 2.99Å
1236Q76Confident71Confident112 Ų11285.4 Ų85.452%0.52345%0.449SS..Hα-helixtrans-62.5-40.2175-72.8174.2-200112.2Q1232 T1233 Q1239 L1240Q1232-Q1236 WeakPolarHBondContact O-CG 3.39Å; Q1232-Q1236 PolarHBondContact O-N 3.17Å; Q1232-Q1236 VanDerWaalsContact O-N 3.08Å; T1233-Q1236 PolarHBondContact O-N 3.1Å; Q1236-Q1239 PolarHBondContact O-N 3.17Å; Q1236-L1240 PolarHBondContact O-N 3.14Å
1237L77.1Confident71.7Confident91 Ų9185.5 Ų85.548%0.47645%0.448SS..Hα-helixtrans-64.3-39.7174.6-75.6167.7000112.5T1233 V1234 T1235 Q1239 L1241T1233-L1237 HydrophobicContact CG2-CD1 4.45Å; T1233-L1237 WeakPolarHBondContact O-CG 3.46Å; T1233-L1237 PolarHBondContact O-N 3.46Å; V1234-L1237 PolarHBondContact O-N 3Å; T1235-L1237 VanDerWaalsContact C-N 3.34Å; T1235-L1237 PolarHBondContact O-N 2.62Å; L1237-Q1239 VanDerWaalsContact C-N 3.34Å; L1237-L1241 VanDerWaalsContact O-CB 3.25Å; L1237-L1241 WeakPolarHBondContact O-CB 3.28Å; L1237-L1241 PolarHBondContact O-N 3.48Å
1238Q73.1Confident71.9Confident58 Ų5886 Ų8627%0.27145%0.445SS..Hα-helixtrans-63.1-39.7173-76.9-177.3-47.100112.1L1191 V1234 T1235 L1241 Q1242L1191-Q1238 HydrophobicContact CD2-CG 3.69Å; L1191-Q1238 HydrophobicContact CG-CG 4.39Å; V1234-Q1238 PolarHBondContact O-N 3.32Å; T1235-Q1238 PolarHBondContact O-N 3.4Å; Q1238-L1241 PolarHBondContact O-N 3.4Å; Q1238-Q1242 WeakPolarHBondContact O-CB 3.35Å; Q1238-Q1242 PolarHBondContact O-N 2.84Å
1239Q77.3Confident71.7Confident124 Ų12486.4 Ų86.458%0.57945%0.448SS*.Hα-helixtrans-69.7-42.3-178.3-1621634.500111.9T1235 Q1236 L1237 L1241 Q1242 E1243T1235-Q1239 PolarHBondContact O-N 2.99Å; Q1236-Q1239 PolarHBondContact O-N 3.17Å; L1237-Q1239 VanDerWaalsContact C-N 3.34Å; Q1239-L1241 PolarHBondContact O-N 3.22Å; Q1239-Q1242 PolarHBondContact O-N 3.19Å; Q1239-E1243 PolarHBondContact O-N 3.28Å
1240L78Confident71.2Confident100 Ų10090.7 Ų90.752%0.52446%0.458SS..Hα-helixtrans-61.5-41.1170.8-75.4167.8000112.1Q1236 Q1242 E1243 V1244Q1236-L1240 PolarHBondContact O-N 3.14Å; L1240-Q1242 VanDerWaalsContact C-N 3.26Å; L1240-Q1242 PolarHBondContact O-N 3Å; L1240-E1243 PolarHBondContact O-N 2.9Å; L1240-V1244 WeakPolarHBondContact O-CG2 3.47Å; L1240-V1244 PolarHBondContact O-N 3.22Å
1241L76Confident70.2Confident29 Ų2993.5 Ų93.515%0.15247%0.469CS..Hα-helixtrans-65.9-30.1177.5-164.864.4000112.1L1184 Q1188 L1191 L1237 Q1238 Q1239 N1245L1184-L1241 HydrophobicContact CD1-CD1 3.53Å; Q1188-L1241 HydrophobicContact CB-CD2 4.44Å; L1191-L1241 HydrophobicContact CD2-CD2 3.73Å; L1237-L1241 VanDerWaalsContact O-CB 3.25Å; L1237-L1241 WeakPolarHBondContact O-CB 3.28Å; L1237-L1241 PolarHBondContact O-N 3.48Å; Q1238-L1241 PolarHBondContact O-N 3.4Å; Q1239-L1241 PolarHBondContact O-N 3.22Å; L1241-N1245 PolarHBondContact O-N 3.37Å; L1241-N1245 VanDerWaalsContact O-N 3.15Å; L1241-N1245 PolarHBondContact O-ND2 2.91Å
1242Q75.6Confident68.9Low127 Ų12798 Ų9859%0.59350%0.499SS*.Hα-helixtrans-75.6-37.1173.6-167.7172.67.400112.4Q1238 Q1239 L1240 N1245 Q1246Q1238-Q1242 WeakPolarHBondContact O-CB 3.35Å; Q1238-Q1242 PolarHBondContact O-N 2.84Å; Q1239-Q1242 PolarHBondContact O-N 3.19Å; L1240-Q1242 VanDerWaalsContact C-N 3.26Å; L1240-Q1242 PolarHBondContact O-N 3Å; Q1242-N1245 PolarHBondContact O-N 3.14Å; Q1242-Q1246 PolarHBondContact O-N 3.49Å
1243E76.2Confident68.7Low122 Ų12296.9 Ų96.957%0.5750%0.496SS*.Hα-helixtrans-64.2-44.4171.3-80.3-173.8137.500112.2Q1239 L1240 N1245 Q1246 Q1247Q1239-E1243 PolarHBondContact O-N 3.28Å; L1240-E1243 PolarHBondContact O-N 2.9Å; E1243-N1245 VanDerWaalsContact C-N 3.34Å; E1243-N1245 PolarHBondContact O-N 3.46Å; E1243-Q1246 CarbonylContact O-C 3.55Å; E1243-Q1246 PolarHBondContact O-N 3.17Å; E1243-Q1246 VanDerWaalsContact O-N 3.09Å; E1243-Q1247 PolarHBondContact O-N 3.28Å
1244V74.9Confident68.4Low67 Ų6798.6 Ų98.641%0.40650%0.501SS..Hα-helixtrans-60.8-42.6175.8170.40000111.2L1240 Q1246 Q1247 L1248L1240-V1244 WeakPolarHBondContact O-CG2 3.47Å; L1240-V1244 PolarHBondContact O-N 3.22Å; V1244-Q1246 VanDerWaalsContact C-N 3.33Å; V1244-Q1246 PolarHBondContact O-N 3.47Å; V1244-Q1247 PolarHBondContact O-N 3.16Å; V1244-L1248 PolarHBondContact O-N 3.23Å
1245N67.1Low68.2Low62 Ų62103.2 Ų103.233%0.33252%0.524SS..Hα-helixtrans-62.5-37.1173.1-88.2-67.8000112.9L1184 L1241 Q1242 E1243 L1248 T1249L1184-N1245 WeakPolarHBondContact CD2-OD1 3.42Å; L1241-N1245 PolarHBondContact O-N 3.37Å; L1241-N1245 VanDerWaalsContact O-N 3.15Å; L1241-N1245 PolarHBondContact O-ND2 2.91Å; Q1242-N1245 PolarHBondContact O-N 3.14Å; E1243-N1245 VanDerWaalsContact C-N 3.34Å; E1243-N1245 PolarHBondContact O-N 3.46Å; N1245-L1248 PolarHBondContact O-N 3.39Å; N1245-T1249 PolarHBondContact O-N 3.07Å; N1245-T1249 VanDerWaalsContact O-N 3.16Å; N1245-T1249 PolarHBondContact O-OG1 3.46Å
1246Q72.9Confident67.9Low104 Ų104104.8 Ų104.849%0.48653%0.527SS..Hα-helixtrans-72.3-26.5175.2-81.1-164.911.700114Q1242 E1243 V1244 T1249 K1250Q1242-Q1246 PolarHBondContact O-N 3.49Å; E1243-Q1246 CarbonylContact O-C 3.55Å; E1243-Q1246 PolarHBondContact O-N 3.17Å; E1243-Q1246 VanDerWaalsContact O-N 3.09Å; V1244-Q1246 VanDerWaalsContact C-N 3.33Å; V1244-Q1246 PolarHBondContact O-N 3.47Å; Q1246-T1249 WeakPolarHBondContact CA-OG1 3.32Å; Q1246-K1250 WeakPolarHBondContact O-CD 3.47Å; Q1246-K1250 VanDerWaalsContact O-CG 3.29Å; Q1246-K1250 WeakPolarHBondContact O-CG 3.45Å
1247Q68.9Low67.4Low134 Ų134104.3 Ų104.363%0.62653%0.527SS*.Hα-helixtrans-72.7-45.5170-79.2-178.9-34.700110.7E1243 V1244 T1249 K1250 E1251E1243-Q1247 PolarHBondContact O-N 3.28Å; V1244-Q1247 PolarHBondContact O-N 3.16Å; Q1247-T1249 PolarHBondContact O-N 3.25Å; Q1247-K1250 PolarHBondContact O-N 3.12Å; Q1247-E1251 PolarHBondContact O-N 2.64Å
1248L62.6Low66.8Low74 Ų74105.2 Ų105.239%0.38753%0.53SS..Hα-helixtrans-59.8-32.3178.8-126.676.3000113.4L1184 V1244 N1245L1184-L1248 HydrophobicContact CD2-CD2 4.3Å; V1244-L1248 PolarHBondContact O-N 3.23Å; N1245-L1248 PolarHBondContact O-N 3.39Å
1249T57.8Low66.3Low99 Ų99108.6 Ų108.661%0.60755%0.549SS*.THydrogen-bonded Turntrans-85.90.6176.139.20000114.6N1245 Q1246 Q1247N1245-T1249 PolarHBondContact O-N 3.07Å; N1245-T1249 VanDerWaalsContact O-N 3.16Å; N1245-T1249 PolarHBondContact O-OG1 3.46Å; Q1246-T1249 WeakPolarHBondContact CA-OG1 3.32Å; Q1247-T1249 PolarHBondContact O-N 3.25Å
1250K52.7Low65.5Low156 Ų156107.4 Ų107.468%0.67855%0.547SS*.THydrogen-bonded Turntrans-104.6-10.7173-76172.9-1761670113.7Q1246 Q1247Q1246-K1250 WeakPolarHBondContact O-CD 3.47Å; Q1246-K1250 VanDerWaalsContact O-CG 3.29Å; Q1246-K1250 WeakPolarHBondContact O-CG 3.45Å; Q1247-K1250 PolarHBondContact O-N 3.12Å
1251E46.5Very low64.4Low159 Ų159108 Ų10874%0.74355%0.548SS*.  trans-10711.2177.4-65.5-169.9153.700113.5Q1247Q1247-E1251 PolarHBondContact O-N 2.64Å
1252T41.8Very low63.4Low163 Ų163115.2 Ų115.2100%158%0.584SS**  trans-97.70163.454.20000110.7

Retrieved 1,252 of 1,252 residues in 301.8 ms (Link to these results)