A0A087Y139_POEFO Loading...

BMERB domain containing 1

AlphaFold DB , UniProt , Accession A0A087Y139, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 199 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
1M39.6Very low44.1Very low247 Ų247145.2 Ų145.2100%1.21772%0.72SS**  0660-72.6-168.4-149.900109.8
2E48.1Very low44.3Very low182 Ų182148.3 Ų148.385%0.8572%0.717SS**  trans-130.67.3-173.9-74.1-175146.300114.7
3M42.2Very low44.6Very low163 Ų163142.8 Ų142.880%0.80371%0.711SS**SBendtrans-91.9-0.6179.1-72.1-170.5173.100114.8F7M3-F7 VanDerWaalsContact O-CD2 3.29Å; M3-F7 WeakPolarHBondContact O-CD2 3.09Å; M3-F7 WeakPolarHBondContact O-CE2 3.39Å
4K46.3Very low44.9Very low201 Ų201142.1 Ų142.187%0.87471%0.71SS**SBendtrans-92.1-11.7-177.9-80.6-173.1171.3-176.10114.6
5K47.6Very low45.8Very low177 Ų177147.5 Ų147.577%0.7772%0.719SS**SBendtrans-90.6-19.5-174-137.4175.8-175.8-178.30113.8
6S45.9Very low47.3Very low71 Ų71140.9 Ų140.950%0.49769%0.692SS.*Hα-helixtrans-81.3-22.6-178.749.10000114T10S6-T10 PolarHBondContact O-OG1 3.06Å
7F38.9Very low49.2Very low138 Ų138135.4 Ų135.461%0.60566%0.662SS**Hα-helixtrans-78.6-33.3-175.3-71.6-77.8000113.8M3 D9 T10 E11M3-F7 VanDerWaalsContact O-CD2 3.29Å; M3-F7 WeakPolarHBondContact O-CD2 3.09Å; M3-F7 WeakPolarHBondContact O-CE2 3.39Å; F7-D9 PolarHBondContact O-N 2.7Å; F7-T10 WeakPolarHBondContact CA-OG1 3.49Å; F7-T10 PolarHBondContact O-N 3.25Å; F7-T10 PolarHBondContact O-OG1 3.35Å; F7-E11 PolarHBondContact O-N 2.79Å
8S46.1Very low51Low68 Ų68128.3 Ų128.348%0.47663%0.63SS.*Hα-helixtrans-70.3-34.3-176.870.60000113.1R12S8-R12 PolarHBondContact O-N 3.36Å
9D43.7Very low52.6Low118 Ų118122.9 Ų122.963%0.63161%0.608SS**Hα-helixtrans-74.4-34.2-179.8-67.6-14.5000111.1F7 A13F7-D9 PolarHBondContact O-N 2.7Å; D9-A13 WeakPolarHBondContact O-CB 3.25Å; D9-A13 PolarHBondContact O-N 3.35Å
10T44Very low53.9Low75 Ų75117.9 Ų117.946%0.4659%0.585SS.*Hα-helixtrans-70.1-40.1172.430.50000113.3S6 F7 R12 A13 L14S6-T10 PolarHBondContact O-OG1 3.06Å; F7-T10 WeakPolarHBondContact CA-OG1 3.49Å; F7-T10 PolarHBondContact O-N 3.25Å; F7-T10 PolarHBondContact O-OG1 3.35Å; T10-R12 PolarHBondContact O-N 2.87Å; T10-A13 PolarHBondContact O-N 3.5Å; T10-L14 WeakPolarHBondContact O-CB 3.5Å; T10-L14 WeakPolarHBondContact O-CD1 3.49Å; T10-L14 PolarHBondContact O-N 3.41Å; T10-L14 VanDerWaalsContact O-N 3.11Å
11E42.7Very low54.5Low157 Ų157117.4 Ų117.473%0.73459%0.593SS**Hα-helixtrans-66.9-36.5178.8-90.9-171.9143.600112.7F7 L14F7-E11 PolarHBondContact O-N 2.79Å; E11-L14 PolarHBondContact O-N 3.45Å
12R47Very low55.7Low182 Ų182111.7 Ų111.769%0.68756%0.563SS**Hα-helixtrans-71.6-33.1178.1-156.4176.7-158.7166.51.9112.4S8 T10 L14S8-R12 PolarHBondContact O-N 3.36Å; T10-R12 PolarHBondContact O-N 2.87Å; R12-L14 VanDerWaalsContact C-N 3.33Å
13A47.2Very low56.3Low78 Ų78106.4 Ų106.465%0.64554%0.543SS*.Hα-helixtrans-75.1-20.2174.700000113.4D9 T10 R15D9-A13 WeakPolarHBondContact O-CB 3.25Å; D9-A13 PolarHBondContact O-N 3.35Å; T10-A13 PolarHBondContact O-N 3.5Å; A13-R15 VanDerWaalsContact C-N 3.32Å; A13-R15 PolarHBondContact O-N 3.03Å
14L49.7Very low57Low132 Ų132101.7 Ų101.769%0.69153%0.53SS*.THydrogen-bonded Turntrans-78.6-7.9-170.3-116.9121000114.9T10 E11 R12T10-L14 WeakPolarHBondContact O-CB 3.5Å; T10-L14 WeakPolarHBondContact O-CD1 3.49Å; T10-L14 PolarHBondContact O-N 3.41Å; T10-L14 VanDerWaalsContact O-N 3.11Å; E11-L14 PolarHBondContact O-N 3.45Å; R12-L14 VanDerWaalsContact C-N 3.33Å
15R58Low57.4Low223 Ų22399.7 Ų99.784%0.84252%0.517SS*.THydrogen-bonded Turntrans-149.855.7-178.8-62.2-174.2-176.1-96.4-0.9112.8A13A13-R15 VanDerWaalsContact C-N 3.32Å; A13-R15 PolarHBondContact O-N 3.03Å
16S69.2Low57.8Low42 Ų4297.1 Ų97.129%0.29452%0.517SS..  trans-130.9123.6165.7-1730000109.6G18 E66S16-G18 PolarHBondContact O-N 3.35Å; S16-G18 PolarHBondContact OG-N 3.02Å; S16-G18 PolarHBondContact OG-O 3.35Å; S16-E66 WeakPolarHBondContact CA-OE1 3.3Å; S16-E66 WeakPolarHBondContact CB-OE1 3.46Å; S16-E66 PolarHBondContact OG-OE1 3.44Å
17Y80.5Confident57.9Low47 Ų4799.3 Ų99.318%0.18453%0.527CS..SBendtrans-81.92.1174.7-73.1-72.3000111.7E66 F69 M70 D73 L123 A127Y17-E66 PolarHBondContact N-OE1 3.39Å; Y17-E66 VanDerWaalsContact N-OE1 3.11Å; Y17-F69 HydrophobicContact CD1-CB 4.33Å; Y17-F69 HydrophobicContact CD2-CB 4.12Å; Y17-F69 HydrophobicContact CG-CB 3.94Å; Y17-M70 HydrophobicContact CD2-CB 4.4Å; Y17-M70 HydrophobicContact CD2-CG 3.4Å; Y17-M70 HydrophobicContact CE2-CB 4.36Å; Y17-M70 HydrophobicContact CE2-CG 3.62Å; Y17-D73 WeakPolarHBondContact OH-CB 3.41Å; Y17-D73 VanDerWaalsContact OH-CG 3.23Å; Y17-D73 PolarHBondContact OH-OD2 3.34Å; Y17-L123 HydrophobicContact CE1-CD2 4.18Å; Y17-A127 HydrophobicContact CD1-CB 3.39Å; Y17-A127 HydrophobicContact CE1-CB 4.1Å; Y17-A127 HydrophobicContact CG-CB 4.19Å
18G81.1Confident58.4Low8 Ų899.2 Ų99.28%0.08253%0.533CS..SBendtrans-132.1169-176.200000113S16S16-G18 PolarHBondContact O-N 3.35Å; S16-G18 PolarHBondContact OG-N 3.02Å; S16-G18 PolarHBondContact OG-O 3.35Å
19A81Confident58.4Low26 Ų26106.1 Ų106.122%0.21555%0.554CS.*SBendtrans-87.4-13.817900000113.1S21 R131 E134A19-S21 PolarHBondContact O-N 2.87Å; A19-S21 VanDerWaalsContact O-N 3.1Å; A19-S21 PolarHBondContact O-OG 3.38Å; A19-R131 HydrophobicContact CB-CG 4.27Å; A19-E134 HydrophobicContact CB-CB 3.71Å; A19-E134 WeakPolarHBondContact CB-OE2 3.36Å; A19-E134 PolarHBondContact N-OE2 3.21Å
20V78.6Confident58.7Low23 Ų23103.8 Ų103.814%0.13956%0.558CS.*  trans-65109.2-177.9179.80000110.7T23 V59 R62V20-T23 HydrophobicContact CG1-CG2 4.03Å; V20-V59 HydrophobicContact CG1-CG1 3.95Å; V20-R62 HydrophobicContact CG2-CB 3.7Å; V20-R62 HydrophobicContact CG2-CG 4.48Å
21S67.3Low58.9Low107 Ų107106.9 Ų106.975%0.74857%0.567SS**  trans-80.3-32.9-175.6-39.30000113.4A19A19-S21 PolarHBondContact O-N 2.87Å; A19-S21 VanDerWaalsContact O-N 3.1Å; A19-S21 PolarHBondContact O-OG 3.38Å
22E64.4Low59.1Low128 Ų128103.9 Ų103.960%0.59856%0.564SS**  trans-151.7134.3-175.1-172.3158.5-141.400110.7A24E22-A24 HydrophobicContact CG-CB 3.68Å
23T61Low59.3Low71 Ų71102.7 Ų102.744%0.43657%0.571SS.*  trans-107.5-4.6170.5580000111.7V20 W25 V59V20-T23 HydrophobicContact CG1-CG2 4.03Å; T23-W25 PolarHBondContact O-N 2.83Å; T23-V59 HydrophobicContact CG2-CG1 3.98Å
24A56.5Low59.7Low63 Ų63104.9 Ų104.952%0.52158%0.576SS.*  trans-67.4119.3-179.600000109.2E22 T26E22-A24 HydrophobicContact CG-CB 3.68Å; A24-T26 PolarHBondContact O-N 3Å
25W54.2Low59.8Low159 Ų159102.5 Ų102.560%0.60257%0.57SS**  trans-69117170.7-8278.2000108.7T23 T27 L56T23-W25 PolarHBondContact O-N 2.83Å; W25-T27 PolarHBondContact O-N 3.24Å; W25-L56 HydrophobicContact CZ2-CB 3.82Å; W25-L56 HydrophobicContact CZ2-CD1 3.63Å; W25-L56 HydrophobicContact CZ2-CD2 3.65Å; W25-L56 HydrophobicContact CZ2-CG 3.84Å
26T56.1Low59.7Low124 Ų124100.4 Ų100.476%0.76157%0.572SS**  trans-72.4105153.348.50000105.1A24 D28A24-T26 PolarHBondContact O-N 3Å; T26-D28 PolarHBondContact O-N 3.26Å
27T49.1Very low59.1Low117 Ų117101.5 Ų101.572%0.71858%0.584SS**  trans-58.2101.1158.427.10000104.9W25 K29W25-T27 PolarHBondContact O-N 3.24Å; T27-K29 PolarHBondContact O-N 3.49Å
28D48.4Very low57.9Low136 Ų136108.5 Ų108.573%0.72762%0.618SS**  trans-50.7118.9165-161.311.9000104.7T26 G30T26-D28 PolarHBondContact O-N 3.26Å; D28-G30 PolarHBondContact O-N 3.29Å
29K45.9Very low56.9Low212 Ų212112.4 Ų112.492%0.92264%0.644SS**THydrogen-bonded Turntrans-66.478.3-171.5-72.6-175.4176.5-176.80107.8T27T27-K29 PolarHBondContact O-N 3.49Å
30G50.4Low56.6Low70 Ų70118 Ų11872%0.72268%0.676SS**THydrogen-bonded Turntrans-172.4-22.8-166.200000115.8D28D28-G30 PolarHBondContact O-N 3.29Å
31H49.3Very low56.6Low140 Ų140120.5 Ų120.565%0.64869%0.687SS**  trans-114.1105.6174-126.7-83000111.3
32S47.1Very low57.6Low94 Ų94117.5 Ų117.566%0.65767%0.666SS**  trans-55.8161.3173.857.20000111.9V34S32-V34 PolarHBondContact O-N 3.4Å
33D49.7Very low58.7Low157 Ų157116.1 Ų116.184%0.8467%0.669SS**  trans-20.4125155.5-85.3-39.7000111.9S35D33-S35 PolarHBondContact O-N 3.38Å
34V55.4Low60.1Low123 Ų123119.7 Ų119.775%0.74568%0.68SS**  trans-6586.1171.4-178.20000107.1S32 M36S32-V34 PolarHBondContact O-N 3.4Å; V34-M36 HydrophobicContact CG1-SD 4.28Å; V34-M36 PolarHBondContact O-N 3.03Å; V34-M36 VanDerWaalsContact O-N 3.15Å
35S52Low61.5Low82 Ų82121.2 Ų121.257%0.57368%0.676SS**  trans-66108.8166.6-176.50000106.5D33 A37D33-S35 PolarHBondContact O-N 3.38Å; S35-A37 PolarHBondContact O-N 2.91Å
36M57.1Low63.2Low180 Ų180117.6 Ų117.689%0.88767%0.668SS**  trans-66.19.9176.4-66.1-74.6-84.800113.1V34 E38V34-M36 HydrophobicContact CG1-SD 4.28Å; V34-M36 PolarHBondContact O-N 3.03Å; V34-M36 VanDerWaalsContact O-N 3.15Å; M36-E38 PolarHBondContact O-N 3.14Å
37A55.5Low64.8Low65 Ų65117.4 Ų117.454%0.53766%0.658SS.*SBendtrans-86.5100.817600000110S35 S39S35-A37 PolarHBondContact O-N 2.91Å; A37-S39 VanDerWaalsContact C-N 3.33Å; A37-S39 PolarHBondContact O-N 2.69Å
38E55Low66.7Low193 Ų193115.1 Ų115.190%0.90264%0.644SS**  trans39.544.6155.4-71.7-177.615300117.9M36 T40M36-E38 PolarHBondContact O-N 3.14Å; E38-T40 PolarHBondContact O-N 3.34Å
39S61.5Low68.6Low91 Ų91111.7 Ų111.764%0.63662%0.624SS**  trans-85.8100.5163.2-65.40000108.7A37 M41A37-S39 VanDerWaalsContact C-N 3.33Å; A37-S39 PolarHBondContact O-N 2.69Å; S39-M41 VanDerWaalsContact C-N 3.27Å; S39-M41 PolarHBondContact O-N 3.14Å
40T74.1Confident70.7Confident144 Ų144106.8 Ų106.888%0.88361%0.606SS**  trans-7091.1165.529.50000107.7E38 S42E38-T40 PolarHBondContact O-N 3.34Å; T40-S42 PolarHBondContact O-N 3.49Å
41M77.7Confident72.5Confident74 Ų74106.5 Ų106.537%0.36560%0.596SS.*  trans-57.3132.6173.8-62.7-70-87.400108.8S39 E45 I46 E49S39-M41 VanDerWaalsContact C-N 3.27Å; S39-M41 PolarHBondContact O-N 3.14Å; M41-E45 HydrophobicContact CB-CB 4.43Å; M41-E45 HydrophobicContact CE-CB 3.91Å; M41-I46 HydrophobicContact CB-CD1 4.27Å; M41-I46 HydrophobicContact CB-CG1 3.75Å; M41-E49 HydrophobicContact CE-CG 4.22Å
42S88.4Confident74.3Confident45 Ų45104.9 Ų104.932%0.31559%0.585SS.*  trans-64.7154.2172.765.20000110.3T40 E44 E45 I46T40-S42 PolarHBondContact O-N 3.49Å; S42-E44 PolarHBondContact O-N 3.3Å; S42-E45 PolarHBondContact N-OE2 2.92Å; S42-E45 PolarHBondContact O-N 3.41Å; S42-E45 VanDerWaalsContact OG-CG 3.23Å; S42-E45 WeakPolarHBondContact OG-CG 3.31Å; S42-E45 PolarHBondContact OG-N 3.12Å; S42-E45 PolarHBondContact OG-OE2 3.43Å; S42-I46 WeakPolarHBondContact O-CG1 3.3Å; S42-I46 PolarHBondContact O-N 3.45Å
43P89.1Confident76.3Confident99 Ų99105.7 Ų105.764%0.64358%0.581SS**Hα-helixtrans-53.3-37.6177.4-27.635.5000113.4I46 E47P43-I46 PolarHBondContact O-N 3.49Å; P43-E47 WeakPolarHBondContact O-CG 3.5Å; P43-E47 PolarHBondContact O-N 2.91Å
44E89.9Confident78.2Confident145 Ų145102.4 Ų102.468%0.67856%0.56SS**Hα-helixtrans-64-42.6177-162.9101.2-173.100112.1S42 I46 E47 V48S42-E44 PolarHBondContact O-N 3.3Å; E44-I46 VanDerWaalsContact C-N 3.33Å; E44-I46 PolarHBondContact O-N 3.09Å; E44-E47 PolarHBondContact O-N 3.26Å; E44-V48 WeakPolarHBondContact O-CG2 3.5Å; E44-V48 PolarHBondContact O-N 3.28Å
45E86.5Confident79.8Confident95 Ų95105.5 Ų105.544%0.44456%0.558SS.*Hα-helixtrans-66.2-36.9177-71.7161.5163.900111.5M41 S42 V48 E49M41-E45 HydrophobicContact CB-CB 4.43Å; M41-E45 HydrophobicContact CE-CB 3.91Å; S42-E45 PolarHBondContact N-OE2 2.92Å; S42-E45 PolarHBondContact O-N 3.41Å; S42-E45 VanDerWaalsContact OG-CG 3.23Å; S42-E45 WeakPolarHBondContact OG-CG 3.31Å; S42-E45 PolarHBondContact OG-N 3.12Å; S42-E45 PolarHBondContact OG-OE2 3.43Å; E45-V48 PolarHBondContact O-N 2.98Å; E45-E49 WeakPolarHBondContact O-CG 3.37Å; E45-E49 PolarHBondContact O-N 3Å
46I89.4Confident81.6Confident83 Ų83104.1 Ų104.143%0.42654%0.544SS..Hα-helixtrans-63.3-44.1174.1-63.6170.3000110.3M41 S42 P43 E44 V48 E49 M50M41-I46 HydrophobicContact CB-CD1 4.27Å; M41-I46 HydrophobicContact CB-CG1 3.75Å; S42-I46 WeakPolarHBondContact O-CG1 3.3Å; S42-I46 PolarHBondContact O-N 3.45Å; P43-I46 PolarHBondContact O-N 3.49Å; E44-I46 VanDerWaalsContact C-N 3.33Å; E44-I46 PolarHBondContact O-N 3.09Å; I46-V48 VanDerWaalsContact C-N 3.34Å; I46-V48 PolarHBondContact O-N 3.46Å; I46-E49 PolarHBondContact O-N 3.37Å; I46-M50 HydrophobicContact CG2-CE 4.23Å; I46-M50 HydrophobicContact CG2-CG 4.33Å; I46-M50 HydrophobicContact CG2-SD 4.39Å; I46-M50 WeakPolarHBondContact O-CB 3.25Å; I46-M50 VanDerWaalsContact O-CG 3.31Å; I46-M50 WeakPolarHBondContact O-CG 3.4Å; I46-M50 PolarHBondContact O-N 2.99Å
47E90.3Very high83.3Confident120 Ų120102.5 Ų102.556%0.56153%0.528SS*.Hα-helixtrans-60.8-41.6176.8-73.7178.2-168.800112.4P43 E44 M50 A51P43-E47 WeakPolarHBondContact O-CG 3.5Å; P43-E47 PolarHBondContact O-N 2.91Å; E44-E47 PolarHBondContact O-N 3.26Å; E47-M50 HydrophobicContact CB-CE 4.48Å; E47-M50 HydrophobicContact CG-CE 4.05Å; E47-M50 PolarHBondContact O-N 3.47Å; E47-A51 PolarHBondContact O-N 3.36Å
48V88Confident85Confident70 Ų70102.2 Ų102.242%0.42452%0.516SS..Hα-helixtrans-63.1-45.5175.5172.30000111.4E44 E45 I46 A51 R52E44-V48 WeakPolarHBondContact O-CG2 3.5Å; E44-V48 PolarHBondContact O-N 3.28Å; E45-V48 PolarHBondContact O-N 2.98Å; I46-V48 VanDerWaalsContact C-N 3.34Å; I46-V48 PolarHBondContact O-N 3.46Å; V48-A51 PolarHBondContact O-N 3.35Å; V48-R52 WeakPolarHBondContact O-CG 3.37Å; V48-R52 PolarHBondContact O-N 3.46Å
49E87.8Confident86.7Confident64 Ų6494.6 Ų94.630%0.29948%0.482SS..Hα-helixtrans-66.9-38.5177.8-72.1-54.2133.900112.5M41 E45 I46 A51 R52 I53M41-E49 HydrophobicContact CE-CG 4.22Å; E45-E49 WeakPolarHBondContact O-CG 3.37Å; E45-E49 PolarHBondContact O-N 3Å; I46-E49 PolarHBondContact O-N 3.37Å; E49-A51 VanDerWaalsContact C-N 3.34Å; E49-A51 PolarHBondContact O-N 3.38Å; E49-R52 WeakPolarHBondContact O-CB 3.4Å; E49-R52 PolarHBondContact O-N 3.4Å; E49-R52 WeakPolarHBondContact OE1-CD 3.39Å; E49-R52 IonicContact OE1-CZ 3.48Å; E49-R52 IonicContact OE1-NE 3.73Å; E49-R52 IonicContact OE1-NH1 3.15Å; E49-R52 PolarHBondContact OE1-NH1 2.99Å; E49-I53 WeakPolarHBondContact O-CG1 3.43Å; E49-I53 PolarHBondContact O-N 3.4Å
50M90.1Very high88.1Confident108 Ų10894.9 Ų94.953%0.53248%0.476SS..Hα-helixtrans-60.2-43.4173.2-74.5-168.2-59.100111.7I46 E47 R52 I53 Q54I46-M50 HydrophobicContact CG2-CE 4.23Å; I46-M50 HydrophobicContact CG2-CG 4.33Å; I46-M50 HydrophobicContact CG2-SD 4.39Å; I46-M50 WeakPolarHBondContact O-CB 3.25Å; I46-M50 VanDerWaalsContact O-CG 3.31Å; I46-M50 WeakPolarHBondContact O-CG 3.4Å; I46-M50 PolarHBondContact O-N 2.99Å; E47-M50 HydrophobicContact CB-CE 4.48Å; E47-M50 HydrophobicContact CG-CE 4.05Å; E47-M50 PolarHBondContact O-N 3.47Å; M50-R52 VanDerWaalsContact C-N 3.32Å; M50-R52 PolarHBondContact O-N 2.97Å; M50-I53 PolarHBondContact O-N 3.32Å; M50-Q54 WeakPolarHBondContact O-CB 3.34Å; M50-Q54 PolarHBondContact O-N 2.9Å
51A87.9Confident89Confident64 Ų6490.9 Ų90.953%0.52945%0.452SS..Hα-helixtrans-63.1-38.4175.900000112E47 V48 E49 Q54 R55E47-A51 PolarHBondContact O-N 3.36Å; V48-A51 PolarHBondContact O-N 3.35Å; E49-A51 VanDerWaalsContact C-N 3.34Å; E49-A51 PolarHBondContact O-N 3.38Å; A51-Q54 PolarHBondContact O-N 2.93Å; A51-R55 PolarHBondContact O-N 3.26Å
52R87.9Confident89.8Confident107 Ų10789.1 Ų89.140%0.40444%0.441SS..Hα-helixtrans-62.9-46.8173.9-72172.4-177.2-170.7-1.9111.9V48 E49 M50 Q54 R55 L56V48-R52 WeakPolarHBondContact O-CG 3.37Å; V48-R52 PolarHBondContact O-N 3.46Å; E49-R52 WeakPolarHBondContact O-CB 3.4Å; E49-R52 PolarHBondContact O-N 3.4Å; E49-R52 WeakPolarHBondContact OE1-CD 3.39Å; E49-R52 IonicContact OE1-CZ 3.48Å; E49-R52 IonicContact OE1-NE 3.73Å; E49-R52 IonicContact OE1-NH1 3.15Å; E49-R52 PolarHBondContact OE1-NH1 2.99Å; M50-R52 VanDerWaalsContact C-N 3.32Å; M50-R52 PolarHBondContact O-N 2.97Å; R52-Q54 VanDerWaalsContact C-N 3.34Å; R52-Q54 PolarHBondContact O-N 2.9Å; R52-R55 PolarHBondContact O-N 3.11Å; R52-L56 PolarHBondContact O-N 3.46Å
53I89Confident89.9Confident111 Ų11191.4 Ų91.457%0.56944%0.443SS*.Hα-helixtrans-61-44.3177.7-69.9166.4000110.7E49 M50 R55 L56 R57E49-I53 WeakPolarHBondContact O-CG1 3.43Å; E49-I53 PolarHBondContact O-N 3.4Å; M50-I53 PolarHBondContact O-N 3.32Å; I53-R55 PolarHBondContact O-N 3.3Å; I53-L56 WeakPolarHBondContact O-CB 3.26Å; I53-L56 PolarHBondContact O-N 2.89Å; I53-R57 WeakPolarHBondContact O-CB 3.41Å; I53-R57 PolarHBondContact O-N 2.88Å
54Q90.1Very high90.2Very high88 Ų8891.9 Ų91.941%0.41144%0.436SS..Hα-helixtrans-61.2-45.6178.7-17959.129.800111.5M50 A51 R52 L56 R57 E58M50-Q54 WeakPolarHBondContact O-CB 3.34Å; M50-Q54 PolarHBondContact O-N 2.9Å; A51-Q54 PolarHBondContact O-N 2.93Å; R52-Q54 VanDerWaalsContact C-N 3.34Å; R52-Q54 PolarHBondContact O-N 2.9Å; Q54-L56 VanDerWaalsContact C-N 3.33Å; Q54-L56 PolarHBondContact O-N 3.36Å; Q54-R57 WeakPolarHBondContact O-CB 3.27Å; Q54-R57 PolarHBondContact O-N 3.33Å; Q54-E58 PolarHBondContact NE2-OE1 3.08Å; Q54-E58 WeakPolarHBondContact O-CG 3.42Å; Q54-E58 PolarHBondContact O-N 2.99Å
55R89.4Confident90.4Very high188 Ų18885.9 Ų85.971%0.70941%0.41SS*.Hα-helixtrans-60.5-42.4175.3-173.6-179.9-175.8-130.6-0.5111.9A51 R52 I53 R57 E58 V59A51-R55 PolarHBondContact O-N 3.26Å; R52-R55 PolarHBondContact O-N 3.11Å; I53-R55 PolarHBondContact O-N 3.3Å; R55-R57 VanDerWaalsContact C-N 3.35Å; R55-E58 PolarHBondContact O-N 3.42Å; R55-V59 WeakPolarHBondContact O-CG2 3.34Å; R55-V59 PolarHBondContact O-N 3.2Å; R55-V59 VanDerWaalsContact O-N 3.13Å
56L88.5Confident90.7Very high53 Ų5381.6 Ų81.628%0.27739%0.39SS..Hα-helixtrans-60.1-47.4176.5-176.249.7000111.5W25 R52 I53 Q54 E58 V59 L60W25-L56 HydrophobicContact CZ2-CB 3.82Å; W25-L56 HydrophobicContact CZ2-CD1 3.63Å; W25-L56 HydrophobicContact CZ2-CD2 3.65Å; W25-L56 HydrophobicContact CZ2-CG 3.84Å; R52-L56 PolarHBondContact O-N 3.46Å; I53-L56 WeakPolarHBondContact O-CB 3.26Å; I53-L56 PolarHBondContact O-N 2.89Å; Q54-L56 VanDerWaalsContact C-N 3.33Å; Q54-L56 PolarHBondContact O-N 3.36Å; L56-E58 VanDerWaalsContact C-N 3.27Å; L56-E58 PolarHBondContact O-N 3.04Å; L56-V59 PolarHBondContact O-N 2.89Å; L56-L60 HydrophobicContact CD1-CD1 4.12Å; L56-L60 HydrophobicContact CD1-CG 4.06Å; L56-L60 HydrophobicContact CD2-CD1 4.5Å; L56-L60 HydrophobicContact CG-CD1 3.93Å; L56-L60 HydrophobicContact CG-CG 4.33Å; L56-L60 WeakPolarHBondContact O-CG 3.36Å; L56-L60 PolarHBondContact O-N 3.37Å
57R92.6Very high90.9Very high145 Ų14582 Ų8255%0.54739%0.393SS..Hα-helixtrans-56.1-44.8178.9-179.7-177175-79.9-3.8110.8I53 Q54 R55 L60 V61I53-R57 WeakPolarHBondContact O-CB 3.41Å; I53-R57 PolarHBondContact O-N 2.88Å; Q54-R57 WeakPolarHBondContact O-CB 3.27Å; Q54-R57 PolarHBondContact O-N 3.33Å; R55-R57 VanDerWaalsContact C-N 3.35Å; R57-L60 PolarHBondContact O-N 3.32Å; R57-V61 HydrophobicContact CG-CG2 4.44Å; R57-V61 VanDerWaalsContact O-CG2 3.27Å; R57-V61 WeakPolarHBondContact O-CG2 3.39Å; R57-V61 PolarHBondContact O-N 2.97Å
58E91.6Very high91.2Very high59 Ų5982.5 Ų82.528%0.27639%0.389SS..Hα-helixtrans-62.2-44.6178.4-71.1167.4-165.600112.3Q54 R55 L56 L60 V61 R62Q54-E58 PolarHBondContact NE2-OE1 3.08Å; Q54-E58 WeakPolarHBondContact O-CG 3.42Å; Q54-E58 PolarHBondContact O-N 2.99Å; R55-E58 PolarHBondContact O-N 3.42Å; L56-E58 VanDerWaalsContact C-N 3.27Å; L56-E58 PolarHBondContact O-N 3.04Å; E58-L60 VanDerWaalsContact C-N 3.34Å; E58-L60 PolarHBondContact O-N 3.15Å; E58-V61 PolarHBondContact O-N 3.38Å; E58-R62 WeakPolarHBondContact O-CG 3.48Å; E58-R62 PolarHBondContact O-N 3.46Å; E58-R62 VanDerWaalsContact O-N 3.12Å
59V90.1Very high91.6Very high33 Ų3381.1 Ų81.120%0.238%0.378CS..Hα-helixtrans-60.7-43.8175.4172.10000111.4V20 T23 R55 L56 R62 R63V20-V59 HydrophobicContact CG1-CG1 3.95Å; T23-V59 HydrophobicContact CG2-CG1 3.98Å; R55-V59 WeakPolarHBondContact O-CG2 3.34Å; R55-V59 PolarHBondContact O-N 3.2Å; R55-V59 VanDerWaalsContact O-N 3.13Å; L56-V59 PolarHBondContact O-N 2.89Å; V59-R62 PolarHBondContact O-N 3.06Å; V59-R63 PolarHBondContact O-N 2.92Å
60L91.4Very high92Very high97 Ų9780.5 Ų80.551%0.50838%0.376SS..Hα-helixtrans-65.8-41.6179.9-70.4174.6000112.3L56 R57 E58 R62 R63 E64L56-L60 HydrophobicContact CD1-CD1 4.12Å; L56-L60 HydrophobicContact CD1-CG 4.06Å; L56-L60 HydrophobicContact CD2-CD1 4.5Å; L56-L60 HydrophobicContact CG-CD1 3.93Å; L56-L60 HydrophobicContact CG-CG 4.33Å; L56-L60 WeakPolarHBondContact O-CG 3.36Å; L56-L60 PolarHBondContact O-N 3.37Å; R57-L60 PolarHBondContact O-N 3.32Å; E58-L60 VanDerWaalsContact C-N 3.34Å; E58-L60 PolarHBondContact O-N 3.15Å; L60-R62 PolarHBondContact O-N 2.94Å; L60-R63 PolarHBondContact O-N 3.22Å; L60-E64 WeakPolarHBondContact O-CB 3.47Å; L60-E64 PolarHBondContact O-N 2.64Å
61V93.7Very high92.3Very high61 Ų6181 Ų8137%0.3738%0.378SS..Hα-helixtrans-64.8-38.8178.4169.10000111.8R57 E58 E64 S65R57-V61 HydrophobicContact CG-CG2 4.44Å; R57-V61 VanDerWaalsContact O-CG2 3.27Å; R57-V61 WeakPolarHBondContact O-CG2 3.39Å; R57-V61 PolarHBondContact O-N 2.97Å; E58-V61 PolarHBondContact O-N 3.38Å; V61-E64 PolarHBondContact O-N 3.31Å; V61-S65 PolarHBondContact O-N 2.75Å; V61-S65 PolarHBondContact O-OG 3.38Å
62R93.8Very high92.8Very high37 Ų3781.8 Ų81.814%0.1437%0.373CS..Hα-helixtrans-63.5-46173-70.7-174-178.3105.5-3111.3V20 E58 V59 L60 E64 S65 E66 E134 E137V20-R62 HydrophobicContact CG2-CB 3.7Å; V20-R62 HydrophobicContact CG2-CG 4.48Å; E58-R62 WeakPolarHBondContact O-CG 3.48Å; E58-R62 PolarHBondContact O-N 3.46Å; E58-R62 VanDerWaalsContact O-N 3.12Å; V59-R62 PolarHBondContact O-N 3.06Å; L60-R62 PolarHBondContact O-N 2.94Å; R62-E64 VanDerWaalsContact C-N 3.34Å; R62-E64 PolarHBondContact O-N 2.72Å; R62-S65 WeakPolarHBondContact O-CB 3.3Å; R62-S65 PolarHBondContact O-N 3.03Å; R62-S65 VanDerWaalsContact O-N 3.12Å; R62-E66 PolarHBondContact O-N 2.87Å; R62-E134 VanDerWaalsContact CB-OE1 3.31Å; R62-E134 WeakPolarHBondContact CB-OE1 3.43Å; R62-E134 WeakPolarHBondContact CD-OE1 3.4Å; R62-E134 HydrophobicContact CG-CG 4.4Å; R62-E134 WeakPolarHBondContact CG-OE1 3.34Å; R62-E137 IonicContact CZ-OE2 2.69Å; R62-E137 IonicContact NE-OE2 3.33Å; R62-E137 IonicContact NH2-OE2 3.62Å; R62-E137 PolarHBondContact NH2-OE2 2.97Å
63R92.1Very high93.3Very high92 Ų9277.8 Ų77.835%0.34736%0.36SS..Hα-helixtrans-63.3-38.2177.2-172.556.5170.2-159.3-1.2113V59 L60 S65 E66 L67V59-R63 PolarHBondContact O-N 2.92Å; L60-R63 PolarHBondContact O-N 3.22Å; R63-S65 VanDerWaalsContact C-N 3.32Å; R63-E66 WeakPolarHBondContact CD-OE2 3.03Å; R63-E66 IonicContact CZ-OE2 3.7Å; R63-E66 IonicContact NE-OE2 3.46Å; R63-E66 IonicContact NH1-OE1 3.17Å; R63-E66 IonicContact NH1-OE2 3.92Å; R63-E66 PolarHBondContact NH1-OE2 3.08Å; R63-E66 WeakPolarHBondContact O-CB 3.39Å; R63-E66 PolarHBondContact O-N 3.49Å; R63-L67 HydrophobicContact CG-CD1 4.25Å; R63-L67 WeakPolarHBondContact O-CB 3.24Å; R63-L67 WeakPolarHBondContact O-CD1 3.5Å; R63-L67 VanDerWaalsContact O-CG 3.29Å; R63-L67 WeakPolarHBondContact O-CG 3.49Å; R63-L67 PolarHBondContact O-N 2.91Å
64E93.7Very high93.7Very high110 Ų11076.8 Ų76.851%0.51436%0.355SS..Hα-helixtrans-60.6-43.2173.1-178.2-173172.800111.2L60 V61 R62 L67 R68L60-E64 WeakPolarHBondContact O-CB 3.47Å; L60-E64 PolarHBondContact O-N 2.64Å; V61-E64 PolarHBondContact O-N 3.31Å; R62-E64 VanDerWaalsContact C-N 3.34Å; R62-E64 PolarHBondContact O-N 2.72Å; E64-L67 PolarHBondContact O-N 2.93Å; E64-R68 WeakPolarHBondContact O-CG 3.27Å; E64-R68 PolarHBondContact O-N 2.96Å
65S94.1Very high94.1Very high18 Ų1876.9 Ų76.913%0.12636%0.355CS..Hα-helixtrans-65-42.5178.3-57.40000111.7V61 R62 R63 L67 R68 F69V61-S65 PolarHBondContact O-N 2.75Å; V61-S65 PolarHBondContact O-OG 3.38Å; R62-S65 WeakPolarHBondContact O-CB 3.3Å; R62-S65 PolarHBondContact O-N 3.03Å; R62-S65 VanDerWaalsContact O-N 3.12Å; R63-S65 VanDerWaalsContact C-N 3.32Å; S65-L67 VanDerWaalsContact C-N 3.33Å; S65-L67 PolarHBondContact O-N 3.41Å; S65-R68 WeakPolarHBondContact O-CB 3.37Å; S65-R68 PolarHBondContact O-N 2.8Å; S65-R68 VanDerWaalsContact O-N 3.16Å; S65-R68 PolarHBondContact OG-NH2 3.49Å; S65-F69 VanDerWaalsContact O-CD2 3.27Å; S65-F69 WeakPolarHBondContact O-CD2 3.11Å; S65-F69 PolarHBondContact O-N 3.2Å; S65-F69 VanDerWaalsContact O-N 3.13Å
66E93.2Very high94.6Very high5 Ų568.3 Ų68.32%0.02332%0.324CS..Hα-helixtrans-57.8-44.2171.7-167.1-169.4177.800112.3S16 Y17 R62 R63 R68 F69 M70S16-E66 WeakPolarHBondContact CA-OE1 3.3Å; S16-E66 WeakPolarHBondContact CB-OE1 3.46Å; S16-E66 PolarHBondContact OG-OE1 3.44Å; Y17-E66 PolarHBondContact N-OE1 3.39Å; Y17-E66 VanDerWaalsContact N-OE1 3.11Å; R62-E66 PolarHBondContact O-N 2.87Å; R63-E66 WeakPolarHBondContact CD-OE2 3.03Å; R63-E66 IonicContact CZ-OE2 3.7Å; R63-E66 IonicContact NE-OE2 3.46Å; R63-E66 IonicContact NH1-OE1 3.17Å; R63-E66 IonicContact NH1-OE2 3.92Å; R63-E66 PolarHBondContact NH1-OE2 3.08Å; R63-E66 WeakPolarHBondContact O-CB 3.39Å; R63-E66 PolarHBondContact O-N 3.49Å; E66-R68 VanDerWaalsContact C-N 3.29Å; E66-R68 PolarHBondContact O-N 3.48Å; E66-F69 PolarHBondContact O-N 3.37Å; E66-M70 HydrophobicContact CG-CE 4.3Å; E66-M70 PolarHBondContact O-N 3Å
67L94.3Very high95Very high92 Ų9267.7 Ų67.748%0.48232%0.323SS..Hα-helixtrans-63.3-35.1177.2-75162.2000112.2R63 E64 S65 M70 M71R63-L67 HydrophobicContact CG-CD1 4.25Å; R63-L67 WeakPolarHBondContact O-CB 3.24Å; R63-L67 WeakPolarHBondContact O-CD1 3.5Å; R63-L67 VanDerWaalsContact O-CG 3.29Å; R63-L67 WeakPolarHBondContact O-CG 3.49Å; R63-L67 PolarHBondContact O-N 2.91Å; E64-L67 PolarHBondContact O-N 2.93Å; S65-L67 VanDerWaalsContact C-N 3.33Å; S65-L67 PolarHBondContact O-N 3.41Å; L67-M70 HydrophobicContact CD2-CE 3.5Å; L67-M70 HydrophobicContact CG-CE 4.03Å; L67-M70 PolarHBondContact O-N 3.36Å; L67-M71 WeakPolarHBondContact O-CB 3.37Å; L67-M71 PolarHBondContact O-N 3.33Å
68R96.4Very high95.3Very high130 Ų13066.6 Ų66.649%0.49132%0.322SS..Hα-helixtrans-65.2-45.1174.3-73.3-173.8-72157.1-0.4111.8E64 S65 E66 M70 M71 D72E64-R68 WeakPolarHBondContact O-CG 3.27Å; E64-R68 PolarHBondContact O-N 2.96Å; S65-R68 WeakPolarHBondContact O-CB 3.37Å; S65-R68 PolarHBondContact O-N 2.8Å; S65-R68 VanDerWaalsContact O-N 3.16Å; S65-R68 PolarHBondContact OG-NH2 3.49Å; E66-R68 VanDerWaalsContact C-N 3.29Å; E66-R68 PolarHBondContact O-N 3.48Å; R68-M70 VanDerWaalsContact C-N 3.33Å; R68-M70 PolarHBondContact O-N 3.49Å; R68-M71 PolarHBondContact O-N 3.23Å; R68-D72 PolarHBondContact O-N 3.43Å
69F96.5Very high95.7Very high42 Ų4267 Ų6718%0.18433%0.326CS..Hα-helixtrans-58-43.7173.2-76.4-68.9000112.2Y17 S65 E66 M71 D72 D73 L123 D126 A127 E130Y17-F69 HydrophobicContact CD1-CB 4.33Å; Y17-F69 HydrophobicContact CD2-CB 4.12Å; Y17-F69 HydrophobicContact CG-CB 3.94Å; S65-F69 VanDerWaalsContact O-CD2 3.27Å; S65-F69 WeakPolarHBondContact O-CD2 3.11Å; S65-F69 PolarHBondContact O-N 3.2Å; S65-F69 VanDerWaalsContact O-N 3.13Å; E66-F69 PolarHBondContact O-N 3.37Å; F69-M71 PolarHBondContact O-N 2.99Å; F69-D72 PolarHBondContact O-N 3.04Å; F69-D73 PolarHBondContact O-N 3.35Å; F69-L123 HydrophobicContact CD1-CD2 4.38Å; F69-L123 HydrophobicContact CD1-CG 4.1Å; F69-D126 HydrophobicContact CE1-CB 4.08Å; F69-D126 HydrophobicContact CZ-CB 4.49Å; F69-A127 HydrophobicContact CD1-CB 3.85Å; F69-A127 HydrophobicContact CD2-CB 4.23Å; F69-A127 HydrophobicContact CE1-CB 4Å; F69-A127 HydrophobicContact CE2-CB 4.37Å; F69-A127 HydrophobicContact CG-CB 3.98Å; F69-A127 HydrophobicContact CZ-CB 4.25Å; F69-E130 HydrophobicContact CE2-CB 4.28Å; F69-E130 HydrophobicContact CE2-CG 4.31Å
70M96Very high96.1Very high51 Ų5165.9 Ų65.925%0.25132%0.319SS..Hα-helixtrans-62-43.8175.6-72.3-168.1-82.100112.6Y17 E66 L67 R68 D72 D73 I74Y17-M70 HydrophobicContact CD2-CB 4.4Å; Y17-M70 HydrophobicContact CD2-CG 3.4Å; Y17-M70 HydrophobicContact CE2-CB 4.36Å; Y17-M70 HydrophobicContact CE2-CG 3.62Å; E66-M70 HydrophobicContact CG-CE 4.3Å; E66-M70 PolarHBondContact O-N 3Å; L67-M70 HydrophobicContact CD2-CE 3.5Å; L67-M70 HydrophobicContact CG-CE 4.03Å; L67-M70 PolarHBondContact O-N 3.36Å; R68-M70 VanDerWaalsContact C-N 3.33Å; R68-M70 PolarHBondContact O-N 3.49Å; M70-D72 VanDerWaalsContact C-N 3.34Å; M70-D73 PolarHBondContact O-N 2.97Å; M70-I74 WeakPolarHBondContact O-CB 3.2Å; M70-I74 WeakPolarHBondContact O-CD1 3.46Å; M70-I74 WeakPolarHBondContact O-CG1 3.48Å; M70-I74 PolarHBondContact O-N 3.24Å
71M97.2Very high96.4Very high117 Ų11767.5 Ų67.558%0.57633%0.326SS*.Hα-helixtrans-61.8-44.4179.6-176.8179.865.800111.2L67 R68 F69 I74 Q75L67-M71 WeakPolarHBondContact O-CB 3.37Å; L67-M71 PolarHBondContact O-N 3.33Å; R68-M71 PolarHBondContact O-N 3.23Å; F69-M71 PolarHBondContact O-N 2.99Å; M71-I74 PolarHBondContact O-N 3.39Å; M71-Q75 PolarHBondContact O-N 3.22Å
72D97.9Very high96.7Very high81 Ų8167.7 Ų67.743%0.43333%0.33SS..Hα-helixtrans-66.8-42.6178.8-73.5-14.8000111.8R68 F69 M70 I74 Q75 L76 L123R68-D72 PolarHBondContact O-N 3.43Å; F69-D72 PolarHBondContact O-N 3.04Å; M70-D72 VanDerWaalsContact C-N 3.34Å; D72-I74 PolarHBondContact O-N 3.09Å; D72-Q75 PolarHBondContact O-N 3.23Å; D72-L76 WeakPolarHBondContact O-CG 3.31Å; D72-L76 PolarHBondContact O-N 3.42Å; D72-L123 HydrophobicContact CB-CD1 3.49Å; D72-L123 VanDerWaalsContact CB-CD1 3.49Å
73D98Very high96.9Very high23 Ų2367.1 Ų67.112%0.12333%0.329CS..Hα-helixtrans-61.9-42.3174-178.736.4000111.7Y17 F69 M70 Q75 L76 C77 R120 L123Y17-D73 WeakPolarHBondContact OH-CB 3.41Å; Y17-D73 VanDerWaalsContact OH-CG 3.23Å; Y17-D73 PolarHBondContact OH-OD2 3.34Å; F69-D73 PolarHBondContact O-N 3.35Å; M70-D73 PolarHBondContact O-N 2.97Å; D73-Q75 VanDerWaalsContact C-N 3.3Å; D73-Q75 PolarHBondContact O-N 3.06Å; D73-L76 PolarHBondContact O-N 3.02Å; D73-C77 WeakPolarHBondContact O-CB 3.21Å; D73-C77 PolarHBondContact O-N 2.88Å; D73-C77 PolarHBondContact O-SG 3.41Å; D73-R120 IonicContact OD1-CZ 3.72Å; D73-R120 IonicContact OD1-NE 3.31Å; D73-R120 PolarHBondContact OD1-NE 3.07Å; D73-R120 IonicContact OD1-NH2 3.61Å; D73-L123 HydrophobicContact CB-CD2 4.01Å
74I97.6Very high97.2Very high90 Ų9067.1 Ų67.146%0.46233%0.332SS..Hα-helixtrans-60.1-42.6174.9-72.4164.8000110.6M70 M71 D72 C77 K78M70-I74 WeakPolarHBondContact O-CB 3.2Å; M70-I74 WeakPolarHBondContact O-CD1 3.46Å; M70-I74 WeakPolarHBondContact O-CG1 3.48Å; M70-I74 PolarHBondContact O-N 3.24Å; M71-I74 PolarHBondContact O-N 3.39Å; D72-I74 PolarHBondContact O-N 3.09Å; I74-C77 PolarHBondContact O-N 3.46Å; I74-K78 HydrophobicContact CG2-CD 4.27Å; I74-K78 WeakPolarHBondContact O-CG 3.35Å; I74-K78 PolarHBondContact O-N 3.33Å
75Q98.5Very high97.4Very high90 Ų9066.2 Ų66.242%0.42133%0.328SS..Hα-helixtrans-67.1-45179.7-169.856.346.700111.5M71 D72 D73 C77 K78 D79M71-Q75 PolarHBondContact O-N 3.22Å; D72-Q75 PolarHBondContact O-N 3.23Å; D73-Q75 VanDerWaalsContact C-N 3.3Å; D73-Q75 PolarHBondContact O-N 3.06Å; Q75-C77 VanDerWaalsContact C-N 3.29Å; Q75-C77 PolarHBondContact O-N 3.23Å; Q75-K78 WeakPolarHBondContact O-CB 3.48Å; Q75-K78 PolarHBondContact O-N 3.11Å; Q75-D79 PolarHBondContact NE2-OD1 3.49Å; Q75-D79 VanDerWaalsContact O-CG 3.31Å; Q75-D79 PolarHBondContact O-N 3.36Å
76L98.6Very high97.6Very high9 Ų969.9 Ų69.95%0.04734%0.343CS..Hα-helixtrans-58.4-43173.7-69.3172.4000111.4D72 D73 K78 D79 I80 L116 K119 R120 L123D72-L76 WeakPolarHBondContact O-CG 3.31Å; D72-L76 PolarHBondContact O-N 3.42Å; D73-L76 PolarHBondContact O-N 3.02Å; L76-K78 PolarHBondContact O-N 3.07Å; L76-D79 PolarHBondContact O-N 2.92Å; L76-I80 WeakPolarHBondContact O-CB 3.42Å; L76-I80 WeakPolarHBondContact O-CD1 3.35Å; L76-I80 WeakPolarHBondContact O-CG1 3.17Å; L76-I80 PolarHBondContact O-N 2.95Å; L76-L116 HydrophobicContact CD2-CD2 4Å; L76-K119 HydrophobicContact CD1-CG 4.25Å; L76-K119 HydrophobicContact CD2-CB 4.44Å; L76-K119 HydrophobicContact CD2-CD 3.84Å; L76-K119 HydrophobicContact CD2-CG 4.12Å; L76-R120 HydrophobicContact CD1-CB 3.97Å; L76-R120 HydrophobicContact CD1-CG 4.45Å; L76-L123 HydrophobicContact CD1-CD1 4.07Å
77C98.4Very high97.9Very high39 Ų3971 Ų7126%0.26435%0.349SS..Hα-helixtrans-61.5-43.4176.9-74.70000112.1D73 I74 Q75 I80 M81D73-C77 WeakPolarHBondContact O-CB 3.21Å; D73-C77 PolarHBondContact O-N 2.88Å; D73-C77 PolarHBondContact O-SG 3.41Å; I74-C77 PolarHBondContact O-N 3.46Å; Q75-C77 VanDerWaalsContact C-N 3.29Å; Q75-C77 PolarHBondContact O-N 3.23Å; C77-I80 PolarHBondContact O-N 3.06Å; C77-M81 VanDerWaalsContact O-CB 3.3Å; C77-M81 WeakPolarHBondContact O-CB 3.45Å; C77-M81 WeakPolarHBondContact O-CG 3.3Å; C77-M81 PolarHBondContact O-N 3.49Å
78K98.7Very high98Very high122 Ų12273 Ų7353%0.5335%0.35SS..Hα-helixtrans-60.7-47.8176.1-74.6171.8-178.3173.20111.6I74 Q75 L76 M81 S82I74-K78 HydrophobicContact CG2-CD 4.27Å; I74-K78 WeakPolarHBondContact O-CG 3.35Å; I74-K78 PolarHBondContact O-N 3.33Å; Q75-K78 WeakPolarHBondContact O-CB 3.48Å; Q75-K78 PolarHBondContact O-N 3.11Å; L76-K78 PolarHBondContact O-N 3.07Å; K78-M81 PolarHBondContact O-N 2.7Å; K78-S82 PolarHBondContact O-N 2.97Å
79D98.7Very high98.1Very high67 Ų6772.1 Ų72.136%0.35835%0.351SS..Hα-helixtrans-63.9-45-179.1-64-11.8000110.8Q75 L76 M81 S82 L83 L116Q75-D79 PolarHBondContact NE2-OD1 3.49Å; Q75-D79 VanDerWaalsContact O-CG 3.31Å; Q75-D79 PolarHBondContact O-N 3.36Å; L76-D79 PolarHBondContact O-N 2.92Å; D79-M81 VanDerWaalsContact C-N 3.33Å; D79-M81 PolarHBondContact O-N 3.46Å; D79-S82 PolarHBondContact O-N 3.16Å; D79-L83 WeakPolarHBondContact O-CG 3.39Å; D79-L83 PolarHBondContact O-N 3.18Å; D79-L116 HydrophobicContact CB-CD1 3.79Å
80I98.7Very high98.1Very high11 Ų1171.2 Ų71.26%0.05635%0.348CS..Hα-helixtrans-60.2-43.5174.8-69.9165.8000110.8L76 C77 L83 K84 L116 V117L76-I80 WeakPolarHBondContact O-CB 3.42Å; L76-I80 WeakPolarHBondContact O-CD1 3.35Å; L76-I80 WeakPolarHBondContact O-CG1 3.17Å; L76-I80 PolarHBondContact O-N 2.95Å; C77-I80 PolarHBondContact O-N 3.06Å; I80-L83 PolarHBondContact O-N 3.48Å; I80-K84 HydrophobicContact CG2-CD 3.87Å; I80-K84 HydrophobicContact CG2-CG 4.28Å; I80-K84 VanDerWaalsContact O-CB 3.3Å; I80-K84 WeakPolarHBondContact O-CB 3.47Å; I80-K84 VanDerWaalsContact O-CG 3.27Å; I80-K84 WeakPolarHBondContact O-CG 3.4Å; I80-K84 PolarHBondContact O-N 3.41Å; I80-L116 HydrophobicContact CD1-CB 3.96Å; I80-L116 HydrophobicContact CG1-CB 3.54Å; I80-L116 HydrophobicContact CG1-CD1 3.95Å; I80-L116 HydrophobicContact CG1-CG 4.43Å; I80-V117 HydrophobicContact CD1-CG2 4.03Å
81M98.7Very high98.1Very high131 Ų13172.5 Ų72.565%0.64536%0.359SS*.Hα-helixtrans-64.6-41.2179.5-78.8179.663.800112.2C77 K78 D79 K84 Q85C77-M81 VanDerWaalsContact O-CB 3.3Å; C77-M81 WeakPolarHBondContact O-CB 3.45Å; C77-M81 WeakPolarHBondContact O-CG 3.3Å; C77-M81 PolarHBondContact O-N 3.49Å; K78-M81 PolarHBondContact O-N 2.7Å; D79-M81 VanDerWaalsContact C-N 3.33Å; D79-M81 PolarHBondContact O-N 3.46Å; M81-K84 PolarHBondContact O-N 3.11Å; M81-Q85 WeakPolarHBondContact O-CB 3.34Å; M81-Q85 PolarHBondContact O-N 2.72Å
82S98.7Very high98Very high65 Ų6571 Ų7146%0.45536%0.36SS..Hα-helixtrans-60.7-52.1175.2-170.30000111K78 D79 K84 Q85 E86K78-S82 PolarHBondContact O-N 2.97Å; D79-S82 PolarHBondContact O-N 3.16Å; S82-K84 VanDerWaalsContact C-N 3.32Å; S82-K84 PolarHBondContact O-N 2.82Å; S82-Q85 WeakPolarHBondContact O-CA 3.45Å; S82-Q85 WeakPolarHBondContact O-CB 3.39Å; S82-Q85 PolarHBondContact O-N 2.93Å; S82-E86 PolarHBondContact O-N 3.39Å
83L98.8Very high97.9Very high25 Ų2569.1 Ų69.113%0.13135%0.351CS..Hα-helixtrans-62.7-39.1179.5-67.1171.8000112.1D79 I80 Q85 E86 L87 L109 K112 I113 L116D79-L83 WeakPolarHBondContact O-CG 3.39Å; D79-L83 PolarHBondContact O-N 3.18Å; I80-L83 PolarHBondContact O-N 3.48Å; L83-Q85 VanDerWaalsContact C-N 3.27Å; L83-Q85 PolarHBondContact O-N 3.29Å; L83-E86 PolarHBondContact O-N 3.48Å; L83-L87 WeakPolarHBondContact O-CB 3.29Å; L83-L87 PolarHBondContact O-N 3.36Å; L83-L109 HydrophobicContact CD2-CD2 3.68Å; L83-K112 HydrophobicContact CD1-CB 3.92Å; L83-K112 HydrophobicContact CD2-CD 4.45Å; L83-I113 HydrophobicContact CB-CD1 4Å; L83-I113 HydrophobicContact CB-CG1 3.55Å; L83-I113 HydrophobicContact CD1-CG1 4.14Å; L83-L116 HydrophobicContact CD1-CD1 3.55Å
84K98.4Very high97.8Very high92 Ų9271.2 Ų71.240%0.437%0.366SS..Hα-helixtrans-63-34.9173.7-79.1-179.6177.7179.80111.8I80 M81 S82 R88 I113I80-K84 HydrophobicContact CG2-CD 3.87Å; I80-K84 HydrophobicContact CG2-CG 4.28Å; I80-K84 VanDerWaalsContact O-CB 3.3Å; I80-K84 WeakPolarHBondContact O-CB 3.47Å; I80-K84 VanDerWaalsContact O-CG 3.27Å; I80-K84 WeakPolarHBondContact O-CG 3.4Å; I80-K84 PolarHBondContact O-N 3.41Å; M81-K84 PolarHBondContact O-N 3.11Å; S82-K84 VanDerWaalsContact C-N 3.32Å; S82-K84 PolarHBondContact O-N 2.82Å; K84-R88 WeakPolarHBondContact O-CG 3.35Å; K84-R88 PolarHBondContact O-N 3.41Å; K84-I113 HydrophobicContact CG-CD1 3.92Å; K84-I113 HydrophobicContact CG-CG1 4.49Å
85Q98.6Very high97.7Very high90 Ų9072 Ų7242%0.42137%0.368SS..Hα-helixtrans-68.4-44176.1-176.361.716.500111.3M81 S82 L83 R88 Q89M81-Q85 WeakPolarHBondContact O-CB 3.34Å; M81-Q85 PolarHBondContact O-N 2.72Å; S82-Q85 WeakPolarHBondContact O-CA 3.45Å; S82-Q85 WeakPolarHBondContact O-CB 3.39Å; S82-Q85 PolarHBondContact O-N 2.93Å; L83-Q85 VanDerWaalsContact C-N 3.27Å; L83-Q85 PolarHBondContact O-N 3.29Å; Q85-R88 PolarHBondContact O-N 2.85Å; Q85-R88 VanDerWaalsContact OE1-CZ 3.26Å; Q85-Q89 PolarHBondContact O-N 3.19Å
86E98.1Very high97.5Very high95 Ų9577.7 Ų77.744%0.44439%0.391SS..Hα-helixtrans-60.3-45173.7-68.7173.4-120.100111.5S82 L83 R88 Q89 I90 L109S82-E86 PolarHBondContact O-N 3.39Å; L83-E86 PolarHBondContact O-N 3.48Å; E86-R88 VanDerWaalsContact C-N 3.33Å; E86-R88 PolarHBondContact O-N 2.97Å; E86-Q89 WeakPolarHBondContact O-CB 3.44Å; E86-Q89 PolarHBondContact O-N 3.38Å; E86-Q89 VanDerWaalsContact O-N 3.11Å; E86-I90 PolarHBondContact O-N 3.39Å; E86-L109 HydrophobicContact CB-CD1 4Å; E86-L109 HydrophobicContact CB-CD2 4.29Å
87L98.4Very high97.3Very high30 Ų3083.6 Ų83.616%0.15742%0.419CS..Hα-helixtrans-60.3-42.8177.4-179.662.7000111.5L83 Q89 I90 V91 E106 L109 I110 I113L83-L87 WeakPolarHBondContact O-CB 3.29Å; L83-L87 PolarHBondContact O-N 3.36Å; L87-Q89 PolarHBondContact O-N 3.38Å; L87-I90 PolarHBondContact O-N 2.96Å; L87-I90 VanDerWaalsContact O-N 3.14Å; L87-V91 HydrophobicContact CD1-CG2 4Å; L87-V91 HydrophobicContact CG-CG2 4.11Å; L87-V91 WeakPolarHBondContact O-CB 3.48Å; L87-V91 VanDerWaalsContact O-CG2 3.31Å; L87-V91 WeakPolarHBondContact O-CG2 3.42Å; L87-V91 PolarHBondContact O-N 2.88Å; L87-E106 HydrophobicContact CD1-CB 4.43Å; L87-E106 HydrophobicContact CD1-CG 3.76Å; L87-L109 HydrophobicContact CB-CB 4.41Å; L87-L109 HydrophobicContact CB-CD1 4.17Å; L87-L109 HydrophobicContact CD1-CB 4.23Å; L87-L109 HydrophobicContact CD1-CD1 4.46Å; L87-I110 HydrophobicContact CD1-CG1 4.12Å; L87-I110 HydrophobicContact CD2-CG1 3.95Å; L87-I113 HydrophobicContact CB-CD1 4.35Å; L87-I113 HydrophobicContact CD2-CD1 3.85Å
88R98Very high97.2Very high134 Ų13483.1 Ų83.151%0.50641%0.412SS..Hα-helixtrans-57.8-36.2175.8-81.2-172.7-69.5-95.92.9112.5K84 Q85 E86 S92K84-R88 WeakPolarHBondContact O-CG 3.35Å; K84-R88 PolarHBondContact O-N 3.41Å; Q85-R88 PolarHBondContact O-N 2.85Å; Q85-R88 VanDerWaalsContact OE1-CZ 3.26Å; E86-R88 VanDerWaalsContact C-N 3.33Å; E86-R88 PolarHBondContact O-N 2.97Å; R88-S92 WeakPolarHBondContact O-CB 3.43Å; R88-S92 PolarHBondContact O-N 3.11Å
89Q96.9Very high97.1Very high110 Ų11081 Ų8151%0.51441%0.406SS..Hα-helixtrans-63.5-45176.5-61.5-56.3-35.700111.1Q85 E86 L87 S92Q85-Q89 PolarHBondContact O-N 3.19Å; E86-Q89 WeakPolarHBondContact O-CB 3.44Å; E86-Q89 PolarHBondContact O-N 3.38Å; E86-Q89 VanDerWaalsContact O-N 3.11Å; L87-Q89 PolarHBondContact O-N 3.38Å; Q89-S92 PolarHBondContact O-N 3.09Å; Q89-S92 PolarHBondContact O-OG 3Å
90I96.4Very high97Very high24 Ų2486.3 Ų86.312%0.12343%0.426CS..Hα-helixtrans-68.3-43.9179.4-57.2-178.2000111.4E86 L87 S92 V93 K98 H102 Q105 E106 L109E86-I90 PolarHBondContact O-N 3.39Å; L87-I90 PolarHBondContact O-N 2.96Å; L87-I90 VanDerWaalsContact O-N 3.14Å; I90-S92 PolarHBondContact O-N 2.96Å; I90-V93 WeakPolarHBondContact O-CB 3.37Å; I90-V93 PolarHBondContact O-N 3.4Å; I90-V93 VanDerWaalsContact O-N 3.14Å; I90-K98 WeakPolarHBondContact O-CE 3.38Å; I90-H102 HydrophobicContact CG2-CB 4.09Å; I90-Q105 HydrophobicContact CD1-CB 3.62Å; I90-E106 HydrophobicContact CG2-CB 4.1Å; I90-L109 HydrophobicContact CD1-CD1 3.74Å
91V96Very high96.8Very high78 Ų7891.9 Ų91.947%0.47345%0.45SS..Hα-helixtrans-64.5-26.7179.6172.80000111.9L87 V93L87-V91 HydrophobicContact CD1-CG2 4Å; L87-V91 HydrophobicContact CG-CG2 4.11Å; L87-V91 WeakPolarHBondContact O-CB 3.48Å; L87-V91 VanDerWaalsContact O-CG2 3.31Å; L87-V91 WeakPolarHBondContact O-CG2 3.42Å; L87-V91 PolarHBondContact O-N 2.88Å; V91-V93 PolarHBondContact O-N 3.48Å
92S96.4Very high96.7Very high85 Ų8588 Ų8859%0.59443%0.43SS*.THydrogen-bonded Turntrans-70.2-1917778.50000113.9R88 Q89 I90R88-S92 WeakPolarHBondContact O-CB 3.43Å; R88-S92 PolarHBondContact O-N 3.11Å; Q89-S92 PolarHBondContact O-N 3.09Å; Q89-S92 PolarHBondContact O-OG 3Å; I90-S92 PolarHBondContact O-N 2.96Å
93V95.5Very high96.6Very high41 Ų4189.1 Ų89.125%0.24843%0.427CS..SBendtrans-73.9127.2176.5-178.50000109.5I90 V91 E97 K98I90-V93 WeakPolarHBondContact O-CB 3.37Å; I90-V93 PolarHBondContact O-N 3.4Å; I90-V93 VanDerWaalsContact O-N 3.14Å; V91-V93 PolarHBondContact O-N 3.48Å; V93-E97 HydrophobicContact CG1-CB 4.02Å; V93-K98 HydrophobicContact CB-CG 4.26Å; V93-K98 HydrophobicContact CG1-CG 4.03Å; V93-K98 VanDerWaalsContact O-CE 3.25Å; V93-K98 WeakPolarHBondContact O-CE 3.45Å
94P96.4Very high96.5Very high68 Ų6894 Ų9444%0.44245%0.449SS..  trans-56.2141.3176.9-24.934000112.5K96 E97 K98P94-K96 PolarHBondContact O-N 2.96Å; P94-E97 WeakPolarHBondContact O-CA 3.33Å; P94-E97 PolarHBondContact O-N 3.12Å; P94-K98 PolarHBondContact O-N 2.97Å
95E94.2Very high96.5Very high106 Ų10693.1 Ų93.150%0.49545%0.446SS..G310 helixtrans-57.3-31.5-174.9-170.158.6-15100113.6E97 K98 K103E95-E97 PolarHBondContact O-N 3.37Å; E95-K98 PolarHBondContact O-N 3.36Å; E95-K98 WeakPolarHBondContact OE2-CD 3.35Å; E95-K98 IonicContact OE2-NZ 3.66Å; E95-K98 PolarHBondContact OE2-NZ 3.34Å; E95-K103 WeakPolarHBondContact OE1-CE 3.39Å; E95-K103 IonicContact OE1-NZ 2.7Å; E95-K103 PolarHBondContact OE1-NZ 3.45Å
96K94.8Very high96.5Very high209 Ų20990.8 Ų90.891%0.90944%0.435SS*.G310 helixtrans-67.1-24177.2-60.6-179.8-1771780113.2P94P94-K96 PolarHBondContact O-N 2.96Å
97E95.5Very high96.5Very high134 Ų13492.2 Ų92.263%0.62644%0.442SS*.G310 helixtrans-101.9-5.7-177.7-64.6171.2-153.900111.8V93 P94 E95 N99V93-E97 HydrophobicContact CG1-CB 4.02Å; P94-E97 WeakPolarHBondContact O-CA 3.33Å; P94-E97 PolarHBondContact O-N 3.12Å; E95-E97 PolarHBondContact O-N 3.37Å; E97-N99 PolarHBondContact O-N 3.42Å
98K95.7Very high96.5Very high28 Ų2895.4 Ų95.412%0.12246%0.456CS..  trans-73.9122.8176.5-71.2-168-171.5171.90111.3I90 V93 P94 E95 H102 E106I90-K98 WeakPolarHBondContact O-CE 3.38Å; V93-K98 HydrophobicContact CB-CG 4.26Å; V93-K98 HydrophobicContact CG1-CG 4.03Å; V93-K98 VanDerWaalsContact O-CE 3.25Å; V93-K98 WeakPolarHBondContact O-CE 3.45Å; P94-K98 PolarHBondContact O-N 2.97Å; E95-K98 PolarHBondContact O-N 3.36Å; E95-K98 WeakPolarHBondContact OE2-CD 3.35Å; E95-K98 IonicContact OE2-NZ 3.66Å; E95-K98 PolarHBondContact OE2-NZ 3.34Å; K98-H102 HydrophobicContact CB-CB 4.26Å; K98-H102 HydrophobicContact CG-CB 4.33Å; K98-E106 IonicContact NZ-OE1 3.83Å; K98-E106 IonicContact NZ-OE2 2.9Å; K98-E106 PolarHBondContact NZ-OE2 2.94Å
99N95.8Very high96.5Very high78 Ų7889.6 Ų89.642%0.41744%0.435SS..  trans-85.6173.9169.464.737.5000111.1E97 K101 H102 K103E97-N99 PolarHBondContact O-N 3.42Å; N99-K101 PolarHBondContact O-N 2.91Å; N99-K101 WeakPolarHBondContact OD1-CA 3.42Å; N99-K101 VanDerWaalsContact OD1-CB 3.3Å; N99-K101 WeakPolarHBondContact OD1-CB 3.5Å; N99-K101 PolarHBondContact OD1-N 3.2Å; N99-H102 PolarHBondContact N-ND1 3.5Å; N99-H102 PolarHBondContact ND2-CE1 2.66Å; N99-H102 PolarHBondContact O-N 2.97Å; N99-H102 PolarHBondContact OD1-CD2 2.97Å; N99-H102 PolarHBondContact OD1-N 2.94Å; N99-K103 PolarHBondContact O-N 3.25Å
100K96.4Very high96.6Very high178 Ų17888.4 Ų88.477%0.77443%0.432SS*.Hα-helixtrans-58.7-33.7178-68.5-176179.2-179.30113.1K103 Q104K100-K103 PolarHBondContact O-N 3.44Å; K100-Q104 WeakPolarHBondContact O-CG 3.43Å; K100-Q104 PolarHBondContact O-N 3.15Å
101K95.7Very high96.7Very high129 Ų12992.4 Ų92.456%0.56145%0.453SS*.Hα-helixtrans-66.9-42.1179.5-172.9-176.1176.9-177.30111.2N99 K103 Q104 Q105N99-K101 PolarHBondContact O-N 2.91Å; N99-K101 WeakPolarHBondContact OD1-CA 3.42Å; N99-K101 VanDerWaalsContact OD1-CB 3.3Å; N99-K101 WeakPolarHBondContact OD1-CB 3.5Å; N99-K101 PolarHBondContact OD1-N 3.2Å; K101-K103 VanDerWaalsContact C-N 3.32Å; K101-K103 PolarHBondContact O-N 2.58Å; K101-Q104 PolarHBondContact O-N 3.43Å; K101-Q105 HydrophobicContact CG-CG 4.37Å; K101-Q105 WeakPolarHBondContact O-CB 3.44Å; K101-Q105 VanDerWaalsContact O-CG 3.27Å; K101-Q105 WeakPolarHBondContact O-CG 3.34Å; K101-Q105 PolarHBondContact O-N 2.95Å
102H96.3Very high96.8Very high49 Ų4993 Ų9323%0.22745%0.449CS..Hα-helixtrans-58.5-45.5175.2-63.1162.2000111I90 K98 N99 Q105 E106I90-H102 HydrophobicContact CG2-CB 4.09Å; K98-H102 HydrophobicContact CB-CB 4.26Å; K98-H102 HydrophobicContact CG-CB 4.33Å; N99-H102 PolarHBondContact N-ND1 3.5Å; N99-H102 PolarHBondContact ND2-CE1 2.66Å; N99-H102 PolarHBondContact O-N 2.97Å; N99-H102 PolarHBondContact OD1-CD2 2.97Å; N99-H102 PolarHBondContact OD1-N 2.94Å; H102-Q105 PolarHBondContact O-N 2.71Å; H102-E106 VanDerWaalsContact O-CB 3.3Å; H102-E106 WeakPolarHBondContact O-CB 3.18Å; H102-E106 PolarHBondContact O-N 2.67Å
103K96Very high96.9Very high88 Ų8889.8 Ų89.838%0.38343%0.425SS..Hα-helixtrans-63.6-44.8178.9-61.8-173.2178.6-156.20112.4E95 N99 K100 K101 E106 E107E95-K103 WeakPolarHBondContact OE1-CE 3.39Å; E95-K103 IonicContact OE1-NZ 2.7Å; E95-K103 PolarHBondContact OE1-NZ 3.45Å; N99-K103 PolarHBondContact O-N 3.25Å; K100-K103 PolarHBondContact O-N 3.44Å; K101-K103 VanDerWaalsContact C-N 3.32Å; K101-K103 PolarHBondContact O-N 2.58Å; K103-E106 WeakPolarHBondContact O-CB 3.32Å; K103-E106 PolarHBondContact O-N 3.18Å; K103-E107 WeakPolarHBondContact O-CG 3.36Å; K103-E107 PolarHBondContact O-N 3.47Å
104Q97.7Very high97.1Very high129 Ų12992.7 Ų92.760%0.60344%0.436SS*.Hα-helixtrans-62.8-43.6176.2-73.8174.3-16.500112.2K100 K101 E107 E108K100-Q104 WeakPolarHBondContact O-CG 3.43Å; K100-Q104 PolarHBondContact O-N 3.15Å; K101-Q104 PolarHBondContact O-N 3.43Å; Q104-E107 PolarHBondContact O-N 3.43Å; Q104-E108 WeakPolarHBondContact O-CB 3.41Å; Q104-E108 PolarHBondContact O-N 3.17Å
105Q97.8Very high97.2Very high72 Ų7296.3 Ų96.334%0.33644%0.444SS..Hα-helixtrans-65.6-38.8177.1-72.8178.7-49.200111.9I90 K101 H102 E108 L109I90-Q105 HydrophobicContact CD1-CB 3.62Å; K101-Q105 HydrophobicContact CG-CG 4.37Å; K101-Q105 WeakPolarHBondContact O-CB 3.44Å; K101-Q105 VanDerWaalsContact O-CG 3.27Å; K101-Q105 WeakPolarHBondContact O-CG 3.34Å; K101-Q105 PolarHBondContact O-N 2.95Å; H102-Q105 PolarHBondContact O-N 2.71Å; Q105-E108 PolarHBondContact O-N 2.79Å; Q105-L109 WeakPolarHBondContact O-CB 3.49Å; Q105-L109 VanDerWaalsContact O-CG 3.26Å; Q105-L109 WeakPolarHBondContact O-CG 3.27Å; Q105-L109 PolarHBondContact O-N 3.4Å
106E97.9Very high97.4Very high41 Ų4193 Ų9319%0.19243%0.43CS..Hα-helixtrans-59-50.6174.5-175.2169.7-176.700111.2L87 I90 K98 H102 K103 E108 L109 I110L87-E106 HydrophobicContact CD1-CB 4.43Å; L87-E106 HydrophobicContact CD1-CG 3.76Å; I90-E106 HydrophobicContact CG2-CB 4.1Å; K98-E106 IonicContact NZ-OE1 3.83Å; K98-E106 IonicContact NZ-OE2 2.9Å; K98-E106 PolarHBondContact NZ-OE2 2.94Å; H102-E106 VanDerWaalsContact O-CB 3.3Å; H102-E106 WeakPolarHBondContact O-CB 3.18Å; H102-E106 PolarHBondContact O-N 2.67Å; K103-E106 WeakPolarHBondContact O-CB 3.32Å; K103-E106 PolarHBondContact O-N 3.18Å; E106-E108 PolarHBondContact O-N 3.04Å; E106-L109 PolarHBondContact O-N 3.41Å; E106-I110 HydrophobicContact CG-CD1 4.07Å; E106-I110 WeakPolarHBondContact O-CD1 3.18Å; E106-I110 VanDerWaalsContact O-CG1 3.25Å; E106-I110 WeakPolarHBondContact O-CG1 3.42Å; E106-I110 PolarHBondContact O-N 3.42Å
107E98.1Very high97.6Very high126 Ų12685.5 Ų85.559%0.58940%0.401SS*.Hα-helixtrans-60.2-43.6176.1-72.2173.3-170.700112.3K103 Q104 I110 L111K103-E107 WeakPolarHBondContact O-CG 3.36Å; K103-E107 PolarHBondContact O-N 3.47Å; Q104-E107 PolarHBondContact O-N 3.43Å; E107-I110 PolarHBondContact O-N 3.45Å; E107-L111 WeakPolarHBondContact O-CG 3.46Å; E107-L111 PolarHBondContact O-N 2.9Å
108E98.4Very high97.8Very high97 Ų9783.2 Ų83.245%0.45339%0.391SS..Hα-helixtrans-63.1-44.4178.5-171.4-173.816800112Q104 Q105 E106 L111 K112Q104-E108 WeakPolarHBondContact O-CB 3.41Å; Q104-E108 PolarHBondContact O-N 3.17Å; Q105-E108 PolarHBondContact O-N 2.79Å; E106-E108 PolarHBondContact O-N 3.04Å; E108-L111 PolarHBondContact O-N 2.93Å; E108-K112 HydrophobicContact CG-CD 4.43Å; E108-K112 WeakPolarHBondContact O-CG 3.21Å; E108-K112 PolarHBondContact O-N 3.49Å; E108-K112 WeakPolarHBondContact OE1-CE 3.44Å; E108-K112 IonicContact OE1-NZ 3.36Å; E108-K112 PolarHBondContact OE1-NZ 3.04Å
109L98.7Very high97.9Very high12 Ų1288.2 Ų88.26%0.06341%0.412CS..Hα-helixtrans-63.6-42.9177.4-74.1173.3000111.3L83 E86 L87 I90 Q105 E106 L111 K112 I113L83-L109 HydrophobicContact CD2-CD2 3.68Å; E86-L109 HydrophobicContact CB-CD1 4Å; E86-L109 HydrophobicContact CB-CD2 4.29Å; L87-L109 HydrophobicContact CB-CB 4.41Å; L87-L109 HydrophobicContact CB-CD1 4.17Å; L87-L109 HydrophobicContact CD1-CB 4.23Å; L87-L109 HydrophobicContact CD1-CD1 4.46Å; I90-L109 HydrophobicContact CD1-CD1 3.74Å; Q105-L109 WeakPolarHBondContact O-CB 3.49Å; Q105-L109 VanDerWaalsContact O-CG 3.26Å; Q105-L109 WeakPolarHBondContact O-CG 3.27Å; Q105-L109 PolarHBondContact O-N 3.4Å; E106-L109 PolarHBondContact O-N 3.41Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 3.37Å; L109-K112 PolarHBondContact O-N 2.98Å; L109-I113 WeakPolarHBondContact O-CB 3.33Å; L109-I113 WeakPolarHBondContact O-CD1 3.46Å; L109-I113 VanDerWaalsContact O-CG1 3.24Å; L109-I113 WeakPolarHBondContact O-CG1 3.47Å; L109-I113 PolarHBondContact O-N 3.29Å
110I98.6Very high98Very high85 Ų8589 Ų8944%0.43641%0.409SS..Hα-helixtrans-59.3-46.2176.3-70.4165.8000110.4L87 E106 E107 K112 I113 H114L87-I110 HydrophobicContact CD1-CG1 4.12Å; L87-I110 HydrophobicContact CD2-CG1 3.95Å; E106-I110 HydrophobicContact CG-CD1 4.07Å; E106-I110 WeakPolarHBondContact O-CD1 3.18Å; E106-I110 VanDerWaalsContact O-CG1 3.25Å; E106-I110 WeakPolarHBondContact O-CG1 3.42Å; E106-I110 PolarHBondContact O-N 3.42Å; E107-I110 PolarHBondContact O-N 3.45Å; I110-K112 PolarHBondContact O-N 3.38Å; I110-I113 PolarHBondContact O-N 3.36Å; I110-H114 WeakPolarHBondContact O-CB 3.17Å; I110-H114 PolarHBondContact O-N 2.9Å
111L98.7Very high98.1Very high108 Ų10884.5 Ų84.557%0.56539%0.394SS*.Hα-helixtrans-62.6-41.4178-72.8170.9000112.5E107 E108 L109 H114 K115E107-L111 WeakPolarHBondContact O-CG 3.46Å; E107-L111 PolarHBondContact O-N 2.9Å; E108-L111 PolarHBondContact O-N 2.93Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 3.37Å; L111-H114 PolarHBondContact O-N 3.43Å; L111-K115 WeakPolarHBondContact O-CG 3.4Å; L111-K115 PolarHBondContact O-N 2.97Å; L111-K115 VanDerWaalsContact O-N 3.09Å
112K98.8Very high98.2Very high89 Ų8984.5 Ų84.539%0.38739%0.394SS..Hα-helixtrans-64.7-46.1176.2-73.3174.9-176.6169.50111.8L83 E108 L109 I110 H114 K115 L116L83-K112 HydrophobicContact CD1-CB 3.92Å; L83-K112 HydrophobicContact CD2-CD 4.45Å; E108-K112 HydrophobicContact CG-CD 4.43Å; E108-K112 WeakPolarHBondContact O-CG 3.21Å; E108-K112 PolarHBondContact O-N 3.49Å; E108-K112 WeakPolarHBondContact OE1-CE 3.44Å; E108-K112 IonicContact OE1-NZ 3.36Å; E108-K112 PolarHBondContact OE1-NZ 3.04Å; L109-K112 PolarHBondContact O-N 2.98Å; I110-K112 PolarHBondContact O-N 3.38Å; K112-H114 VanDerWaalsContact C-N 3.32Å; K112-H114 PolarHBondContact O-N 2.95Å; K112-K115 PolarHBondContact O-N 3.2Å; K112-L116 PolarHBondContact O-N 2.93Å; K112-L116 VanDerWaalsContact O-N 3.08Å
113I98.8Very high98.3Very high18 Ų1883 Ų839%0.09239%0.388CS..Hα-helixtrans-59-46.6176.9-69.4163000110L83 K84 L87 L109 I110 K115 L116 V117L83-I113 HydrophobicContact CB-CD1 4Å; L83-I113 HydrophobicContact CB-CG1 3.55Å; L83-I113 HydrophobicContact CD1-CG1 4.14Å; K84-I113 HydrophobicContact CG-CD1 3.92Å; K84-I113 HydrophobicContact CG-CG1 4.49Å; L87-I113 HydrophobicContact CB-CD1 4.35Å; L87-I113 HydrophobicContact CD2-CD1 3.85Å; L109-I113 WeakPolarHBondContact O-CB 3.33Å; L109-I113 WeakPolarHBondContact O-CD1 3.46Å; L109-I113 VanDerWaalsContact O-CG1 3.24Å; L109-I113 WeakPolarHBondContact O-CG1 3.47Å; L109-I113 PolarHBondContact O-N 3.29Å; I110-I113 PolarHBondContact O-N 3.36Å; I113-K115 PolarHBondContact O-N 2.98Å; I113-L116 PolarHBondContact O-N 3.26Å; I113-V117 HydrophobicContact CG2-CG2 4.31Å; I113-V117 WeakPolarHBondContact O-CG2 3.48Å; I113-V117 PolarHBondContact O-N 3.21Å
114H98.7Very high98.3Very high103 Ų10381.9 Ų81.948%0.47739%0.388SS..Hα-helixtrans-58.6-45.8179-178-96.9000112.1I110 L111 K112 L116 V117 Q118I110-H114 WeakPolarHBondContact O-CB 3.17Å; I110-H114 PolarHBondContact O-N 2.9Å; L111-H114 PolarHBondContact O-N 3.43Å; K112-H114 VanDerWaalsContact C-N 3.32Å; K112-H114 PolarHBondContact O-N 2.95Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-L116 PolarHBondContact O-N 3.13Å; H114-V117 PolarHBondContact O-N 3.16Å; H114-Q118 PolarHBondContact CE1-NE2 2.69Å; H114-Q118 WeakPolarHBondContact O-CG 3.32Å; H114-Q118 PolarHBondContact O-N 3.42Å
115K98.8Very high98.3Very high143 Ų14380.4 Ų80.462%0.62238%0.384SS*.Hα-helixtrans-60.7-40.6176.7-72.8175.8-179-178.20112.8L111 K112 I113 Q118 K119L111-K115 WeakPolarHBondContact O-CG 3.4Å; L111-K115 PolarHBondContact O-N 2.97Å; L111-K115 VanDerWaalsContact O-N 3.09Å; K112-K115 PolarHBondContact O-N 3.2Å; I113-K115 PolarHBondContact O-N 2.98Å; K115-Q118 PolarHBondContact O-N 3.03Å; K115-K119 PolarHBondContact O-N 3.06Å
116L98.8Very high98.3Very high36 Ų3681.6 Ų81.619%0.18839%0.393CS..Hα-helixtrans-69.4-37.8177.3-70.4177.4000112.3L76 D79 I80 L83 K112 I113 H114 K119 R120L76-L116 HydrophobicContact CD2-CD2 4Å; D79-L116 HydrophobicContact CB-CD1 3.79Å; I80-L116 HydrophobicContact CD1-CB 3.96Å; I80-L116 HydrophobicContact CG1-CB 3.54Å; I80-L116 HydrophobicContact CG1-CD1 3.95Å; I80-L116 HydrophobicContact CG1-CG 4.43Å; L83-L116 HydrophobicContact CD1-CD1 3.55Å; K112-L116 PolarHBondContact O-N 2.93Å; K112-L116 VanDerWaalsContact O-N 3.08Å; I113-L116 PolarHBondContact O-N 3.26Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-L116 PolarHBondContact O-N 3.13Å; L116-K119 PolarHBondContact O-N 3.42Å; L116-R120 WeakPolarHBondContact O-CB 3.31Å; L116-R120 PolarHBondContact O-N 2.97Å
117V98.6Very high98.2Very high52 Ų5279.8 Ų79.832%0.31539%0.385SS..Hα-helixtrans-61.9-46.4173.31710000110.2I80 I113 H114 K119 R120 D121I80-V117 HydrophobicContact CD1-CG2 4.03Å; I113-V117 HydrophobicContact CG2-CG2 4.31Å; I113-V117 WeakPolarHBondContact O-CG2 3.48Å; I113-V117 PolarHBondContact O-N 3.21Å; H114-V117 PolarHBondContact O-N 3.16Å; V117-K119 VanDerWaalsContact C-N 3.32Å; V117-K119 PolarHBondContact O-N 3.45Å; V117-R120 WeakPolarHBondContact O-CA 3.39Å; V117-R120 WeakPolarHBondContact O-CB 3.47Å; V117-R120 PolarHBondContact O-N 3.01Å; V117-D121 VanDerWaalsContact O-CG 3.32Å; V117-D121 PolarHBondContact O-N 2.9Å
118Q98.6Very high98Very high87 Ų8777.5 Ų77.541%0.40737%0.374SS..Hα-helixtrans-58.3-43.9174.5-72.5-178.1-40.400112.3H114 K115 R120 D121 F122H114-Q118 PolarHBondContact CE1-NE2 2.69Å; H114-Q118 WeakPolarHBondContact O-CG 3.32Å; H114-Q118 PolarHBondContact O-N 3.42Å; K115-Q118 PolarHBondContact O-N 3.03Å; Q118-R120 VanDerWaalsContact C-N 3.27Å; Q118-R120 PolarHBondContact O-N 3.1Å; Q118-D121 PolarHBondContact O-N 3.47Å; Q118-F122 HydrophobicContact CB-CE2 4.47Å; Q118-F122 WeakPolarHBondContact O-CD2 3.41Å; Q118-F122 PolarHBondContact O-N 3.2Å
119K98.7Very high98Very high132 Ų13277.4 Ų77.457%0.57438%0.38SS*.Hα-helixtrans-60.6-38.1175.9-177.4172.8172.6-171.80112L76 K115 L116 V117 L123L76-K119 HydrophobicContact CD1-CG 4.25Å; L76-K119 HydrophobicContact CD2-CB 4.44Å; L76-K119 HydrophobicContact CD2-CD 3.84Å; L76-K119 HydrophobicContact CD2-CG 4.12Å; K115-K119 PolarHBondContact O-N 3.06Å; L116-K119 PolarHBondContact O-N 3.42Å; V117-K119 VanDerWaalsContact C-N 3.32Å; V117-K119 PolarHBondContact O-N 3.45Å; K119-L123 PolarHBondContact O-N 2.98Å; K119-L123 VanDerWaalsContact O-N 3.07Å
120R98.4Very high97.8Very high94 Ų9479 Ų7936%0.35539%0.387SS..Hα-helixtrans-67.4-39.2175.7-174.9-179.1178.5-124.2-5.3111.8D73 L76 L116 V117 Q118 L123 V124D73-R120 IonicContact OD1-CZ 3.72Å; D73-R120 IonicContact OD1-NE 3.31Å; D73-R120 PolarHBondContact OD1-NE 3.07Å; D73-R120 IonicContact OD1-NH2 3.61Å; L76-R120 HydrophobicContact CD1-CB 3.97Å; L76-R120 HydrophobicContact CD1-CG 4.45Å; L116-R120 WeakPolarHBondContact O-CB 3.31Å; L116-R120 PolarHBondContact O-N 2.97Å; V117-R120 WeakPolarHBondContact O-CA 3.39Å; V117-R120 WeakPolarHBondContact O-CB 3.47Å; V117-R120 PolarHBondContact O-N 3.01Å; Q118-R120 VanDerWaalsContact C-N 3.27Å; Q118-R120 PolarHBondContact O-N 3.1Å; R120-L123 WeakPolarHBondContact O-CB 3.34Å; R120-L123 PolarHBondContact O-N 3.34Å; R120-V124 WeakPolarHBondContact O-CG2 3.34Å; R120-V124 PolarHBondContact O-N 3.23Å; R120-V124 VanDerWaalsContact O-N 3.09Å
121D98Very high97.6Very high85 Ų8578.7 Ų78.746%0.45538%0.381SS..Hα-helixtrans-61.1-45.9175.9-63.8-20.5000110.4V117 Q118 L123 V124 D125V117-D121 VanDerWaalsContact O-CG 3.32Å; V117-D121 PolarHBondContact O-N 2.9Å; Q118-D121 PolarHBondContact O-N 3.47Å; D121-L123 VanDerWaalsContact C-N 3.33Å; D121-L123 PolarHBondContact O-N 3.38Å; D121-V124 WeakPolarHBondContact O-CB 3.29Å; D121-V124 PolarHBondContact O-N 3.47Å; D121-V124 VanDerWaalsContact O-N 3.15Å; D121-D125 PolarHBondContact O-N 2.85Å; D121-D125 VanDerWaalsContact O-N 3.08Å
122F98.4Very high97.5Very high129 Ų12977.9 Ų77.957%0.56638%0.377SS*.Hα-helixtrans-60.5-39.1173.9-68.9-59000113.3Q118 V124 D125 D126Q118-F122 HydrophobicContact CB-CE2 4.47Å; Q118-F122 WeakPolarHBondContact O-CD2 3.41Å; Q118-F122 PolarHBondContact O-N 3.2Å; F122-V124 VanDerWaalsContact C-N 3.27Å; F122-V124 PolarHBondContact O-N 2.96Å; F122-D125 PolarHBondContact O-N 3.46Å; F122-D126 WeakPolarHBondContact O-CB 3.37Å; F122-D126 PolarHBondContact O-N 3.12Å
123L98Very high97.4Very high17 Ų1779 Ų799%0.08938%0.379CS..Hα-helixtrans-61.1-38.3176.6179.2149.4000112Y17 F69 D72 D73 L76 K119 R120 D121 A127Y17-L123 HydrophobicContact CE1-CD2 4.18Å; F69-L123 HydrophobicContact CD1-CD2 4.38Å; F69-L123 HydrophobicContact CD1-CG 4.1Å; D72-L123 HydrophobicContact CB-CD1 3.49Å; D72-L123 VanDerWaalsContact CB-CD1 3.49Å; D73-L123 HydrophobicContact CB-CD2 4.01Å; L76-L123 HydrophobicContact CD1-CD1 4.07Å; K119-L123 PolarHBondContact O-N 2.98Å; K119-L123 VanDerWaalsContact O-N 3.07Å; R120-L123 WeakPolarHBondContact O-CB 3.34Å; R120-L123 PolarHBondContact O-N 3.34Å; D121-L123 VanDerWaalsContact C-N 3.33Å; D121-L123 PolarHBondContact O-N 3.38Å; L123-A127 WeakPolarHBondContact O-CB 3.47Å; L123-A127 PolarHBondContact O-N 3.41Å
124V96.6Very high97.1Very high65 Ų6578.3 Ų78.339%0.39438%0.375SS..Hα-helixtrans-66.4-44.1176.4172.80000110.6R120 D121 F122 A127 E128R120-V124 WeakPolarHBondContact O-CG2 3.34Å; R120-V124 PolarHBondContact O-N 3.23Å; R120-V124 VanDerWaalsContact O-N 3.09Å; D121-V124 WeakPolarHBondContact O-CB 3.29Å; D121-V124 PolarHBondContact O-N 3.47Å; D121-V124 VanDerWaalsContact O-N 3.15Å; F122-V124 VanDerWaalsContact C-N 3.27Å; F122-V124 PolarHBondContact O-N 2.96Å; V124-A127 PolarHBondContact O-N 3.03Å; V124-E128 PolarHBondContact O-N 3.26Å
125D97.1Very high96.9Very high97 Ų9779.6 Ų79.652%0.51938%0.379SS..Hα-helixtrans-61.8-46.3177.1-68.7-23.5000111.4D121 F122 A127 E128 V129D121-D125 PolarHBondContact O-N 2.85Å; D121-D125 VanDerWaalsContact O-N 3.08Å; F122-D125 PolarHBondContact O-N 3.46Å; D125-A127 VanDerWaalsContact C-N 3.34Å; D125-A127 PolarHBondContact O-N 3.46Å; D125-E128 PolarHBondContact O-N 3.12Å; D125-V129 WeakPolarHBondContact O-CG2 3.36Å; D125-V129 PolarHBondContact O-N 2.93Å
126D97.3Very high96.7Very high98 Ų9876.7 Ų76.752%0.52437%0.367SS..Hα-helixtrans-60.5-42.7178.4-74.4-17.9000111.8F69 F122 V129 E130F69-D126 HydrophobicContact CE1-CB 4.08Å; F69-D126 HydrophobicContact CZ-CB 4.49Å; F122-D126 WeakPolarHBondContact O-CB 3.37Å; F122-D126 PolarHBondContact O-N 3.12Å; D126-V129 PolarHBondContact O-N 2.93Å; D126-E130 PolarHBondContact O-N 3.49Å
127A95.9Very high96.4Very high2 Ų278 Ų782%0.01737%0.372CS..Hα-helixtrans-68.5-35.1178.300000112.6Y17 F69 L123 V124 D125 E130 R131Y17-A127 HydrophobicContact CD1-CB 3.39Å; Y17-A127 HydrophobicContact CE1-CB 4.1Å; Y17-A127 HydrophobicContact CG-CB 4.19Å; F69-A127 HydrophobicContact CD1-CB 3.85Å; F69-A127 HydrophobicContact CD2-CB 4.23Å; F69-A127 HydrophobicContact CE1-CB 4Å; F69-A127 HydrophobicContact CE2-CB 4.37Å; F69-A127 HydrophobicContact CG-CB 3.98Å; F69-A127 HydrophobicContact CZ-CB 4.25Å; L123-A127 WeakPolarHBondContact O-CB 3.47Å; L123-A127 PolarHBondContact O-N 3.41Å; V124-A127 PolarHBondContact O-N 3.03Å; D125-A127 VanDerWaalsContact C-N 3.34Å; D125-A127 PolarHBondContact O-N 3.46Å; A127-E130 PolarHBondContact O-N 3.36Å; A127-R131 WeakPolarHBondContact O-CB 3.46Å; A127-R131 PolarHBondContact O-N 3.46Å
128E95.2Very high96.1Very high78 Ų7879.1 Ų79.136%0.36438%0.377SS..Hα-helixtrans-67.1-39.1174.317960-172.100111.5V124 D125 E130 R131 L132V124-E128 PolarHBondContact O-N 3.26Å; D125-E128 PolarHBondContact O-N 3.12Å; E128-E130 VanDerWaalsContact C-N 3.34Å; E128-E130 PolarHBondContact O-N 3.06Å; E128-R131 PolarHBondContact O-N 3.41Å; E128-R131 IonicContact OE1-CZ 3.21Å; E128-R131 IonicContact OE1-NE 3.15Å; E128-R131 IonicContact OE1-NH2 2.64Å; E128-R131 PolarHBondContact OE1-NH2 3.41Å; E128-R131 IonicContact OE2-CZ 3.89Å; E128-R131 IonicContact OE2-NE 3.37Å; E128-R131 PolarHBondContact OE2-NE 2.83Å; E128-R131 IonicContact OE2-NH2 2.79Å; E128-R131 PolarHBondContact OE2-NH2 2.98Å; E128-L132 HydrophobicContact CG-CD1 4.27Å; E128-L132 VanDerWaalsContact O-CG 3.31Å; E128-L132 WeakPolarHBondContact O-CG 3.45Å; E128-L132 PolarHBondContact O-N 3.47Å
129V96.5Very high95.9Very high96 Ų9680.3 Ų80.358%0.58238%0.381SS*.Hα-helixtrans-60.1-45.5173.3171.30000110.8D125 D126 L132 R133D125-V129 WeakPolarHBondContact O-CG2 3.36Å; D125-V129 PolarHBondContact O-N 2.93Å; D126-V129 PolarHBondContact O-N 2.93Å; V129-L132 PolarHBondContact O-N 3.43Å; V129-R133 PolarHBondContact O-N 3.24Å
130E95.8Very high95.7Very high44 Ų4480.1 Ų80.121%0.20638%0.382CS..Hα-helixtrans-59.8-47.9177.1-171.764.1-163.400111.5F69 D126 A127 E128 L132 R133 E134F69-E130 HydrophobicContact CE2-CB 4.28Å; F69-E130 HydrophobicContact CE2-CG 4.31Å; D126-E130 PolarHBondContact O-N 3.49Å; A127-E130 PolarHBondContact O-N 3.36Å; E128-E130 VanDerWaalsContact C-N 3.34Å; E128-E130 PolarHBondContact O-N 3.06Å; E130-L132 VanDerWaalsContact C-N 3.32Å; E130-L132 PolarHBondContact O-N 2.97Å; E130-R133 WeakPolarHBondContact O-CB 3.49Å; E130-R133 PolarHBondContact O-N 3.22Å; E130-R133 VanDerWaalsContact O-N 3.12Å; E130-R133 IonicContact OE1-CZ 2.67Å; E130-R133 IonicContact OE1-NH1 2.8Å; E130-R133 PolarHBondContact OE1-NH1 3.42Å; E130-R133 IonicContact OE1-NH2 2.66Å; E130-R133 PolarHBondContact OE1-NH2 2.9Å; E130-R133 IonicContact OE2-CZ 3.01Å; E130-R133 IonicContact OE2-NH1 3.71Å; E130-R133 PolarHBondContact OE2-NH1 3.02Å; E130-E134 WeakPolarHBondContact O-CG 3.42Å; E130-E134 PolarHBondContact O-N 3.13Å
131R94.9Very high95.4Very high80 Ų8080.1 Ų80.130%0.30239%0.387SS..Hα-helixtrans-59.2-41.5178.3-169.9-172.375.792.93.3112.5A19 A127 E128 K135A19-R131 HydrophobicContact CB-CG 4.27Å; A127-R131 WeakPolarHBondContact O-CB 3.46Å; A127-R131 PolarHBondContact O-N 3.46Å; E128-R131 PolarHBondContact O-N 3.41Å; E128-R131 IonicContact OE1-CZ 3.21Å; E128-R131 IonicContact OE1-NE 3.15Å; E128-R131 IonicContact OE1-NH2 2.64Å; E128-R131 PolarHBondContact OE1-NH2 3.41Å; E128-R131 IonicContact OE2-CZ 3.89Å; E128-R131 IonicContact OE2-NE 3.37Å; E128-R131 PolarHBondContact OE2-NE 2.83Å; E128-R131 IonicContact OE2-NH2 2.79Å; E128-R131 PolarHBondContact OE2-NH2 2.98Å; R131-K135 PolarHBondContact O-N 3.34Å
132L95.2Very high95.1Very high91 Ų9178.8 Ų78.848%0.47639%0.388SS..Hα-helixtrans-67.2-38.7176.6-71.2173.6000111.7E128 V129 E130 K135 E136E128-L132 HydrophobicContact CG-CD1 4.27Å; E128-L132 VanDerWaalsContact O-CG 3.31Å; E128-L132 WeakPolarHBondContact O-CG 3.45Å; E128-L132 PolarHBondContact O-N 3.47Å; V129-L132 PolarHBondContact O-N 3.43Å; E130-L132 VanDerWaalsContact C-N 3.32Å; E130-L132 PolarHBondContact O-N 2.97Å; L132-K135 PolarHBondContact O-N 3.06Å; L132-E136 PolarHBondContact O-N 3.24Å; L132-E136 VanDerWaalsContact O-N 3.09Å
133R96.3Very high94.9Very high113 Ų11376.8 Ų76.843%0.42638%0.38SS..Hα-helixtrans-61.5-51.2176-161.8-166.288.4-125.6-15111.2V129 E130 K135 E136 E137V129-R133 PolarHBondContact O-N 3.24Å; E130-R133 WeakPolarHBondContact O-CB 3.49Å; E130-R133 PolarHBondContact O-N 3.22Å; E130-R133 VanDerWaalsContact O-N 3.12Å; E130-R133 IonicContact OE1-CZ 2.67Å; E130-R133 IonicContact OE1-NH1 2.8Å; E130-R133 PolarHBondContact OE1-NH1 3.42Å; E130-R133 IonicContact OE1-NH2 2.66Å; E130-R133 PolarHBondContact OE1-NH2 2.9Å; E130-R133 IonicContact OE2-CZ 3.01Å; E130-R133 IonicContact OE2-NH1 3.71Å; E130-R133 PolarHBondContact OE2-NH1 3.02Å; R133-K135 VanDerWaalsContact C-N 3.26Å; R133-K135 PolarHBondContact O-N 3.35Å; R133-E136 PolarHBondContact O-N 3.48Å; R133-E136 VanDerWaalsContact O-N 3.11Å; R133-E137 IonicContact CZ-OE1 2.66Å; R133-E137 IonicContact NE-OE1 3.61Å; R133-E137 PolarHBondContact NE-OE1 3.16Å; R133-E137 IonicContact NH2-OE1 3.61Å; R133-E137 PolarHBondContact NH2-OE1 2.91Å; R133-E137 WeakPolarHBondContact O-CG 3.27Å; R133-E137 PolarHBondContact O-N 3.32Å
134E94.2Very high94.7Very high3 Ų381.7 Ų81.71%0.01440%0.401CS..Hα-helixtrans-56.2-42178.4-69-179.7160.600111.7A19 R62 E130 E136 E137 D138A19-E134 HydrophobicContact CB-CB 3.71Å; A19-E134 WeakPolarHBondContact CB-OE2 3.36Å; A19-E134 PolarHBondContact N-OE2 3.21Å; R62-E134 VanDerWaalsContact CB-OE1 3.31Å; R62-E134 WeakPolarHBondContact CB-OE1 3.43Å; R62-E134 WeakPolarHBondContact CD-OE1 3.4Å; R62-E134 HydrophobicContact CG-CG 4.4Å; R62-E134 WeakPolarHBondContact CG-OE1 3.34Å; E130-E134 WeakPolarHBondContact O-CG 3.42Å; E130-E134 PolarHBondContact O-N 3.13Å; E134-E136 PolarHBondContact O-N 3.34Å; E134-E137 PolarHBondContact O-N 2.93Å; E134-D138 PolarHBondContact O-N 3.46Å
135K92.9Very high94.3Very high129 Ų12982.7 Ų82.756%0.56140%0.404SS*.Hα-helixtrans-65.5-37.7178.6-172.6179.5179.3-1770112.9R131 L132 R133 K139R131-K135 PolarHBondContact O-N 3.34Å; L132-K135 PolarHBondContact O-N 3.06Å; R133-K135 VanDerWaalsContact C-N 3.26Å; R133-K135 PolarHBondContact O-N 3.35Å; K135-K139 WeakPolarHBondContact O-CB 3.46Å; K135-K139 PolarHBondContact O-N 2.91Å; K135-K139 VanDerWaalsContact O-N 3.16Å
136E95.9Very high94Very high82 Ų8284.5 Ų84.538%0.38340%0.403SS..Hα-helixtrans-72.4-39.7177.2-166.861-149.900111.1L132 R133 E134 D138 K139 E140L132-E136 PolarHBondContact O-N 3.24Å; L132-E136 VanDerWaalsContact O-N 3.09Å; R133-E136 PolarHBondContact O-N 3.48Å; R133-E136 VanDerWaalsContact O-N 3.11Å; E134-E136 PolarHBondContact O-N 3.34Å; E136-D138 VanDerWaalsContact C-N 3.33Å; E136-D138 PolarHBondContact O-N 3.05Å; E136-K139 VanDerWaalsContact CD-NZ 3.29Å; E136-K139 WeakPolarHBondContact O-CB 3.24Å; E136-K139 PolarHBondContact O-N 3.18Å; E136-K139 IonicContact OE1-NZ 2.75Å; E136-K139 PolarHBondContact OE1-NZ 3.03Å; E136-K139 IonicContact OE2-NZ 3.59Å; E136-K139 PolarHBondContact OE2-NZ 3.46Å; E136-E140 WeakPolarHBondContact O-CG 3.31Å; E136-E140 PolarHBondContact O-N 2.95Å
137E92.7Very high93.8Very high63 Ų6384.8 Ų84.829%0.29440%0.404SS..Hα-helixtrans-55.3-47.2172.5-70.5171.7-174.400111.8R62 R133 E134 K139 E140 M141R62-E137 IonicContact CZ-OE2 2.69Å; R62-E137 IonicContact NE-OE2 3.33Å; R62-E137 IonicContact NH2-OE2 3.62Å; R62-E137 PolarHBondContact NH2-OE2 2.97Å; R133-E137 IonicContact CZ-OE1 2.66Å; R133-E137 IonicContact NE-OE1 3.61Å; R133-E137 PolarHBondContact NE-OE1 3.16Å; R133-E137 IonicContact NH2-OE1 3.61Å; R133-E137 PolarHBondContact NH2-OE1 2.91Å; R133-E137 WeakPolarHBondContact O-CG 3.27Å; R133-E137 PolarHBondContact O-N 3.32Å; E134-E137 PolarHBondContact O-N 2.93Å; E137-K139 VanDerWaalsContact C-N 3.32Å; E137-K139 PolarHBondContact O-N 3.19Å; E137-E140 PolarHBondContact O-N 3.48Å; E137-M141 WeakPolarHBondContact O-CB 3.38Å; E137-M141 PolarHBondContact O-N 3.23Å
138D91.8Very high93.4Very high77 Ų7791 Ų9141%0.41243%0.431SS..Hα-helixtrans-63.5-39.1178.8-77.6-14.9000111.9E134 E136 M141 A142E134-D138 PolarHBondContact O-N 3.46Å; E136-D138 VanDerWaalsContact C-N 3.33Å; E136-D138 PolarHBondContact O-N 3.05Å; D138-M141 PolarHBondContact O-N 2.85Å; D138-A142 WeakPolarHBondContact O-CB 3.46Å; D138-A142 PolarHBondContact O-N 3.27Å
139K94.5Very high93.1Very high112 Ų11291 Ų9149%0.48743%0.433SS..Hα-helixtrans-66.9-44.7177.7176.7177.1153.2-123.40111.5K135 E136 E137 M141 A142 E143K135-K139 WeakPolarHBondContact O-CB 3.46Å; K135-K139 PolarHBondContact O-N 2.91Å; K135-K139 VanDerWaalsContact O-N 3.16Å; E136-K139 VanDerWaalsContact CD-NZ 3.29Å; E136-K139 WeakPolarHBondContact O-CB 3.24Å; E136-K139 PolarHBondContact O-N 3.18Å; E136-K139 IonicContact OE1-NZ 2.75Å; E136-K139 PolarHBondContact OE1-NZ 3.03Å; E136-K139 IonicContact OE2-NZ 3.59Å; E136-K139 PolarHBondContact OE2-NZ 3.46Å; E137-K139 VanDerWaalsContact C-N 3.32Å; E137-K139 PolarHBondContact O-N 3.19Å; K139-M141 VanDerWaalsContact C-N 3.33Å; K139-M141 PolarHBondContact O-N 2.97Å; K139-A142 PolarHBondContact O-N 3.42Å; K139-E143 WeakPolarHBondContact O-CB 3.37Å; K139-E143 WeakPolarHBondContact O-CG 3.27Å; K139-E143 PolarHBondContact O-N 3.32Å
140E95.1Very high92.5Very high128 Ų12891.7 Ų91.760%0.59843%0.425SS*.Hα-helixtrans-60.6-43.4175.5-73.6-175.617200111.2E136 E137 E143 F144E136-E140 WeakPolarHBondContact O-CG 3.31Å; E136-E140 PolarHBondContact O-N 2.95Å; E137-E140 PolarHBondContact O-N 3.48Å; E140-E143 PolarHBondContact O-N 3.48Å; E140-F144 WeakPolarHBondContact O-CB 3.43Å; E140-F144 PolarHBondContact O-N 2.92Å
141M91Very high92Very high94 Ų9492.8 Ų92.846%0.46344%0.436SS..Hα-helixtrans-63.1-45.3176.9-172.2-178.2-62.600112E137 D138 K139 F144 L145E137-M141 WeakPolarHBondContact O-CB 3.38Å; E137-M141 PolarHBondContact O-N 3.23Å; D138-M141 PolarHBondContact O-N 2.85Å; K139-M141 VanDerWaalsContact C-N 3.33Å; K139-M141 PolarHBondContact O-N 2.97Å; M141-F144 PolarHBondContact O-N 2.98Å; M141-L145 HydrophobicContact CG-CD1 4.28Å; M141-L145 WeakPolarHBondContact O-CG 3.1Å; M141-L145 PolarHBondContact O-N 2.66Å
142A91.8Very high91.3Very high57 Ų5793.6 Ų93.647%0.47145%0.446SS..Hα-helixtrans-63.1-4317800000112.1D138 K139 L145 R146D138-A142 WeakPolarHBondContact O-CB 3.46Å; D138-A142 PolarHBondContact O-N 3.27Å; K139-A142 PolarHBondContact O-N 3.42Å; A142-L145 PolarHBondContact O-N 2.89Å; A142-R146 VanDerWaalsContact O-CB 3.32Å; A142-R146 WeakPolarHBondContact O-CB 3.41Å; A142-R146 PolarHBondContact O-N 3.04Å
143E94.4Very high90.3Very high87 Ų8793.6 Ų93.641%0.40744%0.444SS..Hα-helixtrans-65.8-40.2176.5-76.8-62.114700112.1K139 E140 R146 L147K139-E143 WeakPolarHBondContact O-CB 3.37Å; K139-E143 WeakPolarHBondContact O-CG 3.27Å; K139-E143 PolarHBondContact O-N 3.32Å; E140-E143 PolarHBondContact O-N 3.48Å; E143-R146 PolarHBondContact O-N 3.38Å; E143-R146 IonicContact OE1-CZ 2.72Å; E143-R146 IonicContact OE1-NE 2.71Å; E143-R146 IonicContact OE1-NH1 2.7Å; E143-R146 IonicContact OE1-NH2 3.44Å; E143-R146 PolarHBondContact OE1-NH2 3.29Å; E143-R146 IonicContact OE2-CZ 3.46Å; E143-R146 IonicContact OE2-NE 2.97Å; E143-R146 PolarHBondContact OE2-NE 3.49Å; E143-R146 VanDerWaalsContact OE2-NE 3.15Å; E143-R146 IonicContact OE2-NH2 2.72Å; E143-R146 PolarHBondContact OE2-NH2 3.44Å; E143-L147 WeakPolarHBondContact O-CB 3.38Å; E143-L147 PolarHBondContact O-N 3.03Å
144F93.3Very high89.5Confident120 Ų12094 Ų9453%0.52645%0.45SS..Hα-helixtrans-60.1-50.3174.8176-97.6000111.6E140 M141 R146 L147 K148E140-F144 WeakPolarHBondContact O-CB 3.43Å; E140-F144 PolarHBondContact O-N 2.92Å; M141-F144 PolarHBondContact O-N 2.98Å; F144-R146 PolarHBondContact O-N 3.46Å; F144-L147 PolarHBondContact O-N 3.3Å; F144-K148 HydrophobicContact CD1-CG 4.32Å; F144-K148 HydrophobicContact CD2-CG 4.45Å; F144-K148 HydrophobicContact CE1-CG 3.94Å; F144-K148 HydrophobicContact CE2-CD 4.44Å; F144-K148 VanDerWaalsContact CE2-CE 3.45Å; F144-K148 HydrophobicContact CE2-CG 4.09Å; F144-K148 HydrophobicContact CZ-CD 4.26Å; F144-K148 VanDerWaalsContact CZ-CE 3.49Å; F144-K148 HydrophobicContact CZ-CG 3.83Å; F144-K148 WeakPolarHBondContact O-CG 3.44Å; F144-K148 PolarHBondContact O-N 3.34Å
145L88.9Confident88.6Confident86 Ų86101.1 Ų101.145%0.4548%0.481SS..Hα-helixtrans-60.9-44.7177.3-71.7172.8000111.2M141 A142 L147 K148 L149M141-L145 HydrophobicContact CG-CD1 4.28Å; M141-L145 WeakPolarHBondContact O-CG 3.1Å; M141-L145 PolarHBondContact O-N 2.66Å; A142-L145 PolarHBondContact O-N 2.89Å; L145-L147 VanDerWaalsContact C-N 3.3Å; L145-L147 PolarHBondContact O-N 3Å; L145-K148 PolarHBondContact O-N 3.44Å; L145-L149 HydrophobicContact CB-CD1 4.48Å; L145-L149 VanDerWaalsContact O-CB 3.31Å; L145-L149 WeakPolarHBondContact O-CB 3.44Å; L145-L149 VanDerWaalsContact O-CG 3.24Å; L145-L149 WeakPolarHBondContact O-CG 3.42Å; L145-L149 PolarHBondContact O-N 3.01Å
146R91.1Very high87.6Confident135 Ų135101.3 Ų101.351%0.50949%0.488SS..Hα-helixtrans-57.1-43.7176.3-171.3-179.576157.60.7111.6A142 E143 F144 R150A142-R146 VanDerWaalsContact O-CB 3.32Å; A142-R146 WeakPolarHBondContact O-CB 3.41Å; A142-R146 PolarHBondContact O-N 3.04Å; E143-R146 PolarHBondContact O-N 3.38Å; E143-R146 IonicContact OE1-CZ 2.72Å; E143-R146 IonicContact OE1-NE 2.71Å; E143-R146 IonicContact OE1-NH1 2.7Å; E143-R146 IonicContact OE1-NH2 3.44Å; E143-R146 PolarHBondContact OE1-NH2 3.29Å; E143-R146 IonicContact OE2-CZ 3.46Å; E143-R146 IonicContact OE2-NE 2.97Å; E143-R146 PolarHBondContact OE2-NE 3.49Å; E143-R146 VanDerWaalsContact OE2-NE 3.15Å; E143-R146 IonicContact OE2-NH2 2.72Å; E143-R146 PolarHBondContact OE2-NH2 3.44Å; F144-R146 PolarHBondContact O-N 3.46Å; R146-R150 WeakPolarHBondContact O-CB 3.48Å; R146-R150 PolarHBondContact O-N 2.86Å
147L91.9Very high86Confident103 Ų103104.9 Ų104.954%0.53950%0.502SS..Hα-helixtrans-67.2-40.4179.2-174.163.4000112.1E143 F144 L145E143-L147 WeakPolarHBondContact O-CB 3.38Å; E143-L147 PolarHBondContact O-N 3.03Å; F144-L147 PolarHBondContact O-N 3.3Å; L145-L147 VanDerWaalsContact C-N 3.3Å; L145-L147 PolarHBondContact O-N 3Å
148K89.1Confident84.4Confident132 Ų132105.6 Ų105.657%0.57452%0.518SS*.Hα-helixtrans-73-34.1179.8-69.5-67.8-176.4177.80113.5F144 L145 P151F144-K148 HydrophobicContact CD1-CG 4.32Å; F144-K148 HydrophobicContact CD2-CG 4.45Å; F144-K148 HydrophobicContact CE1-CG 3.94Å; F144-K148 HydrophobicContact CE2-CD 4.44Å; F144-K148 VanDerWaalsContact CE2-CE 3.45Å; F144-K148 HydrophobicContact CE2-CG 4.09Å; F144-K148 HydrophobicContact CZ-CD 4.26Å; F144-K148 VanDerWaalsContact CZ-CE 3.49Å; F144-K148 HydrophobicContact CZ-CG 3.83Å; F144-K148 WeakPolarHBondContact O-CG 3.44Å; F144-K148 PolarHBondContact O-N 3.34Å; L145-K148 PolarHBondContact O-N 3.44Å; K148-P151 WeakPolarHBondContact O-CD 3.43Å
149L87.9Confident82.4Confident80 Ų80107 Ų10742%0.41953%0.53SS..Hα-helixtrans-87.8-20.7-177.9-63.2175.3000113.2L145 P151 L152 E153L145-L149 HydrophobicContact CB-CD1 4.48Å; L145-L149 VanDerWaalsContact O-CB 3.31Å; L145-L149 WeakPolarHBondContact O-CB 3.44Å; L145-L149 VanDerWaalsContact O-CG 3.24Å; L145-L149 WeakPolarHBondContact O-CG 3.42Å; L145-L149 PolarHBondContact O-N 3.01Å; L149-P151 VanDerWaalsContact C-CD 3.41Å; L149-P151 VanDerWaalsContact C-N 3.32Å; L149-P151 VanDerWaalsContact O-N 3.17Å; L149-L152 HydrophobicContact CD2-CD1 3.87Å; L149-L152 WeakPolarHBondContact O-CA 3.41Å; L149-L152 WeakPolarHBondContact O-CB 3.38Å; L149-L152 PolarHBondContact O-N 2.93Å; L149-E153 PolarHBondContact O-N 3.39Å
150R84.1Confident80.4Confident110 Ų110106.5 Ų106.542%0.41554%0.538SS..Hα-helixtrans-47-44.1177.4-175.9-169.2-61.71760.2114R146 L152 E153 Q154R146-R150 WeakPolarHBondContact O-CB 3.48Å; R146-R150 PolarHBondContact O-N 2.86Å; R150-L152 VanDerWaalsContact C-N 3.33Å; R150-L152 PolarHBondContact O-N 3.18Å; R150-E153 PolarHBondContact O-N 3.21Å; R150-Q154 WeakPolarHBondContact O-CG 3.33Å; R150-Q154 PolarHBondContact O-N 2.65Å
151P85.3Confident78.2Confident67 Ų67107.7 Ų107.744%0.43555%0.549SS..Hα-helixtrans-66-32177.5-20.934.7000113.7K148 L149 K155K148-P151 WeakPolarHBondContact O-CD 3.43Å; L149-P151 VanDerWaalsContact C-CD 3.41Å; L149-P151 VanDerWaalsContact C-N 3.32Å; L149-P151 VanDerWaalsContact O-N 3.17Å; P151-K155 WeakPolarHBondContact O-CG 3.43Å; P151-K155 PolarHBondContact O-N 3.18Å; P151-K155 VanDerWaalsContact O-N 3.16Å
152L79.9Confident75.9Confident96 Ų96108.9 Ų108.950%0.50357%0.566SS.*Hα-helixtrans-72-42.5176.7-62.5174000110.7L149 R150 Q154 K155 L156L149-L152 HydrophobicContact CD2-CD1 3.87Å; L149-L152 WeakPolarHBondContact O-CA 3.41Å; L149-L152 WeakPolarHBondContact O-CB 3.38Å; L149-L152 PolarHBondContact O-N 2.93Å; R150-L152 VanDerWaalsContact C-N 3.33Å; R150-L152 PolarHBondContact O-N 3.18Å; L152-Q154 VanDerWaalsContact C-N 3.32Å; L152-Q154 PolarHBondContact O-N 3.05Å; L152-K155 PolarHBondContact O-N 3.33Å; L152-L156 WeakPolarHBondContact O-CG 3.31Å; L152-L156 PolarHBondContact O-N 3.05Å
153E75Confident73.8Confident92 Ų92114.2 Ų114.243%0.4358%0.582SS.*Hα-helixtrans-61.2-39.7175.1-66.6179.9-178.300112.4L149 R150 L156 K157L149-E153 PolarHBondContact O-N 3.39Å; R150-E153 PolarHBondContact O-N 3.21Å; E153-L156 PolarHBondContact O-N 3.12Å; E153-K157 WeakPolarHBondContact O-CB 3.48Å; E153-K157 WeakPolarHBondContact O-CG 3.1Å; E153-K157 PolarHBondContact O-N 2.8Å
154Q78.5Confident71.1Confident121 Ų121119.6 Ų119.657%0.56560%0.604SS**Hα-helixtrans-65.7-39.7175.9-73.5173.7-4.900111.9R150 L152 K157 A158R150-Q154 WeakPolarHBondContact O-CG 3.33Å; R150-Q154 PolarHBondContact O-N 2.65Å; L152-Q154 VanDerWaalsContact C-N 3.32Å; L152-Q154 PolarHBondContact O-N 3.05Å; Q154-K157 PolarHBondContact O-N 3.31Å; Q154-A158 VanDerWaalsContact O-CB 3.27Å; Q154-A158 WeakPolarHBondContact O-CB 3.23Å; Q154-A158 PolarHBondContact O-N 3.15Å
155K76.3Confident68.5Low153 Ų153119.5 Ų119.567%0.66562%0.615SS**Hα-helixtrans-64.6-41174.3-76178.5180-176.20112.3P151 L152 A158 T159P151-K155 WeakPolarHBondContact O-CG 3.43Å; P151-K155 PolarHBondContact O-N 3.18Å; P151-K155 VanDerWaalsContact O-N 3.16Å; L152-K155 PolarHBondContact O-N 3.33Å; K155-A158 PolarHBondContact O-N 2.8Å; K155-T159 PolarHBondContact O-OG1 3.4Å
156L71Confident66.2Low133 Ų133125 Ų12570%0.69664%0.635SS**Hα-helixtrans-65.7-38.7175.9-71.4165.8000112.2L152 E153 T159L152-L156 WeakPolarHBondContact O-CG 3.31Å; L152-L156 PolarHBondContact O-N 3.05Å; E153-L156 PolarHBondContact O-N 3.12Å; L156-T159 PolarHBondContact O-OG1 3.41Å
157K63.5Low63.6Low156 Ų156130 Ų13068%0.67865%0.654SS**Hα-helixtrans-74.1-24.4176.2-73.2171.2-179.5168.90113.6E153 Q154 T159E153-K157 WeakPolarHBondContact O-CB 3.48Å; E153-K157 WeakPolarHBondContact O-CG 3.1Å; E153-K157 PolarHBondContact O-N 2.8Å; Q154-K157 PolarHBondContact O-N 3.31Å; K157-T159 VanDerWaalsContact C-N 3.27Å; K157-T159 PolarHBondContact O-N 2.73Å
158A57.6Low61.3Low78 Ų78133.4 Ų133.465%0.64567%0.667SS**THydrogen-bonded Turntrans-79.7-2.1177.200000114.2Q154 K155 P160Q154-A158 VanDerWaalsContact O-CB 3.27Å; Q154-A158 WeakPolarHBondContact O-CB 3.23Å; Q154-A158 PolarHBondContact O-N 3.15Å; K155-A158 PolarHBondContact O-N 2.8Å; A158-P160 WeakPolarHBondContact O-CD 3.49Å
159T51.1Low58.9Low108 Ų108134.7 Ų134.766%0.66368%0.679SS**  trans-99.268.7167.828.50000113.4K155 L156 K157K155-T159 PolarHBondContact O-OG1 3.4Å; L156-T159 PolarHBondContact O-OG1 3.41Å; K157-T159 VanDerWaalsContact C-N 3.27Å; K157-T159 PolarHBondContact O-N 2.73Å
160P51.8Low56.6Low100 Ų100136.3 Ų136.365%0.64969%0.694SS**  trans-97134148.233-20.8000108.7A158A158-P160 WeakPolarHBondContact O-CD 3.49Å
161N49.4Very low54.6Low154 Ų154139.9 Ų139.982%0.82472%0.716SS**  trans79.867.4179.8-73-15.3000117.8
162S42.1Very low52.8Low119 Ų119142.3 Ų142.383%0.83273%0.731SS**  trans-94103.2132.1-74.30000107.3K164S162-K164 PolarHBondContact O-N 3.36Å
163Q47.8Very low51.3Low169 Ų169143.5 Ų143.579%0.7975%0.745SS**  trans-44.6124.1170.5-65.1171.6-1.700108.5P165Q163-P165 WeakPolarHBondContact O-CD 3.47Å; Q163-P165 VanDerWaalsContact O-N 3.08Å
164K38.3Very low50.1Low200 Ų200144.7 Ų144.787%0.8776%0.76SS**  trans-54114.9164.1-74.1179.4176.7178.80107.1S162 K166S162-K164 PolarHBondContact O-N 3.36Å; K164-K166 PolarHBondContact O-N 2.96Å
165P38.6Very low48.2Very low117 Ų117146.5 Ų146.576%0.7677%0.774SS**  trans-66.2119.5157.5-523.2000104.7Q163 R167Q163-P165 WeakPolarHBondContact O-CD 3.47Å; Q163-P165 VanDerWaalsContact O-N 3.08Å; P165-R167 PolarHBondContact O-N 3.4Å
166K40.4Very low46.6Very low203 Ų203148.6 Ų148.688%0.88378%0.783SS**  trans-5697160.9-86.9178.5173.9177.90106.4K164 Q168K164-K166 PolarHBondContact O-N 2.96Å; K166-Q168 PolarHBondContact O-N 2.94Å; K166-Q168 VanDerWaalsContact O-N 3.12Å
167R36.1Very low45.4Very low239 Ų239148 Ų14890%0.90279%0.787SS**  trans-72.4105.7169.2-145.1173.5-170.8175.91.7105.7P165 I169P165-R167 PolarHBondContact O-N 3.4Å; R167-I169 PolarHBondContact O-N 2.92Å
168Q42.8Very low44.2Very low174 Ų174149.5 Ų149.581%0.81379%0.794SS**PPolyproline II helixtrans-55.3129.4171.5-68.5172.9-0.600108.2K166 P170K166-Q168 PolarHBondContact O-N 2.94Å; K166-Q168 VanDerWaalsContact O-N 3.12Å; Q168-P170 WeakPolarHBondContact O-CD 3.36Å
169I40Very low43.5Very low159 Ų159153.1 Ų153.182%0.81580%0.801SS**PPolyproline II helixtrans-68.7121167.8-61.3166000105.8R167 E171R167-I169 PolarHBondContact O-N 2.92Å; I169-E171 PolarHBondContact O-N 3.47Å
170P38.2Very low43.2Very low115 Ų115153.3 Ų153.375%0.74780%0.802SS**PPolyproline II helixtrans-69.3128.7171.3-13.829.3000109.3Q168Q168-P170 WeakPolarHBondContact O-CD 3.36Å
171E42.2Very low43Very low185 Ų185157.9 Ų157.986%0.86481%0.812SS**PPolyproline II helixtrans-60.4138170.8-76.1-173.1147.100110.9I169I169-E171 PolarHBondContact O-N 3.47Å
172P47.8Very low42.6Very low117 Ų117156.4 Ų156.476%0.7681%0.814SS**PPolyproline II helixtrans-77.6143.2170.929.5-29.9000111.4
173P48.8Very low42.3Very low122 Ų122154.5 Ų154.579%0.79281%0.813SS**PPolyproline II helixtrans-70.2155.9-17427.5-33.4000113.7
174P49.1Very low42.1Very low116 Ų116151.2 Ų151.275%0.75382%0.815SS**PPolyproline II helixtrans-86.7119.6-169.333.4-30.3000111.3
175N39.9Very low42.7Very low160 Ų160146.3 Ų146.386%0.85681%0.811SS**  trans-171.1108.7145.7-94.8-32.4000112.7
176K42Very low43.2Very low196 Ų196148.2 Ų148.285%0.85281%0.813SS**  trans-10.9168.5161.2-59.5175.2-175.6177.10121.1
177P45.6Very low43.7Very low120 Ų120146.3 Ų146.378%0.77981%0.811SS**  cis-127.7162.6-0.427.7-5.8000116.7
178F38Very low44.1Very low189 Ų189143.6 Ų143.683%0.82981%0.806SS**  trans-49138.5167-99.4-118.8000114.8T180F178-T180 HydrophobicContact CD1-CG2 4.32Å
179I44.4Very low44.1Very low154 Ų154141.9 Ų141.979%0.7980%0.802SS**  trans-123.8101.8148.9-61.1178.2000107.6K181I179-K181 HydrophobicContact CG2-CG 4.42Å
180T44.1Very low44Very low111 Ų111140.7 Ų140.768%0.68181%0.806SS**  trans-70.5125160.621.30000109.4F178F178-T180 HydrophobicContact CD1-CG2 4.32Å
181K47.2Very low44.4Very low196 Ų196141.7 Ų141.785%0.85282%0.815SS**  trans-133.4106.6152.3-79.8-168.5176.3179.40110.1I179I179-K181 HydrophobicContact CG2-CG 4.42Å
182S40.3Very low44.3Very low124 Ų124136.1 Ų136.187%0.86781%0.807SS**  trans-63.9154.4158.1-67.70000111.7
183G35.8Very low44Very low79 Ų79137.7 Ų137.781%0.81481%0.814SS**  trans97.9135.1156.800000113.5
184A45.3Very low43.7Very low100 Ų100135.6 Ų135.683%0.82681%0.807SS**  cis-160.2152.14.500000107.8
185A49.7Very low43.5Very low96 Ų96139.1 Ų139.179%0.79381%0.813SS**  trans-65.5135.9168.500000110.9
186I49.6Very low43.3Very low157 Ų157137.7 Ų137.781%0.80581%0.814SS**  trans-142.997.7145.3-56.9-174.8000107.6K188I186-K188 HydrophobicContact CG2-CB 4.03Å
187I50.2Low43.1Very low164 Ų164133.2 Ų133.284%0.84181%0.814SS**  trans-81120.3149-63.4172.2000104.6
188K45.9Very low42.7Very low181 Ų181134.1 Ų134.179%0.78782%0.817SS**  trans-148.8116.9158.7-146.6169-175.3178.70110I186I186-K188 HydrophobicContact CG2-CB 4.03Å
189D42.1Very low42.9Very low139 Ų139137.6 Ų137.674%0.74384%0.839SS**  trans-27.9142166.4-56-55.2000115.2
190C38.8Very low42.9Very low133 Ų133136.8 Ų136.890%0.89984%0.842SS**  -163.2102.9129.9-94.30000110.3
191C45.1Very low42.8Very low137 Ų137138.1 Ų138.193%0.92685%0.85SS**  trans-85.2140.6157.7-122.50000108.9
192G39.8Very low42.6Very low68 Ų68134.9 Ų134.970%0.70185%0.85SS**  trans89.1141.3165.300000114.4
193V43.2Very low42.7Very low149 Ų149135.5 Ų135.590%0.90385%0.849SS**  cis-164137.214.3-177.10000106
194A42Very low43.1Very low79 Ų79139.1 Ų139.165%0.65385%0.851SS**  trans156.811913100000114
195Q45.4Very low43Very low189 Ų189141.7 Ų141.788%0.88385%0.853SS**  trans86.397138.8-72.8167.2-15.100121.2
196C34.4Very low42.5Very low130 Ų130144.9 Ų144.988%0.87886%0.857SS**  trans-28.1145.3138.1-71.90000116.3
197A38.9Very low42Very low102 Ų102144 Ų14484%0.84386%0.861SS**  -158.1133.3110.400000111.2
198V37.3Very low41.3Very low140 Ų140142.3 Ų142.385%0.84886%0.863SS**  trans-86.6136.5166.1168.30000107.9
199M42.4Very low40.8Very low261 Ų261138.8 Ų138.8100%1.28687%0.869SS**  trans-145.90140.5-92.9-159-76.400108.4

Retrieved 199 of 199 residues in 171.3 ms (Link to these results)