A0A3Q0KFK5_SCHMA Loading...

MICOS complex subunit MIC19

AlphaFold DB , UniProt , Accession A0A3Q0KFK5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 157 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
1M47.9Very low56.9Low247 Ų247145.5 Ų145.5100%1.21786%0.86SS**  0115.30-74.4173.815200106.6
2G42.4Very low58.7Low84 Ų84140.8 Ų140.887%0.86683%0.834SS**  trans-82.6142.9-162.300000114.3
3S49.1Very low60.1Low126 Ų126140.2 Ų140.288%0.88183%0.832SS**  trans-113105.6165.2-65.30000107.9
4G43.6Very low61.3Low84 Ų84140.2 Ų140.287%0.86682%0.817SS**  trans-81.9113.2170.200000109.9
5A54.1Low62.2Low85 Ų85139.5 Ų139.570%0.70280%0.802SS**  trans-82.1111.7169.800000109H7A5-H7 PolarHBondContact O-N 3.36Å
6S55.4Low62.9Low113 Ų113137.1 Ų137.179%0.7979%0.793SS**  trans-78107.6174.5-170.10000109.3Q8S6-Q8 PolarHBondContact O-N 3.37Å
7H57.4Low63.8Low176 Ų176137.6 Ų137.682%0.81579%0.792SS**  trans-82.9101.4170.6-81.1-99.4000109A5A5-H7 PolarHBondContact O-N 3.36Å
8Q60.8Low64.6Low164 Ų164135.7 Ų135.777%0.76678%0.779SS**  trans-88.5109.3168.8-133172.732.900108.3S6S6-Q8 PolarHBondContact O-N 3.37Å
9T71.9Confident65.2Low143 Ų143134.5 Ų134.588%0.87777%0.769SS**  trans-73.9126168.327.70000109.1
10R69.4Low66.1Low216 Ų216134.5 Ų134.582%0.81577%0.771SS**  trans-104.8134.6168.1-74.9-173.4136.7123.7-0.5108.6
11D74.6Confident66.9Low162 Ų162132.6 Ų132.687%0.86676%0.757SS**  trans-76.3132.1172.3-142.6-9.1000109
12V77.5Confident68.6Low90 Ų90123.9 Ų123.955%0.54572%0.721SS.*  trans-121.6112.9179.2-177.30000107.7F14V12-F14 HydrophobicContact CB-CE2 4.15Å; V12-F14 HydrophobicContact CB-CZ 4.41Å; V12-F14 HydrophobicContact CG1-CD2 4.27Å; V12-F14 HydrophobicContact CG1-CE1 4.12Å; V12-F14 HydrophobicContact CG1-CE2 3.74Å; V12-F14 HydrophobicContact CG1-CZ 3.66Å
13T76.8Confident70.7Confident132 Ų132126.8 Ų126.881%0.8171%0.712SS**PPolyproline II helixtrans-87.5119.4173.6-47.40000108.8
14F76.9Confident72.3Confident141 Ų141125.3 Ų125.362%0.61869%0.694SS**PPolyproline II helixtrans-95136.8171.8-64.9-84.3000109.6V12V12-F14 HydrophobicContact CB-CE2 4.15Å; V12-F14 HydrophobicContact CB-CZ 4.41Å; V12-F14 HydrophobicContact CG1-CD2 4.27Å; V12-F14 HydrophobicContact CG1-CE1 4.12Å; V12-F14 HydrophobicContact CG1-CE2 3.74Å; V12-F14 HydrophobicContact CG1-CZ 3.66Å
15H75.8Confident74.2Confident129 Ų129124.1 Ų124.160%0.59767%0.67SS**PPolyproline II helixtrans-80.4150.9167.5-113-2.3000110.4D17 D18H15-D17 PolarHBondContact O-N 2.99Å; H15-D17 VanDerWaalsContact O-N 3.1Å; H15-D18 WeakPolarHBondContact CB-OD2 3.38Å; H15-D18 PolarHBondContact N-OD2 2.84Å; H15-D18 WeakPolarHBondContact O-CB 3.22Å; H15-D18 PolarHBondContact O-N 3.2Å
16P73.7Confident75.7Confident101 Ų101123.3 Ų123.366%0.65665%0.653SS**G310 helixtrans-54.6-30.2177.9-25.233.9000113.4D18P16-D18 VanDerWaalsContact C-N 3.32Å
17D77.2Confident77Confident146 Ų146123.3 Ų123.378%0.78164%0.638SS**G310 helixtrans-78-14.5179.4-58.9-31.3000113.4H15 I19H15-D17 PolarHBondContact O-N 2.99Å; H15-D17 VanDerWaalsContact O-N 3.1Å; D17-I19 VanDerWaalsContact C-N 3.31Å
18D78.3Confident78.2Confident104 Ų104123.5 Ų123.556%0.55663%0.632SS**G310 helixtrans-82-11.8177.5-59.8-37000112.3H15 P16 V20H15-D18 WeakPolarHBondContact CB-OD2 3.38Å; H15-D18 PolarHBondContact N-OD2 2.84Å; H15-D18 WeakPolarHBondContact O-CB 3.22Å; H15-D18 PolarHBondContact O-N 3.2Å; P16-D18 VanDerWaalsContact C-N 3.32Å; D18-V20 PolarHBondContact O-N 3.35Å
19I76.6Confident79.4Confident113 Ų113120.8 Ų120.858%0.57962%0.622SS**  trans-90.688.6-176.3-53.1176.6000109.4D17 I21D17-I19 VanDerWaalsContact C-N 3.31Å; I19-I21 HydrophobicContact CG2-CG1 4.46Å
20V82.8Confident79.9Confident134 Ų134120.5 Ų120.581%0.81261%0.608SS**  trans-86114.4174.4-173.60000110.2D18D18-V20 PolarHBondContact O-N 3.35Å
21I82.2Confident80.3Confident95 Ų95114.9 Ų114.949%0.48760%0.595SS.*  trans-91.4121.7174.1-53.7177000108.8I19 V25 I26I19-I21 HydrophobicContact CG2-CG1 4.46Å; I21-V25 HydrophobicContact CG2-CB 3.83Å; I21-V25 HydrophobicContact CG2-CG1 3.69Å; I21-I26 HydrophobicContact CB-CG1 4.48Å; I21-I26 HydrophobicContact CG2-CD1 4.48Å; I21-I26 HydrophobicContact CG2-CG1 3.81Å
22S84.5Confident80.2Confident64 Ų64110 Ų11045%0.44858%0.577SS.*  trans-67.4148.8178.9680000112.3D24 V25 I26S22-D24 PolarHBondContact O-N 3.37Å; S22-D24 VanDerWaalsContact O-N 3.12Å; S22-V25 WeakPolarHBondContact O-CB 3.31Å; S22-V25 PolarHBondContact O-N 3.41Å; S22-V25 WeakPolarHBondContact OG-CG2 3.29Å; S22-I26 PolarHBondContact O-N 2.76Å; S22-I26 VanDerWaalsContact O-N 3.14Å
23E85.3Confident79.8Confident145 Ų145109.1 Ų109.168%0.67858%0.579SS**Hα-helixtrans-55.4-32.5179.8-71.9-170.6165.600113.2I26 K27E23-I26 PolarHBondContact O-N 2.81Å; E23-K27 WeakPolarHBondContact O-CG 3.3Å; E23-K27 PolarHBondContact O-N 2.77Å
24D82.9Confident79Confident95 Ų95107.3 Ų107.351%0.50857%0.567SS.*Hα-helixtrans-67.5-36.1177.8-70-22.3000112.5S22 K27 R28S22-D24 PolarHBondContact O-N 3.37Å; S22-D24 VanDerWaalsContact O-N 3.12Å; D24-K27 PolarHBondContact O-N 3.16Å; D24-R28 WeakPolarHBondContact O-CG 3.31Å; D24-R28 PolarHBondContact O-N 3.04Å
25V84.1Confident78Confident58 Ų58106 Ų10635%0.35257%0.572SS.*Hα-helixtrans-68.5-42.5174.2174.20000109.6I21 S22 K27 R28 I29I21-V25 HydrophobicContact CG2-CB 3.83Å; I21-V25 HydrophobicContact CG2-CG1 3.69Å; S22-V25 WeakPolarHBondContact O-CB 3.31Å; S22-V25 PolarHBondContact O-N 3.41Å; S22-V25 WeakPolarHBondContact OG-CG2 3.29Å; V25-K27 VanDerWaalsContact C-N 3.32Å; V25-K27 PolarHBondContact O-N 2.95Å; V25-R28 PolarHBondContact O-N 3.29Å; V25-I29 HydrophobicContact CG1-CD1 3.86Å; V25-I29 HydrophobicContact CG1-CG1 4.47Å; V25-I29 VanDerWaalsContact O-CG1 3.31Å; V25-I29 WeakPolarHBondContact O-CG1 3.37Å; V25-I29 PolarHBondContact O-N 3.4Å
26I85.6Confident76.8Confident69 Ų69107.6 Ų107.635%0.35458%0.579SS.*Hα-helixtrans-59.2-43.7175-60.9172.9000110.7I21 S22 E23 I29 K30I21-I26 HydrophobicContact CB-CG1 4.48Å; I21-I26 HydrophobicContact CG2-CD1 4.48Å; I21-I26 HydrophobicContact CG2-CG1 3.81Å; S22-I26 PolarHBondContact O-N 2.76Å; S22-I26 VanDerWaalsContact O-N 3.14Å; E23-I26 PolarHBondContact O-N 2.81Å; I26-I29 PolarHBondContact O-N 3.48Å; I26-K30 HydrophobicContact CG2-CD 4.19Å; I26-K30 WeakPolarHBondContact O-CB 3.38Å; I26-K30 WeakPolarHBondContact O-CG 3.49Å; I26-K30 PolarHBondContact O-N 2.67Å
27K83.7Confident75.6Confident112 Ų112109.4 Ų109.449%0.48758%0.583SS.*Hα-helixtrans-62.4-43175.9-76.8174-173.3165.40112.1E23 D24 V25 I29 K30 N31E23-K27 WeakPolarHBondContact O-CG 3.3Å; E23-K27 PolarHBondContact O-N 2.77Å; D24-K27 PolarHBondContact O-N 3.16Å; V25-K27 VanDerWaalsContact C-N 3.32Å; V25-K27 PolarHBondContact O-N 2.95Å; K27-I29 PolarHBondContact O-N 3.38Å; K27-K30 PolarHBondContact O-N 2.87Å; K27-N31 VanDerWaalsContact O-CB 3.3Å; K27-N31 WeakPolarHBondContact O-CB 3.45Å; K27-N31 PolarHBondContact O-N 3.37Å; K27-N31 PolarHBondContact O-OD1 3.27Å
28R81.4Confident74.1Confident180 Ų180110.4 Ų110.468%0.67959%0.589SS**Hα-helixtrans-62.5-42.3176.7-72.2178.6-147.3-177.15.2112.1D24 V25 N31 A32D24-R28 WeakPolarHBondContact O-CG 3.31Å; D24-R28 PolarHBondContact O-N 3.04Å; V25-R28 PolarHBondContact O-N 3.29Å; R28-N31 PolarHBondContact O-N 3.22Å; R28-A32 VanDerWaalsContact O-CB 3.29Å; R28-A32 WeakPolarHBondContact O-CB 3.35Å; R28-A32 PolarHBondContact O-N 3.39Å
29I85.4Confident72.8Confident107 Ų107109.4 Ų109.455%0.54960%0.595SS.*Hα-helixtrans-64.3-44.8177.9-66166.8000110.4V25 I26 K27 A32 A33V25-I29 HydrophobicContact CG1-CD1 3.86Å; V25-I29 HydrophobicContact CG1-CG1 4.47Å; V25-I29 VanDerWaalsContact O-CG1 3.31Å; V25-I29 WeakPolarHBondContact O-CG1 3.37Å; V25-I29 PolarHBondContact O-N 3.4Å; I26-I29 PolarHBondContact O-N 3.48Å; K27-I29 PolarHBondContact O-N 3.38Å; I29-A32 PolarHBondContact O-N 3.07Å; I29-A33 PolarHBondContact O-N 3.2Å
30K83.3Confident71.1Confident137 Ų137114.3 Ų114.360%0.59661%0.612SS**Hα-helixtrans-63.1-43.8175.9-74.7179.3177.8-178.20112.2I26 K27 A33 T34I26-K30 HydrophobicContact CG2-CD 4.19Å; I26-K30 WeakPolarHBondContact O-CB 3.38Å; I26-K30 WeakPolarHBondContact O-CG 3.49Å; I26-K30 PolarHBondContact O-N 2.67Å; K27-K30 PolarHBondContact O-N 2.87Å; K30-A33 PolarHBondContact O-N 3.01Å; K30-T34 WeakPolarHBondContact O-CG2 3.39Å; K30-T34 PolarHBondContact O-N 2.88Å; K30-T34 PolarHBondContact O-OG1 3.05Å
31N77.6Confident69.4Low99 Ų99114.4 Ų114.453%0.52961%0.608SS.*Hα-helixtrans-65.7-43.5179.5-69.6-3.6000111.1K27 R28 A33 T34 T35K27-N31 VanDerWaalsContact O-CB 3.3Å; K27-N31 WeakPolarHBondContact O-CB 3.45Å; K27-N31 PolarHBondContact O-N 3.37Å; K27-N31 PolarHBondContact O-OD1 3.27Å; R28-N31 PolarHBondContact O-N 3.22Å; N31-A33 VanDerWaalsContact C-N 3.29Å; N31-A33 PolarHBondContact O-N 3.4Å; N31-T34 VanDerWaalsContact CA-OG1 3.31Å; N31-T34 WeakPolarHBondContact CA-OG1 3.39Å; N31-T34 PolarHBondContact O-N 3.41Å; N31-T34 PolarHBondContact O-OG1 2.98Å; N31-T35 PolarHBondContact O-N 3.38Å; N31-T35 PolarHBondContact O-OG1 3.3Å
32A73.5Confident67.7Low59 Ų59118.1 Ų118.149%0.48863%0.629SS.*Hα-helixtrans-57.7-42.8174.300000111.5R28 I29 T34 T35R28-A32 VanDerWaalsContact O-CB 3.29Å; R28-A32 WeakPolarHBondContact O-CB 3.35Å; R28-A32 PolarHBondContact O-N 3.39Å; I29-A32 PolarHBondContact O-N 3.07Å; A32-T34 VanDerWaalsContact C-N 3.3Å; A32-T34 PolarHBondContact O-N 2.84Å; A32-T35 PolarHBondContact O-N 3.5Å
33A67.4Low66.2Low71 Ų71121.8 Ų121.859%0.58764%0.642SS**Hα-helixtrans-65.6-28.7175.300000113.7I29 K30 N31I29-A33 PolarHBondContact O-N 3.2Å; K30-A33 PolarHBondContact O-N 3.01Å; N31-A33 VanDerWaalsContact C-N 3.29Å; N31-A33 PolarHBondContact O-N 3.4Å
34T60.1Low64.4Low94 Ų94120.7 Ų120.758%0.57765%0.648SS**Hα-helixtrans-88.5-12.4178.352.40000114.8K30 N31 A32 E36K30-T34 WeakPolarHBondContact O-CG2 3.39Å; K30-T34 PolarHBondContact O-N 2.88Å; K30-T34 PolarHBondContact O-OG1 3.05Å; N31-T34 VanDerWaalsContact CA-OG1 3.31Å; N31-T34 WeakPolarHBondContact CA-OG1 3.39Å; N31-T34 PolarHBondContact O-N 3.41Å; N31-T34 PolarHBondContact O-OG1 2.98Å; A32-T34 VanDerWaalsContact C-N 3.3Å; A32-T34 PolarHBondContact O-N 2.84Å; T34-E36 VanDerWaalsContact C-N 3.31Å
35T56.3Low62.8Low115 Ų115120 Ų12071%0.70666%0.656SS**THydrogen-bonded Turntrans-87.2-3.2-176.9-30.50000112.6N31 A32N31-T35 PolarHBondContact O-N 3.38Å; N31-T35 PolarHBondContact O-OG1 3.3Å; A32-T35 PolarHBondContact O-N 3.5Å
36E51.3Low61.2Low161 Ų161123.4 Ų123.475%0.75268%0.679SS**THydrogen-bonded Turntrans-96.33.4-176.7-64.2-171.516200114.2T34 N38T34-E36 VanDerWaalsContact C-N 3.31Å; E36-N38 VanDerWaalsContact C-N 3.35Å; E36-N38 PolarHBondContact O-N 2.64Å
37D49.2Very low59.5Low139 Ų139128 Ų12874%0.74370%0.699SS**THydrogen-bonded Turntrans-83.116-173.5-94.6-23.5000116.3
38N45.2Very low57.9Low167 Ų167127.3 Ų127.389%0.89371%0.708SS**THydrogen-bonded Turntrans-133.911.7-179-84.3-74.4000117.4E36E36-N38 VanDerWaalsContact C-N 3.35Å; E36-N38 PolarHBondContact O-N 2.64Å
39A50.2Low56.3Low83 Ų83127.6 Ų127.669%0.68672%0.715SS**  trans-118103171.400000109.9D41A39-D41 VanDerWaalsContact C-N 3.32Å; A39-D41 PolarHBondContact O-N 3.03Å
40K41.2Very low54.9Low217 Ų217130.7 Ų130.794%0.94372%0.724SS**  trans-66.791.5166.1-71.5173.6176.11700108.3
41D47Very low53.3Low135 Ų135127.1 Ų127.172%0.72272%0.715SS**  trans-130.8122.8160.7-107.9-30.5000107.3A39 L43A39-D41 VanDerWaalsContact C-N 3.32Å; A39-D41 PolarHBondContact O-N 3.03Å; D41-L43 VanDerWaalsContact C-N 3.31Å; D41-L43 HydrophobicContact CB-CD1 4.3Å; D41-L43 PolarHBondContact O-N 2.84Å
42D47.3Very low52.2Low173 Ų173130.8 Ų130.893%0.92573%0.729SS**  trans-59.288.2174-77-70.7000109.9
43L53.1Low51.4Low141 Ų141137.6 Ų137.674%0.73874%0.744SS**  trans-110.4131.9165.7-99.380.9000109.9D41 A45D41-L43 VanDerWaalsContact C-N 3.31Å; D41-L43 HydrophobicContact CB-CD1 4.3Å; D41-L43 PolarHBondContact O-N 2.84Å; L43-A45 PolarHBondContact O-N 2.99Å
44P47.1Very low51.4Low122 Ų122136.9 Ų136.979%0.79273%0.734SS**  trans-60.9129.9177.26.31.6000108.7
45A48.7Very low52.2Low82 Ų82138.5 Ų138.568%0.67874%0.739SS**  trans-43.3133.1173.800000109.8L43 E47L43-A45 PolarHBondContact O-N 2.99Å; A45-E47 PolarHBondContact O-N 2.65Å
46P51.6Low53.3Low128 Ų128134.6 Ų134.683%0.83172%0.722SS**  trans-58.2112.8179.523.6-30.6000106.9S48P46-S48 PolarHBondContact O-N 3.39Å; P46-S48 VanDerWaalsContact O-N 3.16Å
47E49.8Very low54.9Low166 Ų166132.5 Ų132.578%0.77672%0.715SS**  trans-48.8128.3176.4-75.6-172.615000107.5A45 F49A45-E47 PolarHBondContact O-N 2.65Å; E47-F49 PolarHBondContact O-N 2.91Å
48S48.5Very low56.8Low98 Ų98132 Ų13269%0.68571%0.706SS**  trans-52.188.8176.5-165.60000109.5P46 K50P46-S48 PolarHBondContact O-N 3.39Å; P46-S48 VanDerWaalsContact O-N 3.16Å; S48-K50 PolarHBondContact O-N 3.35Å
49F49.7Very low58.9Low185 Ų185128.9 Ų128.981%0.81169%0.686SS**  trans-71.868.6167.4-103.7-93.5000106.7E47 P51E47-F49 PolarHBondContact O-N 2.91Å; F49-P51 WeakPolarHBondContact O-CD 3.18Å; F49-P51 VanDerWaalsContact O-N 3.12Å
50K54.7Low60.9Low172 Ų172130.8 Ų130.875%0.74868%0.681SS**  trans-65.2105.2159.5-81.5-173.5179.2-177.80105S48 Q52S48-K50 PolarHBondContact O-N 3.35Å; K50-Q52 PolarHBondContact O-N 2.89Å
51P50.9Low63.3Low63 Ų63125.3 Ų125.341%0.40966%0.661SS.*  trans-71.6138.8-156.8-10.125.1000108.3F49 Y53 S54F49-P51 WeakPolarHBondContact O-CD 3.18Å; F49-P51 VanDerWaalsContact O-N 3.12Å; P51-Y53 HydrophobicContact CB-CD2 3.63Å; P51-Y53 HydrophobicContact CB-CG 4.39Å; P51-Y53 PolarHBondContact O-N 3Å; P51-S54 WeakPolarHBondContact O-CB 3.31Å; P51-S54 PolarHBondContact O-N 3.47Å; P51-S54 PolarHBondContact O-OG 3.5Å
52Q54.4Low65.6Low176 Ų176123.3 Ų123.382%0.82265%0.647SS**THydrogen-bonded Turntrans-49.3-24170.9-163.5162.2900112.4K50 S54 L55 G56K50-Q52 PolarHBondContact O-N 2.89Å; Q52-S54 VanDerWaalsContact C-N 3.29Å; Q52-S54 PolarHBondContact O-N 2.92Å; Q52-L55 PolarHBondContact O-N 3.46Å; Q52-G56 PolarHBondContact O-N 3.17Å
53Y55.5Low67.8Low202 Ų202118.3 Ų118.379%0.79262%0.618SS**Hα-helixtrans-57.8-31.8170.2-57.9-79.5000114.5P51 L55 G56 L57P51-Y53 HydrophobicContact CB-CD2 3.63Å; P51-Y53 HydrophobicContact CB-CG 4.39Å; P51-Y53 PolarHBondContact O-N 3Å; Y53-L55 VanDerWaalsContact C-N 3.3Å; Y53-L55 PolarHBondContact O-N 3.39Å; Y53-G56 PolarHBondContact O-N 3.4Å; Y53-L57 VanDerWaalsContact O-CB 3.31Å; Y53-L57 WeakPolarHBondContact O-CB 3.37Å; Y53-L57 PolarHBondContact O-N 2.94Å
54S67.3Low69.8Low56 Ų56113.2 Ų113.239%0.39260%0.597SS.*Hα-helixtrans-67.6-29.7177.365.80000112.9P51 Q52 K58P51-S54 WeakPolarHBondContact O-CB 3.31Å; P51-S54 PolarHBondContact O-N 3.47Å; P51-S54 PolarHBondContact O-OG 3.5Å; Q52-S54 VanDerWaalsContact C-N 3.29Å; Q52-S54 PolarHBondContact O-N 2.92Å; S54-K58 WeakPolarHBondContact O-CB 3.5Å; S54-K58 WeakPolarHBondContact O-CD 3.47Å; S54-K58 WeakPolarHBondContact O-CG 3.35Å; S54-K58 PolarHBondContact O-N 3.27Å
55L76.4Confident72.2Confident127 Ų127112.1 Ų112.167%0.66558%0.581SS**Hα-helixtrans-78.2-42177.1-158.181.8000110.8Q52 Y53 K58 H59Q52-L55 PolarHBondContact O-N 3.46Å; Y53-L55 VanDerWaalsContact C-N 3.3Å; Y53-L55 PolarHBondContact O-N 3.39Å; L55-K58 PolarHBondContact O-N 3.46Å; L55-H59 PolarHBondContact O-N 2.91Å
56G79.6Confident74.5Confident34 Ų34113.9 Ų113.935%0.35157%0.57SS.*Hα-helixtrans-61-47.8174.900000112.2Q52 Y53 K58 H59 E60Q52-G56 PolarHBondContact O-N 3.17Å; Y53-G56 PolarHBondContact O-N 3.4Å; G56-K58 VanDerWaalsContact C-N 3.33Å; G56-K58 PolarHBondContact O-N 3.44Å; G56-H59 PolarHBondContact O-N 2.93Å; G56-E60 WeakPolarHBondContact O-CG 3.47Å; G56-E60 PolarHBondContact O-N 2.86Å
57L86.3Confident76.7Confident117 Ų117115.4 Ų115.461%0.61356%0.559SS**Hα-helixtrans-62.3-38.6178.1-17365.7000112.5Y53 E60 L61Y53-L57 VanDerWaalsContact O-CB 3.31Å; Y53-L57 WeakPolarHBondContact O-CB 3.37Å; Y53-L57 PolarHBondContact O-N 2.94Å; L57-E60 PolarHBondContact O-N 3.45Å; L57-L61 WeakPolarHBondContact O-CB 3.38Å; L57-L61 PolarHBondContact O-N 3.2Å
58K88.4Confident79Confident128 Ų128115.6 Ų115.656%0.55755%0.554SS**Hα-helixtrans-63.2-46.2173.5-78.3175.3-179.4-169.10111.8S54 L55 G56 E60 L61 E62S54-K58 WeakPolarHBondContact O-CB 3.5Å; S54-K58 WeakPolarHBondContact O-CD 3.47Å; S54-K58 WeakPolarHBondContact O-CG 3.35Å; S54-K58 PolarHBondContact O-N 3.27Å; L55-K58 PolarHBondContact O-N 3.46Å; G56-K58 VanDerWaalsContact C-N 3.33Å; G56-K58 PolarHBondContact O-N 3.44Å; K58-E60 VanDerWaalsContact C-N 3.34Å; K58-E60 PolarHBondContact O-N 2.97Å; K58-L61 PolarHBondContact O-N 2.94Å; K58-E62 WeakPolarHBondContact O-CG 3.46Å; K58-E62 PolarHBondContact O-N 3.12Å
59H89.4Confident81.3Confident101 Ų101116.4 Ų116.447%0.46855%0.547SS..Hα-helixtrans-62.5-42178.2-179.8-82.3000111.9L55 G56 E62 E63L55-H59 PolarHBondContact O-N 2.91Å; G56-H59 PolarHBondContact O-N 2.93Å; H59-E62 PolarHBondContact O-N 3.1Å; H59-E63 IonicContact CE1-OE2 2.65Å; H59-E63 WeakPolarHBondContact O-CB 3.49Å; H59-E63 PolarHBondContact O-N 3.26Å
60E91.1Very high83.6Confident124 Ų124114.9 Ų114.958%0.57954%0.54SS*.Hα-helixtrans-62.6-41.9174.9-73.7174.1-16800112.1G56 L57 K58 E63 A64G56-E60 WeakPolarHBondContact O-CG 3.47Å; G56-E60 PolarHBondContact O-N 2.86Å; L57-E60 PolarHBondContact O-N 3.45Å; K58-E60 VanDerWaalsContact C-N 3.34Å; K58-E60 PolarHBondContact O-N 2.97Å; E60-E63 PolarHBondContact O-N 3.32Å; E60-A64 WeakPolarHBondContact O-CB 3.4Å; E60-A64 PolarHBondContact O-N 3.14Å
61L93.3Very high85.7Confident102 Ų102111.7 Ų111.753%0.53453%0.531SS..Hα-helixtrans-62.6-49.3175.7-177.665.6000111.3L57 K58 E63 A64 E65L57-L61 WeakPolarHBondContact O-CB 3.38Å; L57-L61 PolarHBondContact O-N 3.2Å; K58-L61 PolarHBondContact O-N 2.94Å; L61-E63 VanDerWaalsContact C-N 3.26Å; L61-E63 PolarHBondContact O-N 3.13Å; L61-A64 WeakPolarHBondContact O-CB 3.1Å; L61-A64 PolarHBondContact O-N 3.06Å; L61-A64 VanDerWaalsContact O-N 3.14Å; L61-E65 WeakPolarHBondContact O-CG 3.22Å; L61-E65 PolarHBondContact O-N 3.16Å
62E93.9Very high87.9Confident92 Ų92113.3 Ų113.343%0.4354%0.535SS..Hα-helixtrans-61.6-35.6177.3-70.8175.4-166.900111.9K58 H59 R66K58-E62 WeakPolarHBondContact O-CG 3.46Å; K58-E62 PolarHBondContact O-N 3.12Å; H59-E62 PolarHBondContact O-N 3.1Å; E62-R66 WeakPolarHBondContact O-CB 3.46Å; E62-R66 VanDerWaalsContact O-CG 3.28Å; E62-R66 WeakPolarHBondContact O-CG 3.47Å; E62-R66 PolarHBondContact O-N 3.5Å; E62-R66 PolarHBondContact O-NE 3.02Å; E62-R66 IonicContact OE2-NH1 3.37Å
63E94.7Very high90Very high68 Ų68111 Ų11132%0.31852%0.524SS..Hα-helixtrans-68.7-40.6175.1-168.3179.9172.900111.9H59 E60 L61 R67H59-E63 IonicContact CE1-OE2 2.65Å; H59-E63 WeakPolarHBondContact O-CB 3.49Å; H59-E63 PolarHBondContact O-N 3.26Å; E60-E63 PolarHBondContact O-N 3.32Å; L61-E63 VanDerWaalsContact C-N 3.26Å; L61-E63 PolarHBondContact O-N 3.13Å; E63-R67 WeakPolarHBondContact O-CB 3.47Å; E63-R67 VanDerWaalsContact O-CG 3.22Å; E63-R67 WeakPolarHBondContact O-CG 3.43Å; E63-R67 PolarHBondContact O-N 3.24Å; E63-R67 IonicContact OE1-CZ 2.72Å; E63-R67 IonicContact OE1-NE 2.75Å; E63-R67 PolarHBondContact OE1-NE 2.91Å; E63-R67 IonicContact OE1-NH2 3.77Å; E63-R67 PolarHBondContact OE1-NH2 3.49Å
64A95.4Very high92Very high34 Ų34105.8 Ų105.828%0.28151%0.51SS..Hα-helixtrans-62.9-45.7174.100000111.5E60 L61 R67 Y68E60-A64 WeakPolarHBondContact O-CB 3.4Å; E60-A64 PolarHBondContact O-N 3.14Å; L61-A64 WeakPolarHBondContact O-CB 3.1Å; L61-A64 PolarHBondContact O-N 3.06Å; L61-A64 VanDerWaalsContact O-N 3.14Å; A64-R67 WeakPolarHBondContact O-CB 3.39Å; A64-R67 PolarHBondContact O-N 2.85Å; A64-R67 VanDerWaalsContact O-N 3.16Å; A64-Y68 HydrophobicContact CB-CD2 4.5Å; A64-Y68 HydrophobicContact CB-CE2 4.39Å; A64-Y68 WeakPolarHBondContact O-CD2 3.32Å; A64-Y68 PolarHBondContact O-N 2.9Å
65E96.6Very high93.5Very high100 Ų100107.8 Ų107.847%0.46752%0.516SS..Hα-helixtrans-56.6-51.7175.4-74.4174.6170.900111L61 R67 Y68 E69L61-E65 WeakPolarHBondContact O-CG 3.22Å; L61-E65 PolarHBondContact O-N 3.16Å; E65-R67 VanDerWaalsContact C-N 3.27Å; E65-R67 PolarHBondContact O-N 3.14Å; E65-Y68 PolarHBondContact O-N 3.27Å; E65-Y68 VanDerWaalsContact O-N 3.13Å; E65-E69 WeakPolarHBondContact O-CB 3.46Å; E65-E69 WeakPolarHBondContact O-CG 3.49Å; E65-E69 PolarHBondContact O-N 3.09Å
66R97Very high94.5Very high119 Ų119107 Ų10745%0.44951%0.509SS..Hα-helixtrans-57.6-37.8176.2-73.8-174.9-63.8-98.32.4112.9E62 K70E62-R66 WeakPolarHBondContact O-CB 3.46Å; E62-R66 VanDerWaalsContact O-CG 3.28Å; E62-R66 WeakPolarHBondContact O-CG 3.47Å; E62-R66 PolarHBondContact O-N 3.5Å; E62-R66 PolarHBondContact O-NE 3.02Å; E62-R66 IonicContact OE2-NH1 3.37Å; R66-K70 WeakPolarHBondContact O-CB 3.44Å; R66-K70 PolarHBondContact O-N 3.28Å
67R97.3Very high95.4Very high159 Ų159111.6 Ų111.660%0.652%0.519SS*.Hα-helixtrans-67.6-43.9177.1-73.9170.5-175.4-170.44.7111.5E63 A64 E65 K70 L71E63-R67 WeakPolarHBondContact O-CB 3.47Å; E63-R67 VanDerWaalsContact O-CG 3.22Å; E63-R67 WeakPolarHBondContact O-CG 3.43Å; E63-R67 PolarHBondContact O-N 3.24Å; E63-R67 IonicContact OE1-CZ 2.72Å; E63-R67 IonicContact OE1-NE 2.75Å; E63-R67 PolarHBondContact OE1-NE 2.91Å; E63-R67 IonicContact OE1-NH2 3.77Å; E63-R67 PolarHBondContact OE1-NH2 3.49Å; A64-R67 WeakPolarHBondContact O-CB 3.39Å; A64-R67 PolarHBondContact O-N 2.85Å; A64-R67 VanDerWaalsContact O-N 3.16Å; E65-R67 VanDerWaalsContact C-N 3.27Å; E65-R67 PolarHBondContact O-N 3.14Å; R67-K70 PolarHBondContact O-N 3.34Å; R67-L71 PolarHBondContact O-N 3.02Å
68Y97.7Very high95.9Very high170 Ų170112.8 Ų112.867%0.66752%0.515SS*.Hα-helixtrans-70.7-39.8179.5-74.8-59.7000112.6A64 E65 K70 L71 L72A64-Y68 HydrophobicContact CB-CD2 4.5Å; A64-Y68 HydrophobicContact CB-CE2 4.39Å; A64-Y68 WeakPolarHBondContact O-CD2 3.32Å; A64-Y68 PolarHBondContact O-N 2.9Å; E65-Y68 PolarHBondContact O-N 3.27Å; E65-Y68 VanDerWaalsContact O-N 3.13Å; Y68-K70 VanDerWaalsContact C-N 3.32Å; Y68-K70 PolarHBondContact O-N 2.85Å; Y68-L71 PolarHBondContact O-N 3.43Å; Y68-L71 VanDerWaalsContact O-N 3.16Å; Y68-L72 WeakPolarHBondContact O-CB 3.28Å; Y68-L72 PolarHBondContact O-N 3.43Å
69E97.9Very high96.4Very high116 Ų116111.8 Ų111.854%0.54252%0.516SS..Hα-helixtrans-57.1-46172.7-75.1178174.900111.4E65 L71 L72 Q73E65-E69 WeakPolarHBondContact O-CB 3.46Å; E65-E69 WeakPolarHBondContact O-CG 3.49Å; E65-E69 PolarHBondContact O-N 3.09Å; E69-L71 VanDerWaalsContact C-N 3.33Å; E69-L71 PolarHBondContact O-N 3.16Å; E69-L72 PolarHBondContact O-N 3.19Å; E69-Q73 WeakPolarHBondContact O-CG 3.36Å; E69-Q73 PolarHBondContact O-N 2.94Å
70K97.7Very high96.8Very high153 Ų153112.9 Ų112.967%0.66552%0.522SS*.Hα-helixtrans-62.5-39.3176.4-176.2176.6-179.5178.80112.3R66 R67 Y68 L74R66-K70 WeakPolarHBondContact O-CB 3.44Å; R66-K70 PolarHBondContact O-N 3.28Å; R67-K70 PolarHBondContact O-N 3.34Å; Y68-K70 VanDerWaalsContact C-N 3.32Å; Y68-K70 PolarHBondContact O-N 2.85Å; K70-L74 PolarHBondContact O-N 3.3Å; K70-L74 VanDerWaalsContact O-N 3.14Å
71L97.9Very high97.1Very high105 Ų105111.8 Ų111.855%0.5552%0.517SS..Hα-helixtrans-67-40.9177.2-177.861.4000111.4R67 Y68 E69 L74 L75R67-L71 PolarHBondContact O-N 3.02Å; Y68-L71 PolarHBondContact O-N 3.43Å; Y68-L71 VanDerWaalsContact O-N 3.16Å; E69-L71 VanDerWaalsContact C-N 3.33Å; E69-L71 PolarHBondContact O-N 3.16Å; L71-L74 PolarHBondContact O-N 3.14Å; L71-L75 WeakPolarHBondContact O-CB 3.38Å; L71-L75 PolarHBondContact O-N 2.85Å
72L98.2Very high97.4Very high96 Ų96111.5 Ų111.550%0.50352%0.515SS..Hα-helixtrans-62.8-47.8177.6-171.865.4000111Y68 E69 L74 L75 E76Y68-L72 WeakPolarHBondContact O-CB 3.28Å; Y68-L72 PolarHBondContact O-N 3.43Å; E69-L72 PolarHBondContact O-N 3.19Å; L72-L74 VanDerWaalsContact C-N 3.28Å; L72-L74 PolarHBondContact O-N 2.97Å; L72-L75 WeakPolarHBondContact O-CB 3.31Å; L72-L75 PolarHBondContact O-N 3.14Å; L72-L75 VanDerWaalsContact O-N 3.09Å; L72-E76 WeakPolarHBondContact O-CB 3.38Å; L72-E76 WeakPolarHBondContact O-CG 3.37Å; L72-E76 PolarHBondContact O-N 2.87Å
73Q97.8Very high97.6Very high127 Ų127113.8 Ų113.859%0.59352%0.524SS*.Hα-helixtrans-58-39.9175.2-72.2175.32.100112.6E69 K77E69-Q73 WeakPolarHBondContact O-CG 3.36Å; E69-Q73 PolarHBondContact O-N 2.94Å; Q73-K77 WeakPolarHBondContact O-CB 3.45Å; Q73-K77 PolarHBondContact O-N 3Å
74L97.8Very high97.7Very high93 Ų93114.1 Ų114.149%0.48753%0.528SS..Hα-helixtrans-67-40176.6-176.7147.6000111.7K70 L71 L72 R78K70-L74 PolarHBondContact O-N 3.3Å; K70-L74 VanDerWaalsContact O-N 3.14Å; L71-L74 PolarHBondContact O-N 3.14Å; L72-L74 VanDerWaalsContact C-N 3.28Å; L72-L74 PolarHBondContact O-N 2.97Å; L74-R78 WeakPolarHBondContact O-CB 3.5Å; L74-R78 PolarHBondContact O-N 3.03Å
75L98.4Very high97.8Very high98 Ų98118.3 Ų118.351%0.51354%0.541SS..Hα-helixtrans-66.6-45.2177.5-177.563.1000111.3L71 L72 R78 N79L71-L75 WeakPolarHBondContact O-CB 3.38Å; L71-L75 PolarHBondContact O-N 2.85Å; L72-L75 WeakPolarHBondContact O-CB 3.31Å; L72-L75 PolarHBondContact O-N 3.14Å; L72-L75 VanDerWaalsContact O-N 3.09Å; L75-R78 PolarHBondContact O-N 3.38Å; L75-N79 WeakPolarHBondContact O-CB 3.47Å; L75-N79 PolarHBondContact O-N 2.83Å
76E98.2Very high97.9Very high112 Ų112116.4 Ų116.452%0.52354%0.543SS..Hα-helixtrans-58.1-49.7175.7-73.7173.2167.600111L72 R78 N79 E80L72-E76 WeakPolarHBondContact O-CB 3.38Å; L72-E76 WeakPolarHBondContact O-CG 3.37Å; L72-E76 PolarHBondContact O-N 2.87Å; E76-R78 VanDerWaalsContact C-N 3.33Å; E76-R78 PolarHBondContact O-N 3.28Å; E76-N79 PolarHBondContact O-N 3.31Å; E76-N79 VanDerWaalsContact O-N 3.14Å; E76-E80 PolarHBondContact O-N 2.97Å
77K98Very high97.9Very high130 Ų130112.6 Ų112.657%0.56554%0.537SS*.Hα-helixtrans-58.7-43.3176.7-176.2178.5-178.8177.70112.4Q73 N79 Q81Q73-K77 WeakPolarHBondContact O-CB 3.45Å; Q73-K77 PolarHBondContact O-N 3Å; K77-N79 VanDerWaalsContact C-N 3.35Å; K77-Q81 VanDerWaalsContact O-CG 3.31Å; K77-Q81 WeakPolarHBondContact O-CG 3.48Å; K77-Q81 PolarHBondContact O-N 3.34Å; K77-Q81 VanDerWaalsContact O-N 3.07Å
78R98.1Very high98Very high141 Ų141110 Ų11053%0.53253%0.532SS..Hα-helixtrans-64.7-41.5177.1-177.1-173.5-66.5171.5-1.4111.1L74 L75 E76 Q81 L82L74-R78 WeakPolarHBondContact O-CB 3.5Å; L74-R78 PolarHBondContact O-N 3.03Å; L75-R78 PolarHBondContact O-N 3.38Å; E76-R78 VanDerWaalsContact C-N 3.33Å; E76-R78 PolarHBondContact O-N 3.28Å; R78-Q81 PolarHBondContact O-N 3.07Å; R78-L82 HydrophobicContact CG-CD1 4.25Å; R78-L82 WeakPolarHBondContact O-CG 3.35Å; R78-L82 PolarHBondContact O-N 3.02Å
79N98.2Very high97.9Very high107 Ų107106.1 Ų106.157%0.57252%0.519SS*.Hα-helixtrans-65.2-42.7179.7-165.910.1000111.2L75 E76 K77 Q81 L82 F83L75-N79 WeakPolarHBondContact O-CB 3.47Å; L75-N79 PolarHBondContact O-N 2.83Å; E76-N79 PolarHBondContact O-N 3.31Å; E76-N79 VanDerWaalsContact O-N 3.14Å; K77-N79 VanDerWaalsContact C-N 3.35Å; N79-Q81 VanDerWaalsContact C-N 3.34Å; N79-Q81 PolarHBondContact O-N 3.27Å; N79-L82 PolarHBondContact O-N 3.43Å; N79-F83 WeakPolarHBondContact O-CB 3.37Å; N79-F83 PolarHBondContact O-N 3.3Å
80E98.2Very high97.9Very high125 Ų125108.4 Ų108.458%0.58452%0.524SS*.Hα-helixtrans-59.2-44.1173.8-172.4-176178.400111.7E76 F83 N84E76-E80 PolarHBondContact O-N 2.97Å; E80-F83 PolarHBondContact O-N 3.46Å; E80-N84 WeakPolarHBondContact O-CB 3.37Å; E80-N84 PolarHBondContact O-N 3.45Å; E80-N84 PolarHBondContact O-ND2 2.94Å
81Q97.7Very high97.9Very high101 Ų101104.6 Ų104.647%0.47251%0.514SS..Hα-helixtrans-59.7-49.1175.4-73.7175.6-24.900112.2K77 R78 N79 F83 N84 E85K77-Q81 VanDerWaalsContact O-CG 3.31Å; K77-Q81 WeakPolarHBondContact O-CG 3.48Å; K77-Q81 PolarHBondContact O-N 3.34Å; K77-Q81 VanDerWaalsContact O-N 3.07Å; R78-Q81 PolarHBondContact O-N 3.07Å; N79-Q81 VanDerWaalsContact C-N 3.34Å; N79-Q81 PolarHBondContact O-N 3.27Å; Q81-F83 VanDerWaalsContact C-N 3.32Å; Q81-F83 PolarHBondContact O-N 2.94Å; Q81-N84 PolarHBondContact O-N 3.24Å; Q81-E85 WeakPolarHBondContact O-CG 3.33Å; Q81-E85 PolarHBondContact O-N 2.97Å
82L98.1Very high97.8Very high96 Ų96105.6 Ų105.650%0.50351%0.51SS..Hα-helixtrans-62.5-39.3178.5-70.7172.6000112.2R78 N79 A86R78-L82 HydrophobicContact CG-CD1 4.25Å; R78-L82 WeakPolarHBondContact O-CG 3.35Å; R78-L82 PolarHBondContact O-N 3.02Å; N79-L82 PolarHBondContact O-N 3.43Å; L82-A86 WeakPolarHBondContact O-CB 3.41Å; L82-A86 PolarHBondContact O-N 2.72Å
83F98.2Very high97.6Very high139 Ų139103.5 Ų103.561%0.6150%0.502SS*.Hα-helixtrans-62.8-46.3175.7178.9-95.9000111.4N79 E80 Q81 A86 A87N79-F83 WeakPolarHBondContact O-CB 3.37Å; N79-F83 PolarHBondContact O-N 3.3Å; E80-F83 PolarHBondContact O-N 3.46Å; Q81-F83 VanDerWaalsContact C-N 3.32Å; Q81-F83 PolarHBondContact O-N 2.94Å; F83-A86 PolarHBondContact O-N 3.44Å; F83-A87 WeakPolarHBondContact O-CB 3.23Å; F83-A87 PolarHBondContact O-N 3.3Å
84N98Very high97.4Very high75 Ų7599.6 Ų99.640%0.40149%0.486SS..Hα-helixtrans-62.8-44.8178.4-70-24000111.6E80 Q81 A86 A87 E88E80-N84 WeakPolarHBondContact O-CB 3.37Å; E80-N84 PolarHBondContact O-N 3.45Å; E80-N84 PolarHBondContact O-ND2 2.94Å; Q81-N84 PolarHBondContact O-N 3.24Å; N84-A86 VanDerWaalsContact C-N 3.35Å; N84-A86 PolarHBondContact O-N 3.36Å; N84-A87 PolarHBondContact O-N 2.89Å; N84-E88 WeakPolarHBondContact O-CB 3.46Å; N84-E88 WeakPolarHBondContact O-CG 3.38Å; N84-E88 PolarHBondContact O-N 3.13Å
85E97.8Very high97.2Very high122 Ų122100.1 Ų100.157%0.5749%0.486SS*.Hα-helixtrans-59.5-44.1175.2-73.1173.6-170.700112Q81 E88 E89Q81-E85 WeakPolarHBondContact O-CG 3.33Å; Q81-E85 PolarHBondContact O-N 2.97Å; E85-E88 PolarHBondContact O-N 3.31Å; E85-E89 WeakPolarHBondContact O-CB 3.45Å; E85-E89 PolarHBondContact O-N 2.88Å
86A97.8Very high96.9Very high60 Ų60102.9 Ų102.950%0.49649%0.49SS..Hα-helixtrans-66.3-40.3177.500000112.4L82 F83 N84 E89 Y90L82-A86 WeakPolarHBondContact O-CB 3.41Å; L82-A86 PolarHBondContact O-N 2.72Å; F83-A86 PolarHBondContact O-N 3.44Å; N84-A86 VanDerWaalsContact C-N 3.35Å; N84-A86 PolarHBondContact O-N 3.36Å; A86-E89 PolarHBondContact O-N 3.45Å; A86-Y90 WeakPolarHBondContact O-CB 3.49Å; A86-Y90 PolarHBondContact O-N 2.76Å
87A97.9Very high96.5Very high40 Ų40101.5 Ų101.533%0.33149%0.486SS..Hα-helixtrans-65-42176.400000111.7F83 N84 Y90 T91F83-A87 WeakPolarHBondContact O-CB 3.23Å; F83-A87 PolarHBondContact O-N 3.3Å; N84-A87 PolarHBondContact O-N 2.89Å; A87-Y90 PolarHBondContact O-N 3.45Å; A87-T91 PolarHBondContact O-N 2.9Å; A87-T91 PolarHBondContact O-OG1 2.89Å; A87-T91 VanDerWaalsContact O-OG1 3.13Å
88E97.8Very high95.9Very high104 Ų104100.4 Ų100.449%0.48648%0.483SS..Hα-helixtrans-62.5-46.7174.2-75.7-175.8-163.100111.8N84 E85 Y90 T91 R92N84-E88 WeakPolarHBondContact O-CB 3.46Å; N84-E88 WeakPolarHBondContact O-CG 3.38Å; N84-E88 PolarHBondContact O-N 3.13Å; E85-E88 PolarHBondContact O-N 3.31Å; E88-Y90 VanDerWaalsContact C-N 3.31Å; E88-Y90 PolarHBondContact O-N 3.01Å; E88-T91 PolarHBondContact O-N 3.45Å; E88-R92 WeakPolarHBondContact O-CB 3.34Å; E88-R92 VanDerWaalsContact O-CG 3.23Å; E88-R92 WeakPolarHBondContact O-CG 3.25Å; E88-R92 PolarHBondContact O-N 3.3Å; E88-R92 IonicContact OE2-CZ 3.98Å; E88-R92 IonicContact OE2-NH2 3.56Å; E88-R92 PolarHBondContact OE2-NH2 3.49Å
89E97.2Very high95.4Very high88 Ų8897.3 Ų97.341%0.41148%0.476SS..Hα-helixtrans-65.3-37.1179.4-172.960-164.300111.9E85 A86 R92 T93E85-E89 WeakPolarHBondContact O-CB 3.45Å; E85-E89 PolarHBondContact O-N 2.88Å; A86-E89 PolarHBondContact O-N 3.45Å; E89-R92 IonicContact OE2-NH1 3.39Å; E89-T93 VanDerWaalsContact O-CB 3.25Å; E89-T93 WeakPolarHBondContact O-CB 3.5Å; E89-T93 PolarHBondContact O-N 3.33Å; E89-T93 PolarHBondContact O-OG1 3.35Å
90Y97.5Very high94.6Very high165 Ų16599.1 Ų99.165%0.64748%0.479SS*.Hα-helixtrans-59.2-53.2172.5179-94.3000111A86 A87 E88 R92 T93 V94A86-Y90 WeakPolarHBondContact O-CB 3.49Å; A86-Y90 PolarHBondContact O-N 2.76Å; A87-Y90 PolarHBondContact O-N 3.45Å; E88-Y90 VanDerWaalsContact C-N 3.31Å; E88-Y90 PolarHBondContact O-N 3.01Å; Y90-R92 PolarHBondContact O-N 2.86Å; Y90-T93 WeakPolarHBondContact O-CB 3.36Å; Y90-T93 PolarHBondContact O-N 3.13Å; Y90-T93 VanDerWaalsContact O-N 3.11Å; Y90-V94 HydrophobicContact CD1-CG2 4.09Å; Y90-V94 HydrophobicContact CE1-CG2 3.65Å; Y90-V94 HydrophobicContact CE2-CG2 4.13Å; Y90-V94 HydrophobicContact CG-CG2 4.5Å; Y90-V94 WeakPolarHBondContact O-CG2 3.49Å; Y90-V94 PolarHBondContact O-N 3.34Å
91T96.8Very high93.7Very high72 Ų7295.7 Ų95.744%0.44246%0.461SS..Hα-helixtrans-57.6-48.9178.6-62.80000111.5A87 E88 T93 V94 E95A87-T91 PolarHBondContact O-N 2.9Å; A87-T91 PolarHBondContact O-OG1 2.89Å; A87-T91 VanDerWaalsContact O-OG1 3.13Å; E88-T91 PolarHBondContact O-N 3.45Å; T91-T93 PolarHBondContact O-N 2.89Å; T91-V94 PolarHBondContact O-N 3.11Å; T91-E95 HydrophobicContact CG2-CG 4.44Å; T91-E95 WeakPolarHBondContact O-CB 3.47Å; T91-E95 WeakPolarHBondContact O-CG 3.2Å; T91-E95 PolarHBondContact O-N 2.91Å
92R96.5Very high92.7Very high126 Ų12697.8 Ų97.848%0.47547%0.473SS..Hα-helixtrans-59-37.5177.1-69.7173.9-157.8168.83.2112.1E88 E89 Y90 R96E88-R92 WeakPolarHBondContact O-CB 3.34Å; E88-R92 VanDerWaalsContact O-CG 3.23Å; E88-R92 WeakPolarHBondContact O-CG 3.25Å; E88-R92 PolarHBondContact O-N 3.3Å; E88-R92 IonicContact OE2-CZ 3.98Å; E88-R92 IonicContact OE2-NH2 3.56Å; E88-R92 PolarHBondContact OE2-NH2 3.49Å; E89-R92 IonicContact OE2-NH1 3.39Å; Y90-R92 PolarHBondContact O-N 2.86Å; R92-R96 VanDerWaalsContact O-CB 3.27Å; R92-R96 WeakPolarHBondContact O-CB 3.39Å; R92-R96 PolarHBondContact O-N 3.05Å
93T94.6Very high91.4Very high53 Ų53101.2 Ų101.233%0.32548%0.479SS..Hα-helixtrans-70.3-45.8178.7-62.60000111E89 Y90 T91 R96 L97E89-T93 VanDerWaalsContact O-CB 3.25Å; E89-T93 WeakPolarHBondContact O-CB 3.5Å; E89-T93 PolarHBondContact O-N 3.33Å; E89-T93 PolarHBondContact O-OG1 3.35Å; Y90-T93 WeakPolarHBondContact O-CB 3.36Å; Y90-T93 PolarHBondContact O-N 3.13Å; Y90-T93 VanDerWaalsContact O-N 3.11Å; T91-T93 PolarHBondContact O-N 2.89Å; T93-R96 WeakPolarHBondContact O-CB 3.5Å; T93-R96 PolarHBondContact O-N 2.85Å; T93-L97 HydrophobicContact CG2-CD1 4.06Å; T93-L97 HydrophobicContact CG2-CG 4.42Å; T93-L97 VanDerWaalsContact O-CG 3.27Å; T93-L97 WeakPolarHBondContact O-CG 3.39Å; T93-L97 PolarHBondContact O-N 2.89Å
94V93.6Very high89.7Confident44 Ų44100.3 Ų100.327%0.26749%0.487SS..Hα-helixtrans-58.4-51.5175.5171.60000110.4Y90 T91 R96 L97 E98Y90-V94 HydrophobicContact CD1-CG2 4.09Å; Y90-V94 HydrophobicContact CE1-CG2 3.65Å; Y90-V94 HydrophobicContact CE2-CG2 4.13Å; Y90-V94 HydrophobicContact CG-CG2 4.5Å; Y90-V94 WeakPolarHBondContact O-CG2 3.49Å; Y90-V94 PolarHBondContact O-N 3.34Å; T91-V94 PolarHBondContact O-N 3.11Å; V94-R96 VanDerWaalsContact C-N 3.27Å; V94-R96 PolarHBondContact O-N 2.91Å; V94-L97 PolarHBondContact O-N 3.24Å; V94-L97 VanDerWaalsContact O-N 3.07Å; V94-E98 HydrophobicContact CG1-CG 4.22Å; V94-E98 WeakPolarHBondContact O-CB 3.06Å; V94-E98 WeakPolarHBondContact O-CG 3.35Å; V94-E98 PolarHBondContact O-N 3.03Å
95E93.2Very high88Confident104 Ų104101.4 Ų101.449%0.48650%0.497SS..Hα-helixtrans-57.7-39.7177.9-73.7179.9174.200112.2T91 N99T91-E95 HydrophobicContact CG2-CG 4.44Å; T91-E95 WeakPolarHBondContact O-CB 3.47Å; T91-E95 WeakPolarHBondContact O-CG 3.2Å; T91-E95 PolarHBondContact O-N 2.91Å; E95-N99 WeakPolarHBondContact O-CB 3.27Å; E95-N99 VanDerWaalsContact O-CG 3.28Å; E95-N99 PolarHBondContact O-N 3.24Å; E95-N99 PolarHBondContact O-ND2 3.26Å
96R91.5Very high86.2Confident157 Ų157101.9 Ų101.959%0.59251%0.511SS*.Hα-helixtrans-64.6-43.1176.7-171.1-169.8-50-165.88.4111.6R92 T93 V94 K100R92-R96 VanDerWaalsContact O-CB 3.27Å; R92-R96 WeakPolarHBondContact O-CB 3.39Å; R92-R96 PolarHBondContact O-N 3.05Å; T93-R96 WeakPolarHBondContact O-CB 3.5Å; T93-R96 PolarHBondContact O-N 2.85Å; V94-R96 VanDerWaalsContact C-N 3.27Å; V94-R96 PolarHBondContact O-N 2.91Å; R96-K100 VanDerWaalsContact O-CB 3.29Å; R96-K100 WeakPolarHBondContact O-CB 3.32Å; R96-K100 PolarHBondContact O-N 3.43Å
97L89Confident84.6Confident83 Ų83101.6 Ų101.644%0.43551%0.513SS..Hα-helixtrans-69-44.6179.5-68.4174.7000111.3T93 V94 N99 K100 Y101T93-L97 HydrophobicContact CG2-CD1 4.06Å; T93-L97 HydrophobicContact CG2-CG 4.42Å; T93-L97 VanDerWaalsContact O-CG 3.27Å; T93-L97 WeakPolarHBondContact O-CG 3.39Å; T93-L97 PolarHBondContact O-N 2.89Å; V94-L97 PolarHBondContact O-N 3.24Å; V94-L97 VanDerWaalsContact O-N 3.07Å; L97-N99 VanDerWaalsContact C-N 3.35Å; L97-N99 PolarHBondContact O-N 2.94Å; L97-K100 PolarHBondContact O-N 3.07Å; L97-Y101 HydrophobicContact CB-CD2 4.39Å; L97-Y101 HydrophobicContact CD2-CD2 4.09Å; L97-Y101 HydrophobicContact CD2-CE2 3.65Å; L97-Y101 WeakPolarHBondContact O-CB 3.29Å; L97-Y101 VanDerWaalsContact O-CD2 3.31Å; L97-Y101 WeakPolarHBondContact O-CD2 3.27Å; L97-Y101 PolarHBondContact O-N 2.83Å
98E87.2Confident83.6Confident107 Ų107101.8 Ų101.850%0.552%0.519SS..Iπ-helixtrans-59.6-46.4174.1-72.5-177.9163.300110.9V94 K100 M102 R103V94-E98 HydrophobicContact CG1-CG 4.22Å; V94-E98 WeakPolarHBondContact O-CB 3.06Å; V94-E98 WeakPolarHBondContact O-CG 3.35Å; V94-E98 PolarHBondContact O-N 3.03Å; E98-K100 VanDerWaalsContact C-N 3.26Å; E98-K100 PolarHBondContact O-N 3.02Å; E98-M102 HydrophobicContact CB-CB 4.41Å; E98-M102 CarbonylContact O-C 3.45Å; E98-M102 VanDerWaalsContact O-CA 3.28Å; E98-M102 WeakPolarHBondContact O-CA 3.41Å; E98-M102 VanDerWaalsContact O-CB 3.3Å; E98-M102 WeakPolarHBondContact O-CB 3.5Å; E98-M102 PolarHBondContact O-N 2.86Å; E98-R103 PolarHBondContact O-N 3.28Å; E98-R103 VanDerWaalsContact O-N 3.09Å
99N86Confident83.1Confident75 Ų7598.9 Ų98.940%0.40151%0.509SS..Iπ-helixtrans-61.4-34.6176.6-83.1-55.8000113E95 L97 R103E95-N99 WeakPolarHBondContact O-CB 3.27Å; E95-N99 VanDerWaalsContact O-CG 3.28Å; E95-N99 PolarHBondContact O-N 3.24Å; E95-N99 PolarHBondContact O-ND2 3.26Å; L97-N99 VanDerWaalsContact C-N 3.35Å; L97-N99 PolarHBondContact O-N 2.94Å; N99-R103 WeakPolarHBondContact O-CB 3.37Å; N99-R103 WeakPolarHBondContact O-CD 3.24Å; N99-R103 VanDerWaalsContact O-CG 3.24Å; N99-R103 WeakPolarHBondContact O-CG 3.18Å; N99-R103 PolarHBondContact OD1-NE 3.06Å; N99-R103 PolarHBondContact OD1-NH2 3.21Å
100K82.7Confident82.8Confident145 Ų14595.5 Ų95.563%0.6350%0.496SS*.Iπ-helixtrans-81.3-38.3-177.3-172.9176.3178.9-165.80113.2R96 L97 E98R96-K100 VanDerWaalsContact O-CB 3.29Å; R96-K100 WeakPolarHBondContact O-CB 3.32Å; R96-K100 PolarHBondContact O-N 3.43Å; L97-K100 PolarHBondContact O-N 3.07Å; E98-K100 VanDerWaalsContact C-N 3.26Å; E98-K100 PolarHBondContact O-N 3.02Å
101Y78.2Confident82.5Confident53 Ų5389.6 Ų89.621%0.20848%0.481CS..Iπ-helixtrans-115.7-27.3-168.9-59.1-65.6000114.1L97 K152 A156L97-Y101 HydrophobicContact CB-CD2 4.39Å; L97-Y101 HydrophobicContact CD2-CD2 4.09Å; L97-Y101 HydrophobicContact CD2-CE2 3.65Å; L97-Y101 WeakPolarHBondContact O-CB 3.29Å; L97-Y101 VanDerWaalsContact O-CD2 3.31Å; L97-Y101 WeakPolarHBondContact O-CD2 3.27Å; L97-Y101 PolarHBondContact O-N 2.83Å; Y101-K152 HydrophobicContact CE1-CB 4.35Å; Y101-A156 WeakPolarHBondContact OH-CB 3.39Å
102M77.5Confident82.3Confident145 Ų14589.8 Ų89.871%0.71449%0.49SS*.Iπ-helixtrans-103.5-9.5-176.2-59.1-63.1-17200113.6E98 P104E98-M102 HydrophobicContact CB-CB 4.41Å; E98-M102 CarbonylContact O-C 3.45Å; E98-M102 VanDerWaalsContact O-CA 3.28Å; E98-M102 WeakPolarHBondContact O-CA 3.41Å; E98-M102 VanDerWaalsContact O-CB 3.3Å; E98-M102 WeakPolarHBondContact O-CB 3.5Å; E98-M102 PolarHBondContact O-N 2.86Å; M102-P104 VanDerWaalsContact O-CD 3.22Å; M102-P104 WeakPolarHBondContact O-CD 3.44Å
103R70Confident82.2Confident169 Ų16984.2 Ų84.264%0.63847%0.471SS*.PPolyproline II helixtrans-52.3117.9177.3-99.2-176.1-168.8-154.31.8109.8E98 N99 T105E98-R103 PolarHBondContact O-N 3.28Å; E98-R103 VanDerWaalsContact O-N 3.09Å; N99-R103 WeakPolarHBondContact O-CB 3.37Å; N99-R103 WeakPolarHBondContact O-CD 3.24Å; N99-R103 VanDerWaalsContact O-CG 3.24Å; N99-R103 WeakPolarHBondContact O-CG 3.18Å; N99-R103 PolarHBondContact OD1-NE 3.06Å; N99-R103 PolarHBondContact OD1-NH2 3.21Å; R103-T105 PolarHBondContact O-N 3.47Å
104P62.9Low82.2Confident119 Ų11985.5 Ų85.577%0.77347%0.473SS*.PPolyproline II helixtrans-58.5117175.4-21.432.4000107.8M102M102-P104 VanDerWaalsContact O-CD 3.22Å; M102-P104 WeakPolarHBondContact O-CD 3.44Å
105T63.3Low82.2Confident99 Ų9987.7 Ų87.761%0.60748%0.48SS*.PPolyproline II helixtrans-64.5129.3167.4-48.50000105.7R103 G107 G108R103-T105 PolarHBondContact O-N 3.47Å; T105-G107 PolarHBondContact O-N 3.41Å; T105-G108 PolarHBondContact O-N 2.97Å
106P59Low82.4Confident132 Ų13288 Ų8886%0.85748%0.477SS*.THydrogen-bonded Turntrans-53.7114.8178.1-23.932.4000109.4
107G65.4Low82.6Confident53 Ų5381.3 Ų81.355%0.54645%0.454SS..THydrogen-bonded Turntrans106.3-7.3-174.600000116T105 A111T105-G107 PolarHBondContact O-N 3.41Å; G107-A111 WeakPolarHBondContact O-CB 3.31Å
108G76.6Confident82.9Confident44 Ų4481.1 Ų81.145%0.45445%0.45SS..  trans71.4179.1-178.800000113.5T105T105-G108 PolarHBondContact O-N 2.97Å
109C85.7Confident83.4Confident43 Ų4378.7 Ų78.729%0.29144%0.441SS..THydrogen-bonded Turntrans-72.8133.1176.2175.70000109.8A111 F145C109-A111 VanDerWaalsContact C-N 3.29Å; C109-A111 PolarHBondContact O-N 3.01Å; C109-F145 HydrophobicContact CB-CD1 4.07Å; C109-F145 HydrophobicContact CB-CD2 4.15Å; C109-F145 HydrophobicContact CB-CE1 4.09Å; C109-F145 HydrophobicContact CB-CE2 4.15Å; C109-F145 HydrophobicContact CB-CG 4.1Å; C109-F145 HydrophobicContact CB-CZ 4.13Å; C109-F145 WeakPolarHBondContact SG-CB 3.3Å; C109-F145 VanDerWaalsContact SG-CD1 3.53Å; C109-F145 WeakPolarHBondContact SG-CD2 3.04Å; C109-F145 WeakPolarHBondContact SG-CG 3.28Å
110C92Very high84Confident18 Ų1875.8 Ų75.812%0.12243%0.427CS..THydrogen-bonded Turntrans64.223.7173.9-54.10000116A112 A113 E114 Y138 C141 V142C110-A112 VanDerWaalsContact C-N 3.26Å; C110-A112 PolarHBondContact O-N 3.06Å; C110-A112 VanDerWaalsContact O-N 3.08Å; C110-A113 HydrophobicContact CB-CB 4.4Å; C110-A113 WeakPolarHBondContact O-CA 3.39Å; C110-A113 WeakPolarHBondContact O-CB 3.31Å; C110-A113 PolarHBondContact O-N 2.91Å; C110-E114 PolarHBondContact O-N 2.86Å; C110-Y138 HydrophobicContact CB-CD2 4.04Å; C110-Y138 HydrophobicContact CB-CE2 4Å; C110-C141 HydrophobicContact CB-CB 3.83Å; C110-C141 WeakPolarHBondContact CB-SG 3.49Å; C110-C141 WeakPolarHBondContact SG-CB 3.49Å; C110-C141 CovalentContact SG-SG 2.02Å; C110-C141 PolarHBondContact SG-SG 3.09Å; C110-V142 PolarHBondContact SG-N 3.22Å; C110-V142 VanDerWaalsContact SG-N 3.44Å
111A91.8Very high84.7Confident41 Ų4173.5 Ų73.534%0.33941%0.414SS..Hα-helixtrans-42.9-46.4-179.800000114.4G107 C109 A113 E114 Q115G107-A111 WeakPolarHBondContact O-CB 3.31Å; C109-A111 VanDerWaalsContact C-N 3.29Å; C109-A111 PolarHBondContact O-N 3.01Å; A111-A113 PolarHBondContact O-N 2.86Å; A111-E114 PolarHBondContact O-N 3.29Å; A111-Q115 WeakPolarHBondContact O-CB 3.49Å; A111-Q115 PolarHBondContact O-N 3.33Å
112A91.6Very high85.6Confident75 Ų7577.4 Ų77.462%0.6243%0.433SS*.Hα-helixtrans-70.5-29-17900000113.5C110 R116C110-A112 VanDerWaalsContact C-N 3.26Å; C110-A112 PolarHBondContact O-N 3.06Å; C110-A112 VanDerWaalsContact O-N 3.08Å; A112-R116 WeakPolarHBondContact O-CG 3.44Å; A112-R116 PolarHBondContact O-N 3.08Å; A112-R116 PolarHBondContact O-NE 3.46Å
113A93.8Very high86.5Confident10 Ų1077.4 Ų77.48%0.08343%0.431CS..Hα-helixtrans-78.2-40.5174.200000110.8C110 A111 R116 V117 Y138C110-A113 HydrophobicContact CB-CB 4.4Å; C110-A113 WeakPolarHBondContact O-CA 3.39Å; C110-A113 WeakPolarHBondContact O-CB 3.31Å; C110-A113 PolarHBondContact O-N 2.91Å; A111-A113 PolarHBondContact O-N 2.86Å; A113-R116 PolarHBondContact O-N 2.85Å; A113-V117 WeakPolarHBondContact O-CG2 3.22Å; A113-V117 PolarHBondContact O-N 2.81Å; A113-V117 VanDerWaalsContact O-N 3.09Å; A113-Y138 HydrophobicContact CB-CD2 4.11Å
114E94.4Very high87.8Confident80 Ų8071.4 Ų71.437%0.37441%0.412SS..Hα-helixtrans-56.4-51.6173.4-176.6175.3-160.600111.2C110 A111 R116 V117 E118 Y138C110-E114 PolarHBondContact O-N 2.86Å; A111-E114 PolarHBondContact O-N 3.29Å; E114-R116 VanDerWaalsContact C-N 3.29Å; E114-R116 PolarHBondContact O-N 3.21Å; E114-V117 WeakPolarHBondContact O-CA 3.45Å; E114-V117 WeakPolarHBondContact O-CB 3.47Å; E114-V117 PolarHBondContact O-N 3.17Å; E114-E118 PolarHBondContact O-N 3.48Å; E114-Y138 HydrophobicContact CB-CD2 4.1Å; E114-Y138 HydrophobicContact CB-CE2 3.86Å; E114-Y138 HydrophobicContact CG-CE2 4.44Å
115Q95.1Very high89.3Confident90 Ų9070.8 Ų70.842%0.42141%0.407SS..Hα-helixtrans-56.3-42.9178.3-171.463.846.100112.2A111 V117 E118 D119A111-Q115 WeakPolarHBondContact O-CB 3.49Å; A111-Q115 PolarHBondContact O-N 3.33Å; Q115-V117 VanDerWaalsContact C-N 3.32Å; Q115-V117 PolarHBondContact O-N 3.09Å; Q115-E118 PolarHBondContact O-N 2.73Å; Q115-D119 PolarHBondContact NE2-OD1 3.03Å; Q115-D119 WeakPolarHBondContact O-CB 3.35Å; Q115-D119 PolarHBondContact O-N 2.9Å
116R96Very high90.8Very high110 Ų11070 Ų7042%0.41542%0.419SS..Hα-helixtrans-63.8-37.9177.8-73.2-175.2-65.2144.44.8112.2A112 A113 E114 C120 L134 E137A112-R116 WeakPolarHBondContact O-CG 3.44Å; A112-R116 PolarHBondContact O-N 3.08Å; A112-R116 PolarHBondContact O-NE 3.46Å; A113-R116 PolarHBondContact O-N 2.85Å; E114-R116 VanDerWaalsContact C-N 3.29Å; E114-R116 PolarHBondContact O-N 3.21Å; R116-C120 WeakPolarHBondContact O-CB 3.38Å; R116-C120 PolarHBondContact O-N 2.95Å; R116-C120 VanDerWaalsContact O-N 3.11Å; R116-L134 HydrophobicContact CB-CD2 4.27Å; R116-L134 WeakPolarHBondContact O-CD1 3.01Å; R116-E137 IonicContact CZ-OE2 2.91Å; R116-E137 VanDerWaalsContact CZ-OE2 3.26Å; R116-E137 IonicContact NH1-OE2 3.26Å; R116-E137 PolarHBondContact NH1-OE2 3.12Å; R116-E137 IonicContact NH2-OE2 2.92Å; R116-E137 PolarHBondContact NH2-OE2 2.99Å
117V96.7Very high92.5Very high17 Ų1770.2 Ų70.210%0.10341%0.407CS..Hα-helixtrans-65-47.9175.2171.50000110.3A113 E114 Q115 D119 C120 Y121 L134 V135A113-V117 WeakPolarHBondContact O-CG2 3.22Å; A113-V117 PolarHBondContact O-N 2.81Å; A113-V117 VanDerWaalsContact O-N 3.09Å; E114-V117 WeakPolarHBondContact O-CA 3.45Å; E114-V117 WeakPolarHBondContact O-CB 3.47Å; E114-V117 PolarHBondContact O-N 3.17Å; Q115-V117 VanDerWaalsContact C-N 3.32Å; Q115-V117 PolarHBondContact O-N 3.09Å; V117-D119 PolarHBondContact O-N 2.95Å; V117-C120 PolarHBondContact O-N 3.18Å; V117-Y121 HydrophobicContact CG1-CD2 3.94Å; V117-Y121 HydrophobicContact CG1-CE2 3.43Å; V117-Y121 VanDerWaalsContact CG1-CE2 3.43Å; V117-Y121 WeakPolarHBondContact O-CD2 3.36Å; V117-Y121 PolarHBondContact O-N 2.91Å; V117-Y121 VanDerWaalsContact O-N 3.1Å; V117-L134 HydrophobicContact CG2-CB 3.88Å; V117-L134 WeakPolarHBondContact CG2-O 3.44Å; V117-V135 HydrophobicContact CG1-CG2 3.95Å; V117-V135 HydrophobicContact CG2-CG2 4.3Å
118E96.3Very high93.8Very high78 Ų7872.8 Ų72.836%0.36441%0.406SS..Hα-helixtrans-58.7-48177.3-70.9-165.7-17900112.6E114 Q115 C120 Y121 K122E114-E118 PolarHBondContact O-N 3.48Å; Q115-E118 PolarHBondContact O-N 2.73Å; E118-C120 VanDerWaalsContact C-N 3.25Å; E118-C120 PolarHBondContact O-N 3.46Å; E118-Y121 PolarHBondContact O-N 3.19Å; E118-K122 WeakPolarHBondContact O-CG 3.13Å; E118-K122 PolarHBondContact O-N 3.33Å; E118-K122 IonicContact OE2-NZ 3.61Å; E118-K122 PolarHBondContact OE2-NZ 3.35Å
119D97.2Very high94.7Very high57 Ų5777.4 Ų77.431%0.30542%0.42SS..Hα-helixtrans-61.4-38.2-179.1-68.5-17.1000110.8Q115 V117 K122 Q123Q115-D119 PolarHBondContact NE2-OD1 3.03Å; Q115-D119 WeakPolarHBondContact O-CB 3.35Å; Q115-D119 PolarHBondContact O-N 2.9Å; V117-D119 PolarHBondContact O-N 2.95Å; D119-K122 PolarHBondContact O-N 3.38Å; D119-Q123 WeakPolarHBondContact O-CB 3.29Å; D119-Q123 VanDerWaalsContact O-CG 3.22Å; D119-Q123 WeakPolarHBondContact O-CG 2.94Å; D119-Q123 PolarHBondContact O-N 3.13Å; D119-Q123 PolarHBondContact O-NE2 2.99Å
120C97.9Very high95.2Very high14 Ų1480.7 Ų80.710%0.09543%0.434CS..Hα-helixtrans-64.2-43.1175.7-175.50000112.3R116 V117 E118 Q123 N124 C131 L134R116-C120 WeakPolarHBondContact O-CB 3.38Å; R116-C120 PolarHBondContact O-N 2.95Å; R116-C120 VanDerWaalsContact O-N 3.11Å; V117-C120 PolarHBondContact O-N 3.18Å; E118-C120 VanDerWaalsContact C-N 3.25Å; E118-C120 PolarHBondContact O-N 3.46Å; C120-Q123 PolarHBondContact O-N 3.48Å; C120-N124 WeakPolarHBondContact O-CB 3.39Å; C120-N124 PolarHBondContact O-N 3Å; C120-N124 PolarHBondContact O-ND2 3.44Å; C120-C131 HydrophobicContact CB-CB 3.83Å; C120-C131 WeakPolarHBondContact CB-SG 3.33Å; C120-C131 PolarHBondContact O-SG 3.09Å; C120-C131 WeakPolarHBondContact SG-CA 3.31Å; C120-C131 WeakPolarHBondContact SG-CB 3.44Å; C120-C131 CovalentContact SG-SG 2.04Å; C120-C131 PolarHBondContact SG-SG 3.41Å; C120-L134 HydrophobicContact CB-CD1 3.5Å; C120-L134 VanDerWaalsContact CB-CD1 3.5Å
121Y97.5Very high95.5Very high96 Ų9679.9 Ų79.938%0.37643%0.429SS..Hα-helixtrans-65.3-40.2176.3-68.8-37.4000112.4V117 E118 Q123 N124 I128 C131 V135V117-Y121 HydrophobicContact CG1-CD2 3.94Å; V117-Y121 HydrophobicContact CG1-CE2 3.43Å; V117-Y121 VanDerWaalsContact CG1-CE2 3.43Å; V117-Y121 WeakPolarHBondContact O-CD2 3.36Å; V117-Y121 PolarHBondContact O-N 2.91Å; V117-Y121 VanDerWaalsContact O-N 3.1Å; E118-Y121 PolarHBondContact O-N 3.19Å; Y121-Q123 VanDerWaalsContact C-N 3.29Å; Y121-Q123 PolarHBondContact O-N 3.27Å; Y121-N124 CarbonylContact O-C 3.52Å; Y121-N124 PolarHBondContact O-N 2.96Å; Y121-I128 HydrophobicContact CD1-CB 4.21Å; Y121-I128 HydrophobicContact CD1-CG2 3.98Å; Y121-I128 HydrophobicContact CE1-CB 3.83Å; Y121-I128 HydrophobicContact CE1-CG2 4.01Å; Y121-C131 HydrophobicContact CD1-CB 3.93Å; Y121-C131 HydrophobicContact CE1-CB 3.64Å; Y121-V135 VanDerWaalsContact OH-CG2 3.26Å; Y121-V135 WeakPolarHBondContact OH-CG2 3.43Å
122K97.2Very high95.7Very high135 Ų13581.1 Ų81.159%0.58744%0.435SS*.Hα-helixtrans-61-38.1175-71167.7-170.8155.20111.6E118 D119E118-K122 WeakPolarHBondContact O-CG 3.13Å; E118-K122 PolarHBondContact O-N 3.33Å; E118-K122 IonicContact OE2-NZ 3.61Å; E118-K122 PolarHBondContact OE2-NZ 3.35Å; D119-K122 PolarHBondContact O-N 3.38Å
123Q96.8Very high96Very high146 Ų14684.8 Ų84.868%0.68244%0.437SS*.Hα-helixtrans-79.8-23.1179.3-69.7170.640.400114D119 C120 Y121 P125D119-Q123 WeakPolarHBondContact O-CB 3.29Å; D119-Q123 VanDerWaalsContact O-CG 3.22Å; D119-Q123 WeakPolarHBondContact O-CG 2.94Å; D119-Q123 PolarHBondContact O-N 3.13Å; D119-Q123 PolarHBondContact O-NE2 2.99Å; C120-Q123 PolarHBondContact O-N 3.48Å; Y121-Q123 VanDerWaalsContact C-N 3.29Å; Y121-Q123 PolarHBondContact O-N 3.27Å; Q123-P125 VanDerWaalsContact O-CD 3.31Å; Q123-P125 WeakPolarHBondContact O-CD 3.31Å
124N96.4Very high96.2Very high43 Ų4386.4 Ų86.423%0.2344%0.444CS..SBendtrans-123.360.8-173.5-64-83000112.2C120 Y121 G126 K127 L130C120-N124 WeakPolarHBondContact O-CB 3.39Å; C120-N124 PolarHBondContact O-N 3Å; C120-N124 PolarHBondContact O-ND2 3.44Å; Y121-N124 CarbonylContact O-C 3.52Å; Y121-N124 PolarHBondContact O-N 2.96Å; N124-G126 PolarHBondContact O-N 2.85Å; N124-K127 HydrophobicContact CB-CB 4.27Å; N124-K127 PolarHBondContact O-N 3.31Å; N124-L130 WeakPolarHBondContact OD1-CD1 3.48Å
125P95Very high96.3Very high105 Ų10584.2 Ų84.268%0.68244%0.436SS*.THydrogen-bonded Turntrans-59.2130.318026.5-34.5000110.5Q123 K127Q123-P125 VanDerWaalsContact O-CD 3.31Å; Q123-P125 WeakPolarHBondContact O-CD 3.31Å; P125-K127 PolarHBondContact O-N 2.94Å
126G93.6Very high96.4Very high83 Ų8383.5 Ų83.586%0.85644%0.441SS*.THydrogen-bonded Turntrans72.7-2.9-17800000115.7N124N124-G126 PolarHBondContact O-N 2.85Å
127K95.1Very high96.4Very high137 Ų13780.9 Ų80.960%0.59643%0.433SS*.  trans-119.446.2-179.7-58.5-177.4-173.61750111.9N124 P125 L129 L130N124-K127 HydrophobicContact CB-CB 4.27Å; N124-K127 PolarHBondContact O-N 3.31Å; P125-K127 PolarHBondContact O-N 2.94Å; K127-L129 PolarHBondContact O-N 3.24Å; K127-L130 HydrophobicContact CB-CD1 3.77Å; K127-L130 HydrophobicContact CB-CG 4.14Å; K127-L130 HydrophobicContact CD-CD1 4Å; K127-L130 WeakPolarHBondContact O-CB 3.07Å; K127-L130 PolarHBondContact O-N 3.35Å
128I93.4Very high96.4Very high106 Ų10683.3 Ų83.354%0.54444%0.441SS..G310 helixtrans-55.7-29-174.259.4168.8000114.3Y121 L130 C131Y121-I128 HydrophobicContact CD1-CB 4.21Å; Y121-I128 HydrophobicContact CD1-CG2 3.98Å; Y121-I128 HydrophobicContact CE1-CB 3.83Å; Y121-I128 HydrophobicContact CE1-CG2 4.01Å; I128-L130 PolarHBondContact O-N 2.02Å; I128-C131 WeakPolarHBondContact O-CB 3.46Å; I128-C131 PolarHBondContact O-N 3Å
129L96Very high96.4Very high142 Ų14283.1 Ų83.174%0.74344%0.443SS*.G310 helixtrans-65.7-22.3-179.4-63.2177.7000113.1K127 C131 S132K127-L129 PolarHBondContact O-N 3.24Å; L129-C131 PolarHBondContact O-N 3.38Å; L129-S132 VanDerWaalsContact O-CB 3.29Å; L129-S132 WeakPolarHBondContact O-CB 3.48Å; L129-S132 PolarHBondContact O-N 3.06Å; L129-S132 PolarHBondContact O-OG 3.32Å
130L96.1Very high96.4Very high112 Ų11287.9 Ų87.959%0.58646%0.456SS*.G310 helixtrans-64-22.4172.9-63.3179.8000112.2N124 K127 I128N124-L130 WeakPolarHBondContact OD1-CD1 3.48Å; K127-L130 HydrophobicContact CB-CD1 3.77Å; K127-L130 HydrophobicContact CB-CG 4.14Å; K127-L130 HydrophobicContact CD-CD1 4Å; K127-L130 WeakPolarHBondContact O-CB 3.07Å; K127-L130 PolarHBondContact O-N 3.35Å; I128-L130 PolarHBondContact O-N 2.02Å
131C97.4Very high96.2Very high0 Ų089.4 Ų89.40%047%0.467CS..G310 helixtrans-91.9-0.6179.7-53.30000113.4C120 Y121 I128 L129 K133 L134 V135C120-C131 HydrophobicContact CB-CB 3.83Å; C120-C131 WeakPolarHBondContact CB-SG 3.33Å; C120-C131 PolarHBondContact O-SG 3.09Å; C120-C131 WeakPolarHBondContact SG-CA 3.31Å; C120-C131 WeakPolarHBondContact SG-CB 3.44Å; C120-C131 CovalentContact SG-SG 2.04Å; C120-C131 PolarHBondContact SG-SG 3.41Å; Y121-C131 HydrophobicContact CD1-CB 3.93Å; Y121-C131 HydrophobicContact CE1-CB 3.64Å; I128-C131 WeakPolarHBondContact O-CB 3.46Å; I128-C131 PolarHBondContact O-N 3Å; L129-C131 PolarHBondContact O-N 3.38Å; C131-K133 VanDerWaalsContact C-N 3.25Å; C131-K133 PolarHBondContact O-N 3.46Å; C131-K133 VanDerWaalsContact O-N 3.14Å; C131-L134 WeakPolarHBondContact O-CB 3.47Å; C131-L134 PolarHBondContact O-N 2.84Å; C131-V135 PolarHBondContact O-N 2.95Å
132S97.2Very high96.1Very high68 Ų6886.8 Ų86.848%0.47646%0.461SS..Hα-helixtrans-50.6-41.9-176.152.50000113.6L129 L134 V135 S136L129-S132 VanDerWaalsContact O-CB 3.29Å; L129-S132 WeakPolarHBondContact O-CB 3.48Å; L129-S132 PolarHBondContact O-N 3.06Å; L129-S132 PolarHBondContact O-OG 3.32Å; S132-L134 PolarHBondContact O-N 3.48Å; S132-V135 PolarHBondContact O-N 3.08Å; S132-S136 PolarHBondContact O-N 2.91Å; S132-S136 PolarHBondContact O-OG 2.87Å; S132-S136 VanDerWaalsContact O-OG 3.11Å
133K96.9Very high95.9Very high152 Ų15286.2 Ų86.266%0.66146%0.46SS*.Hα-helixtrans-62.1-41.4177.5-173.6177178.3-177.50112.8C131 S136 E137C131-K133 VanDerWaalsContact C-N 3.25Å; C131-K133 PolarHBondContact O-N 3.46Å; C131-K133 VanDerWaalsContact O-N 3.14Å; K133-S136 PolarHBondContact O-N 2.75Å; K133-E137 PolarHBondContact O-N 2.91Å; K133-E137 VanDerWaalsContact O-N 3.13Å
134L97.5Very high95.7Very high44 Ų4483.8 Ų83.823%0.2345%0.452CS..Hα-helixtrans-69.4-38.5178.6-65.7172000111.1R116 V117 C120 C131 S132 E137 Y138R116-L134 HydrophobicContact CB-CD2 4.27Å; R116-L134 WeakPolarHBondContact O-CD1 3.01Å; V117-L134 HydrophobicContact CG2-CB 3.88Å; V117-L134 WeakPolarHBondContact CG2-O 3.44Å; C120-L134 HydrophobicContact CB-CD1 3.5Å; C120-L134 VanDerWaalsContact CB-CD1 3.5Å; C131-L134 WeakPolarHBondContact O-CB 3.47Å; C131-L134 PolarHBondContact O-N 2.84Å; S132-L134 PolarHBondContact O-N 3.48Å; L134-E137 WeakPolarHBondContact O-CB 3.39Å; L134-E137 PolarHBondContact O-N 3.42Å; L134-Y138 PolarHBondContact O-N 3.13Å
135V97.2Very high95.4Very high34 Ų3485.5 Ų85.521%0.20646%0.457CS..Hα-helixtrans-61.1-45.9174.1178.10000110.5V117 Y121 C131 S132 E137 Y138 D139V117-V135 HydrophobicContact CG1-CG2 3.95Å; V117-V135 HydrophobicContact CG2-CG2 4.3Å; Y121-V135 VanDerWaalsContact OH-CG2 3.26Å; Y121-V135 WeakPolarHBondContact OH-CG2 3.43Å; C131-V135 PolarHBondContact O-N 2.95Å; S132-V135 PolarHBondContact O-N 3.08Å; V135-E137 VanDerWaalsContact C-N 3.27Å; V135-E137 PolarHBondContact O-N 3.34Å; V135-Y138 WeakPolarHBondContact O-CB 3.41Å; V135-Y138 PolarHBondContact O-N 3.3Å; V135-Y138 VanDerWaalsContact O-N 3.12Å; V135-D139 PolarHBondContact O-N 3.26Å
136S97.1Very high95.1Very high75 Ų7585.2 Ų85.252%0.52445%0.45SS..Hα-helixtrans-61.1-34.6176.2-58.60000113.1S132 K133 R140S132-S136 PolarHBondContact O-N 2.91Å; S132-S136 PolarHBondContact O-OG 2.87Å; S132-S136 VanDerWaalsContact O-OG 3.11Å; K133-S136 PolarHBondContact O-N 2.75Å; S136-R140 WeakPolarHBondContact O-CB 3.43Å; S136-R140 PolarHBondContact O-N 2.89Å
137E96Very high94.9Very high54 Ų5484.5 Ų84.525%0.25243%0.428SS..Hα-helixtrans-67.1-42.1173.7-75.1-178.1-164.400112.4R116 K133 L134 V135 C141R116-E137 IonicContact CZ-OE2 2.91Å; R116-E137 VanDerWaalsContact CZ-OE2 3.26Å; R116-E137 IonicContact NH1-OE2 3.26Å; R116-E137 PolarHBondContact NH1-OE2 3.12Å; R116-E137 IonicContact NH2-OE2 2.92Å; R116-E137 PolarHBondContact NH2-OE2 2.99Å; K133-E137 PolarHBondContact O-N 2.91Å; K133-E137 VanDerWaalsContact O-N 3.13Å; L134-E137 WeakPolarHBondContact O-CB 3.39Å; L134-E137 PolarHBondContact O-N 3.42Å; V135-E137 VanDerWaalsContact C-N 3.27Å; V135-E137 PolarHBondContact O-N 3.34Å; E137-C141 PolarHBondContact O-N 3.31Å; E137-C141 VanDerWaalsContact O-N 3.09Å
138Y96.4Very high94.5Very high69 Ų6980.9 Ų80.927%0.27142%0.418SS..Hα-helixtrans-61.6-49.5174.1172.7-102.3000111.2C110 A113 E114 L134 V135 R140 C141 V142C110-Y138 HydrophobicContact CB-CD2 4.04Å; C110-Y138 HydrophobicContact CB-CE2 4Å; A113-Y138 HydrophobicContact CB-CD2 4.11Å; E114-Y138 HydrophobicContact CB-CD2 4.1Å; E114-Y138 HydrophobicContact CB-CE2 3.86Å; E114-Y138 HydrophobicContact CG-CE2 4.44Å; L134-Y138 PolarHBondContact O-N 3.13Å; V135-Y138 WeakPolarHBondContact O-CB 3.41Å; V135-Y138 PolarHBondContact O-N 3.3Å; V135-Y138 VanDerWaalsContact O-N 3.12Å; Y138-R140 VanDerWaalsContact C-N 3.33Å; Y138-R140 PolarHBondContact O-N 2.85Å; Y138-C141 WeakPolarHBondContact O-CA 3.42Å; Y138-C141 VanDerWaalsContact O-CB 3.31Å; Y138-C141 WeakPolarHBondContact O-CB 3.26Å; Y138-C141 PolarHBondContact O-N 3.43Å; Y138-V142 HydrophobicContact CD1-CG2 4.37Å; Y138-V142 HydrophobicContact CD2-CG2 4.41Å; Y138-V142 HydrophobicContact CE1-CG2 3.93Å; Y138-V142 HydrophobicContact CE2-CG2 3.94Å; Y138-V142 PolarHBondContact O-N 3.43Å
139D96.3Very high94Very high74 Ų7478.4 Ų78.440%0.39641%0.405SS..Hα-helixtrans-57.6-45178.5-72.8-19000111.8V135 C141 V142 Q143V135-D139 PolarHBondContact O-N 3.26Å; D139-C141 VanDerWaalsContact C-N 3.28Å; D139-C141 PolarHBondContact O-N 2.93Å; D139-V142 PolarHBondContact O-N 2.95Å; D139-Q143 WeakPolarHBondContact O-CB 3.43Å; D139-Q143 VanDerWaalsContact O-CG 3.31Å; D139-Q143 WeakPolarHBondContact O-CG 3.5Å; D139-Q143 PolarHBondContact O-N 3.29Å
140R96.5Very high93.4Very high156 Ų15675.2 Ų75.259%0.58939%0.394SS*.Hα-helixtrans-60.7-39.4175.8-176.5178.664.7159.3-1111.7S136 Y138 N144S136-R140 WeakPolarHBondContact O-CB 3.43Å; S136-R140 PolarHBondContact O-N 2.89Å; Y138-R140 VanDerWaalsContact C-N 3.33Å; Y138-R140 PolarHBondContact O-N 2.85Å; R140-N144 WeakPolarHBondContact O-CB 3.42Å; R140-N144 PolarHBondContact O-N 3.05Å; R140-N144 PolarHBondContact O-ND2 3.46Å
141C95.2Very high92.8Very high46 Ų4678 Ų7831%0.31140%0.397SS..Hα-helixtrans-63.9-46176.9-1790000111.1C110 E137 Y138 D139 N144 F145C110-C141 HydrophobicContact CB-CB 3.83Å; C110-C141 WeakPolarHBondContact CB-SG 3.49Å; C110-C141 WeakPolarHBondContact SG-CB 3.49Å; C110-C141 CovalentContact SG-SG 2.02Å; C110-C141 PolarHBondContact SG-SG 3.09Å; E137-C141 PolarHBondContact O-N 3.31Å; E137-C141 VanDerWaalsContact O-N 3.09Å; Y138-C141 WeakPolarHBondContact O-CA 3.42Å; Y138-C141 VanDerWaalsContact O-CB 3.31Å; Y138-C141 WeakPolarHBondContact O-CB 3.26Å; Y138-C141 PolarHBondContact O-N 3.43Å; D139-C141 VanDerWaalsContact C-N 3.28Å; D139-C141 PolarHBondContact O-N 2.93Å; C141-N144 PolarHBondContact O-N 3.02Å; C141-F145 WeakPolarHBondContact O-CB 3.5Å; C141-F145 PolarHBondContact O-N 2.95Å
142V94Very high91.7Very high42 Ų4283 Ų8326%0.25542%0.419SS..Hα-helixtrans-61.2-47.4176.6174.40000111C110 Y138 D139 N144 F145 L146C110-V142 PolarHBondContact SG-N 3.22Å; C110-V142 VanDerWaalsContact SG-N 3.44Å; Y138-V142 HydrophobicContact CD1-CG2 4.37Å; Y138-V142 HydrophobicContact CD2-CG2 4.41Å; Y138-V142 HydrophobicContact CE1-CG2 3.93Å; Y138-V142 HydrophobicContact CE2-CG2 3.94Å; Y138-V142 PolarHBondContact O-N 3.43Å; D139-V142 PolarHBondContact O-N 2.95Å; V142-N144 VanDerWaalsContact C-N 3.35Å; V142-N144 PolarHBondContact O-N 3.31Å; V142-F145 WeakPolarHBondContact O-CB 3.37Å; V142-F145 PolarHBondContact O-N 3.14Å; V142-L146 HydrophobicContact CG1-CD1 4.13Å; V142-L146 HydrophobicContact CG1-CG 4.4Å; V142-L146 WeakPolarHBondContact O-CG 3.22Å; V142-L146 PolarHBondContact O-N 2.92Å
143Q94.7Very high90.6Very high123 Ų12383.8 Ų83.858%0.57542%0.421SS*.Hα-helixtrans-58.6-45.4177.5-72.8175.66.300112.1D139 F145 L146 V147D139-Q143 WeakPolarHBondContact O-CB 3.43Å; D139-Q143 VanDerWaalsContact O-CG 3.31Å; D139-Q143 WeakPolarHBondContact O-CG 3.5Å; D139-Q143 PolarHBondContact O-N 3.29Å; Q143-F145 VanDerWaalsContact C-N 3.33Å; Q143-F145 PolarHBondContact O-N 3.11Å; Q143-L146 PolarHBondContact O-N 3.45Å; Q143-V147 WeakPolarHBondContact O-CG2 3.01Å; Q143-V147 PolarHBondContact O-N 3.28Å
144N92Very high89.6Confident95 Ų9580.6 Ų80.651%0.50842%0.418SS..Hα-helixtrans-63.2-39.9177.1-75.3-21.8000112.2R140 C141 V142 T148R140-N144 WeakPolarHBondContact O-CB 3.42Å; R140-N144 PolarHBondContact O-N 3.05Å; R140-N144 PolarHBondContact O-ND2 3.46Å; C141-N144 PolarHBondContact O-N 3.02Å; V142-N144 VanDerWaalsContact C-N 3.35Å; V142-N144 PolarHBondContact O-N 3.31Å; N144-T148 VanDerWaalsContact O-CB 3.31Å; N144-T148 WeakPolarHBondContact O-CB 3.4Å; N144-T148 PolarHBondContact O-N 3.36Å; N144-T148 PolarHBondContact O-OG1 2.94Å
145F89.5Confident88.5Confident78 Ų7885.2 Ų85.234%0.34244%0.443SS..Hα-helixtrans-63.1-47176.1178.4-97000111.5C109 C141 V142 Q143 V147 T148 M149C109-F145 HydrophobicContact CB-CD1 4.07Å; C109-F145 HydrophobicContact CB-CD2 4.15Å; C109-F145 HydrophobicContact CB-CE1 4.09Å; C109-F145 HydrophobicContact CB-CE2 4.15Å; C109-F145 HydrophobicContact CB-CG 4.1Å; C109-F145 HydrophobicContact CB-CZ 4.13Å; C109-F145 WeakPolarHBondContact SG-CB 3.3Å; C109-F145 VanDerWaalsContact SG-CD1 3.53Å; C109-F145 WeakPolarHBondContact SG-CD2 3.04Å; C109-F145 WeakPolarHBondContact SG-CG 3.28Å; C141-F145 WeakPolarHBondContact O-CB 3.5Å; C141-F145 PolarHBondContact O-N 2.95Å; V142-F145 WeakPolarHBondContact O-CB 3.37Å; V142-F145 PolarHBondContact O-N 3.14Å; Q143-F145 VanDerWaalsContact C-N 3.33Å; Q143-F145 PolarHBondContact O-N 3.11Å; F145-V147 PolarHBondContact O-N 2.89Å; F145-T148 PolarHBondContact O-N 2.99Å; F145-M149 HydrophobicContact CD1-CG 4.15Å; F145-M149 HydrophobicContact CD2-CE 4.12Å; F145-M149 HydrophobicContact CD2-CG 4.45Å; F145-M149 HydrophobicContact CE1-CE 4.48Å; F145-M149 HydrophobicContact CE1-CG 3.77Å; F145-M149 HydrophobicContact CE2-CE 3.31Å; F145-M149 HydrophobicContact CE2-CG 4.11Å; F145-M149 HydrophobicContact CG-CG 4.47Å; F145-M149 HydrophobicContact CZ-CE 3.53Å; F145-M149 HydrophobicContact CZ-CG 3.75Å; F145-M149 HydrophobicContact CZ-SD 4.39Å; F145-M149 WeakPolarHBondContact O-CG 3.49Å; F145-M149 PolarHBondContact O-N 3.18Å
146L88.7Confident86.9Confident100 Ų10086.3 Ų86.352%0.52446%0.455SS..Hα-helixtrans-58.2-49.9177.2-69.6175.3000111.4V142 Q143 T148 M149 S150V142-L146 HydrophobicContact CG1-CD1 4.13Å; V142-L146 HydrophobicContact CG1-CG 4.4Å; V142-L146 WeakPolarHBondContact O-CG 3.22Å; V142-L146 PolarHBondContact O-N 2.92Å; Q143-L146 PolarHBondContact O-N 3.45Å; L146-T148 VanDerWaalsContact C-N 3.28Å; L146-T148 PolarHBondContact O-N 3.39Å; L146-M149 PolarHBondContact O-N 2.04Å; L146-S150 PolarHBondContact O-N 3.1Å; L146-S150 PolarHBondContact O-OG 3.11Å; L146-S150 VanDerWaalsContact O-OG 3.13Å
147V90Very high85Confident67 Ų6789.5 Ų89.541%0.40649%0.486SS..Hα-helixtrans-58.9-41.6177171.30000111.5Q143 F145 R151Q143-V147 WeakPolarHBondContact O-CG2 3.01Å; Q143-V147 PolarHBondContact O-N 3.28Å; F145-V147 PolarHBondContact O-N 2.89Å; V147-R151 VanDerWaalsContact O-CG 3.32Å; V147-R151 WeakPolarHBondContact O-CG 3.4Å; V147-R151 PolarHBondContact O-N 3.19Å
148T86.4Confident84.4Confident62 Ų6291.3 Ų91.338%0.3850%0.497SS..Hα-helixtrans-65.7-42.5179-58.90000111.5N144 F145 L146 R151 K152N144-T148 VanDerWaalsContact O-CB 3.31Å; N144-T148 WeakPolarHBondContact O-CB 3.4Å; N144-T148 PolarHBondContact O-N 3.36Å; N144-T148 PolarHBondContact O-OG1 2.94Å; F145-T148 PolarHBondContact O-N 2.99Å; L146-T148 VanDerWaalsContact C-N 3.28Å; L146-T148 PolarHBondContact O-N 3.39Å; T148-R151 PolarHBondContact O-N 3.47Å; T148-K152 HydrophobicContact CG2-CD 4.39Å; T148-K152 WeakPolarHBondContact O-CG 3.29Å; T148-K152 PolarHBondContact O-N 3Å
149M82.2Confident83.8Confident53 Ų5392.4 Ų92.426%0.26151%0.509SS..Hα-helixtrans-67.4-44.1178.2-72.7-56.3166.500111.8F145 L146 R151 K152 V153F145-M149 HydrophobicContact CD1-CG 4.15Å; F145-M149 HydrophobicContact CD2-CE 4.12Å; F145-M149 HydrophobicContact CD2-CG 4.45Å; F145-M149 HydrophobicContact CE1-CE 4.48Å; F145-M149 HydrophobicContact CE1-CG 3.77Å; F145-M149 HydrophobicContact CE2-CE 3.31Å; F145-M149 HydrophobicContact CE2-CG 4.11Å; F145-M149 HydrophobicContact CG-CG 4.47Å; F145-M149 HydrophobicContact CZ-CE 3.53Å; F145-M149 HydrophobicContact CZ-CG 3.75Å; F145-M149 HydrophobicContact CZ-SD 4.39Å; F145-M149 WeakPolarHBondContact O-CG 3.49Å; F145-M149 PolarHBondContact O-N 3.18Å; L146-M149 PolarHBondContact O-N 2.04Å; M149-R151 VanDerWaalsContact C-N 3.33Å; M149-R151 PolarHBondContact O-N 3.47Å; M149-K152 PolarHBondContact O-N 3.23Å; M149-K152 HydrophobicContact SD-CD 4.32Å; M149-V153 WeakPolarHBondContact O-CG2 3.47Å; M149-V153 PolarHBondContact O-N 3.31Å
150S83.1Confident83.1Confident76 Ų7693.4 Ų93.453%0.53152%0.516SS..Hα-helixtrans-57.7-44.6174.4-60.30000112L146 K152 V153 S154L146-S150 PolarHBondContact O-N 3.1Å; L146-S150 PolarHBondContact O-OG 3.11Å; L146-S150 VanDerWaalsContact O-OG 3.13Å; S150-K152 PolarHBondContact O-N 2.83Å; S150-V153 PolarHBondContact O-N 3.42Å; S150-S154 PolarHBondContact O-N 2.93Å; S150-S154 PolarHBondContact O-OG 2.96Å; S150-S154 VanDerWaalsContact O-OG 3.08Å
151R84Confident82.3Confident170 Ų17089.8 Ų89.864%0.64251%0.511SS*.Hα-helixtrans-63.4-40.1177.1-73.6176-178.6177.51.8113.1V147 T148 M149 V153 S154 N155V147-R151 VanDerWaalsContact O-CG 3.32Å; V147-R151 WeakPolarHBondContact O-CG 3.4Å; V147-R151 PolarHBondContact O-N 3.19Å; T148-R151 PolarHBondContact O-N 3.47Å; M149-R151 VanDerWaalsContact C-N 3.33Å; M149-R151 PolarHBondContact O-N 3.47Å; R151-V153 VanDerWaalsContact C-N 3.34Å; R151-S154 PolarHBondContact O-N 3.26Å; R151-N155 WeakPolarHBondContact O-CB 3.35Å; R151-N155 VanDerWaalsContact O-CG 3.3Å; R151-N155 PolarHBondContact O-N 3.3Å; R151-N155 PolarHBondContact O-ND2 3.29Å
152K74.9Confident81.5Confident104 Ų10492.5 Ų92.545%0.45252%0.524SS..Hα-helixtrans-65.6-38.4177.8-75.8177.6-179.8178.70112Y101 T148 M149 S150 A156Y101-K152 HydrophobicContact CE1-CB 4.35Å; T148-K152 HydrophobicContact CG2-CD 4.39Å; T148-K152 WeakPolarHBondContact O-CG 3.29Å; T148-K152 PolarHBondContact O-N 3Å; M149-K152 PolarHBondContact O-N 3.23Å; M149-K152 HydrophobicContact SD-CD 4.32Å; S150-K152 PolarHBondContact O-N 2.83Å; K152-A156 WeakPolarHBondContact O-CB 3.31Å; K152-A156 PolarHBondContact O-N 3.06Å
153V73.9Confident80.6Confident85 Ų8595.9 Ų95.952%0.51554%0.542SS..Hα-helixtrans-66-46.5174.9173.50000110.3M149 S150 R151 N155 A156 A157M149-V153 WeakPolarHBondContact O-CG2 3.47Å; M149-V153 PolarHBondContact O-N 3.31Å; S150-V153 PolarHBondContact O-N 3.42Å; R151-V153 VanDerWaalsContact C-N 3.34Å; V153-N155 VanDerWaalsContact C-N 3.31Å; V153-N155 PolarHBondContact O-N 3.02Å; V153-A156 PolarHBondContact O-N 3.07Å; V153-A156 VanDerWaalsContact O-N 3.13Å; V153-A157 PolarHBondContact O-N 3.18Å
154S76.1Confident79.6Confident86 Ų8693.9 Ų93.960%0.60154%0.54SS*.Hα-helixtrans-62.6-32.6178.3-58.60000114.2S150 R151 A156S150-S154 PolarHBondContact O-N 2.93Å; S150-S154 PolarHBondContact O-OG 2.96Å; S150-S154 VanDerWaalsContact O-OG 3.08Å; R151-S154 PolarHBondContact O-N 3.26Å; S154-A156 VanDerWaalsContact C-N 3.31Å
155N74.8Confident78.7Confident141 Ų14193.8 Ų93.875%0.75454%0.542SS*.THydrogen-bonded Turntrans-82.3-8178-70.1-14.9000113.8R151 V153R151-N155 WeakPolarHBondContact O-CB 3.35Å; R151-N155 VanDerWaalsContact O-CG 3.3Å; R151-N155 PolarHBondContact O-N 3.3Å; R151-N155 PolarHBondContact O-ND2 3.29Å; V153-N155 VanDerWaalsContact C-N 3.31Å; V153-N155 PolarHBondContact O-N 3.02Å
156A64Low77.8Confident57 Ų5795.2 Ų95.247%0.47156%0.559SS.*THydrogen-bonded Turntrans-106.5-10.6-177.100000113.7Y101 K152 V153 S154Y101-A156 WeakPolarHBondContact OH-CB 3.39Å; K152-A156 WeakPolarHBondContact O-CB 3.31Å; K152-A156 PolarHBondContact O-N 3.06Å; V153-A156 PolarHBondContact O-N 3.07Å; V153-A156 VanDerWaalsContact O-N 3.13Å; S154-A156 VanDerWaalsContact C-N 3.31Å
157A55.4Low76.8Confident141 Ų14194.7 Ų94.7100%1.16556%0.562SS**  trans-88.20167.300000109.8V153V153-A157 PolarHBondContact O-N 3.18Å

Retrieved 157 of 157 residues in 272.7 ms (Link to these results)