A0A060VRM2_ONCMY Loading...

Hes-related family bHLH transcription factor with YRPW motif 2

AlphaFold DB , UniProt , Accession A0A060VRM2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 333 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M47.8Very low46.9Very low230 Ų230155.6 Ų155.6100%1.13385%0.845SS**  0139.10-56.288.2168.800107.3
2K48.3Very low46.8Very low191 Ų191148.4 Ų148.483%0.8382%0.815SS**  cis59.691.89.5-162.5172.3-1731750115.8
3R49.6Very low46.9Very low231 Ų231149.7 Ų149.787%0.87282%0.82SS**  -149.9146.3102.3-85.9-173.9-177.383.3-1.9109.6
4P53Low47.2Very low101 Ų101150.1 Ų150.166%0.65682%0.816SS**  trans-88170.6160.738.1-33.2000110.6
5C49Very low47.4Very low129 Ų129149.1 Ų149.187%0.87281%0.81SS**  trans-132.6110.2160.9-66.80000108.2
6D46.6Very low47.4Very low147 Ų147150.8 Ų150.879%0.78681%0.811SS**  trans-71.8147.8154.1-55.4-95.7000108.4
7D44Very low47.5Very low165 Ų165148.7 Ų148.788%0.88280%0.804SS**  trans-150.7133151.2-118.9-42000109.7
8S45.6Very low47.7Very low112 Ų112148.4 Ų148.478%0.78380%0.801SS**  trans-91.9138.7-174.5-68.50000110.7
9T45.4Very low47.8Very low146 Ų146148.4 Ų148.490%0.89680%0.8SS**  trans-131.2113.3161.2-58.30000109.1
10S49.8Very low47.7Very low117 Ų117146.9 Ų146.982%0.81880%0.796SS**  trans-112.9128.7171.3170.60000106.9
11D37Very low47.4Very low143 Ų143142.8 Ų142.877%0.76579%0.788SS**  trans-156.9154.1155.7-163.241.1000113.9
12S45.1Very low47.6Very low69 Ų69137.1 Ų137.148%0.48377%0.771SS.*  trans46.1112.6159.6410000121.4M14S12-M14 WeakPolarHBondContact O-CE 3.37Å
13D47.8Very low47.6Very low165 Ų165136 Ų13688%0.88277%0.769SS**  trans-69.5149.4143.8-60.4-94.4000111.3
14M51.5Low47.1Very low155 Ų155132.2 Ų132.276%0.76477%0.766SS**  trans-145.2111.3154.144.6-102.6115.700110.7S12S12-M14 WeakPolarHBondContact O-CE 3.37Å
15D49.7Very low46.8Very low135 Ų135133.8 Ų133.872%0.72277%0.769SS**  trans-72.9133.8167.2-176.5-86.3000109.7T17D15-T17 VanDerWaalsContact OD1-CB 3.29Å; D15-T17 WeakPolarHBondContact OD1-CB 3.08Å; D15-T17 PolarHBondContact OD1-N 2.99Å; D15-T17 PolarHBondContact OD1-OG1 3.03Å
16E48.1Very low46.3Very low177 Ų177137.7 Ų137.783%0.82777%0.766SS**  trans-12569.5167.3-165.1170.392.500109.7I18E16-I18 PolarHBondContact O-N 3.02Å
17T48.6Very low46Very low115 Ų115136 Ų13671%0.70677%0.766SS**  trans-57.3102.2166-67.90000109.8D15 D19D15-T17 VanDerWaalsContact OD1-CB 3.29Å; D15-T17 WeakPolarHBondContact OD1-CB 3.08Å; D15-T17 PolarHBondContact OD1-N 2.99Å; D15-T17 PolarHBondContact OD1-OG1 3.03Å; T17-D19 PolarHBondContact O-N 3.29Å
18I51Low45.6Very low143 Ų143131.8 Ų131.873%0.73376%0.762SS**  trans-69.4113.6179.749.7168.6000111.7E16E16-I18 PolarHBondContact O-N 3.02Å
19D50.5Low45.6Very low149 Ų149135.9 Ų135.980%0.79777%0.768SS**  trans-61.9143.3-179.4179.641.3000113.3T17 G21T17-D19 PolarHBondContact O-N 3.29Å; D19-G21 PolarHBondContact O-N 3.31Å
20V45.8Very low45.4Very low118 Ų118134.1 Ų134.172%0.71576%0.762SS**  trans-95.575.7-178.3-174.80000109.2S22V20-S22 PolarHBondContact O-N 2.88Å; V20-S22 PolarHBondContact O-OG 2.89Å; V20-S22 VanDerWaalsContact O-OG 3.08Å
21G41Very low44.7Very low61 Ų61135.9 Ų135.963%0.62976%0.762SS**  trans-49.5105.5-178.300000113.4D19D19-G21 PolarHBondContact O-N 3.31Å
22S51.8Low45.2Very low111 Ų111133.2 Ų133.278%0.77677%0.768SS**  trans-99.784.2-177.6-65.80000110.9V20 N24V20-S22 PolarHBondContact O-N 2.88Å; V20-S22 PolarHBondContact O-OG 2.89Å; V20-S22 VanDerWaalsContact O-OG 3.08Å; S22-N24 PolarHBondContact O-N 3.36Å
23E47.8Very low44.9Very low167 Ų167134.6 Ų134.678%0.7878%0.778SS**  trans-79.188.2-177.456.2179.9100.100113.9N25E23-N25 PolarHBondContact O-N 3.47Å; E23-N25 PolarHBondContact O-ND2 3.35Å
24N39.6Very low45Very low152 Ų152137.1 Ų137.181%0.81378%0.781SS**  trans-59.1112.6173.6175.276000112.3S22S22-N24 PolarHBondContact O-N 3.36Å
25N46.3Very low45Very low133 Ų133136.4 Ų136.471%0.71178%0.779SS**  trans-92.3109.5-177.3-104.8-103.4000112.6E23E23-N25 PolarHBondContact O-N 3.47Å; E23-N25 PolarHBondContact O-ND2 3.35Å
26Y39.4Very low44.6Very low211 Ų211140.3 Ų140.383%0.82778%0.784SS**  trans-156.7147159.7-144.9-103.5000114.8
27S39.5Very low44.6Very low112 Ų112137.5 Ų137.578%0.78378%0.782SS**  trans85.3137.4170.8-40.50000118.3
28G36.3Very low44.5Very low77 Ų77135.7 Ų135.779%0.79479%0.787SS**  trans126.569.9161.500000116.9
29H46.7Very low44.6Very low198 Ų198133.5 Ų133.592%0.91778%0.784SS**  trans-75.6133167.1-7872.9000111.2
30S39.9Very low45Very low108 Ų108130.4 Ų130.476%0.75577%0.772SS**  trans-165.8140.6139.148.50000113.8
31N35.9Very low45.4Very low155 Ų155128.8 Ų128.883%0.82976%0.763SS**  trans45.7102.9153.2-58.1-7.9000119.3
32G46.8Very low46.4Very low86 Ų86131.7 Ų131.789%0.88777%0.768SS**  trans-67130.4165.400000112.5
33S38.7Very low46.9Very low98 Ų98130.3 Ų130.369%0.68576%0.755SS**  trans-124.8116.1170.9-174.30000109.8I35S33-I35 VanDerWaalsContact C-N 3.27Å; S33-I35 PolarHBondContact O-N 2.83Å
34F51.2Low47.9Very low218 Ų218126.1 Ų126.196%0.95674%0.741SS**  trans-76.172179.9-97.4-91.4000111.5
35I50.7Low49.4Very low140 Ų140122.7 Ų122.772%0.71872%0.72SS**  trans-102.393.1173.1-59.8-62.4000111.2S33S33-I35 VanDerWaalsContact C-N 3.27Å; S33-I35 PolarHBondContact O-N 2.83Å
36R41.6Very low50.5Low218 Ų218120.6 Ų120.682%0.82371%0.712SS**  trans45.6105.2139.3-176.5-178-81.2-152.4-5.1117.5G38R36-G38 PolarHBondContact O-N 3.41Å
37C47.8Very low52.2Low118 Ų118116.3 Ų116.380%0.79770%0.701SS**  trans19.278.9132.5-80.90000117S39C37-S39 VanDerWaalsContact C-N 3.26Å; C37-S39 PolarHBondContact O-N 3.14Å
38G47.2Very low53.7Low77 Ų77113.8 Ų113.879%0.79469%0.687SS**  trans-70.486.3152.500000109R36 P40R36-G38 PolarHBondContact O-N 3.41Å; G38-P40 VanDerWaalsContact O-N 3.17Å
39S53Low55.5Low96 Ų96117.5 Ų117.567%0.67168%0.677SS**  trans-52.4122.7174.4-61.50000108.9C37 T41C37-S39 VanDerWaalsContact C-N 3.26Å; C37-S39 PolarHBondContact O-N 3.14Å; S39-T41 PolarHBondContact O-N 2.87Å
40P57.3Low57Low85 Ų85115.7 Ų115.755%0.55267%0.666SS**  trans-64.6105.5-176.225.2-33.2000107.9G38 T42 Q45G38-P40 VanDerWaalsContact O-N 3.17Å; P40-T42 PolarHBondContact O-N 2.91Å; P40-Q45 HydrophobicContact CB-CG 4.08Å; P40-Q45 HydrophobicContact CG-CG 4.33Å
41T55.8Low58.7Low84 Ų84118.2 Ų118.252%0.51566%0.664SS.*  trans-48.4128.2-168.947.80000109.3S39 T43 T44 Q45S39-T41 PolarHBondContact O-N 2.87Å; T41-T43 CarbonylContact O-C 3.59Å; T41-T43 PolarHBondContact O-N 3.48Å; T41-T44 WeakPolarHBondContact O-CA 3.3Å; T41-T44 WeakPolarHBondContact O-CB 3.43Å; T41-T44 PolarHBondContact O-N 3.32Å; T41-T44 PolarHBondContact OG1-OG1 2.78Å; T41-Q45 PolarHBondContact O-N 3.37Å
42T61.2Low60.7Low122 Ų122119.7 Ų119.775%0.74866%0.658SS**Hα-helixtrans-57.3-34.5-164.348.10000112P40 T44 Q45 V46P40-T42 PolarHBondContact O-N 2.91Å; T42-T44 PolarHBondContact O-N 3.4Å; T42-Q45 PolarHBondContact O-N 3.47Å; T42-V46 WeakPolarHBondContact O-CB 3.27Å; T42-V46 VanDerWaalsContact O-CG2 3.27Å; T42-V46 WeakPolarHBondContact O-CG2 3.48Å; T42-V46 PolarHBondContact O-N 2.98Å
43T61.3Low62.6Low82 Ų82125 Ų12550%0.50365%0.651SS.*Hα-helixtrans-52.6-47.5168-177.90000113.6T41 Q45 V46 M47T41-T43 CarbonylContact O-C 3.59Å; T41-T43 PolarHBondContact O-N 3.48Å; T43-Q45 PolarHBondContact O-N 2.97Å; T43-V46 CarbonylContact O-C 3.57Å; T43-V46 PolarHBondContact O-N 3.31Å; T43-V46 VanDerWaalsContact O-N 3.17Å; T43-M47 WeakPolarHBondContact O-CB 3.31Å; T43-M47 VanDerWaalsContact O-CG 3.29Å; T43-M47 WeakPolarHBondContact O-CG 3.4Å; T43-M47 PolarHBondContact O-N 3.4Å
44T69.5Low65.1Low79 Ų79122.4 Ų122.449%0.48564%0.639SS.*Hα-helixtrans-64.5-43.4-179.3-53.60000111.8T41 T42 M47 A48T41-T44 WeakPolarHBondContact O-CA 3.3Å; T41-T44 WeakPolarHBondContact O-CB 3.43Å; T41-T44 PolarHBondContact O-N 3.32Å; T41-T44 PolarHBondContact OG1-OG1 2.78Å; T42-T44 PolarHBondContact O-N 3.4Å; T44-M47 PolarHBondContact O-N 3.21Å; T44-A48 WeakPolarHBondContact O-CB 3.16Å; T44-A48 PolarHBondContact O-N 2.93Å
45Q71.3Confident66.9Low79 Ų79116 Ų11637%0.36961%0.614SS.*Hα-helixtrans-62.5-42.4172.1-78.1-119.511.600112P40 T41 T42 T43 A48 R49P40-Q45 HydrophobicContact CB-CG 4.08Å; P40-Q45 HydrophobicContact CG-CG 4.33Å; T41-Q45 PolarHBondContact O-N 3.37Å; T42-Q45 PolarHBondContact O-N 3.47Å; T43-Q45 PolarHBondContact O-N 2.97Å; Q45-A48 PolarHBondContact O-N 3.46Å; Q45-R49 WeakPolarHBondContact O-CB 3.29Å; Q45-R49 WeakPolarHBondContact O-CD 3.33Å; Q45-R49 WeakPolarHBondContact O-CG 3.07Å; Q45-R49 PolarHBondContact O-N 2.98Å
46V70.2Confident68.9Low90 Ų90114.5 Ų114.555%0.54561%0.607SS.*Hα-helixtrans-64.8-42177167.40000111.4T42 T43 R49 K50T42-V46 WeakPolarHBondContact O-CB 3.27Å; T42-V46 VanDerWaalsContact O-CG2 3.27Å; T42-V46 WeakPolarHBondContact O-CG2 3.48Å; T42-V46 PolarHBondContact O-N 2.98Å; T43-V46 CarbonylContact O-C 3.57Å; T43-V46 PolarHBondContact O-N 3.31Å; T43-V46 VanDerWaalsContact O-N 3.17Å; V46-R49 PolarHBondContact O-N 3.4Å; V46-K50 WeakPolarHBondContact O-CB 3.36Å; V46-K50 PolarHBondContact O-N 3.28Å
47M74.8Confident71.5Confident121 Ų121106.6 Ų106.660%0.59658%0.579SS**Hα-helixtrans-67.3-40.5176.7-69.2-137.6-79.300112.2T43 T44 R49 K50 K51T43-M47 WeakPolarHBondContact O-CB 3.31Å; T43-M47 VanDerWaalsContact O-CG 3.29Å; T43-M47 WeakPolarHBondContact O-CG 3.4Å; T43-M47 PolarHBondContact O-N 3.4Å; T44-M47 PolarHBondContact O-N 3.21Å; M47-R49 PolarHBondContact O-N 3.49Å; M47-K50 PolarHBondContact O-N 3.09Å; M47-K51 WeakPolarHBondContact O-CB 3.36Å; M47-K51 PolarHBondContact O-N 2.81Å
48A71.3Confident73.8Confident59 Ų59107.5 Ų107.549%0.48857%0.569SS.*Hα-helixtrans-62.1-42.5172.800000112.1T44 Q45 K51 R52T44-A48 WeakPolarHBondContact O-CB 3.16Å; T44-A48 PolarHBondContact O-N 2.93Å; Q45-A48 PolarHBondContact O-N 3.46Å; A48-K51 PolarHBondContact O-N 3.33Å; A48-R52 WeakPolarHBondContact O-CB 3.38Å; A48-R52 PolarHBondContact O-N 2.93Å
49R72.5Confident76.1Confident155 Ų155112.1 Ų112.159%0.58556%0.563SS**Hα-helixtrans-64.1-39.5173.7-68.8167.1-166.3-153.65.5111.6Q45 V46 M47 R52 R53Q45-R49 WeakPolarHBondContact O-CB 3.29Å; Q45-R49 WeakPolarHBondContact O-CD 3.33Å; Q45-R49 WeakPolarHBondContact O-CG 3.07Å; Q45-R49 PolarHBondContact O-N 2.98Å; V46-R49 PolarHBondContact O-N 3.4Å; M47-R49 PolarHBondContact O-N 3.49Å; R49-R52 PolarHBondContact O-N 3.47Å; R49-R53 WeakPolarHBondContact O-CG 3.46Å; R49-R53 PolarHBondContact O-N 3.38Å
50K78.3Confident78.3Confident159 Ų159114.2 Ų114.269%0.69156%0.556SS**Hα-helixtrans-64.9-45.5175.2-170.4177.7179.7-177.90111.8V46 M47 R53 G54V46-K50 WeakPolarHBondContact O-CB 3.36Å; V46-K50 PolarHBondContact O-N 3.28Å; M47-K50 PolarHBondContact O-N 3.09Å; K50-R53 PolarHBondContact O-N 3.24Å; K50-G54 PolarHBondContact O-N 2.94Å
51K77Confident80.2Confident161 Ų161117 Ų11770%0.756%0.556SS**Hα-helixtrans-59.8-45.5174.8-170.1173.7-177.81770111.2M47 A48 G54 I55M47-K51 WeakPolarHBondContact O-CB 3.36Å; M47-K51 PolarHBondContact O-N 2.81Å; A48-K51 PolarHBondContact O-N 3.33Å; K51-G54 PolarHBondContact O-N 3.32Å; K51-I55 HydrophobicContact CG-CD1 4.5Å; K51-I55 WeakPolarHBondContact O-CG1 3.43Å; K51-I55 PolarHBondContact O-N 3.25Å; K51-I55 VanDerWaalsContact O-N 3.12Å
52R77.4Confident82.2Confident187 Ų187116 Ų11671%0.70655%0.547SS*.Hα-helixtrans-60.7-45175.2-170.8-178.8-67.9-131.41.9112.4A48 R49 G54 I55 I56A48-R52 WeakPolarHBondContact O-CB 3.38Å; A48-R52 PolarHBondContact O-N 2.93Å; R49-R52 PolarHBondContact O-N 3.47Å; R52-G54 VanDerWaalsContact C-N 3.34Å; R52-G54 PolarHBondContact O-N 2.94Å; R52-I55 PolarHBondContact O-N 3.37Å; R52-I56 HydrophobicContact CG-CD1 4.32Å; R52-I56 WeakPolarHBondContact O-CG1 3.29Å; R52-I56 PolarHBondContact O-N 2.79Å
53R86.5Confident84Confident198 Ų198119.3 Ų119.375%0.74755%0.546SS*.Hα-helixtrans-59.9-41.7174.6-75.5177.1177.9-163.6-1.4111.9R49 K50 I55 I56 E57R49-R53 WeakPolarHBondContact O-CG 3.46Å; R49-R53 PolarHBondContact O-N 3.38Å; K50-R53 PolarHBondContact O-N 3.24Å; R53-I55 PolarHBondContact O-N 2.89Å; R53-I56 PolarHBondContact O-N 3.02Å; R53-E57 WeakPolarHBondContact O-CB 3.34Å; R53-E57 PolarHBondContact O-N 3.18Å
54G90.7Very high85.7Confident42 Ų42119.1 Ų119.143%0.43354%0.541SS..Hα-helixtrans-60.6-40.4176.100000113.9K50 K51 R52 E57 K58K50-G54 PolarHBondContact O-N 2.94Å; K51-G54 PolarHBondContact O-N 3.32Å; R52-G54 VanDerWaalsContact C-N 3.34Å; R52-G54 PolarHBondContact O-N 2.94Å; G54-E57 PolarHBondContact O-N 2.9Å; G54-K58 WeakPolarHBondContact O-CB 3.46Å; G54-K58 PolarHBondContact O-N 2.86Å
55I90.6Very high87Confident84 Ų84118.3 Ų118.343%0.43153%0.534SS..Hα-helixtrans-65.7-42.1177.3-65.6162.2000111.4K51 R52 R53 K58 R59K51-I55 HydrophobicContact CG-CD1 4.5Å; K51-I55 WeakPolarHBondContact O-CG1 3.43Å; K51-I55 PolarHBondContact O-N 3.25Å; K51-I55 VanDerWaalsContact O-N 3.12Å; R52-I55 PolarHBondContact O-N 3.37Å; R53-I55 PolarHBondContact O-N 2.89Å; I55-K58 PolarHBondContact O-N 3.01Å; I55-R59 WeakPolarHBondContact O-CG 3.38Å; I55-R59 PolarHBondContact O-N 3.16Å; I55-R59 VanDerWaalsContact O-N 3.12Å
56I92.6Very high88.2Confident109 Ų109119.8 Ų119.856%0.55954%0.544SS*.Hα-helixtrans-65.3-43.9177-64.3165.6000110.4R52 R53 R59 R60R52-I56 HydrophobicContact CG-CD1 4.32Å; R52-I56 WeakPolarHBondContact O-CG1 3.29Å; R52-I56 PolarHBondContact O-N 2.79Å; R53-I56 PolarHBondContact O-N 3.02Å; I56-R59 PolarHBondContact O-N 2.88Å; I56-R60 PolarHBondContact O-N 3.5Å
57E95.4Very high89.5Confident51 Ų51118.1 Ų118.124%0.23854%0.536CS..Hα-helixtrans-64.8-39.5177.617358.7-17900112.6R53 G54 R60 R61R53-E57 WeakPolarHBondContact O-CB 3.34Å; R53-E57 PolarHBondContact O-N 3.18Å; G54-E57 PolarHBondContact O-N 2.9Å; E57-R60 WeakPolarHBondContact O-CB 3.34Å; E57-R60 PolarHBondContact O-N 3.37Å; E57-R60 IonicContact OE1-CZ 2.67Å; E57-R60 IonicContact OE1-NE 3.97Å; E57-R60 IonicContact OE1-NH2 2.68Å; E57-R60 PolarHBondContact OE1-NH2 2.7Å; E57-R60 IonicContact OE2-CZ 3.63Å; E57-R60 IonicContact OE2-NE 2.72Å; E57-R60 PolarHBondContact OE2-NE 3.34Å; E57-R60 IonicContact OE2-NH2 2.69Å; E57-R60 PolarHBondContact OE2-NH2 2.92Å; E57-R61 WeakPolarHBondContact O-CG 3.46Å; E57-R61 PolarHBondContact O-N 3.36Å; E57-R61 IonicContact OE1-CZ 2.65Å; E57-R61 VanDerWaalsContact OE1-CZ 3.25Å; E57-R61 IonicContact OE1-NE 3.86Å; E57-R61 PolarHBondContact OE1-NE 3.28Å; E57-R61 IonicContact OE1-NH2 3.1Å; E57-R61 PolarHBondContact OE1-NH2 3.46Å
58K95.4Very high90.5Very high137 Ų137113 Ų11360%0.59651%0.511SS*.Hα-helixtrans-57.5-54.6172.5-178.3176.7175.6-178.90110.3G54 I55 R60 R61 D62G54-K58 WeakPolarHBondContact O-CB 3.46Å; G54-K58 PolarHBondContact O-N 2.86Å; I55-K58 PolarHBondContact O-N 3.01Å; K58-R60 PolarHBondContact O-N 3.29Å; K58-R60 VanDerWaalsContact O-N 3.16Å; K58-R61 WeakPolarHBondContact O-CA 3.49Å; K58-R61 WeakPolarHBondContact O-CB 3.23Å; K58-R61 PolarHBondContact O-N 3.2Å; K58-D62 WeakPolarHBondContact CG-OD2 3.43Å; K58-D62 PolarHBondContact O-N 2.98Å
59R96.8Very high91.6Very high174 Ų174113.3 Ų113.366%0.65751%0.51SS*.Hα-helixtrans-56.2-34177.5-69.8174.7179.3-178.5-1.5113.1I55 I56 R63I55-R59 WeakPolarHBondContact O-CG 3.38Å; I55-R59 PolarHBondContact O-N 3.16Å; I55-R59 VanDerWaalsContact O-N 3.12Å; I56-R59 PolarHBondContact O-N 2.88Å; R59-R63 WeakPolarHBondContact O-CG 3.48Å; R59-R63 PolarHBondContact O-N 3.03Å
60R98Very high92.8Very high140 Ų140110.9 Ų110.953%0.52851%0.505SS..Hα-helixtrans-65.7-46.5173.5-172.9-178.969.3138.14.4111.8I56 E57 K58 R63 I64I56-R60 PolarHBondContact O-N 3.5Å; E57-R60 WeakPolarHBondContact O-CB 3.34Å; E57-R60 PolarHBondContact O-N 3.37Å; E57-R60 IonicContact OE1-CZ 2.67Å; E57-R60 IonicContact OE1-NE 3.97Å; E57-R60 IonicContact OE1-NH2 2.68Å; E57-R60 PolarHBondContact OE1-NH2 2.7Å; E57-R60 IonicContact OE2-CZ 3.63Å; E57-R60 IonicContact OE2-NE 2.72Å; E57-R60 PolarHBondContact OE2-NE 3.34Å; E57-R60 IonicContact OE2-NH2 2.69Å; E57-R60 PolarHBondContact OE2-NH2 2.92Å; K58-R60 PolarHBondContact O-N 3.29Å; K58-R60 VanDerWaalsContact O-N 3.16Å; R60-R63 PolarHBondContact O-N 3.46Å; R60-I64 HydrophobicContact CG-CD1 4.16Å; R60-I64 WeakPolarHBondContact O-CG1 3.35Å; R60-I64 PolarHBondContact O-N 3.21Å
61R97.9Very high93.6Very high145 Ų145105.6 Ų105.655%0.54748%0.484SS..Hα-helixtrans-63.8-42177.5-67.9174.2-171.9-162.40.8111.9E57 K58 R63 I64 N65E57-R61 WeakPolarHBondContact O-CG 3.46Å; E57-R61 PolarHBondContact O-N 3.36Å; E57-R61 IonicContact OE1-CZ 2.65Å; E57-R61 VanDerWaalsContact OE1-CZ 3.25Å; E57-R61 IonicContact OE1-NE 3.86Å; E57-R61 PolarHBondContact OE1-NE 3.28Å; E57-R61 IonicContact OE1-NH2 3.1Å; E57-R61 PolarHBondContact OE1-NH2 3.46Å; K58-R61 WeakPolarHBondContact O-CA 3.49Å; K58-R61 WeakPolarHBondContact O-CB 3.23Å; K58-R61 PolarHBondContact O-N 3.2Å; R61-R63 PolarHBondContact O-N 3.33Å; R61-I64 PolarHBondContact O-N 3.1Å; R61-I64 VanDerWaalsContact O-N 3.17Å; R61-N65 VanDerWaalsContact O-CG 3.25Å; R61-N65 PolarHBondContact O-N 3.49Å; R61-N65 PolarHBondContact O-ND2 3.4Å
62D97.5Very high94.4Very high63 Ų63100.8 Ų100.834%0.33746%0.462SS..Hα-helixtrans-59.7-47.2178.9-58-23.5000110.2K58 I64 N65 N66K58-D62 WeakPolarHBondContact CG-OD2 3.43Å; K58-D62 PolarHBondContact O-N 2.98Å; D62-I64 VanDerWaalsContact C-N 3.35Å; D62-I64 PolarHBondContact O-N 3.22Å; D62-N65 PolarHBondContact O-N 3Å; D62-N66 VanDerWaalsContact O-CG 3.25Å; D62-N66 PolarHBondContact O-N 3.12Å; D62-N66 PolarHBondContact O-OD1 2.92Å
63R98Very high95.2Very high191 Ų19198.8 Ų98.872%0.72145%0.454SS*.Hα-helixtrans-57.4-41.6173.7-73.3179.668.2-125.6-1.4113.6R59 R60 R61 N66 S67R59-R63 WeakPolarHBondContact O-CG 3.48Å; R59-R63 PolarHBondContact O-N 3.03Å; R60-R63 PolarHBondContact O-N 3.46Å; R61-R63 PolarHBondContact O-N 3.33Å; R63-N66 PolarHBondContact O-N 3.34Å; R63-S67 PolarHBondContact O-N 3.03Å; R63-S67 PolarHBondContact O-OG 3.17Å
64I97.3Very high95.5Very high77 Ų7794 Ų9440%0.39544%0.442SS..Hα-helixtrans-69.2-37.1178.6-66.7164.5000111.4R60 R61 D62 S67 L68R60-I64 HydrophobicContact CG-CD1 4.16Å; R60-I64 WeakPolarHBondContact O-CG1 3.35Å; R60-I64 PolarHBondContact O-N 3.21Å; R61-I64 PolarHBondContact O-N 3.1Å; R61-I64 VanDerWaalsContact O-N 3.17Å; D62-I64 VanDerWaalsContact C-N 3.35Å; D62-I64 PolarHBondContact O-N 3.22Å; I64-S67 PolarHBondContact O-OG 3.3Å; I64-S67 VanDerWaalsContact O-OG 3.09Å; I64-L68 HydrophobicContact CG2-CD1 4.12Å; I64-L68 WeakPolarHBondContact O-CB 3.41Å; I64-L68 WeakPolarHBondContact O-CG 3.42Å; I64-L68 PolarHBondContact O-N 3.39Å; I64-L68 VanDerWaalsContact O-N 3.07Å
65N96.9Very high95.6Very high63 Ų6392.2 Ų92.234%0.33742%0.423SS..Hα-helixtrans-68.1-38.4175.5-68.1-27.4000111.4R61 D62 L68 S69 K89R61-N65 VanDerWaalsContact O-CG 3.25Å; R61-N65 PolarHBondContact O-N 3.49Å; R61-N65 PolarHBondContact O-ND2 3.4Å; D62-N65 PolarHBondContact O-N 3Å; N65-L68 PolarHBondContact O-N 3.12Å; N65-S69 WeakPolarHBondContact O-CB 3.39Å; N65-S69 PolarHBondContact O-N 2.72Å; N65-S69 PolarHBondContact O-OG 3.31Å; N65-K89 PolarHBondContact OD1-NZ 3.14Å
66N97.5Very high95.6Very high110 Ų11090.7 Ų90.759%0.58842%0.419SS*.Hα-helixtrans-62.8-49.9175.1-68.66.7000110.7D62 R63 L68 S69 E70D62-N66 VanDerWaalsContact O-CG 3.25Å; D62-N66 PolarHBondContact O-N 3.12Å; D62-N66 PolarHBondContact O-OD1 2.92Å; R63-N66 PolarHBondContact O-N 3.34Å; N66-L68 VanDerWaalsContact C-N 3.34Å; N66-L68 PolarHBondContact O-N 3.34Å; N66-S69 WeakPolarHBondContact O-CB 3.45Å; N66-S69 PolarHBondContact O-N 3.29Å; N66-E70 PolarHBondContact O-N 2.8Å
67S97.6Very high95.5Very high55 Ų5588.6 Ų88.639%0.38541%0.411SS..Hα-helixtrans-63.7-36.3179.363.50000112.9R63 I64 S69 E70 L71R63-S67 PolarHBondContact O-N 3.03Å; R63-S67 PolarHBondContact O-OG 3.17Å; I64-S67 PolarHBondContact O-OG 3.3Å; I64-S67 VanDerWaalsContact O-OG 3.09Å; S67-S69 VanDerWaalsContact C-N 3.31Å; S67-S69 PolarHBondContact O-N 2.86Å; S67-E70 PolarHBondContact O-N 3.38Å; S67-L71 WeakPolarHBondContact O-CB 3.48Å; S67-L71 VanDerWaalsContact O-CG 3.31Å; S67-L71 WeakPolarHBondContact O-CG 3.29Å; S67-L71 PolarHBondContact O-N 3.36Å
68L95.8Very high95.3Very high14 Ų1486.2 Ų86.27%0.07340%0.4CS..Hα-helixtrans-66.2-32172.5-75.7168.1000112.9I64 N65 N66 R72 K89 I92 L93I64-L68 HydrophobicContact CG2-CD1 4.12Å; I64-L68 WeakPolarHBondContact O-CB 3.41Å; I64-L68 WeakPolarHBondContact O-CG 3.42Å; I64-L68 PolarHBondContact O-N 3.39Å; I64-L68 VanDerWaalsContact O-N 3.07Å; N65-L68 PolarHBondContact O-N 3.12Å; N66-L68 VanDerWaalsContact C-N 3.34Å; N66-L68 PolarHBondContact O-N 3.34Å; L68-R72 PolarHBondContact O-N 2.96Å; L68-K89 HydrophobicContact CD1-CD 3.74Å; L68-K89 HydrophobicContact CD1-CG 4.05Å; L68-I92 HydrophobicContact CB-CD1 4.49Å; L68-I92 HydrophobicContact CD2-CB 4.46Å; L68-I92 HydrophobicContact CD2-CD1 4.49Å; L68-I92 HydrophobicContact CD2-CG2 4.2Å; L68-L93 HydrophobicContact CD2-CD2 3.9Å; L68-L93 HydrophobicContact CD2-CG 4.01Å
69S94.6Very high95.1Very high64 Ų6485.2 Ų85.245%0.44840%0.396SS..Hα-helixtrans-75-35.1176.5-54.10000111.5N65 N66 S67 R73N65-S69 WeakPolarHBondContact O-CB 3.39Å; N65-S69 PolarHBondContact O-N 2.72Å; N65-S69 PolarHBondContact O-OG 3.31Å; N66-S69 WeakPolarHBondContact O-CB 3.45Å; N66-S69 PolarHBondContact O-N 3.29Å; S67-S69 VanDerWaalsContact C-N 3.31Å; S67-S69 PolarHBondContact O-N 2.86Å; S69-R73 PolarHBondContact O-N 3.01Å
70E96.3Very high94.7Very high104 Ų10484.5 Ų84.549%0.48640%0.4SS..Hα-helixtrans-67.7-42.9172-179.9162.2-137.800112.1N66 S67 R72 R73 L74N66-E70 PolarHBondContact O-N 2.8Å; S67-E70 PolarHBondContact O-N 3.38Å; E70-R72 VanDerWaalsContact C-N 3.33Å; E70-R72 PolarHBondContact O-N 3.48Å; E70-R73 WeakPolarHBondContact O-CA 3.4Å; E70-R73 WeakPolarHBondContact O-CB 3.48Å; E70-R73 PolarHBondContact O-N 3.1Å; E70-L74 HydrophobicContact CG-CD1 3.66Å; E70-L74 HydrophobicContact CG-CG 4.12Å; E70-L74 WeakPolarHBondContact O-CG 3.49Å; E70-L74 PolarHBondContact O-N 3.19Å
71L96.6Very high94Very high48 Ų4882 Ų8225%0.25139%0.393SS..Hα-helixtrans-58.4-40.6175.1-75.8176.3000112.7S67 R73 L74 V75 I92 L93 T96S67-L71 WeakPolarHBondContact O-CB 3.48Å; S67-L71 VanDerWaalsContact O-CG 3.31Å; S67-L71 WeakPolarHBondContact O-CG 3.29Å; S67-L71 PolarHBondContact O-N 3.36Å; L71-R73 PolarHBondContact O-N 2.74Å; L71-L74 PolarHBondContact O-N 2.86Å; L71-V75 WeakPolarHBondContact O-CB 3.17Å; L71-V75 WeakPolarHBondContact O-CG2 3.36Å; L71-V75 PolarHBondContact O-N 2.95Å; L71-I92 HydrophobicContact CB-CG2 3.95Å; L71-L93 HydrophobicContact CD1-CD2 4.45Å; L71-T96 HydrophobicContact CD1-CG2 4.25Å; L71-T96 HydrophobicContact CD2-CG2 3.7Å
72R93.1Very high92.9Very high61 Ų6180.3 Ų80.323%0.2339%0.392CS..Hα-helixtrans-56.5-35.4171.9-77-178.5-179.4152.2-4.9113.1L68 E70 A78 F79 L87 I92L68-R72 PolarHBondContact O-N 2.96Å; E70-R72 VanDerWaalsContact C-N 3.33Å; E70-R72 PolarHBondContact O-N 3.48Å; R72-A78 CarbonylContact O-C 3.46Å; R72-F79 VanDerWaalsContact O-CA 3.23Å; R72-F79 WeakPolarHBondContact O-CA 3.41Å; R72-F79 WeakPolarHBondContact O-CB 3.43Å; R72-F79 PolarHBondContact O-N 2.7Å; R72-L87 HydrophobicContact CG-CD1 4.16Å; R72-L87 PolarHBondContact NH2-O 3.35Å; R72-I92 HydrophobicContact CG-CD1 3.91Å; R72-I92 HydrophobicContact CG-CG1 3.77Å; R72-I92 HydrophobicContact CG-CG2 4.1Å
73R93.6Very high91.6Very high145 Ų14581.2 Ų81.255%0.54742%0.416SS..Hα-helixtrans-82.3-28.9-178.7-168.2-1736477.10.1112.9S69 E70 L71S69-R73 PolarHBondContact O-N 3.01Å; E70-R73 WeakPolarHBondContact O-CA 3.4Å; E70-R73 WeakPolarHBondContact O-CB 3.48Å; E70-R73 PolarHBondContact O-N 3.1Å; L71-R73 PolarHBondContact O-N 2.74Å
74L93.3Very high89.9Confident96 Ų9676.9 Ų76.950%0.50341%0.414SS..Hα-helixtrans-91.6-25.1-176.2-67.4179.5000114E70 L71E70-L74 HydrophobicContact CG-CD1 3.66Å; E70-L74 HydrophobicContact CG-CG 4.12Å; E70-L74 WeakPolarHBondContact O-CG 3.49Å; E70-L74 PolarHBondContact O-N 3.19Å; L71-L74 PolarHBondContact O-N 2.86Å
75V92.8Very high88.7Confident5 Ų576.2 Ų76.23%0.0342%0.421CS..SBendtrans-91.8115.1179.7175.70000109.1L71 T77 A78 F79 M95 T96 H99L71-V75 WeakPolarHBondContact O-CB 3.17Å; L71-V75 WeakPolarHBondContact O-CG2 3.36Å; L71-V75 PolarHBondContact O-N 2.95Å; V75-T77 VanDerWaalsContact C-N 3.35Å; V75-T77 PolarHBondContact O-N 3.41Å; V75-A78 HydrophobicContact CB-CB 4.01Å; V75-A78 HydrophobicContact CG1-CB 4.08Å; V75-A78 PolarHBondContact O-N 3.14Å; V75-F79 PolarHBondContact O-N 3.14Å; V75-M95 HydrophobicContact CG1-CB 4.3Å; V75-T96 HydrophobicContact CG2-CG2 4.21Å; V75-H99 HydrophobicContact CG1-CB 3.93Å
76P90.8Very high88.1Confident52 Ų5282.9 Ų82.934%0.33845%0.447SS..Hα-helixtrans-54.9-44.8-170.1-28.735.4000114.1A78 F79 E80 H99P76-A78 VanDerWaalsContact C-N 3.34Å; P76-A78 PolarHBondContact O-N 2.9Å; P76-F79 PolarHBondContact O-N 2.99Å; P76-E80 WeakPolarHBondContact O-CB 3.43Å; P76-E80 PolarHBondContact O-N 3.46Å; P76-H99 WeakPolarHBondContact CD-NE2 3.47Å
77T90.4Very high87.6Confident66 Ų6677.9 Ų77.941%0.40542%0.42SS..Hα-helixtrans-67-3318053.50000112.7V75 K81 M95V75-T77 VanDerWaalsContact C-N 3.35Å; V75-T77 PolarHBondContact O-N 3.41Å; T77-K81 PolarHBondContact O-N 3.43Å; T77-M95 WeakPolarHBondContact O-CE 3.35Å
78A91.5Very high87.3Confident0 Ų081.9 Ų81.90%043%0.433CS..Hα-helixtrans-77.8-31.3176.600000111.9R72 V75 P76 Q82 L87 M95R72-A78 CarbonylContact O-C 3.46Å; V75-A78 HydrophobicContact CB-CB 4.01Å; V75-A78 HydrophobicContact CG1-CB 4.08Å; V75-A78 PolarHBondContact O-N 3.14Å; P76-A78 VanDerWaalsContact C-N 3.34Å; P76-A78 PolarHBondContact O-N 2.9Å; A78-Q82 PolarHBondContact O-N 2.93Å; A78-L87 HydrophobicContact CB-CD1 4.2Å; A78-L87 WeakPolarHBondContact O-CD1 3.49Å; A78-M95 HydrophobicContact CB-CB 4.41Å; A78-M95 HydrophobicContact CB-CE 4.3Å; A78-M95 HydrophobicContact CB-SD 4.07Å
79F91.2Very high87.2Confident117 Ų11786.7 Ų86.751%0.51345%0.453SS..Hα-helixtrans-67.8-45.4173.8177-102.8000111.1R72 V75 P76 K81 Q82R72-F79 VanDerWaalsContact O-CA 3.23Å; R72-F79 WeakPolarHBondContact O-CA 3.41Å; R72-F79 WeakPolarHBondContact O-CB 3.43Å; R72-F79 PolarHBondContact O-N 2.7Å; V75-F79 PolarHBondContact O-N 3.14Å; P76-F79 PolarHBondContact O-N 2.99Å; F79-K81 PolarHBondContact O-N 2.91Å; F79-Q82 WeakPolarHBondContact O-CB 3.29Å; F79-Q82 PolarHBondContact O-N 2.87Å
80E88.3Confident87.3Confident159 Ų15986.9 Ų86.974%0.74346%0.459SS*.Hα-helixtrans-59.3-43.5177.1-174.8173.7-143.500112.3P76 Q82P76-E80 WeakPolarHBondContact O-CB 3.43Å; P76-E80 PolarHBondContact O-N 3.46Å; E80-Q82 PolarHBondContact O-N 3.26Å
81K84.2Confident87.2Confident87 Ų8784.8 Ų84.838%0.37845%0.449SS..G310 helixtrans-70.2-9.2174.7-71.5-163.6-176.9-170.20114.9T77 F79 G83 S84 L87 E91 M95T77-K81 PolarHBondContact O-N 3.43Å; F79-K81 PolarHBondContact O-N 2.91Å; K81-G83 PolarHBondContact O-N 3.43Å; K81-G83 VanDerWaalsContact O-N 3.09Å; K81-S84 PolarHBondContact O-N 3.32Å; K81-S84 VanDerWaalsContact O-N 3.13Å; K81-S84 PolarHBondContact O-OG 3.33Å; K81-L87 HydrophobicContact CB-CD1 4.26Å; K81-L87 HydrophobicContact CB-CD2 3.76Å; K81-L87 HydrophobicContact CB-CG 4.34Å; K81-L87 HydrophobicContact CD-CD2 3.72Å; K81-L87 HydrophobicContact CG-CD2 4.43Å; K81-E91 IonicContact NZ-OE1 2.75Å; K81-E91 PolarHBondContact NZ-OE1 3.07Å; K81-M95 HydrophobicContact CD-CE 3.75Å; K81-M95 HydrophobicContact CD-SD 4.41Å; K81-M95 HydrophobicContact CG-CE 4.17Å
82Q74.8Confident87.1Confident110 Ų11082.6 Ų82.651%0.51444%0.437SS..G310 helixtrans-61-23.6-176.1-166.1178.6-90.400112.9A78 F79 E80A78-Q82 PolarHBondContact O-N 2.93Å; F79-Q82 WeakPolarHBondContact O-CB 3.29Å; F79-Q82 PolarHBondContact O-N 2.87Å; E80-Q82 PolarHBondContact O-N 3.26Å
83G69.4Low87.3Confident82 Ų8284 Ų8485%0.84545%0.449SS*.G310 helixtrans-83.9-15.2178.100000116.2K81K81-G83 PolarHBondContact O-N 3.43Å; K81-G83 VanDerWaalsContact O-N 3.09Å
84S62.1Low87.5Confident99 Ų9982 Ų8269%0.69245%0.446SS*.THydrogen-bonded Turntrans-112.2-28.5-168.559.30000115.3K81K81-S84 PolarHBondContact O-N 3.32Å; K81-S84 VanDerWaalsContact O-N 3.13Å; K81-S84 PolarHBondContact O-OG 3.33Å
85A71.6Confident87.6Confident64 Ų6478.5 Ų78.553%0.52943%0.427SS..SBendtrans-155.6158.5175.300000113.1L87A85-L87 VanDerWaalsContact C-N 3.29Å; A85-L87 PolarHBondContact O-N 3.07Å
86K84.9Confident87.8Confident202 Ų20279 Ų7988%0.87843%0.43SS*.  trans-7678.2172.4-174.8-177.4175.3179.50110.4E88K86-E88 PolarHBondContact O-N 3.32Å
87L86.1Confident88Confident6 Ų679.6 Ų79.63%0.03143%0.433CS..  trans-37.1129.8179.5-67174.6000113.7R72 A78 K81 A85 E91 I92 M95R72-L87 HydrophobicContact CG-CD1 4.16Å; R72-L87 PolarHBondContact NH2-O 3.35Å; A78-L87 HydrophobicContact CB-CD1 4.2Å; A78-L87 WeakPolarHBondContact O-CD1 3.49Å; K81-L87 HydrophobicContact CB-CD1 4.26Å; K81-L87 HydrophobicContact CB-CD2 3.76Å; K81-L87 HydrophobicContact CB-CG 4.34Å; K81-L87 HydrophobicContact CD-CD2 3.72Å; K81-L87 HydrophobicContact CG-CD2 4.43Å; A85-L87 VanDerWaalsContact C-N 3.29Å; A85-L87 PolarHBondContact O-N 3.07Å; L87-E91 VanDerWaalsContact CD2-CD 3.4Å; L87-E91 HydrophobicContact CD2-CG 4.28Å; L87-E91 WeakPolarHBondContact CD2-OE2 3.43Å; L87-I92 HydrophobicContact CB-CG1 4.09Å; L87-M95 HydrophobicContact CD2-SD 4.39Å
88E92.6Very high88.2Confident139 Ų13979.6 Ų79.665%0.6543%0.43SS*.  trans-70.9157.9178.4-66.4-152.215000112.7K86 A90 E91 I92K86-E88 PolarHBondContact O-N 3.32Å; E88-A90 VanDerWaalsContact C-N 3.28Å; E88-A90 PolarHBondContact O-N 3.33Å; E88-E91 HydrophobicContact CB-CB 4.24Å; E88-E91 PolarHBondContact O-N 2.69Å; E88-E91 VanDerWaalsContact O-N 3.16Å; E88-I92 VanDerWaalsContact O-CG1 3.3Å; E88-I92 WeakPolarHBondContact O-CG1 3.44Å; E88-I92 PolarHBondContact O-N 3.04Å
89K93.6Very high88.2Confident114 Ų11481.4 Ų81.450%0.49644%0.438SS..Hα-helixtrans-61.8-35.1177.9-71.8-164.3168.6-164.90113.1N65 L68 L93N65-K89 PolarHBondContact OD1-NZ 3.14Å; L68-K89 HydrophobicContact CD1-CD 3.74Å; L68-K89 HydrophobicContact CD1-CG 4.05Å; K89-L93 WeakPolarHBondContact O-CG 3.45Å; K89-L93 PolarHBondContact O-N 3.25Å
90A95.5Very high88.3Confident69 Ų6980.2 Ų80.257%0.5744%0.437SS*.Hα-helixtrans-68.4-42.5174.600000111.3E88 L93 Q94E88-A90 VanDerWaalsContact C-N 3.28Å; E88-A90 PolarHBondContact O-N 3.33Å; A90-L93 PolarHBondContact O-N 3.36Å; A90-Q94 WeakPolarHBondContact O-CB 3.45Å; A90-Q94 PolarHBondContact O-N 2.67Å
91E94.9Very high88.5Confident60 Ų6077.6 Ų77.628%0.2842%0.423SS..Hα-helixtrans-61.6-47.2179.8-165.6-177.1-174.800112K81 L87 E88 L93 Q94 M95K81-E91 IonicContact NZ-OE1 2.75Å; K81-E91 PolarHBondContact NZ-OE1 3.07Å; L87-E91 VanDerWaalsContact CD2-CD 3.4Å; L87-E91 HydrophobicContact CD2-CG 4.28Å; L87-E91 WeakPolarHBondContact CD2-OE2 3.43Å; E88-E91 HydrophobicContact CB-CB 4.24Å; E88-E91 PolarHBondContact O-N 2.69Å; E88-E91 VanDerWaalsContact O-N 3.16Å; E91-L93 VanDerWaalsContact C-N 3.28Å; E91-L93 PolarHBondContact O-N 3Å; E91-Q94 PolarHBondContact O-N 3.42Å; E91-M95 HydrophobicContact CG-CG 4.37Å; E91-M95 HydrophobicContact CG-SD 3.8Å; E91-M95 WeakPolarHBondContact O-CB 3.4Å; E91-M95 WeakPolarHBondContact O-CG 3.45Å; E91-M95 PolarHBondContact O-N 2.99Å
92I94.8Very high88.6Confident2 Ų276.3 Ų76.31%0.0142%0.419CS..Hα-helixtrans-54.7-45.7175.8-57.5159.5000110.9L68 L71 R72 L87 E88 T96L68-I92 HydrophobicContact CB-CD1 4.49Å; L68-I92 HydrophobicContact CD2-CB 4.46Å; L68-I92 HydrophobicContact CD2-CD1 4.49Å; L68-I92 HydrophobicContact CD2-CG2 4.2Å; L71-I92 HydrophobicContact CB-CG2 3.95Å; R72-I92 HydrophobicContact CG-CD1 3.91Å; R72-I92 HydrophobicContact CG-CG1 3.77Å; R72-I92 HydrophobicContact CG-CG2 4.1Å; L87-I92 HydrophobicContact CB-CG1 4.09Å; E88-I92 VanDerWaalsContact O-CG1 3.3Å; E88-I92 WeakPolarHBondContact O-CG1 3.44Å; E88-I92 PolarHBondContact O-N 3.04Å; I92-T96 WeakPolarHBondContact O-CB 3.4Å; I92-T96 PolarHBondContact O-N 3.39Å; I92-T96 PolarHBondContact O-OG1 2.94Å
93L97.4Very high89.2Confident89 Ų8972.9 Ų72.947%0.46640%0.404SS..Hα-helixtrans-68.4-41-178.6-69.3171.7000111.6L68 L71 K89 A90 E91 T96 V97L68-L93 HydrophobicContact CD2-CD2 3.9Å; L68-L93 HydrophobicContact CD2-CG 4.01Å; L71-L93 HydrophobicContact CD1-CD2 4.45Å; K89-L93 WeakPolarHBondContact O-CG 3.45Å; K89-L93 PolarHBondContact O-N 3.25Å; A90-L93 PolarHBondContact O-N 3.36Å; E91-L93 VanDerWaalsContact C-N 3.28Å; E91-L93 PolarHBondContact O-N 3Å; L93-T96 WeakPolarHBondContact O-CB 3.37Å; L93-T96 PolarHBondContact O-N 3.31Å; L93-V97 WeakPolarHBondContact O-CB 3.37Å; L93-V97 WeakPolarHBondContact O-CG2 3.31Å; L93-V97 PolarHBondContact O-N 3.2Å
94Q96.4Very high89.9Confident104 Ų10476.2 Ų76.249%0.48640%0.398SS..Hα-helixtrans-61.7-50.2175.7-173.361.245.800111.1A90 E91 T96 V97 D98A90-Q94 WeakPolarHBondContact O-CB 3.45Å; A90-Q94 PolarHBondContact O-N 2.67Å; E91-Q94 PolarHBondContact O-N 3.42Å; Q94-T96 VanDerWaalsContact C-N 3.27Å; Q94-T96 PolarHBondContact O-N 3.34Å; Q94-V97 PolarHBondContact O-N 3.45Å; Q94-V97 VanDerWaalsContact O-N 3.1Å; Q94-D98 VanDerWaalsContact NE2-CG 3.33Å; Q94-D98 PolarHBondContact NE2-OD1 3.1Å; Q94-D98 PolarHBondContact NE2-OD2 2.88Å; Q94-D98 PolarHBondContact O-N 3.46Å
95M95.8Very high90.8Very high23 Ų2376.7 Ų76.711%0.11340%0.397CS..Hα-helixtrans-60.8-36.7177.6-63.4172.49400111.8V75 T77 A78 K81 L87 E91 H99V75-M95 HydrophobicContact CG1-CB 4.3Å; T77-M95 WeakPolarHBondContact O-CE 3.35Å; A78-M95 HydrophobicContact CB-CB 4.41Å; A78-M95 HydrophobicContact CB-CE 4.3Å; A78-M95 HydrophobicContact CB-SD 4.07Å; K81-M95 HydrophobicContact CD-CE 3.75Å; K81-M95 HydrophobicContact CD-SD 4.41Å; K81-M95 HydrophobicContact CG-CE 4.17Å; L87-M95 HydrophobicContact CD2-SD 4.39Å; E91-M95 HydrophobicContact CG-CG 4.37Å; E91-M95 HydrophobicContact CG-SD 3.8Å; E91-M95 WeakPolarHBondContact O-CB 3.4Å; E91-M95 WeakPolarHBondContact O-CG 3.45Å; E91-M95 PolarHBondContact O-N 2.99Å; M95-H99 VanDerWaalsContact O-CB 3.27Å; M95-H99 WeakPolarHBondContact O-CB 3.42Å; M95-H99 PolarHBondContact O-N 3.25Å
96T96.4Very high91Very high14 Ų1476.7 Ų76.79%0.08639%0.39CS..Hα-helixtrans-63.6-47.7172.5-55.90000111.6L71 V75 I92 L93 Q94 H99 L100L71-T96 HydrophobicContact CD1-CG2 4.25Å; L71-T96 HydrophobicContact CD2-CG2 3.7Å; V75-T96 HydrophobicContact CG2-CG2 4.21Å; I92-T96 WeakPolarHBondContact O-CB 3.4Å; I92-T96 PolarHBondContact O-N 3.39Å; I92-T96 PolarHBondContact O-OG1 2.94Å; L93-T96 WeakPolarHBondContact O-CB 3.37Å; L93-T96 PolarHBondContact O-N 3.31Å; Q94-T96 VanDerWaalsContact C-N 3.27Å; Q94-T96 PolarHBondContact O-N 3.34Å; T96-H99 PolarHBondContact O-N 2.8Å; T96-L100 HydrophobicContact CG2-CD1 4.11Å; T96-L100 VanDerWaalsContact O-CG 3.31Å; T96-L100 WeakPolarHBondContact O-CG 3.42Å; T96-L100 PolarHBondContact O-N 3.45Å
97V96.5Very high90.3Very high66 Ų6669.2 Ų69.240%0.437%0.371SS..Hα-helixtrans-63.8-42.5-179.5164.20000111.4L93 Q94 L100 K101L93-V97 WeakPolarHBondContact O-CB 3.37Å; L93-V97 WeakPolarHBondContact O-CG2 3.31Å; L93-V97 PolarHBondContact O-N 3.2Å; Q94-V97 PolarHBondContact O-N 3.45Å; Q94-V97 VanDerWaalsContact O-N 3.1Å; V97-L100 PolarHBondContact O-N 2.89Å; V97-K101 WeakPolarHBondContact O-CG 3.41Å; V97-K101 PolarHBondContact O-N 2.95Å
98D94.1Very high89.3Confident66 Ų6671.9 Ų71.935%0.35340%0.4SS..Hα-helixtrans-72.8-32.7-179.9-63.4-32.7000112.2Q94 K101 M102Q94-D98 VanDerWaalsContact NE2-CG 3.33Å; Q94-D98 PolarHBondContact NE2-OD1 3.1Å; Q94-D98 PolarHBondContact NE2-OD2 2.88Å; Q94-D98 PolarHBondContact O-N 3.46Å; D98-K101 PolarHBondContact O-N 2.91Å; D98-K101 IonicContact OD1-NZ 2.74Å; D98-K101 PolarHBondContact OD1-NZ 3Å; D98-M102 WeakPolarHBondContact O-CB 3.24Å; D98-M102 PolarHBondContact O-N 3.44Å
99H91.6Very high87.9Confident37 Ų3768.8 Ų68.817%0.17138%0.384CS..Hα-helixtrans-63.4-41.7167.8-175.9-113.7000111.9V75 P76 M95 T96 M102 L103V75-H99 HydrophobicContact CG1-CB 3.93Å; P76-H99 WeakPolarHBondContact CD-NE2 3.47Å; M95-H99 VanDerWaalsContact O-CB 3.27Å; M95-H99 WeakPolarHBondContact O-CB 3.42Å; M95-H99 PolarHBondContact O-N 3.25Å; T96-H99 PolarHBondContact O-N 2.8Å; H99-M102 WeakPolarHBondContact CD2-CE 3.39Å; H99-M102 PolarHBondContact O-N 3.46Å; H99-L103 WeakPolarHBondContact O-CG 3.48Å; H99-L103 PolarHBondContact O-N 3.35Å
100L93.3Very high86.3Confident93 Ų9365.3 Ų65.349%0.48738%0.38SS..Hα-helixtrans-65.6-38.4175.4-72.2170.4000112.6T96 V97 L103 Q104T96-L100 HydrophobicContact CG2-CD1 4.11Å; T96-L100 VanDerWaalsContact O-CG 3.31Å; T96-L100 WeakPolarHBondContact O-CG 3.42Å; T96-L100 PolarHBondContact O-N 3.45Å; V97-L100 PolarHBondContact O-N 2.89Å; L100-L103 HydrophobicContact CD2-CD1 4.49Å; L100-L103 PolarHBondContact O-N 3.2Å; L100-Q104 WeakPolarHBondContact O-CG 3.4Å; L100-Q104 PolarHBondContact O-N 3.46Å
101K91.4Very high84.5Confident103 Ų10370.2 Ų70.245%0.44839%0.385SS..Hα-helixtrans-61.4-46.4171.4-69.9171.3-167.5158.20111.4V97 D98 L103 Q104 T105V97-K101 WeakPolarHBondContact O-CG 3.41Å; V97-K101 PolarHBondContact O-N 2.95Å; D98-K101 PolarHBondContact O-N 2.91Å; D98-K101 IonicContact OD1-NZ 2.74Å; D98-K101 PolarHBondContact OD1-NZ 3Å; K101-L103 VanDerWaalsContact C-N 3.33Å; K101-L103 PolarHBondContact O-N 2.87Å; K101-Q104 WeakPolarHBondContact O-CB 3.49Å; K101-Q104 PolarHBondContact O-N 3.17Å; K101-Q104 VanDerWaalsContact O-N 3.1Å; K101-T105 PolarHBondContact O-N 2.92Å; K101-T105 PolarHBondContact O-OG1 3.26Å
102M87.2Confident82.9Confident61 Ų6175.6 Ų75.630%0.341%0.408SS..Hα-helixtrans-57.9-46.2177.1178.9-77.2-64.400110.9D98 H99 Q104 T105 T106D98-M102 WeakPolarHBondContact O-CB 3.24Å; D98-M102 PolarHBondContact O-N 3.44Å; H99-M102 WeakPolarHBondContact CD2-CE 3.39Å; H99-M102 PolarHBondContact O-N 3.46Å; M102-Q104 VanDerWaalsContact C-N 3.31Å; M102-Q104 PolarHBondContact O-N 3.25Å; M102-T105 WeakPolarHBondContact CA-OG1 3.43Å; M102-T105 PolarHBondContact O-N 3.43Å; M102-T105 PolarHBondContact O-OG1 2.68Å; M102-T106 WeakPolarHBondContact O-CB 3.36Å; M102-T106 PolarHBondContact O-N 3.19Å; M102-T106 PolarHBondContact O-OG1 3.46Å
103L86.6Confident81.9Confident38 Ų3877.5 Ų77.520%0.19942%0.418CS..Hα-helixtrans-61-38174.9-69.5174.3000112.4H99 L100 K101 T106 G107 G108H99-L103 WeakPolarHBondContact O-CG 3.48Å; H99-L103 PolarHBondContact O-N 3.35Å; L100-L103 HydrophobicContact CD2-CD1 4.49Å; L100-L103 PolarHBondContact O-N 3.2Å; K101-L103 VanDerWaalsContact C-N 3.33Å; K101-L103 PolarHBondContact O-N 2.87Å; L103-T106 PolarHBondContact O-N 3.23Å; L103-G107 PolarHBondContact O-N 2.88Å; L103-G108 WeakPolarHBondContact O-CA 3.17Å; L103-G108 PolarHBondContact O-N 2.97Å
104Q84.8Confident81.1Confident152 Ų15276.8 Ų76.871%0.7143%0.425SS*.Hα-helixtrans-66.4-43.3175-74.3173.9-12.900112.2L100 K101 M102 T106 G107L100-Q104 WeakPolarHBondContact O-CG 3.4Å; L100-Q104 PolarHBondContact O-N 3.46Å; K101-Q104 WeakPolarHBondContact O-CB 3.49Å; K101-Q104 PolarHBondContact O-N 3.17Å; K101-Q104 VanDerWaalsContact O-N 3.1Å; M102-Q104 VanDerWaalsContact C-N 3.31Å; M102-Q104 PolarHBondContact O-N 3.25Å; Q104-T106 VanDerWaalsContact C-N 3.3Å; Q104-T106 PolarHBondContact O-N 3.46Å; Q104-G107 PolarHBondContact O-N 3.5Å
105T80.9Confident80.4Confident108 Ų10877.7 Ų77.766%0.66343%0.429SS*.Hα-helixtrans-69.7-25.1176.550.10000113.6K101 M102 G107K101-T105 PolarHBondContact O-N 2.92Å; K101-T105 PolarHBondContact O-OG1 3.26Å; M102-T105 WeakPolarHBondContact CA-OG1 3.43Å; M102-T105 PolarHBondContact O-N 3.43Å; M102-T105 PolarHBondContact O-OG1 2.68Å; T105-G107 VanDerWaalsContact C-N 3.28Å
106T75.7Confident79.8Confident64 Ų6479 Ų7939%0.39344%0.44SS..THydrogen-bonded Turntrans-90.813.5176.3-52.10000111.8M102 L103 Q104 G108 K109M102-T106 WeakPolarHBondContact O-CB 3.36Å; M102-T106 PolarHBondContact O-N 3.19Å; M102-T106 PolarHBondContact O-OG1 3.46Å; L103-T106 PolarHBondContact O-N 3.23Å; Q104-T106 VanDerWaalsContact C-N 3.3Å; Q104-T106 PolarHBondContact O-N 3.46Å; T106-G108 PolarHBondContact O-N 2.75Å; T106-K109 HydrophobicContact CG2-CB 4.37Å; T106-K109 PolarHBondContact O-N 3.02Å
107G69.6Low79.3Confident46 Ų4682.2 Ų82.247%0.47446%0.457SS..THydrogen-bonded Turntrans69.830173.800000114.6L103 Q104 T105 K109L103-G107 PolarHBondContact O-N 2.88Å; Q104-G107 PolarHBondContact O-N 3.5Å; T105-G107 VanDerWaalsContact C-N 3.28Å; G107-K109 PolarHBondContact O-N 3.2Å
108G66.3Low79Confident62 Ų6281.1 Ų81.164%0.63946%0.455SS*.THydrogen-bonded Turntrans75.9-7.7-178.400000114.8L103 T106 G110L103-G108 WeakPolarHBondContact O-CA 3.17Å; L103-G108 PolarHBondContact O-N 2.97Å; T106-G108 PolarHBondContact O-N 2.75Å; G108-G110 PolarHBondContact O-N 3.26Å
109K63.3Low78.7Confident74 Ų7480.9 Ų80.932%0.32245%0.452SS..  trans-66.6121.2170.9-68.4-179.2167.8-159.90108.9T106 G107 D113T106-K109 HydrophobicContact CG2-CB 4.37Å; T106-K109 PolarHBondContact O-N 3.02Å; G107-K109 PolarHBondContact O-N 3.2Å; K109-D113 HydrophobicContact CB-CB 4.5Å; K109-D113 HydrophobicContact CD-CB 4.32Å; K109-D113 VanDerWaalsContact CD-OD2 3.31Å; K109-D113 WeakPolarHBondContact CD-OD2 3.33Å; K109-D113 VanDerWaalsContact CE-OD2 3.24Å; K109-D113 WeakPolarHBondContact CE-OD2 3.46Å; K109-D113 IonicContact NZ-OD2 2.85Å; K109-D113 PolarHBondContact NZ-OD2 3.32Å
110G59.1Low78.6Confident40 Ų4083.1 Ų83.141%0.41247%0.465SS..  trans-67.6177.6177.800000112.8G108 F112G108-G110 PolarHBondContact O-N 3.26Å; G110-F112 PolarHBondContact O-N 2.89Å
111Y58.5Low78.5Confident172 Ų17285.4 Ų85.468%0.67547%0.472SS*.SBendtrans-58.5-3.6177-154.8-96000114.7
112F61.4Low78.7Confident173 Ų17384.6 Ų84.676%0.75947%0.47SS*.  trans-138.178.4174.8-68-83000110.4G110 A114G110-F112 PolarHBondContact O-N 2.89Å; F112-A114 VanDerWaalsContact C-N 3.28Å; F112-A114 PolarHBondContact O-N 3.41Å; F112-A114 VanDerWaalsContact O-N 3.08Å
113D74.1Confident79Confident42 Ų4283 Ų8323%0.22547%0.465CS..  trans-74.390.1156.4-176.1-1000108.7K109 H115 S116 L117K109-D113 HydrophobicContact CB-CB 4.5Å; K109-D113 HydrophobicContact CD-CB 4.32Å; K109-D113 VanDerWaalsContact CD-OD2 3.31Å; K109-D113 WeakPolarHBondContact CD-OD2 3.33Å; K109-D113 VanDerWaalsContact CE-OD2 3.24Å; K109-D113 WeakPolarHBondContact CE-OD2 3.46Å; K109-D113 IonicContact NZ-OD2 2.85Å; K109-D113 PolarHBondContact NZ-OD2 3.32Å; D113-H115 PolarHBondContact O-N 2.91Å; D113-H115 WeakPolarHBondContact OD1-CA 3.29Å; D113-H115 VanDerWaalsContact OD1-CB 3.29Å; D113-H115 WeakPolarHBondContact OD1-CB 3.29Å; D113-H115 PolarHBondContact OD1-N 3.1Å; D113-S116 PolarHBondContact O-N 3.26Å; D113-S116 VanDerWaalsContact O-N 3.13Å; D113-S116 PolarHBondContact OD1-N 3.02Å; D113-L117 PolarHBondContact O-N 2.93Å
114A79.9Confident79.4Confident74 Ų7483.7 Ų83.761%0.61247%0.471SS*.Hα-helixtrans-59.9-22.5177.600000112.9F112 A118F112-A114 VanDerWaalsContact C-N 3.28Å; F112-A114 PolarHBondContact O-N 3.41Å; F112-A114 VanDerWaalsContact O-N 3.08Å; A114-A118 VanDerWaalsContact O-CB 3.29Å; A114-A118 WeakPolarHBondContact O-CB 3.49Å; A114-A118 PolarHBondContact O-N 2.83Å; A114-A118 VanDerWaalsContact O-N 3.11Å
115H81.8Confident79.9Confident123 Ų12378 Ų7857%0.56945%0.453SS*.Hα-helixtrans-75.8-44.4173.9-177.281.8000111.2D113 A118 M119D113-H115 PolarHBondContact O-N 2.91Å; D113-H115 WeakPolarHBondContact OD1-CA 3.29Å; D113-H115 VanDerWaalsContact OD1-CB 3.29Å; D113-H115 WeakPolarHBondContact OD1-CB 3.29Å; D113-H115 PolarHBondContact OD1-N 3.1Å; H115-A118 PolarHBondContact O-N 3.31Å; H115-M119 WeakPolarHBondContact O-CG 3.47Å; H115-M119 PolarHBondContact O-N 3.08Å
116S83.1Confident80.7Confident50 Ų5075.3 Ų75.335%0.3543%0.432SS..Hα-helixtrans-57.5-51.5172.3-167.70000110.7D113 A118 M119 D120D113-S116 PolarHBondContact O-N 3.26Å; D113-S116 VanDerWaalsContact O-N 3.13Å; D113-S116 PolarHBondContact OD1-N 3.02Å; S116-A118 PolarHBondContact O-N 3.42Å; S116-M119 CarbonylContact O-C 3.59Å; S116-M119 WeakPolarHBondContact O-CA 3.21Å; S116-M119 WeakPolarHBondContact O-CB 3.47Å; S116-M119 PolarHBondContact O-N 2.95Å; S116-D120 VanDerWaalsContact O-CG 3.28Å; S116-D120 PolarHBondContact O-N 3.43Å
117L86.1Confident81.6Confident82 Ų8276.9 Ų76.943%0.42943%0.431SS..Hα-helixtrans-58.8-35179.6-176.161.1000112.4D113 D120 F121D113-L117 PolarHBondContact O-N 2.93Å; L117-D120 PolarHBondContact O-N 3.27Å; L117-F121 HydrophobicContact CD1-CD2 4Å; L117-F121 HydrophobicContact CD1-CE2 3.57Å; L117-F121 HydrophobicContact CD1-CZ 4.2Å; L117-F121 HydrophobicContact CD2-CE2 4.14Å; L117-F121 HydrophobicContact CG-CD2 3.9Å; L117-F121 HydrophobicContact CG-CE2 3.63Å; L117-F121 WeakPolarHBondContact O-CD2 3.27Å; L117-F121 PolarHBondContact O-N 2.93Å
118A89.3Confident82.9Confident43 Ų4380.6 Ų80.636%0.35544%0.436SS..Hα-helixtrans-69.9-36.3172.800000113.1A114 H115 S116 M122A114-A118 VanDerWaalsContact O-CB 3.29Å; A114-A118 WeakPolarHBondContact O-CB 3.49Å; A114-A118 PolarHBondContact O-N 2.83Å; A114-A118 VanDerWaalsContact O-N 3.11Å; H115-A118 PolarHBondContact O-N 3.31Å; S116-A118 PolarHBondContact O-N 3.42Å; A118-M122 WeakPolarHBondContact O-CB 3.14Å; A118-M122 WeakPolarHBondContact O-CG 3.36Å; A118-M122 PolarHBondContact O-N 3.49Å
119M88.3Confident84.4Confident61 Ų6181.3 Ų81.330%0.343%0.43SS..Hα-helixtrans-64.3-42.9171.3-63.1-50.9104.300110.8H115 S116 M122 S123H115-M119 WeakPolarHBondContact O-CG 3.47Å; H115-M119 PolarHBondContact O-N 3.08Å; S116-M119 CarbonylContact O-C 3.59Å; S116-M119 WeakPolarHBondContact O-CA 3.21Å; S116-M119 WeakPolarHBondContact O-CB 3.47Å; S116-M119 PolarHBondContact O-N 2.95Å; M119-M122 HydrophobicContact CE-CE 3.35Å; M119-M122 PolarHBondContact O-N 2.65Å; M119-M122 HydrophobicContact SD-CE 3.48Å; M119-M122 WeakPolarHBondContact SD-CE 3.31Å; M119-S123 PolarHBondContact O-N 3.11Å
120D89.1Confident86Confident84 Ų8479 Ų7945%0.44942%0.422SS..Hα-helixtrans-61.1-50.8179.5-63.6-42.6000110.7S116 L117 M122 S123 V124S116-D120 VanDerWaalsContact O-CG 3.28Å; S116-D120 PolarHBondContact O-N 3.43Å; L117-D120 PolarHBondContact O-N 3.27Å; D120-M122 PolarHBondContact O-N 3Å; D120-S123 WeakPolarHBondContact O-CB 3.38Å; D120-S123 PolarHBondContact O-N 3.17Å; D120-S123 VanDerWaalsContact O-N 3.07Å; D120-S123 PolarHBondContact O-OG 3.25Å; D120-V124 WeakPolarHBondContact O-CG2 3.39Å; D120-V124 PolarHBondContact O-N 3.13Å
121F93.1Very high87.8Confident141 Ų14181.4 Ų81.462%0.61843%0.428SS*.Hα-helixtrans-61.4-38.3174.5-78.3-56.1000113.1L117 S123 V124 G125L117-F121 HydrophobicContact CD1-CD2 4Å; L117-F121 HydrophobicContact CD1-CE2 3.57Å; L117-F121 HydrophobicContact CD1-CZ 4.2Å; L117-F121 HydrophobicContact CD2-CE2 4.14Å; L117-F121 HydrophobicContact CG-CD2 3.9Å; L117-F121 HydrophobicContact CG-CE2 3.63Å; L117-F121 WeakPolarHBondContact O-CD2 3.27Å; L117-F121 PolarHBondContact O-N 2.93Å; F121-S123 VanDerWaalsContact C-N 3.31Å; F121-S123 PolarHBondContact O-N 3.27Å; F121-V124 PolarHBondContact O-N 2.9Å; F121-G125 PolarHBondContact O-N 3.29Å
122M93.7Very high89.7Confident86 Ų8677.6 Ų77.642%0.42442%0.417SS..Hα-helixtrans-65.5-31.4172.9-80.2-161.6-58.500113.1A118 M119 D120 F126A118-M122 WeakPolarHBondContact O-CB 3.14Å; A118-M122 WeakPolarHBondContact O-CG 3.36Å; A118-M122 PolarHBondContact O-N 3.49Å; M119-M122 HydrophobicContact CE-CE 3.35Å; M119-M122 PolarHBondContact O-N 2.65Å; M119-M122 HydrophobicContact SD-CE 3.48Å; M119-M122 WeakPolarHBondContact SD-CE 3.31Å; D120-M122 PolarHBondContact O-N 3Å; M122-F126 VanDerWaalsContact O-CB 3.29Å; M122-F126 WeakPolarHBondContact O-CB 3.17Å; M122-F126 PolarHBondContact O-N 3.2Å; M122-F126 VanDerWaalsContact O-N 3.14Å
123S93.7Very high91.4Very high27 Ų2771.5 Ų71.519%0.18939%0.393CS..Hα-helixtrans-68.1-43.917484.10000110.9M119 D120 F121 F126 R127M119-S123 PolarHBondContact O-N 3.11Å; D120-S123 WeakPolarHBondContact O-CB 3.38Å; D120-S123 PolarHBondContact O-N 3.17Å; D120-S123 VanDerWaalsContact O-N 3.07Å; D120-S123 PolarHBondContact O-OG 3.25Å; F121-S123 VanDerWaalsContact C-N 3.31Å; F121-S123 PolarHBondContact O-N 3.27Å; S123-F126 PolarHBondContact O-N 3.22Å; S123-R127 WeakPolarHBondContact O-CG 3.49Å; S123-R127 PolarHBondContact O-N 3.34Å; S123-R127 VanDerWaalsContact O-N 3.1Å; S123-R127 PolarHBondContact O-NH1 2.69Å; S123-R127 PolarHBondContact OG-NH1 2.93Å
124V94.8Very high92.5Very high53 Ų5370.3 Ų70.332%0.32139%0.39SS..Hα-helixtrans-60.2-57.3177.11750000110.2D120 F121 F126 R127 E128D120-V124 WeakPolarHBondContact O-CG2 3.39Å; D120-V124 PolarHBondContact O-N 3.13Å; F121-V124 PolarHBondContact O-N 2.9Å; V124-F126 PolarHBondContact O-N 2.9Å; V124-R127 PolarHBondContact O-N 2.95Å; V124-E128 HydrophobicContact CG1-CG 4.33Å; V124-E128 WeakPolarHBondContact O-CG 3.33Å; V124-E128 PolarHBondContact O-N 2.9Å
125G96.4Very high93.3Very high33 Ų3372.7 Ų72.734%0.3438%0.383SS..Hα-helixtrans-61.1-29.5-178.700000113.7F121 C129F121-G125 PolarHBondContact O-N 3.29Å; G125-C129 WeakPolarHBondContact O-CB 3.3Å; G125-C129 PolarHBondContact O-N 3.07Å
126F96.7Very high94Very high51 Ų5171.8 Ų71.822%0.22438%0.375CS..Hα-helixtrans-70.1-42173-170.3-83.5000112.2M122 S123 V124 C129 L130 L157 C160 A161M122-F126 VanDerWaalsContact O-CB 3.29Å; M122-F126 WeakPolarHBondContact O-CB 3.17Å; M122-F126 PolarHBondContact O-N 3.2Å; M122-F126 VanDerWaalsContact O-N 3.14Å; S123-F126 PolarHBondContact O-N 3.22Å; V124-F126 PolarHBondContact O-N 2.9Å; F126-C129 PolarHBondContact O-N 3.43Å; F126-L130 WeakPolarHBondContact O-CB 3.33Å; F126-L130 PolarHBondContact O-N 3.28Å; F126-L157 WeakPolarHBondContact CE1-O 3.44Å; F126-L157 HydrophobicContact CZ-CD2 4.12Å; F126-C160 HydrophobicContact CZ-CB 4.16Å; F126-A161 HydrophobicContact CD1-CB 3.77Å; F126-A161 HydrophobicContact CE1-CB 3.77Å
127R95.8Very high94.6Very high98 Ų9870.2 Ų70.237%0.3736%0.363SS..Hα-helixtrans-68.9-35.4176.2-66.1-173.7-52.2-91.5-6.9112.1S123 V124 T131 E165S123-R127 WeakPolarHBondContact O-CG 3.49Å; S123-R127 PolarHBondContact O-N 3.34Å; S123-R127 VanDerWaalsContact O-N 3.1Å; S123-R127 PolarHBondContact O-NH1 2.69Å; S123-R127 PolarHBondContact OG-NH1 2.93Å; V124-R127 PolarHBondContact O-N 2.95Å; R127-T131 WeakPolarHBondContact O-CB 3.42Å; R127-T131 PolarHBondContact O-N 3.24Å; R127-T131 PolarHBondContact O-OG1 3.33Å; R127-E165 IonicContact CZ-OE1 2.82Å; R127-E165 IonicContact NH1-OE1 2.9Å; R127-E165 PolarHBondContact NH1-OE1 2.82Å
128E97.4Very high95Very high123 Ų12368.8 Ų68.858%0.57536%0.36SS*.Hα-helixtrans-64.3-48.1171.4-69.5175151.100111.1V124 L130 T131 E132V124-E128 HydrophobicContact CG1-CG 4.33Å; V124-E128 WeakPolarHBondContact O-CG 3.33Å; V124-E128 PolarHBondContact O-N 2.9Å; E128-L130 PolarHBondContact O-N 3.44Å; E128-T131 WeakPolarHBondContact O-CB 3.23Å; E128-T131 PolarHBondContact O-N 3.03Å; E128-T131 VanDerWaalsContact O-N 3.14Å; E128-E132 WeakPolarHBondContact O-CB 3.39Å; E128-E132 PolarHBondContact O-N 3.16Å
129C97.6Very high95.3Very high77 Ų7770.2 Ų70.252%0.5237%0.367SS..Hα-helixtrans-58-44.8175.1-174.80000112.4G125 F126 T131 E132 V133G125-C129 WeakPolarHBondContact O-CB 3.3Å; G125-C129 PolarHBondContact O-N 3.07Å; F126-C129 PolarHBondContact O-N 3.43Å; C129-T131 VanDerWaalsContact C-N 3.34Å; C129-T131 PolarHBondContact O-N 3.37Å; C129-E132 PolarHBondContact O-N 3.33Å; C129-V133 WeakPolarHBondContact O-CG2 3.31Å; C129-V133 PolarHBondContact O-N 3.45Å
130L97.2Very high95.5Very high26 Ų2671.3 Ų71.314%0.13638%0.377CS..Hα-helixtrans-58.5-45.4174-178.3167.7000111.5F126 E128 E132 V133 A134 V154 L157F126-L130 WeakPolarHBondContact O-CB 3.33Å; F126-L130 PolarHBondContact O-N 3.28Å; E128-L130 PolarHBondContact O-N 3.44Å; L130-E132 VanDerWaalsContact C-N 3.34Å; L130-V133 PolarHBondContact O-N 3.09Å; L130-A134 WeakPolarHBondContact O-CB 3.08Å; L130-A134 PolarHBondContact O-N 3.05Å; L130-V154 HydrophobicContact CD2-CG1 4.23Å; L130-L157 HydrophobicContact CD1-CB 3.8Å; L130-L157 HydrophobicContact CG-CB 3.9Å
131T96.9Very high95.7Very high91 Ų9172.4 Ų72.456%0.55838%0.379SS*.Hα-helixtrans-63.7-40.9178.9-56.70000111R127 E128 C129 A134 R135R127-T131 WeakPolarHBondContact O-CB 3.42Å; R127-T131 PolarHBondContact O-N 3.24Å; R127-T131 PolarHBondContact O-OG1 3.33Å; E128-T131 WeakPolarHBondContact O-CB 3.23Å; E128-T131 PolarHBondContact O-N 3.03Å; E128-T131 VanDerWaalsContact O-N 3.14Å; C129-T131 VanDerWaalsContact C-N 3.34Å; C129-T131 PolarHBondContact O-N 3.37Å; T131-A134 PolarHBondContact O-N 3.43Å; T131-R135 WeakPolarHBondContact O-CB 3.35Å; T131-R135 PolarHBondContact O-N 3.02Å
132E98.1Very high95.6Very high92 Ų9268.3 Ų68.343%0.4338%0.377SS..Hα-helixtrans-69.2-37.5176.7-178.459.3-171.100112.5E128 C129 L130 R135 Y136E128-E132 WeakPolarHBondContact O-CB 3.39Å; E128-E132 PolarHBondContact O-N 3.16Å; C129-E132 PolarHBondContact O-N 3.33Å; L130-E132 VanDerWaalsContact C-N 3.34Å; E132-R135 WeakPolarHBondContact O-CB 3.33Å; E132-R135 PolarHBondContact O-N 3.42Å; E132-R135 IonicContact OE1-CZ 3.74Å; E132-R135 IonicContact OE1-NE 3.43Å; E132-R135 PolarHBondContact OE1-NE 2.94Å; E132-R135 IonicContact OE1-NH2 3.36Å; E132-R135 PolarHBondContact OE1-NH2 3.27Å; E132-R135 IonicContact OE2-CZ 2.7Å; E132-R135 IonicContact OE2-NE 3.61Å; E132-R135 PolarHBondContact OE2-NE 3.27Å; E132-R135 IonicContact OE2-NH2 3.25Å; E132-Y136 VanDerWaalsContact O-CB 3.29Å; E132-Y136 WeakPolarHBondContact O-CB 3.49Å; E132-Y136 PolarHBondContact O-N 2.96Å
133V97.4Very high95.5Very high44 Ų4466.2 Ų66.227%0.26737%0.367SS..Hα-helixtrans-61.1-46169.51680000110.6C129 L130 R135 Y136 L137 L153 L157C129-V133 WeakPolarHBondContact O-CG2 3.31Å; C129-V133 PolarHBondContact O-N 3.45Å; L130-V133 PolarHBondContact O-N 3.09Å; V133-R135 VanDerWaalsContact C-N 3.28Å; V133-R135 PolarHBondContact O-N 3.06Å; V133-Y136 PolarHBondContact O-N 3.13Å; V133-L137 HydrophobicContact CG1-CD1 3.76Å; V133-L137 HydrophobicContact CG1-CG 4.36Å; V133-L137 WeakPolarHBondContact O-CB 3.47Å; V133-L137 WeakPolarHBondContact O-CD1 3.45Å; V133-L137 VanDerWaalsContact O-CG 3.23Å; V133-L137 WeakPolarHBondContact O-CG 3.43Å; V133-L137 PolarHBondContact O-N 2.75Å; V133-L153 HydrophobicContact CG1-CD2 4.27Å; V133-L157 HydrophobicContact CB-CD1 4.46Å; V133-L157 HydrophobicContact CG1-CD1 4.07Å
134A95.8Very high95.2Very high18 Ų1870.8 Ų70.815%0.14939%0.389CS..Hα-helixtrans-63.8-32.2176.300000112.5L130 T131 R150 V154L130-A134 WeakPolarHBondContact O-CB 3.08Å; L130-A134 PolarHBondContact O-N 3.05Å; T131-A134 PolarHBondContact O-N 3.43Å; A134-R150 VanDerWaalsContact O-CZ 3.26Å; A134-R150 PolarHBondContact O-NH1 2.85Å; A134-R150 PolarHBondContact O-NH2 3.31Å; A134-V154 HydrophobicContact CB-CG1 4.49Å; A134-V154 HydrophobicContact CB-CG2 3.89Å
135R96.7Very high94.8Very high124 Ų12473 Ų7347%0.46841%0.407SS..Hα-helixtrans-69.3-54.6172.5-166.9-165.36873.10.1111T131 E132 V133 L137 S138 S139T131-R135 WeakPolarHBondContact O-CB 3.35Å; T131-R135 PolarHBondContact O-N 3.02Å; E132-R135 WeakPolarHBondContact O-CB 3.33Å; E132-R135 PolarHBondContact O-N 3.42Å; E132-R135 IonicContact OE1-CZ 3.74Å; E132-R135 IonicContact OE1-NE 3.43Å; E132-R135 PolarHBondContact OE1-NE 2.94Å; E132-R135 IonicContact OE1-NH2 3.36Å; E132-R135 PolarHBondContact OE1-NH2 3.27Å; E132-R135 IonicContact OE2-CZ 2.7Å; E132-R135 IonicContact OE2-NE 3.61Å; E132-R135 PolarHBondContact OE2-NE 3.27Å; E132-R135 IonicContact OE2-NH2 3.25Å; V133-R135 VanDerWaalsContact C-N 3.28Å; V133-R135 PolarHBondContact O-N 3.06Å; R135-L137 VanDerWaalsContact C-N 3.35Å; R135-L137 PolarHBondContact O-N 2.92Å; R135-S138 PolarHBondContact O-N 2.74Å; R135-S139 PolarHBondContact NH1-OG 2.99Å; R135-S139 PolarHBondContact O-N 2.96Å; R135-S139 PolarHBondContact O-OG 3.28Å
136Y97.2Very high94.6Very high104 Ų10478.5 Ų78.541%0.40843%0.427SS..Hα-helixtrans-52.2-49.4-179.1-179.5-89.5000112.2E132 V133 S138 S139 V140 E141E132-Y136 VanDerWaalsContact O-CB 3.29Å; E132-Y136 WeakPolarHBondContact O-CB 3.49Å; E132-Y136 PolarHBondContact O-N 2.96Å; V133-Y136 PolarHBondContact O-N 3.13Å; Y136-S138 PolarHBondContact O-N 3.02Å; Y136-S139 PolarHBondContact O-N 3.04Å; Y136-V140 HydrophobicContact CD2-CB 3.93Å; Y136-V140 HydrophobicContact CD2-CG1 4.38Å; Y136-V140 HydrophobicContact CD2-CG2 3.61Å; Y136-V140 HydrophobicContact CE1-CB 4.41Å; Y136-V140 HydrophobicContact CE2-CB 3.81Å; Y136-V140 HydrophobicContact CE2-CG1 3.75Å; Y136-V140 HydrophobicContact CE2-CG2 3.79Å; Y136-V140 HydrophobicContact CG-CB 4.29Å; Y136-V140 HydrophobicContact CG-CG2 4.23Å; Y136-V140 WeakPolarHBondContact O-CB 3.38Å; Y136-V140 PolarHBondContact O-N 3.48Å; Y136-E141 HydrophobicContact CD1-CG 4.17Å; Y136-E141 HydrophobicContact CE1-CG 3.73Å; Y136-E141 WeakPolarHBondContact CE1-OE1 3.46Å; Y136-E141 PolarHBondContact O-N 3.27Å; Y136-E141 PolarHBondContact OH-OE1 3.49Å
137L95.8Very high94.6Very high17 Ų1778 Ų789%0.08943%0.427CS..Hα-helixtrans-60.8-27.1-179.8-68.2167.5000113V133 R135 E141 L143 R150 L153V133-L137 HydrophobicContact CG1-CD1 3.76Å; V133-L137 HydrophobicContact CG1-CG 4.36Å; V133-L137 WeakPolarHBondContact O-CB 3.47Å; V133-L137 WeakPolarHBondContact O-CD1 3.45Å; V133-L137 VanDerWaalsContact O-CG 3.23Å; V133-L137 WeakPolarHBondContact O-CG 3.43Å; V133-L137 PolarHBondContact O-N 2.75Å; R135-L137 VanDerWaalsContact C-N 3.35Å; R135-L137 PolarHBondContact O-N 2.92Å; L137-E141 HydrophobicContact CD2-CG 4.36Å; L137-L143 HydrophobicContact CD2-CD1 4.04Å; L137-L143 WeakPolarHBondContact O-CA 3.45Å; L137-L143 VanDerWaalsContact O-CB 3.27Å; L137-L143 WeakPolarHBondContact O-CB 3.42Å; L137-L143 PolarHBondContact O-N 3.07Å; L137-R150 HydrophobicContact CB-CG 4.49Å; L137-R150 HydrophobicContact CD1-CG 4.47Å; L137-L153 HydrophobicContact CD1-CD2 4.07Å
138S94.6Very high94.5Very high52 Ų5277.5 Ų77.536%0.36444%0.437SS..Hα-helixtrans-90.5-40.9173.6-79.20000113.3R135 Y136 G142 L143 R150R135-S138 PolarHBondContact O-N 2.74Å; Y136-S138 PolarHBondContact O-N 3.02Å; S138-G142 WeakPolarHBondContact O-CA 3.48Å; S138-L143 PolarHBondContact OG-O 3.49Å; S138-R150 PolarHBondContact OG-NH1 2.75Å; S138-R150 PolarHBondContact OG-NH2 3.2Å
139S94.3Very high94.3Very high73 Ų7376.5 Ų76.551%0.5144%0.435SS..Hα-helixtrans-89.9-19.6-171.466.10000115.1R135 Y136R135-S139 PolarHBondContact NH1-OG 2.99Å; R135-S139 PolarHBondContact O-N 2.96Å; R135-S139 PolarHBondContact O-OG 3.28Å; Y136-S139 PolarHBondContact O-N 3.04Å
140V93.7Very high94.2Very high83 Ų8374.7 Ų74.750%0.50342%0.417SS..THydrogen-bonded Turntrans-113.5-53.7-176.8-173.20000110.6Y136 G142Y136-V140 HydrophobicContact CD2-CB 3.93Å; Y136-V140 HydrophobicContact CD2-CG1 4.38Å; Y136-V140 HydrophobicContact CD2-CG2 3.61Å; Y136-V140 HydrophobicContact CE1-CB 4.41Å; Y136-V140 HydrophobicContact CE2-CB 3.81Å; Y136-V140 HydrophobicContact CE2-CG1 3.75Å; Y136-V140 HydrophobicContact CE2-CG2 3.79Å; Y136-V140 HydrophobicContact CG-CB 4.29Å; Y136-V140 HydrophobicContact CG-CG2 4.23Å; Y136-V140 WeakPolarHBondContact O-CB 3.38Å; Y136-V140 PolarHBondContact O-N 3.48Å; V140-G142 VanDerWaalsContact C-N 3.3Å; V140-G142 PolarHBondContact O-N 3.38Å
141E92.4Very high94.2Very high107 Ų10777 Ų7750%0.543%0.432SS..SBendtrans-78.2-14.9177.3-59.9-58.4144.400113.1Y136 L137 L143Y136-E141 HydrophobicContact CD1-CG 4.17Å; Y136-E141 HydrophobicContact CE1-CG 3.73Å; Y136-E141 WeakPolarHBondContact CE1-OE1 3.46Å; Y136-E141 PolarHBondContact O-N 3.27Å; Y136-E141 PolarHBondContact OH-OE1 3.49Å; L137-E141 HydrophobicContact CD2-CG 4.36Å; E141-L143 VanDerWaalsContact C-N 3.27Å; E141-L143 HydrophobicContact CB-CD1 4.4Å; E141-L143 HydrophobicContact CB-CG 3.95Å; E141-L143 PolarHBondContact O-N 2.96Å
142G91.7Very high94.2Very high55 Ų5581.3 Ų81.357%0.56744%0.438SS*.  trans6920-179.800000114.5S138 V140 D144S138-G142 WeakPolarHBondContact O-CA 3.48Å; V140-G142 VanDerWaalsContact C-N 3.3Å; V140-G142 PolarHBondContact O-N 3.38Å; G142-D144 PolarHBondContact O-N 3.37Å
143L91.1Very high94.1Very high42 Ų4279.9 Ų79.922%0.2243%0.433CS..  trans-75.5121.4179.9-55.3-179.3000110.9L137 S138 E141 D147 R150L137-L143 HydrophobicContact CD2-CD1 4.04Å; L137-L143 WeakPolarHBondContact O-CA 3.45Å; L137-L143 VanDerWaalsContact O-CB 3.27Å; L137-L143 WeakPolarHBondContact O-CB 3.42Å; L137-L143 PolarHBondContact O-N 3.07Å; S138-L143 PolarHBondContact OG-O 3.49Å; E141-L143 VanDerWaalsContact C-N 3.27Å; E141-L143 HydrophobicContact CB-CD1 4.4Å; E141-L143 HydrophobicContact CB-CG 3.95Å; E141-L143 PolarHBondContact O-N 2.96Å; L143-D147 HydrophobicContact CB-CB 4.11Å; L143-R150 HydrophobicContact CB-CB 4.44Å
144D88.4Confident94.1Very high123 Ų12379.5 Ų79.566%0.65843%0.431SS*.  trans-56.2154.6174.4-80.7-49.8000112.5G142 I146 D147 R150G142-D144 PolarHBondContact O-N 3.37Å; D144-I146 PolarHBondContact O-N 2.91Å; D144-D147 WeakPolarHBondContact O-CB 3.46Å; D144-D147 PolarHBondContact O-N 2.89Å; D144-R150 WeakPolarHBondContact O-CD 3.46Å
145S86.7Confident94.2Very high100 Ų10082 Ų8270%0.69945%0.447SS*.THydrogen-bonded Turntrans-55.7-21.8177.860.90000114.7V151S145-V151 WeakPolarHBondContact O-CG2 3.5Å
146I91.7Very high94.2Very high148 Ų14881.8 Ų81.876%0.75945%0.451SS*.THydrogen-bonded Turntrans-98.8-3-177.5-142165.8000113.5D144D144-I146 PolarHBondContact O-N 2.91Å
147D95.6Very high94.2Very high40 Ų4078.6 Ų78.621%0.21444%0.441CS..  trans-60.2130.9-177.7170.6-89000112L143 D144 L149 R150 V151L143-D147 HydrophobicContact CB-CB 4.11Å; D144-D147 WeakPolarHBondContact O-CB 3.46Å; D144-D147 PolarHBondContact O-N 2.89Å; D147-L149 VanDerWaalsContact C-N 3.3Å; D147-L149 PolarHBondContact O-N 2.9Å; D147-L149 WeakPolarHBondContact OD1-CA 3.48Å; D147-L149 VanDerWaalsContact OD1-CB 3.29Å; D147-L149 WeakPolarHBondContact OD1-CB 3.43Å; D147-L149 PolarHBondContact OD1-N 3.09Å; D147-R150 HydrophobicContact CB-CB 3.97Å; D147-R150 PolarHBondContact O-N 3.4Å; D147-R150 PolarHBondContact OD1-N 3.42Å; D147-V151 WeakPolarHBondContact O-CB 3.42Å; D147-V151 VanDerWaalsContact O-CG2 3.3Å; D147-V151 WeakPolarHBondContact O-CG2 3.36Å; D147-V151 PolarHBondContact O-N 2.82Å
148P94.2Very high94.2Very high89 Ų8980.6 Ų80.658%0.57846%0.456SS*.Hα-helixtrans-71.1-17.9-172.827.9-36.5000114.6R152P148-R152 WeakPolarHBondContact O-CB 3.46Å; P148-R152 PolarHBondContact O-N 2.74Å
149L94.1Very high94.3Very high102 Ų10282 Ų8253%0.53446%0.463SS..Hα-helixtrans-79.7-49.2171.5172.463.3000109.8D147 R152 L153D147-L149 VanDerWaalsContact C-N 3.3Å; D147-L149 PolarHBondContact O-N 2.9Å; D147-L149 WeakPolarHBondContact OD1-CA 3.48Å; D147-L149 VanDerWaalsContact OD1-CB 3.29Å; D147-L149 WeakPolarHBondContact OD1-CB 3.43Å; D147-L149 PolarHBondContact OD1-N 3.09Å; L149-R152 PolarHBondContact O-N 2.72Å; L149-L153 WeakPolarHBondContact O-CB 3.41Å; L149-L153 PolarHBondContact O-N 3.03Å
150R94.9Very high94.4Very high38 Ų3880.5 Ų80.514%0.14345%0.452CS..Hα-helixtrans-53.9-55.9175.2-179.2-166.717669.46.9111.5A134 L137 S138 L143 D144 D147 R152 L153 V154A134-R150 VanDerWaalsContact O-CZ 3.26Å; A134-R150 PolarHBondContact O-NH1 2.85Å; A134-R150 PolarHBondContact O-NH2 3.31Å; L137-R150 HydrophobicContact CB-CG 4.49Å; L137-R150 HydrophobicContact CD1-CG 4.47Å; S138-R150 PolarHBondContact OG-NH1 2.75Å; S138-R150 PolarHBondContact OG-NH2 3.2Å; L143-R150 HydrophobicContact CB-CB 4.44Å; D144-R150 WeakPolarHBondContact O-CD 3.46Å; D147-R150 HydrophobicContact CB-CB 3.97Å; D147-R150 PolarHBondContact O-N 3.4Å; D147-R150 PolarHBondContact OD1-N 3.42Å; R150-R152 VanDerWaalsContact C-N 3.32Å; R150-R152 PolarHBondContact O-N 3.05Å; R150-L153 PolarHBondContact O-N 3.35Å; R150-V154 WeakPolarHBondContact O-CG2 3.27Å; R150-V154 PolarHBondContact O-N 2.97Å
151V96.3Very high94.4Very high76 Ų7677 Ų7746%0.46143%0.432SS..Hα-helixtrans-59.6-43.6-177.8171.30000110.7S145 D147 S155S145-V151 WeakPolarHBondContact O-CG2 3.5Å; D147-V151 WeakPolarHBondContact O-CB 3.42Å; D147-V151 VanDerWaalsContact O-CG2 3.3Å; D147-V151 WeakPolarHBondContact O-CG2 3.36Å; D147-V151 PolarHBondContact O-N 2.82Å; V151-S155 WeakPolarHBondContact O-CB 3.42Å; V151-S155 PolarHBondContact O-N 2.88Å
152R97.4Very high94.5Very high180 Ų18075.1 Ų75.168%0.67943%0.43SS*.Hα-helixtrans-65.1-45.7178.7-174.1-175.6-56.7162.15.3112.3P148 L149 R150 H156P148-R152 WeakPolarHBondContact O-CB 3.46Å; P148-R152 PolarHBondContact O-N 2.74Å; L149-R152 PolarHBondContact O-N 2.72Å; R150-R152 VanDerWaalsContact C-N 3.32Å; R150-R152 PolarHBondContact O-N 3.05Å; R152-H156 VanDerWaalsContact O-CB 3.29Å; R152-H156 WeakPolarHBondContact O-CB 3.43Å; R152-H156 PolarHBondContact O-N 3.35Å
153L97Very high94.5Very high62 Ų6279.2 Ų79.233%0.32544%0.435SS..Hα-helixtrans-68.4-47.5-177.3179.654.2000111.6V133 L137 L149 R150 S155 H156 L157V133-L153 HydrophobicContact CG1-CD2 4.27Å; L137-L153 HydrophobicContact CD1-CD2 4.07Å; L149-L153 WeakPolarHBondContact O-CB 3.41Å; L149-L153 PolarHBondContact O-N 3.03Å; R150-L153 PolarHBondContact O-N 3.35Å; L153-S155 PolarHBondContact O-N 3Å; L153-H156 PolarHBondContact O-N 3.17Å; L153-L157 HydrophobicContact CD1-CD1 4.03Å; L153-L157 HydrophobicContact CD1-CG 4.13Å; L153-L157 HydrophobicContact CG-CD1 4.19Å; L153-L157 WeakPolarHBondContact O-CG 3.34Å; L153-L157 PolarHBondContact O-N 3.21Å
154V96.5Very high94.4Very high36 Ų3683 Ų8322%0.21845%0.446CS..Hα-helixtrans-64.7-40.3178.2176.80000111.2L130 A134 R150 L157 S158L130-V154 HydrophobicContact CD2-CG1 4.23Å; A134-V154 HydrophobicContact CB-CG1 4.49Å; A134-V154 HydrophobicContact CB-CG2 3.89Å; R150-V154 WeakPolarHBondContact O-CG2 3.27Å; R150-V154 PolarHBondContact O-N 2.97Å; V154-L157 PolarHBondContact O-N 3.27Å; V154-S158 VanDerWaalsContact O-CB 3.31Å; V154-S158 WeakPolarHBondContact O-CB 3.48Å; V154-S158 PolarHBondContact O-N 3.16Å
155S97.4Very high94.4Very high70 Ų7080.3 Ų80.349%0.4943%0.43SS..Hα-helixtrans-63.4-43174.7-179.40000112.7V151 L153 S158 T159V151-S155 WeakPolarHBondContact O-CB 3.42Å; V151-S155 PolarHBondContact O-N 2.88Å; L153-S155 PolarHBondContact O-N 3Å; S155-S158 PolarHBondContact O-N 3.48Å; S155-T159 WeakPolarHBondContact O-CB 3.29Å; S155-T159 PolarHBondContact O-N 2.91Å; S155-T159 PolarHBondContact O-OG1 3.06Å
156H97.8Very high94.4Very high121 Ų12178.3 Ų78.356%0.5642%0.419SS*.Hα-helixtrans-63.7-46.1176178.165.5000112.2R152 L153 S158 T159 C160R152-H156 VanDerWaalsContact O-CB 3.29Å; R152-H156 WeakPolarHBondContact O-CB 3.43Å; R152-H156 PolarHBondContact O-N 3.35Å; L153-H156 PolarHBondContact O-N 3.17Å; H156-S158 VanDerWaalsContact C-N 3.34Å; H156-S158 PolarHBondContact O-N 3.47Å; H156-T159 PolarHBondContact O-N 2.89Å; H156-C160 WeakPolarHBondContact O-CB 3.41Å; H156-C160 PolarHBondContact O-N 3.28Å
157L97.3Very high94.1Very high37 Ų3773.9 Ų73.919%0.19441%0.405CS..Hα-helixtrans-62.7-40.5176.2-69172.9000111.5F126 L130 V133 L153 V154 C160 A161F126-L157 WeakPolarHBondContact CE1-O 3.44Å; F126-L157 HydrophobicContact CZ-CD2 4.12Å; L130-L157 HydrophobicContact CD1-CB 3.8Å; L130-L157 HydrophobicContact CG-CB 3.9Å; V133-L157 HydrophobicContact CB-CD1 4.46Å; V133-L157 HydrophobicContact CG1-CD1 4.07Å; L153-L157 HydrophobicContact CD1-CD1 4.03Å; L153-L157 HydrophobicContact CD1-CG 4.13Å; L153-L157 HydrophobicContact CG-CD1 4.19Å; L153-L157 WeakPolarHBondContact O-CG 3.34Å; L153-L157 PolarHBondContact O-N 3.21Å; V154-L157 PolarHBondContact O-N 3.27Å; L157-C160 WeakPolarHBondContact O-CB 3.17Å; L157-C160 PolarHBondContact O-N 3.41Å; L157-A161 PolarHBondContact O-N 2.89Å
158S96.3Very high93.5Very high58 Ų5874 Ų7441%0.40641%0.411SS..Hα-helixtrans-63.3-43.8176.6-177.40000111.7V154 S155 H156 C160 A161 S162V154-S158 VanDerWaalsContact O-CB 3.31Å; V154-S158 WeakPolarHBondContact O-CB 3.48Å; V154-S158 PolarHBondContact O-N 3.16Å; S155-S158 PolarHBondContact O-N 3.48Å; H156-S158 VanDerWaalsContact C-N 3.34Å; H156-S158 PolarHBondContact O-N 3.47Å; S158-C160 VanDerWaalsContact C-N 3.3Å; S158-C160 PolarHBondContact O-N 3.36Å; S158-A161 WeakPolarHBondContact O-CB 3.43Å; S158-A161 PolarHBondContact O-N 3.2Å; S158-S162 PolarHBondContact O-N 3.14Å; S158-S162 VanDerWaalsContact O-N 3.09Å; S158-S162 PolarHBondContact O-OG 2.94Å
159T96.6Very high92.5Very high83 Ų8376.5 Ų76.551%0.50942%0.417SS..Hα-helixtrans-60.6-40.4173.9-540000111.5S155 H156 S162 Q163S155-T159 WeakPolarHBondContact O-CB 3.29Å; S155-T159 PolarHBondContact O-N 2.91Å; S155-T159 PolarHBondContact O-OG1 3.06Å; H156-T159 PolarHBondContact O-N 2.89Å; T159-S162 PolarHBondContact O-N 3.44Å; T159-Q163 WeakPolarHBondContact O-CB 3.45Å; T159-Q163 PolarHBondContact O-N 3.37Å
160C95.6Very high91.5Very high41 Ų4176.2 Ų76.228%0.27742%0.419SS..Hα-helixtrans-65.2-41176.7-170.10000112.1F126 H156 L157 S158 Q163 R164F126-C160 HydrophobicContact CZ-CB 4.16Å; H156-C160 WeakPolarHBondContact O-CB 3.41Å; H156-C160 PolarHBondContact O-N 3.28Å; L157-C160 WeakPolarHBondContact O-CB 3.17Å; L157-C160 PolarHBondContact O-N 3.41Å; S158-C160 VanDerWaalsContact C-N 3.3Å; S158-C160 PolarHBondContact O-N 3.36Å; C160-Q163 PolarHBondContact O-N 3.12Å; C160-R164 WeakPolarHBondContact O-CG 3.46Å; C160-R164 PolarHBondContact O-N 3.43Å
161A94.3Very high90.1Very high9 Ų977.5 Ų77.57%0.07443%0.434CS..Hα-helixtrans-58-54.2173.700000111.2F126 L157 S158 Q163 R164 E165F126-A161 HydrophobicContact CD1-CB 3.77Å; F126-A161 HydrophobicContact CE1-CB 3.77Å; L157-A161 PolarHBondContact O-N 2.89Å; S158-A161 WeakPolarHBondContact O-CB 3.43Å; S158-A161 PolarHBondContact O-N 3.2Å; A161-Q163 VanDerWaalsContact C-N 3.29Å; A161-Q163 PolarHBondContact O-N 3.48Å; A161-R164 PolarHBondContact O-N 3.47Å; A161-R164 VanDerWaalsContact O-N 3.12Å; A161-E165 PolarHBondContact O-N 2.96Å
162S93.5Very high88.3Confident67 Ų6776.5 Ų76.547%0.46943%0.43SS..Hα-helixtrans-60.8-36.1-180-56.10000112.8S158 T159 A166S158-S162 PolarHBondContact O-N 3.14Å; S158-S162 VanDerWaalsContact O-N 3.09Å; S158-S162 PolarHBondContact O-OG 2.94Å; T159-S162 PolarHBondContact O-N 3.44Å; S162-A166 WeakPolarHBondContact O-CB 3.33Å; S162-A166 PolarHBondContact O-N 3.24Å
163Q92.2Very high86.3Confident141 Ų14173.9 Ų73.966%0.65943%0.427SS*.Hα-helixtrans-68.5-37.8176.3-174.7171.689.300112.3T159 C160 A161 A167T159-Q163 WeakPolarHBondContact O-CB 3.45Å; T159-Q163 PolarHBondContact O-N 3.37Å; C160-Q163 PolarHBondContact O-N 3.12Å; A161-Q163 VanDerWaalsContact C-N 3.29Å; A161-Q163 PolarHBondContact O-N 3.48Å; Q163-A167 WeakPolarHBondContact O-CB 3.43Å; Q163-A167 PolarHBondContact O-N 3.29Å
164R89.5Confident84.2Confident121 Ų12174 Ų7446%0.45744%0.438SS..Hα-helixtrans-67.9-41.8175.1-68.9178.799.7-130.73.4111.7C160 A161 A167 A168C160-R164 WeakPolarHBondContact O-CG 3.46Å; C160-R164 PolarHBondContact O-N 3.43Å; A161-R164 PolarHBondContact O-N 3.47Å; A161-R164 VanDerWaalsContact O-N 3.12Å; R164-A167 PolarHBondContact O-N 3.32Å; R164-A168 PolarHBondContact O-N 3.47Å
165E87.8Confident82Confident68 Ų6878.6 Ų78.632%0.31846%0.456SS..Hα-helixtrans-63.5-44176.2-70.8172.6-177.400111.4R127 A161 A167 A168 M169R127-E165 IonicContact CZ-OE1 2.82Å; R127-E165 IonicContact NH1-OE1 2.9Å; R127-E165 PolarHBondContact NH1-OE1 2.82Å; A161-E165 PolarHBondContact O-N 2.96Å; E165-A167 PolarHBondContact O-N 3.34Å; E165-A168 PolarHBondContact O-N 3.22Å; E165-M169 PolarHBondContact O-N 3.46Å
166A87.4Confident79.8Confident58 Ų5879.8 Ų79.848%0.47945%0.454SS..Hα-helixtrans-61.3-41.8174.100000112.9S162 A168 M169 T170S162-A166 WeakPolarHBondContact O-CB 3.33Å; S162-A166 PolarHBondContact O-N 3.24Å; A166-A168 VanDerWaalsContact C-N 3.35Å; A166-A168 PolarHBondContact O-N 3.41Å; A166-M169 PolarHBondContact O-N 2.77Å; A166-T170 PolarHBondContact O-N 3.36Å
167A85.2Confident77.1Confident55 Ų5582.5 Ų82.546%0.45547%0.467SS..Hα-helixtrans-67.2-32177.300000113.3Q163 R164 E165 T170 S171Q163-A167 WeakPolarHBondContact O-CB 3.43Å; Q163-A167 PolarHBondContact O-N 3.29Å; R164-A167 PolarHBondContact O-N 3.32Å; E165-A167 PolarHBondContact O-N 3.34Å; A167-T170 PolarHBondContact O-OG1 3.17Å; A167-T170 VanDerWaalsContact O-OG1 3.1Å; A167-S171 PolarHBondContact O-N 2.93Å; A167-S171 PolarHBondContact O-OG 3.12Å
168A81.7Confident74.5Confident41 Ų4188.5 Ų88.534%0.33949%0.494SS..Hα-helixtrans-68.5-34.617400000112.3R164 E165 A166 S171 S172R164-A168 PolarHBondContact O-N 3.47Å; E165-A168 PolarHBondContact O-N 3.22Å; A166-A168 VanDerWaalsContact C-N 3.35Å; A166-A168 PolarHBondContact O-N 3.41Å; A168-S171 PolarHBondContact O-OG 3.48Å; A168-S171 VanDerWaalsContact O-OG 3.07Å; A168-S172 PolarHBondContact O-N 2.97Å
169M73.6Confident72.1Confident143 Ų14391.6 Ų91.670%0.70451%0.51SS*.Hα-helixtrans-70.4-37.7175.5-65.3-159.3-179.300112.7E165 A166 M173E165-M169 PolarHBondContact O-N 3.46Å; A166-M169 PolarHBondContact O-N 2.77Å; M169-M173 PolarHBondContact O-N 2.82Å
170T73.6Confident70.1Confident96 Ų9694.6 Ų94.659%0.58952%0.522SS*.Hα-helixtrans-71.7-35.8178.857.80000113.1A166 A167 M173 A174A166-T170 PolarHBondContact O-N 3.36Å; A167-T170 PolarHBondContact O-OG1 3.17Å; A167-T170 VanDerWaalsContact O-OG1 3.1Å; T170-M173 PolarHBondContact O-N 2.97Å; T170-A174 PolarHBondContact O-N 3.24Å; T170-A174 VanDerWaalsContact O-N 3.12Å
171S64.4Low68Low65 Ų6598.3 Ų98.346%0.45555%0.546SS..Hα-helixtrans-67.5-34.2175.766.10000112.8A167 A168 A174A167-S171 PolarHBondContact O-N 2.93Å; A167-S171 PolarHBondContact O-OG 3.12Å; A168-S171 PolarHBondContact O-OG 3.48Å; A168-S171 VanDerWaalsContact O-OG 3.07Å; S171-A174 PolarHBondContact O-N 3.5Å
172S59.3Low66Low55 Ų55103.4 Ų103.439%0.38558%0.578SS.*Hα-helixtrans-63.5-39173.4-165.30000112.4A168A168-S172 PolarHBondContact O-N 2.97Å
173M55.8Low63.9Low124 Ų124107.2 Ų107.261%0.61159%0.588SS**Hα-helixtrans-69.7-33.9175.4-69.4-70.399.900113.3M169 T170 H175 H176M169-M173 PolarHBondContact O-N 2.82Å; T170-M173 PolarHBondContact O-N 2.97Å; M173-H175 VanDerWaalsContact C-N 3.34Å; M173-H175 PolarHBondContact O-N 3.49Å; M173-H176 WeakPolarHBondContact O-CB 3.39Å; M173-H176 PolarHBondContact O-N 2.98Å
174A52.5Low61.7Low66 Ų66109.2 Ų109.255%0.54560%0.597SS.*Hα-helixtrans-61.3-39.9-17900000112.7T170 S171 H176 Q177T170-A174 PolarHBondContact O-N 3.24Å; T170-A174 VanDerWaalsContact O-N 3.12Å; S171-A174 PolarHBondContact O-N 3.5Å; A174-H176 PolarHBondContact O-N 3.47Å; A174-Q177 PolarHBondContact O-N 2.75Å
175H50.3Low59.7Low131 Ų131112.5 Ų112.561%0.60661%0.61SS**G310 helixtrans-65.2-21.9178.1-85.2-65.3000114.2M173 Q177M173-H175 VanDerWaalsContact C-N 3.34Å; M173-H175 PolarHBondContact O-N 3.49Å; H175-Q177 VanDerWaalsContact C-N 3.26Å; H175-Q177 PolarHBondContact O-N 3.49Å
176H50.6Low57.8Low95 Ų95112.5 Ų112.544%0.4462%0.622SS.*G310 helixtrans-71.7-15.7179-10281000114.1M173 A174M173-H176 WeakPolarHBondContact O-CB 3.39Å; M173-H176 PolarHBondContact O-N 2.98Å; A174-H176 PolarHBondContact O-N 3.47Å
177Q42.6Very low55.9Low178 Ų178113.7 Ų113.783%0.83263%0.631SS**G310 helixtrans-85.9-9.2-179.4-65.2-164.7-7.200114.2A174 H175 V179A174-Q177 PolarHBondContact O-N 2.75Å; H175-Q177 VanDerWaalsContact C-N 3.26Å; H175-Q177 PolarHBondContact O-N 3.49Å; Q177-V179 PolarHBondContact O-N 3.05Å; Q177-V179 VanDerWaalsContact O-N 3.14Å
178Q42.1Very low54.2Low163 Ų163114.8 Ų114.876%0.76264%0.64SS**  trans-90.440-176.2-147.9166.31.300113.3
179V46.3Very low52.5Low124 Ų124121.5 Ų121.575%0.75266%0.662SS**PPolyproline II helixtrans-72.7129.6172.5177.50000109.5Q177Q177-V179 PolarHBondContact O-N 3.05Å; Q177-V179 VanDerWaalsContact O-N 3.14Å
180L54.8Low51.3Low145 Ų145123.2 Ų123.276%0.75967%0.668SS**PPolyproline II helixtrans-62.8147.4179.8-8565.9000111.9
181P49.9Very low50.1Low119 Ų119124.1 Ų124.177%0.77368%0.676SS**PPolyproline II helixtrans-55.7138.4173.1-26.335.2000112.9H183P181-H183 PolarHBondContact O-N 3.41Å
182P53Low49.1Very low117 Ų117128.6 Ų128.676%0.7669%0.693SS**PPolyproline II helixtrans-64.6131.2-177.6-24.634.8000114.9
183H48.9Very low48.3Very low147 Ų147131.5 Ų131.568%0.68171%0.711SS**  trans36.3100.6151.1-54.8-60.6000119.9P181 W185P181-H183 PolarHBondContact O-N 3.41Å; H183-W185 AromaticContact CG-CD1 4Å; H183-W185 AromaticContact CG-NE1 3.78Å; H183-W185 AromaticContact ND1-CD1 3.81Å; H183-W185 AromaticContact ND1-NE1 3.71Å
184H46.1Very low48Very low182 Ų182132.6 Ų132.684%0.84373%0.725SS**  trans-89.10.4167.458.5-107.9000115.2A186 A187H184-A186 PolarHBondContact O-N 3.24Å; H184-A187 PolarHBondContact O-N 3.31Å
185W47.8Very low47.3Very low191 Ų191133.2 Ų133.272%0.72373%0.73SS**G310 helixtrans-70-13.3-174.169-95.8000114.7H183 A187H183-W185 AromaticContact CG-CD1 4Å; H183-W185 AromaticContact CG-NE1 3.78Å; H183-W185 AromaticContact ND1-CD1 3.81Å; H183-W185 AromaticContact ND1-NE1 3.71Å; W185-A187 VanDerWaalsContact C-N 3.32Å; W185-A187 PolarHBondContact O-N 2.91Å
186A47.1Very low46.7Very low68 Ų68137.2 Ų137.256%0.56275%0.746SS**G310 helixtrans-76.9-11.5-179.100000114.4H184 A188H184-A186 PolarHBondContact O-N 3.24Å; A186-A188 PolarHBondContact O-N 2.76Å
187A48.8Very low46Very low83 Ų83139.5 Ų139.569%0.68676%0.761SS**G310 helixtrans-73.69.8-174.200000115.4H184 W185H184-A187 PolarHBondContact O-N 3.31Å; W185-A187 VanDerWaalsContact C-N 3.32Å; W185-A187 PolarHBondContact O-N 2.91Å
188A48.1Very low45.6Very low77 Ų77138.1 Ų138.164%0.63676%0.755SS**G310 helixtrans-90.4-3.4-174.700000115.1A186A186-A188 PolarHBondContact O-N 2.76Å
189F47.6Very low45.3Very low183 Ų183138 Ų13880%0.80375%0.754SS**  trans-123.578.3-174.2-65.6-72.1000112.8P191F189-P191 WeakPolarHBondContact O-CD 3.11Å
190H48.3Very low44.5Very low178 Ų178137 Ų13782%0.82475%0.752SS**PPolyproline II helixtrans-76.6124163.2-78.5-85.5000110.4
191P47.3Very low43.3Very low116 Ų116133.7 Ų133.775%0.75375%0.753SS**PPolyproline II helixtrans-72.7133163.530.5-32.1000109.6F189F189-P191 WeakPolarHBondContact O-CD 3.11Å
192L43.8Very low42.6Very low158 Ų158136.2 Ų136.283%0.82776%0.759SS**PPolyproline II helixtrans-74.9129.2178.5-161.975.5000110.1T194L192-T194 PolarHBondContact O-N 2.85Å
193P42.5Very low42.3Very low117 Ų117135.9 Ų135.976%0.7676%0.757SS**PPolyproline II helixtrans-71.9121.4-178.428-33.7000111.4A195P193-A195 PolarHBondContact O-N 3.02Å
194T49.2Very low41.3Very low146 Ų146134.8 Ų134.890%0.89677%0.766SS**  trans-90.691.6178.7-57.80000110.6L192L192-T194 PolarHBondContact O-N 2.85Å
195A38.4Very low40.7Very low80 Ų80131.2 Ų131.266%0.66176%0.761SS**  trans-157.5104.5168.300000112.2P193P193-A195 PolarHBondContact O-N 3.02Å
196F36.8Very low39.9Very low215 Ų215129.2 Ų129.294%0.94377%0.765SS**  -165.8153.9106.2-119.8-92.3000110.8
197L37.3Very low39.2Very low143 Ų143130.9 Ų130.975%0.74977%0.773SS**  trans-99.1148.7-176.3-84.2165.7000111.5
198Q34.5Very low38.5Very low149 Ų149131.6 Ų131.670%0.69678%0.779SS**  53.4116.9128.8-169.4176.3-20.800117.5
199Q34.2Very low37.7Very low160 Ų160134.2 Ų134.275%0.74879%0.787SS**  175156.270.9-129169.3115.700104.8
200S31.1Very low36.8Very low103 Ų103130.5 Ų130.572%0.7278%0.784SS**  cis176.1167.241.9-88.90000108
201G27.8Very low35.9Very low75 Ų75132.7 Ų132.777%0.77379%0.785SS**  trans102.5116145.800000119.8
202L35.2Very low35.1Very low172 Ų172134.6 Ų134.690%0.90179%0.788SS**  trans-128.2170.4152.1-74.1173.9000105.9
203P46.8Very low34.3Very low111 Ų111132.3 Ų132.372%0.72179%0.785SS**  cis-141.2-160.314.843-22.8000115.4
204S29.3Very low33.8Very low124 Ų124133.6 Ų133.687%0.86779%0.79SS**  trans95159.2150.3-73.60000120.8
205S33.8Very low32.7Very low106 Ų106135.5 Ų135.574%0.74179%0.789SS**  trans-117.7146.7-163.3174.20000110.6
206D30.8Very low32.4Very low150 Ų150137.8 Ų137.880%0.80280%0.795SS**  -164.5-171.3116.3-138-37.3000112.6
207S32.7Very low32.7Very low103 Ų103132.3 Ų132.372%0.7278%0.781SS**  trans-112.1138.6-156.7-44.50000112.8
208A32.4Very low32.3Very low98 Ų98135 Ų13581%0.8179%0.789SS**  trans-178.8139138.200000114.2
209T31.5Very low32.2Very low131 Ų131139.7 Ų139.780%0.80480%0.801SS**  trans-35.4137168.249.10000118.7
210S30.1Very low32.1Very low106 Ų106135.5 Ų135.574%0.74180%0.8SS**  -176.2124.4108-84.60000117.3
211R29.5Very low32.3Very low224 Ų224136.4 Ų136.485%0.84581%0.807SS**  trans59.4139.5140.3-69.2-170.8-179.9-96.5-0.3123.5
212L29.8Very low32.6Very low156 Ų156137.8 Ų137.882%0.81781%0.811SS**  trans81.7104.2149-73.2162.6000120.2
213S27.6Very low32.6Very low110 Ų110137.1 Ų137.177%0.76981%0.807SS**  trans-24.6134.7156-40.30000118.4
214V30.6Very low32Very low144 Ų144140.2 Ų140.287%0.87382%0.817SS**  -139151.6114171.90000108.7
215E26Very low32.1Very low185 Ų185139.8 Ų139.886%0.86481%0.809SS**  trans-57.5133.8-175.9-179-165.414500116.9
216V32.7Very low32.1Very low129 Ų129138.9 Ų138.978%0.78281%0.808SS**  trans-160.2152.5167.4-1710000107.8
217P43.2Very low32.2Very low100 Ų100137.8 Ų137.865%0.64981%0.807SS**  cis-124.5-173.9-38.139.6-25.3000112.1
218Q29.3Very low32.2Very low199 Ų199142.3 Ų142.393%0.9381%0.814SS**  -137.8144.9128.8-75.9-155-3.200111.6
219R32.8Very low32.1Very low248 Ų248142.2 Ų142.294%0.93681%0.813SS**  trans-106.2137.5180-89-173.1171.4-172.8-0.9111.7
220G32.3Very low32.1Very low72 Ų72145 Ų14574%0.74282%0.817SS**  97.2101.9128.600000118.5
221S35Very low32.4Very low122 Ų122146.6 Ų146.685%0.85382%0.822SS**  trans-168.499.7134.4-840000110.1L223S221-L223 PolarHBondContact O-N 2.99Å
222A32.7Very low32.5Very low104 Ų104143 Ų14386%0.8682%0.819SS**  trans-8698.9175.200000110.1
223L36.6Very low32.5Very low157 Ų157140.7 Ų140.782%0.82282%0.816SS**  trans-87118.5168.2-76.1170.1000109.7S221 T225S221-L223 PolarHBondContact O-N 2.99Å; L223-T225 PolarHBondContact O-N 2.88Å
224L32.6Very low32.7Very low176 Ų176140.1 Ų140.192%0.92181%0.812SS**  trans-78.685.1173.8-68.6175.9000110.6A226L224-A226 PolarHBondContact O-N 3.04Å
225T32.7Very low32.8Very low115 Ų115141.6 Ų141.671%0.70681%0.81SS**  trans-77.1106.6168.1-61.50000109.7L223 T227L223-T225 PolarHBondContact O-N 2.88Å; T225-T227 HydrophobicContact CG2-CG2 4.49Å; T225-T227 PolarHBondContact O-N 2.64Å
226A32.5Very low33.1Very low88 Ų88143.9 Ų143.973%0.72781%0.81SS**  trans-79.5100.4172.100000110.7L224L224-A226 PolarHBondContact O-N 3.04Å
227T33.2Very low33.3Very low127 Ų127142 Ų14278%0.77981%0.808SS**  trans-84.3125.116929.60000110.8T225T225-T227 HydrophobicContact CG2-CG2 4.49Å; T225-T227 PolarHBondContact O-N 2.64Å
228F32.5Very low33.2Very low198 Ų198143.4 Ų143.487%0.86882%0.817SS**  trans-76.7122.6170.8-71.1-97.1000109.5H230F228-H230 PolarHBondContact O-N 3.24Å
229A31.8Very low33.5Very low95 Ų95139 Ų13979%0.78581%0.808SS**  trans-80.9110.9174.800000110.4
230H31.6Very low33.5Very low191 Ų191135.1 Ų135.188%0.88481%0.806SS**  trans-82.1122.2161.4-111.2-92000108.5F228F228-H230 PolarHBondContact O-N 3.24Å
231T34.9Very low33.5Very low138 Ų138135.2 Ų135.285%0.84781%0.807SS**  trans-94.694.5170.853.20000109.8
232D31.7Very low33.5Very low148 Ų148134.7 Ų134.779%0.79180%0.803SS**  trans-94.7145.4154.9-17843.1000108.7
233S30.3Very low33.5Very low108 Ų108136.7 Ų136.776%0.75580%0.804SS**  trans-150.2105.6-177.3-170.50000110.6
234S31.8Very low33.4Very low98 Ų98133.7 Ų133.769%0.68580%0.803SS**  trans-114.3106-166.4-176.90000112.8
235H32.3Very low34Very low176 Ų176131.4 Ų131.482%0.81580%0.798SS**  trans-150.2144.6170.5-71.4-28.7000108.6
236R32.3Very low34.1Very low233 Ų233131.6 Ų131.688%0.87980%0.803SS**  cis-165.6134.3-11.5167.6177.1177.4169-0.4107.7
237A36.3Very low34.3Very low88 Ų88134.3 Ų134.373%0.72781%0.81SS**  trans-88.5157.8175.300000113
238P42.3Very low34.9Very low131 Ų131133.4 Ų133.485%0.85181%0.806SS**  trans-125.8164.7139.837.5-28.7000112.2
239S34.3Very low35.4Very low105 Ų105129.9 Ų129.973%0.73480%0.803SS**  trans-138.8143.2-170.157.20000113.4
240N34.4Very low35.3Very low168 Ų168133.4 Ų133.490%0.89881%0.808SS**  trans167157.6141-88.1-3.7000109.9
241G32Very low35.5Very low73 Ų73129.4 Ų129.475%0.75380%0.801SS**  trans171.4-43.9163.500000121.8
242S35.3Very low35.5Very low112 Ų112129.8 Ų129.878%0.78380%0.804SS**  trans63.5156.8175.4-152.20000120.3
243V33.1Very low35.6Very low145 Ų145127.6 Ų127.688%0.87980%0.8SS**  trans60.3151.9166.5-72.90000122
244A33.9Very low36Very low95 Ų95130 Ų13079%0.78580%0.804SS**  trans-114.4-173.1-174.400000110.1
245P43.9Very low36.1Very low127 Ų127134.1 Ų134.183%0.82582%0.817SS**  cis-142.7-159.733.543.6-21.1000116.5
246C36Very low36.2Very low119 Ų119131 Ų13180%0.80482%0.815SS**  trans-72.5140.8-164.7-34.20000117
247V36.5Very low36.2Very low146 Ų146128 Ų12889%0.88582%0.816SS**  trans-168.4159.8135.6-97.50000110.7
248P46.1Very low36.2Very low107 Ų107129 Ų12970%0.69582%0.817SS**PPolyproline II helixtrans-103162-170.939.3-35.3000115.5
249P41.7Very low36Very low124 Ų124127 Ų12781%0.80581%0.812SS**PPolyproline II helixtrans-89159.6159.935.9-32000112.6
250L31.5Very low36.1Very low169 Ų169128.4 Ų128.489%0.88582%0.816SS**PPolyproline II helixtrans-83.8161.5-171.5-89.766.3000114.9
251S34.3Very low36.2Very low107 Ų107126.5 Ų126.575%0.74881%0.81SS**PPolyproline II helixtrans-59.2146.8172.9-40.90000114.7
252T35.1Very low36.2Very low146 Ų146130.8 Ų130.890%0.89681%0.81SS**  trans-130.994.4139.339.90000110
253S33.4Very low36Very low103 Ų103130.8 Ų130.872%0.7282%0.817SS**  trans-70.8145.1156.8-64.70000109.1
254L38.6Very low36.2Very low159 Ų159127.8 Ų127.883%0.83281%0.808SS**  168.9113.5117.7-89.7178.5000109.9
255L34.8Very low36.3Very low183 Ų183128.1 Ų128.196%0.95881%0.811SS**  trans17865.7138.4-97.6161.9000109.7
256S34.2Very low35.9Very low111 Ų111127.1 Ų127.178%0.77681%0.813SS**  trans-128.7113.2156.2-175.80000106.7
257L32.7Very low36.1Very low171 Ų171126.6 Ų126.690%0.89582%0.817SS**  trans-129.3128.8166.6-175.460.8000107.5
258S37Very low36.2Very low107 Ų107124 Ų12475%0.74881%0.811SS**  trans-75.9161.3-164.4-56.90000113.8
259A37.8Very low35.7Very low90 Ų90124.1 Ų124.174%0.74482%0.821SS**  trans-68.1176.9170.100000113.1
260T36Very low35.7Very low134 Ų134123 Ų12382%0.82282%0.822SS**  trans103.796.6158.1-39.90000116.7
261V35.3Very low36.3Very low128 Ų128122.8 Ų122.878%0.77682%0.817SS**  trans-146.3140.1138.5-114.50000110.6
262H33.3Very low36.3Very low163 Ų163124.6 Ų124.676%0.75582%0.823SS**  trans59.879.8166.4-62.2105.3000119.9
263A30.2Very low36.4Very low113 Ų113125.7 Ų125.793%0.93482%0.816SS**  trans-87.4102.7133.600000108.6
264A38Very low36.9Very low82 Ų82126.1 Ų126.168%0.67882%0.816SS**  trans-15522.3-176.100000116
265A36.3Very low36.7Very low102 Ų102126.7 Ų126.784%0.84382%0.819SS**SBendtrans-156.770.4-178.800000115.1
266A35.2Very low36.7Very low106 Ų106123 Ų12388%0.87681%0.808SS**  trans-17260.8162.200000112.8
267A40.7Very low36.9Very low108 Ų108127.5 Ų127.589%0.89382%0.815SS**  trans-12654178.700000112.2
268A38.2Very low37.7Very low92 Ų92125.1 Ų125.176%0.7681%0.809SS**  trans-153.6161.6175.800000111.1
269A36.1Very low37.5Very low108 Ų108123.9 Ų123.989%0.89381%0.813SS**  trans62.261.617200000117
270A40.4Very low37.1Very low100 Ų100123.4 Ų123.483%0.82682%0.817SS**  trans-134.238.616500000113.3
271Q45.1Very low37.2Very low166 Ų166126.6 Ų126.678%0.77682%0.82SS**  trans-145.4120.5165.6-70.5-164.112.200111.3
272T33.2Very low37.8Very low144 Ų144125.6 Ų125.688%0.88382%0.816SS**  trans-141.7135.7163.1-44.90000108.1
273F36.8Very low38Very low169 Ų169124.2 Ų124.274%0.74181%0.813SS**  trans-83.3155.1-169.1-74.4-98.5000113.6
274P45.6Very low38Very low113 Ų113128.4 Ų128.473%0.73481%0.81SS**  trans-76.2137.716333-32.9000110.7
275L34.5Very low38Very low171 Ų171130.4 Ų130.490%0.89581%0.814SS**  trans-136.2117.2165.5-73177.3000110
276S34.5Very low38.5Very low104 Ų104130.9 Ų130.973%0.72781%0.809SS**  trans-90.2151.4170.5-55.10000110.4
277F38.3Very low38.3Very low207 Ų207134.9 Ų134.991%0.90881%0.809SS**  trans178.4167.2130.9-91.3-48.8000110.3
278P49.9Very low38.1Very low120 Ų120134.7 Ų134.778%0.77980%0.801SS**  trans-127.4170.9-133.342.8-29.2000116.5
279G31.8Very low38Very low81 Ų81137.1 Ų137.184%0.83581%0.806SS**  trans128.7145.2149.100000116
280G30.6Very low37.7Very low80 Ų80137 Ų13783%0.82580%0.798SS**  trans110.995.6163.800000116.9
281F37.6Very low37.4Very low202 Ų202136.9 Ų136.989%0.88679%0.792SS**  trans-74.5165.8151.5-75.2-70.2000109.3
282P46.9Very low36.8Very low106 Ų106134.7 Ų134.769%0.68879%0.79SS**  cis-148.8168.331.844.1-24000120.1
283I38Very low36.8Very low134 Ų134132.3 Ų132.369%0.68779%0.785SS**  trans37.9120.2136.2-58.7167.4000118.9
284F31.1Very low36.5Very low201 Ų201128.5 Ų128.588%0.88278%0.779SS**  -165.2141.3110.1-103.1-68.6000112.5
285T36.8Very low36Very low124 Ų124130.6 Ų130.676%0.76178%0.781SS**  trans-102.1155.8163.449.90000109.4
286P46.3Very low36Very low113 Ų113129.3 Ų129.373%0.73478%0.78SS**  -150.3147.9109.334.9-17.3000117.6
287H31.3Very low35.9Very low190 Ų190128.8 Ų128.888%0.8878%0.782SS**  trans52.7137.1140.7-72.2-79.3000124.9
288S36.7Very low35.6Very low103 Ų103124.6 Ų124.672%0.7278%0.778SS**  trans-83.5152.3163.1163.60000111.9
289V36.2Very low34.7Very low144 Ų144122.9 Ų122.987%0.87377%0.774SS**  trans-129.5161.2147.1-73.30000109.7
290S31Very low34.8Very low104 Ų104125.7 Ų125.773%0.72778%0.775SS**  trans-123.2-177.9-175.1-168.30000110.6
291S32.9Very low35.1Very low98 Ų98127.1 Ų127.169%0.68577%0.771SS**  trans72.7158.2162-58.10000117
292T32.7Very low35.4Very low121 Ų121123.4 Ų123.474%0.74277%0.767SS**  cis-171.7146.2-33.8370000106.6
293A33Very low34.7Very low93 Ų93123.5 Ų123.577%0.76977%0.771SS**  trans63.4171.815400000115.2
294S32.1Very low34.7Very low89 Ų89125.3 Ų125.362%0.62278%0.78SS**  cis-161.8138.8-19.8-114.30000110.6
295M34.8Very low34.7Very low158 Ų158121 Ų12178%0.77878%0.775SS**  trans51.4164.3145.4-38-59.1172.700121.7
296V32.9Very low34.5Very low144 Ų144122.1 Ų122.187%0.87378%0.781SS**  trans58.6152157.9-62.20000119.7
297A32.4Very low33.8Very low93 Ų93122.9 Ų122.977%0.76978%0.784SS**  cis-161.5172.6-27.800000109.3
298S33.5Very low33.9Very low118 Ų118118.6 Ų118.683%0.82578%0.775SS**  trans-47.5150.4175.6-420000115.3
299A30.8Very low33.6Very low85 Ų85119.2 Ų119.270%0.70278%0.775SS**  164.9173.491.900000115
300V34.3Very low33.5Very low140 Ų140117.2 Ų117.285%0.84877%0.768SS**  trans78.7130.7158.3-152.60000118.4
301C35.4Very low33.6Very low109 Ų109121 Ų12174%0.73677%0.774SS**  trans-83.6-172.8171.9-49.90000111.8
302P44.8Very low33.6Very low124 Ų124124.2 Ų124.281%0.80578%0.778SS**  -134147.2116.736.5-29.6000113.9
303S32.7Very low33.6Very low109 Ų109123 Ų12376%0.76278%0.775SS**  trans-91.5146.3166-56.70000110.1
304I36.7Very low33.6Very low172 Ų172130.2 Ų130.288%0.88278%0.782SS**  trans-137.3142.5161.810.5174.2000109
305S31.2Very low33.8Very low111 Ų111133.3 Ų133.378%0.77679%0.792SS**  trans-135.2132.4-171.4-560000111.3
306T32.8Very low33.9Very low146 Ų146136.1 Ų136.190%0.89679%0.794SS**  trans-148.1128172.248.90000111.8
307T31.8Very low34Very low129 Ų129137 Ų13779%0.79179%0.788SS**  trans-86.2-175157.761.60000108.7
308S32.9Very low34.1Very low100 Ų100136.2 Ų136.270%0.69979%0.789SS**  cis-169.5161.610.27.80000107.3
309T31.6Very low34.3Very low117 Ų117136.2 Ų136.272%0.71879%0.789SS**  cis-172.3161.9-13.7-91.70000107.8
310S33.5Very low34.8Very low102 Ų102137.7 Ų137.771%0.71380%0.795SS**  trans63.5119.6161.562.20000121.7
311Q33.2Very low35.8Very low184 Ų184140.4 Ų140.486%0.8680%0.795SS**  165.1151122.5-92.21782.100108.2
312Q33.2Very low37.1Very low164 Ų164141 Ų14177%0.76680%0.798SS**  cis-179.5125-30173.9177.50.800104.8
313S32.3Very low37.5Very low97 Ų97145 Ų14568%0.67880%0.798SS**  trans50.1125.116565.20000121.4
314R33.8Very low38.9Very low244 Ų244150 Ų15092%0.92180%0.8SS**  -170.8146.8116.6-104.2171.3-171.4-171.22.8112
315D35.8Very low39.7Very low154 Ų154146.1 Ų146.182%0.82479%0.786SS**  trans-84.9141.7-175.4-46.8-97.7000112.9
316R35.3Very low40.6Very low217 Ų217153.7 Ų153.782%0.81980%0.798SS**  -175.5112.8128.8-106.9-175.4146.9155.8-1.2115
317E35.1Very low41.4Very low161 Ų161149.7 Ų149.775%0.75279%0.786SS**  5499.5110.7-161.8169.4-147.700119.7
318G34.5Very low42.3Very low77 Ų77149.6 Ų149.679%0.79479%0.785SS**  99.793.8124.100000120.9
319S39.3Very low43.2Very low119 Ų119153.3 Ų153.383%0.83279%0.792SS**  trans-165.771135.1-156.60000113.1K321S319-K321 PolarHBondContact O-N 3.25Å
320S39.7Very low44Very low116 Ų116153.8 Ų153.881%0.81179%0.794SS**  trans-83107.4169.551.60000110.5
321K56.6Low44.9Very low197 Ų197152.6 Ų152.686%0.85780%0.798SS**PPolyproline II helixtrans-63.9126.8170.8-65.8178.3-176.4175.40109.5S319S319-K321 PolarHBondContact O-N 3.25Å
322P61.7Low45.4Very low122 Ų122147.7 Ų147.779%0.79279%0.789SS**PPolyproline II helixtrans-74135.8-177.328.7-34000111.9R324P322-R324 PolarHBondContact O-N 2.91Å
323Y54.3Low45.9Very low206 Ų206153.7 Ų153.781%0.80881%0.813SS**PPolyproline II helixtrans-60.4126.2169.2171.5-95.5000110.5P325Y323-P325 HydrophobicContact CD1-CG 4.15Å; Y323-P325 HydrophobicContact CE1-CB 4.25Å; Y323-P325 HydrophobicContact CE1-CG 4Å; Y323-P325 WeakPolarHBondContact O-CD 3.29Å
324R62.1Low46.6Very low214 Ų214156.5 Ų156.581%0.80882%0.819SS**  trans-91115.5168.6-97.7-171.2174.2-111.15.7109.3P322P322-R324 PolarHBondContact O-N 2.91Å
325P54.2Low47.3Very low91 Ų91151.9 Ų151.959%0.59181%0.814SS**  trans-67.9141.8161.2-9.525.8000109.4Y323 G327Y323-P325 HydrophobicContact CD1-CG 4.15Å; Y323-P325 HydrophobicContact CE1-CB 4.25Å; Y323-P325 HydrophobicContact CE1-CG 4Å; Y323-P325 WeakPolarHBondContact O-CD 3.29Å; P325-G327 PolarHBondContact O-N 3.08Å
326W50Low47.9Very low270 Ų270151.8 Ų151.8100%1.02381%0.813SS**  trans-70.8111.8164.2-76.4-32.7000109.2
327G47.7Very low48.6Very low62 Ų62147.9 Ų147.964%0.63981%0.813SS**  trans-135.378.4-174.200000112.2P325 E329P325-G327 PolarHBondContact O-N 3.08Å; G327-E329 PolarHBondContact O-N 3.05Å
328T51Low49.5Very low128 Ų128147.1 Ų147.179%0.78582%0.817SS**  trans16.586.7153.4-46.80000117.4V330T328-V330 HydrophobicContact CG2-CG2 3.88Å; T328-V330 PolarHBondContact O-N 2.97Å
329E52.8Low50.5Low178 Ų178151.8 Ų151.883%0.83282%0.819SS**  trans-95.883.3165.955-160.6131.800111.2G327 G331G327-E329 PolarHBondContact O-N 3.05Å; E329-G331 VanDerWaalsContact C-N 3.35Å; E329-G331 PolarHBondContact O-N 3.21Å; E329-G331 VanDerWaalsContact O-N 3.07Å
330V48.7Very low51.3Low127 Ų127154.1 Ų154.177%0.7782%0.818SS**  trans-75.889168.1175.50000108.3T328 A332T328-V330 HydrophobicContact CG2-CG2 3.88Å; T328-V330 PolarHBondContact O-N 2.97Å; V330-A332 PolarHBondContact O-N 3.4Å
331G51.3Low52.2Low77 Ų77157.1 Ų157.179%0.79482%0.818SS**  trans-76.5111.3170.600000110.8E329E329-G331 VanDerWaalsContact C-N 3.35Å; E329-G331 PolarHBondContact O-N 3.21Å; E329-G331 VanDerWaalsContact O-N 3.07Å
332A45Very low51.8Low81 Ų81153.8 Ų153.867%0.66982%0.815SS**  trans-101.5113.8172.200000110.4V330V330-A332 PolarHBondContact O-N 3.4Å
333F42.8Very low50.9Low289 Ų289156.6 Ų156.6100%1.26882%0.817SS**  trans-155.70157.7-85.3-62.5000109.3

Retrieved 333 of 333 residues in 427.1 ms (Link to these results)