A0A096NST1_PAPAN Loading...

Cerebellar deration related protein 2 like

AlphaFold DB (A0A2K5ZTB6), UniProt , Accession A0A096NST1, Species PAPAN (Papio anubis, Olive baboon), Gene CDR2L, Length 465 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.2Very low44.1Very low244 Ų244156.7 Ų156.7100%1.20283%0.826SS**  0105.80-96.9-138.2-104.800109.9
2R40.9Very low44.3Very low249 Ų249151.8 Ų151.894%0.9482%0.824SS**  trans179.3105130.9-97.3175.7-163.7-155.65.5109.9
3R39.7Very low44.3Very low245 Ų245153.5 Ų153.593%0.92582%0.823SS**  trans45.1110.1150.8-76.2-179.6178156.8-0.9120.4
4A48.9Very low44.9Very low107 Ų107155.9 Ų155.988%0.88483%0.827SS**  trans-54.9136.9138.500000110.9
5A46.7Very low45.5Very low99 Ų99157.3 Ų157.382%0.81883%0.827SS**  trans-150.8124.716400000108.2
6G42.3Very low46.3Very low66 Ų66156.6 Ų156.668%0.6882%0.818SS**  trans83.281.3157.600000117.3E8G6-E8 PolarHBondContact O-N 3.07Å
7M47Very low47.2Very low170 Ų170154.5 Ų154.584%0.83782%0.816SS**  trans-65.6106.1134.4-91.6160.769.900105.4
8E43.9Very low48.1Very low148 Ų148158 Ų15869%0.69282%0.817SS**  trans-102.694.8160-71.7179.9156.600106.3G6 F10G6-E8 PolarHBondContact O-N 3.07Å; E8-F10 HydrophobicContact CB-CD2 3.61Å; E8-F10 HydrophobicContact CB-CE2 3.55Å; E8-F10 HydrophobicContact CG-CE2 4.03Å; E8-F10 PolarHBondContact O-N 2.86Å; E8-F10 WeakPolarHBondContact OE2-CE2 3.11Å
9D50.4Low48.8Very low140 Ų140158.3 Ų158.375%0.74981%0.807SS**  trans-58.986.6156-68-45.2000107.3S11D9-S11 PolarHBondContact O-N 3.02Å
10F41.2Very low50.4Low165 Ų165156.5 Ų156.572%0.72480%0.799SS**  trans-87.996.7160.5-81-77.4000106.9E8E8-F10 HydrophobicContact CB-CD2 3.61Å; E8-F10 HydrophobicContact CB-CE2 3.55Å; E8-F10 HydrophobicContact CG-CE2 4.03Å; E8-F10 PolarHBondContact O-N 2.86Å; E8-F10 WeakPolarHBondContact OE2-CE2 3.11Å
11S38.3Very low51.8Low91 Ų91156 Ų15664%0.63679%0.794SS**  trans21.3116.6141.6-42.50000113.9D9 E13D9-S11 PolarHBondContact O-N 3.02Å; S11-E13 PolarHBondContact O-N 3.38Å
12A46.4Very low53.6Low97 Ų97151 Ų15180%0.80277%0.768SS**  trans-51.797.2146.300000105.7E14A12-E14 PolarHBondContact O-N 2.76Å
13E43.6Very low55.8Low174 Ų174142.7 Ų142.781%0.81374%0.742SS**  trans-55104.7160.3-75.2-179.816300102.7S11 E15S11-E13 PolarHBondContact O-N 3.38Å; E13-E15 PolarHBondContact O-N 3.01Å
14E52.9Low58Low187 Ų187136 Ų13687%0.87472%0.724SS**  trans-53.898.9163.8-71178.4160.800104.2A12 E16A12-E14 PolarHBondContact O-N 2.76Å; E14-E16 PolarHBondContact O-N 2.97Å
15E53.8Low59.9Low177 Ų177135.3 Ų135.383%0.82770%0.702SS**  trans-46.7115.1174.4-88.7178.2149.200106.3E13E13-E15 PolarHBondContact O-N 3.01Å
16E58.8Low62Low147 Ų147136 Ų13669%0.68769%0.689SS**  trans-44.3126.9176-77.6178.7143.100108.2E14 W18E14-E16 PolarHBondContact O-N 2.97Å; E16-W18 VanDerWaalsContact C-N 3.34Å; E16-W18 PolarHBondContact O-N 3.43Å
17P60.6Low64.5Low121 Ų121137.5 Ų137.579%0.78668%0.681SS**  trans-62.796.9179-23.233.6000109.2Y19P17-Y19 PolarHBondContact O-N 3.39Å
18W63.5Low66.7Low217 Ų217135.2 Ų135.282%0.82267%0.672SS**SBendtrans-66.813.8-177.7-79.690.7000114.1E16E16-W18 VanDerWaalsContact C-N 3.34Å; E16-W18 PolarHBondContact O-N 3.43Å
19Y62Low69Low164 Ų164134.1 Ų134.164%0.64367%0.666SS**SBendtrans-140.7127175.3-77.5-85.3000109.7P17 Q21P17-Y19 PolarHBondContact O-N 3.39Å; Y19-Q21 PolarHBondContact O-N 2.79Å
20D80.9Confident71.2Confident121 Ų121131.9 Ų131.965%0.64765%0.654SS**  trans-58.7127.4166.3-75.5-38.5000108.3Q22 D23 L24D20-Q22 PolarHBondContact O-N 2.88Å; D20-D23 HydrophobicContact CB-CB 4.47Å; D20-D23 PolarHBondContact O-N 3.08Å; D20-L24 PolarHBondContact O-N 3.28Å
21Q80.8Confident73.8Confident147 Ų147126.9 Ų126.969%0.68764%0.643SS**Hα-helixtrans-56.8-29.7-173.6-175166.2-800112.7Y19 E25Y19-Q21 PolarHBondContact O-N 2.79Å; Q21-E25 VanDerWaalsContact O-CG 3.24Å; Q21-E25 WeakPolarHBondContact O-CG 3.36Å; Q21-E25 PolarHBondContact O-N 2.85Å; Q21-E25 VanDerWaalsContact O-N 3.12Å
22Q83.1Confident76.5Confident139 Ų139125.6 Ų125.665%0.6564%0.638SS**Hα-helixtrans-71.2-31.2176-73.6171-1.100113.6D20 Q26D20-Q22 PolarHBondContact O-N 2.88Å; Q22-Q26 VanDerWaalsContact O-CG 3.25Å; Q22-Q26 WeakPolarHBondContact O-CG 3.49Å; Q22-Q26 PolarHBondContact O-N 3.43Å; Q22-Q26 PolarHBondContact O-NE2 3Å
23D86.6Confident78.9Confident74 Ų74126.9 Ų126.940%0.39663%0.627SS.*Hα-helixtrans-76.7-39.5179.2-70.9-13.3000110.4D20 E25 Q26 D27D20-D23 HydrophobicContact CB-CB 4.47Å; D20-D23 PolarHBondContact O-N 3.08Å; D23-E25 VanDerWaalsContact C-N 3.3Å; D23-E25 PolarHBondContact O-N 2.81Å; D23-Q26 PolarHBondContact O-N 2.88Å; D23-D27 PolarHBondContact O-N 3.32Å
24L87.5Confident81.4Confident104 Ų104123.5 Ų123.555%0.54561%0.614SS.*Hα-helixtrans-61.1-40.9171.3-177.863.8000111.7D20 L28D20-L24 PolarHBondContact O-N 3.28Å; L24-L28 VanDerWaalsContact O-CB 3.29Å; L24-L28 WeakPolarHBondContact O-CB 3.17Å; L24-L28 PolarHBondContact O-N 3.16Å
25E88.4Confident83.5Confident93 Ų93116 Ų11644%0.43559%0.587SS.*Hα-helixtrans-63.1-42.6175-76.6170.3-17000111.6Q21 D23 L28 H29Q21-E25 VanDerWaalsContact O-CG 3.24Å; Q21-E25 WeakPolarHBondContact O-CG 3.36Å; Q21-E25 PolarHBondContact O-N 2.85Å; Q21-E25 VanDerWaalsContact O-N 3.12Å; D23-E25 VanDerWaalsContact C-N 3.3Å; D23-E25 PolarHBondContact O-N 2.81Å; E25-L28 PolarHBondContact O-N 3.26Å; E25-H29 PolarHBondContact O-N 2.99Å; E25-H29 PolarHBondContact O-ND1 3.49Å
26Q90Very high85.6Confident114 Ų114113.7 Ų113.753%0.53357%0.574SS.*Hα-helixtrans-64.8-46.1177.6-75.2164.86400112.6Q22 D23 L28 H29 L30Q22-Q26 VanDerWaalsContact O-CG 3.25Å; Q22-Q26 WeakPolarHBondContact O-CG 3.49Å; Q22-Q26 PolarHBondContact O-N 3.43Å; Q22-Q26 PolarHBondContact O-NE2 3Å; D23-Q26 PolarHBondContact O-N 2.88Å; Q26-L28 VanDerWaalsContact C-N 3.28Å; Q26-L28 PolarHBondContact O-N 2.89Å; Q26-H29 PolarHBondContact O-N 3.46Å; Q26-L30 PolarHBondContact O-N 2.97Å
27D93.9Very high87.4Confident98 Ų98110.7 Ų110.752%0.52457%0.566SS.*Hα-helixtrans-62.8-37.4177.2-79-15.9000111.6D23 L30 A31D23-D27 PolarHBondContact O-N 3.32Å; D27-L30 PolarHBondContact O-N 3.42Å; D27-A31 VanDerWaalsContact O-CB 3.32Å; D27-A31 WeakPolarHBondContact O-CB 2.84Å; D27-A31 PolarHBondContact O-N 3.28Å
28L93.4Very high89.2Confident122 Ų122110.6 Ų110.664%0.63956%0.558SS**Hα-helixtrans-65-42.5174.8-172.470.2000111.9L24 E25 Q26 A31 A32L24-L28 VanDerWaalsContact O-CB 3.29Å; L24-L28 WeakPolarHBondContact O-CB 3.17Å; L24-L28 PolarHBondContact O-N 3.16Å; E25-L28 PolarHBondContact O-N 3.26Å; Q26-L28 VanDerWaalsContact C-N 3.28Å; Q26-L28 PolarHBondContact O-N 2.89Å; L28-A31 PolarHBondContact O-N 3.37Å; L28-A32 WeakPolarHBondContact O-CB 3.43Å; L28-A32 PolarHBondContact O-N 2.91Å
29H93.9Very high90.8Very high124 Ų124105.3 Ų105.357%0.57455%0.545SS*.Hα-helixtrans-62.7-45.1174.6-77.190000111.2E25 Q26 A31 A32 E33E25-H29 PolarHBondContact O-N 2.99Å; E25-H29 PolarHBondContact O-ND1 3.49Å; Q26-H29 PolarHBondContact O-N 3.46Å; H29-A31 PolarHBondContact O-N 2.87Å; H29-A32 WeakPolarHBondContact O-CB 3.15Å; H29-A32 PolarHBondContact O-N 3.48Å; H29-E33 WeakPolarHBondContact O-CG 3.32Å; H29-E33 PolarHBondContact O-N 2.81Å
30L95.4Very high92.5Very high94 Ų94101.8 Ų101.849%0.49254%0.535SS..Hα-helixtrans-62.7-43.3178.2-176.565.6000111.9Q26 D27 A32 E33 L34Q26-L30 PolarHBondContact O-N 2.97Å; D27-L30 PolarHBondContact O-N 3.42Å; L30-A32 VanDerWaalsContact C-N 3.29Å; L30-A32 PolarHBondContact O-N 3.45Å; L30-E33 PolarHBondContact O-N 3.38Å; L30-L34 HydrophobicContact CG-CD1 4.37Å; L30-L34 WeakPolarHBondContact O-CG 3.47Å; L30-L34 PolarHBondContact O-N 2.91Å
31A96Very high93.3Very high60 Ų60103.6 Ų103.650%0.49653%0.533SS..Hα-helixtrans-61.6-38.9174.900000111.8D27 L28 H29 G35D27-A31 VanDerWaalsContact O-CB 3.32Å; D27-A31 WeakPolarHBondContact O-CB 2.84Å; D27-A31 PolarHBondContact O-N 3.28Å; L28-A31 PolarHBondContact O-N 3.37Å; H29-A31 PolarHBondContact O-N 2.87Å; A31-G35 PolarHBondContact O-N 3.19Å
32A95.6Very high94.1Very high63 Ų63100.4 Ų100.452%0.52152%0.52SS..Hα-helixtrans-67.3-40.9175.600000112.3L28 H29 L30 G35 K36L28-A32 WeakPolarHBondContact O-CB 3.43Å; L28-A32 PolarHBondContact O-N 2.91Å; H29-A32 WeakPolarHBondContact O-CB 3.15Å; H29-A32 PolarHBondContact O-N 3.48Å; L30-A32 VanDerWaalsContact C-N 3.29Å; L30-A32 PolarHBondContact O-N 3.45Å; A32-G35 PolarHBondContact O-N 3.17Å; A32-K36 WeakPolarHBondContact O-CB 3.46Å; A32-K36 PolarHBondContact O-N 2.91Å
33E95.8Very high94.8Very high125 Ų125100.4 Ų100.458%0.58452%0.518SS*.Hα-helixtrans-64.2-42.7175.6-73.7-176.9173.100112.1H29 L30 K36 T37H29-E33 WeakPolarHBondContact O-CG 3.32Å; H29-E33 PolarHBondContact O-N 2.81Å; L30-E33 PolarHBondContact O-N 3.38Å; E33-K36 PolarHBondContact O-N 2.67Å; E33-T37 PolarHBondContact O-N 3.02Å; E33-T37 PolarHBondContact O-OG1 3.39Å
34L96.9Very high95.4Very high102 Ų102103.3 Ų103.353%0.53453%0.529SS..Hα-helixtrans-65-44.3174-73172.1000111.4L30 K36 T37 L38L30-L34 HydrophobicContact CG-CD1 4.37Å; L30-L34 WeakPolarHBondContact O-CG 3.47Å; L30-L34 PolarHBondContact O-N 2.91Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 3.44Å; L34-T37 PolarHBondContact O-N 2.86Å; L34-L38 WeakPolarHBondContact O-CB 3.26Å; L34-L38 WeakPolarHBondContact O-CG 3.44Å; L34-L38 PolarHBondContact O-N 3.2Å
35G97.3Very high95.9Very high29 Ų29102.9 Ų102.930%0.29953%0.527SS..Hα-helixtrans-58.5-43.7175.100000112A31 A32 L38 L39A31-G35 PolarHBondContact O-N 3.19Å; A32-G35 PolarHBondContact O-N 3.17Å; G35-L38 PolarHBondContact O-N 2.97Å; G35-L39 WeakPolarHBondContact O-CB 3.43Å; G35-L39 VanDerWaalsContact O-CG 3.27Å; G35-L39 WeakPolarHBondContact O-CG 3.21Å; G35-L39 PolarHBondContact O-N 2.88Å
36K97.7Very high96.3Very high130 Ų130103.3 Ų103.357%0.56553%0.529SS*.Hα-helixtrans-61.2-47.6174.6-178.7-179.9171.7-173.80111.7A32 E33 L34 L38 L39 E40A32-K36 WeakPolarHBondContact O-CB 3.46Å; A32-K36 PolarHBondContact O-N 2.91Å; E33-K36 PolarHBondContact O-N 2.67Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 3.44Å; K36-L38 VanDerWaalsContact C-N 3.34Å; K36-L38 PolarHBondContact O-N 3.46Å; K36-L39 PolarHBondContact O-N 3.44Å; K36-E40 WeakPolarHBondContact CE-OE1 3.26Å; K36-E40 WeakPolarHBondContact CG-OE1 3.27Å; K36-E40 WeakPolarHBondContact O-CB 3.34Å; K36-E40 WeakPolarHBondContact O-CG 3.2Å; K36-E40 PolarHBondContact O-N 2.89Å
37T96.7Very high96.7Very high83 Ų8399.5 Ų99.551%0.50952%0.52SS..Hα-helixtrans-62.6-41.3179.2-53.20000111.7E33 L34 E40 R41E33-T37 PolarHBondContact O-N 3.02Å; E33-T37 PolarHBondContact O-OG1 3.39Å; L34-T37 PolarHBondContact O-N 2.86Å; T37-E40 PolarHBondContact O-N 3.37Å; T37-R41 WeakPolarHBondContact O-CB 3.49Å; T37-R41 PolarHBondContact O-N 3.49Å
38L98Very high96.9Very high119 Ų11997.5 Ų97.562%0.62351%0.514SS*.Hα-helixtrans-65.5-40.7176.2-73.5173.1000111.8L34 G35 K36 R41 N42L34-L38 WeakPolarHBondContact O-CB 3.26Å; L34-L38 WeakPolarHBondContact O-CG 3.44Å; L34-L38 PolarHBondContact O-N 3.2Å; G35-L38 PolarHBondContact O-N 2.97Å; K36-L38 VanDerWaalsContact C-N 3.34Å; K36-L38 PolarHBondContact O-N 3.46Å; L38-R41 PolarHBondContact O-N 2.83Å; L38-N42 VanDerWaalsContact O-CB 3.24Å; L38-N42 WeakPolarHBondContact O-CB 3.4Å; L38-N42 PolarHBondContact O-N 2.91Å
39L98Very high97.1Very high106 Ų10696.1 Ų96.156%0.55551%0.507SS*.Hα-helixtrans-65.7-40.7175-74.5171.1000112G35 K36 N42 K43G35-L39 WeakPolarHBondContact O-CB 3.43Å; G35-L39 VanDerWaalsContact O-CG 3.27Å; G35-L39 WeakPolarHBondContact O-CG 3.21Å; G35-L39 PolarHBondContact O-N 2.88Å; K36-L39 PolarHBondContact O-N 3.44Å; L39-N42 PolarHBondContact O-N 2.89Å; L39-K43 WeakPolarHBondContact O-CB 3.37Å; L39-K43 VanDerWaalsContact O-CG 3.29Å; L39-K43 WeakPolarHBondContact O-CG 3.49Å; L39-K43 PolarHBondContact O-N 2.94Å
40E97Very high97.3Very high90 Ų9096.6 Ų96.642%0.42151%0.509SS..Hα-helixtrans-61.9-48.8174.9-74.8170.6-179.400110.8K36 T37 N42 K43 E44K36-E40 WeakPolarHBondContact CE-OE1 3.26Å; K36-E40 WeakPolarHBondContact CG-OE1 3.27Å; K36-E40 WeakPolarHBondContact O-CB 3.34Å; K36-E40 WeakPolarHBondContact O-CG 3.2Å; K36-E40 PolarHBondContact O-N 2.89Å; T37-E40 PolarHBondContact O-N 3.37Å; E40-N42 VanDerWaalsContact C-N 3.31Å; E40-N42 PolarHBondContact O-N 3.44Å; E40-K43 PolarHBondContact O-N 3.44Å; E40-E44 WeakPolarHBondContact O-CG 3.35Å; E40-E44 PolarHBondContact O-N 2.86Å
41R97.4Very high97.4Very high160 Ų16098.5 Ų98.560%0.60452%0.516SS*.Hα-helixtrans-60.9-39.1175.2-172.4179.2-178.484.40.6112.4T37 L38 E44 L45T37-R41 WeakPolarHBondContact O-CB 3.49Å; T37-R41 PolarHBondContact O-N 3.49Å; L38-R41 PolarHBondContact O-N 2.83Å; R41-E44 PolarHBondContact O-N 2.9Å; R41-L45 HydrophobicContact CG-CD1 4.4Å; R41-L45 VanDerWaalsContact O-CG 3.27Å; R41-L45 WeakPolarHBondContact O-CG 3.44Å; R41-L45 PolarHBondContact O-N 3.31Å
42N97.6Very high97.5Very high80 Ų80101.7 Ų101.743%0.42852%0.522SS..Hα-helixtrans-66.1-43.5177.8-169-97000111.1L38 L39 E40 E44 L45 E46L38-N42 VanDerWaalsContact O-CB 3.24Å; L38-N42 WeakPolarHBondContact O-CB 3.4Å; L38-N42 PolarHBondContact O-N 2.91Å; L39-N42 PolarHBondContact O-N 2.89Å; E40-N42 VanDerWaalsContact C-N 3.31Å; E40-N42 PolarHBondContact O-N 3.44Å; N42-E44 PolarHBondContact O-N 3.29Å; N42-L45 PolarHBondContact O-N 3.49Å; N42-E46 WeakPolarHBondContact O-CG 3.24Å; N42-E46 PolarHBondContact O-N 3.46Å; N42-E46 PolarHBondContact OD1-OE1 3.03Å
43K97.9Very high97.6Very high138 Ų138105.5 Ų105.560%0.652%0.524SS*.Hα-helixtrans-61.6-40173.3-73.6173-177.5177.90112.9L39 E40 E46 G47L39-K43 WeakPolarHBondContact O-CB 3.37Å; L39-K43 VanDerWaalsContact O-CG 3.29Å; L39-K43 WeakPolarHBondContact O-CG 3.49Å; L39-K43 PolarHBondContact O-N 2.94Å; E40-K43 PolarHBondContact O-N 3.44Å; K43-E46 PolarHBondContact O-N 2.91Å; K43-G47 PolarHBondContact O-N 3.29Å
44E98Very high97.8Very high136 Ų136102.2 Ų102.264%0.63652%0.515SS*.Hα-helixtrans-63.2-42.8174.5-73.4174.3178.900111.5E40 R41 N42 G47 S48E40-E44 WeakPolarHBondContact O-CG 3.35Å; E40-E44 PolarHBondContact O-N 2.86Å; R41-E44 PolarHBondContact O-N 2.9Å; N42-E44 PolarHBondContact O-N 3.29Å; E44-G47 PolarHBondContact O-N 2.89Å; E44-S48 WeakPolarHBondContact O-CB 3.46Å; E44-S48 PolarHBondContact O-N 2.96Å; E44-S48 PolarHBondContact O-OG 3.29Å
45L98Very high97.8Very high94 Ų9499.6 Ų99.649%0.49250%0.503SS..Hα-helixtrans-64.1-45.3176.1-72171.9000111.4R41 N42 G47 S48 L49R41-L45 HydrophobicContact CG-CD1 4.4Å; R41-L45 VanDerWaalsContact O-CG 3.27Å; R41-L45 WeakPolarHBondContact O-CG 3.44Å; R41-L45 PolarHBondContact O-N 3.31Å; N42-L45 PolarHBondContact O-N 3.49Å; L45-G47 VanDerWaalsContact C-N 3.34Å; L45-G47 PolarHBondContact O-N 2.73Å; L45-S48 WeakPolarHBondContact CA-OG 3.34Å; L45-S48 PolarHBondContact O-N 3.46Å; L45-S48 PolarHBondContact O-OG 3.06Å; L45-L49 WeakPolarHBondContact O-CB 3.32Å; L45-L49 PolarHBondContact O-N 3.15Å
46E97.5Very high97.9Very high102 Ų102102.4 Ų102.448%0.47751%0.511SS..Hα-helixtrans-58.5-45.1174.1-72.9176.8162.200111.5N42 K43 L49 Q50N42-E46 WeakPolarHBondContact O-CG 3.24Å; N42-E46 PolarHBondContact O-N 3.46Å; N42-E46 PolarHBondContact OD1-OE1 3.03Å; K43-E46 PolarHBondContact O-N 2.91Å; E46-L49 PolarHBondContact O-N 3.38Å; E46-Q50 WeakPolarHBondContact O-CG 3.29Å; E46-Q50 PolarHBondContact O-N 3.26Å
47G98.3Very high97.9Very high34 Ų34101.9 Ų101.935%0.35151%0.511SS..Hα-helixtrans-62.1-43.4175.900000112.5K43 E44 L45 L49 Q50 Q51K43-G47 PolarHBondContact O-N 3.29Å; E44-G47 PolarHBondContact O-N 2.89Å; L45-G47 VanDerWaalsContact C-N 3.34Å; L45-G47 PolarHBondContact O-N 2.73Å; G47-L49 VanDerWaalsContact C-N 3.32Å; G47-L49 PolarHBondContact O-N 2.91Å; G47-Q50 PolarHBondContact O-N 3.34Å; G47-Q51 WeakPolarHBondContact O-CB 3.43Å; G47-Q51 PolarHBondContact O-N 3.27Å
48S97.9Very high98Very high57 Ų57103.4 Ų103.440%0.39951%0.512SS..Hα-helixtrans-64.7-36.8176.673.90000112.4E44 L45 Q51 M52E44-S48 WeakPolarHBondContact O-CB 3.46Å; E44-S48 PolarHBondContact O-N 2.96Å; E44-S48 PolarHBondContact O-OG 3.29Å; L45-S48 WeakPolarHBondContact CA-OG 3.34Å; L45-S48 PolarHBondContact O-N 3.46Å; L45-S48 PolarHBondContact O-OG 3.06Å; S48-Q51 PolarHBondContact O-N 2.99Å; S48-M52 WeakPolarHBondContact O-CG 3.5Å; S48-M52 PolarHBondContact O-N 2.67Å
49L98.1Very high98Very high92 Ų92102.9 Ų102.948%0.48251%0.506SS..Hα-helixtrans-69-43.7176.9-177.369000111.1L45 E46 G47 Q51 M52 Y53L45-L49 WeakPolarHBondContact O-CB 3.32Å; L45-L49 PolarHBondContact O-N 3.15Å; E46-L49 PolarHBondContact O-N 3.38Å; G47-L49 VanDerWaalsContact C-N 3.32Å; G47-L49 PolarHBondContact O-N 2.91Å; L49-Q51 VanDerWaalsContact C-N 3.32Å; L49-Q51 PolarHBondContact O-N 3.39Å; L49-M52 WeakPolarHBondContact O-CB 3.38Å; L49-M52 PolarHBondContact O-N 2.83Å; L49-Y53 HydrophobicContact CD1-CD2 4.34Å; L49-Y53 HydrophobicContact CD1-CE2 3.81Å; L49-Y53 HydrophobicContact CD2-CE2 3.84Å; L49-Y53 HydrophobicContact CG-CD2 3.9Å; L49-Y53 HydrophobicContact CG-CE2 3.5Å; L49-Y53 VanDerWaalsContact CG-CE2 3.5Å; L49-Y53 WeakPolarHBondContact O-CD2 3.37Å; L49-Y53 PolarHBondContact O-N 3.04Å
50Q98.1Very high98Very high134 Ų134100.8 Ų100.863%0.62650%0.498SS*.Hα-helixtrans-60.9-42.2174.3-74.1173.91.600111.7E46 G47 M52 Y53 S54E46-Q50 WeakPolarHBondContact O-CG 3.29Å; E46-Q50 PolarHBondContact O-N 3.26Å; G47-Q50 PolarHBondContact O-N 3.34Å; Q50-M52 VanDerWaalsContact C-N 3.35Å; Q50-Y53 PolarHBondContact O-N 3.13Å; Q50-S54 PolarHBondContact O-N 3.36Å
51Q98.3Very high98.1Very high135 Ų135102.4 Ų102.463%0.63151%0.505SS*.Hα-helixtrans-61.1-45.2174.4-173.2177.212.700111.1G47 S48 L49 Y53 S54 T55G47-Q51 WeakPolarHBondContact O-CB 3.43Å; G47-Q51 PolarHBondContact O-N 3.27Å; S48-Q51 PolarHBondContact O-N 2.99Å; L49-Q51 VanDerWaalsContact C-N 3.32Å; L49-Q51 PolarHBondContact O-N 3.39Å; Q51-Y53 PolarHBondContact O-N 3.13Å; Q51-S54 PolarHBondContact O-N 3Å; Q51-T55 WeakPolarHBondContact O-CG2 3.35Å; Q51-T55 PolarHBondContact O-N 3.02Å; Q51-T55 PolarHBondContact O-OG1 3.24Å
52M97.6Very high98.1Very high127 Ų127100.6 Ų100.663%0.62650%0.504SS*.Hα-helixtrans-58.3-44.9174.8-79.3-65.6-67.700112S48 L49 Q50 T55 N56S48-M52 WeakPolarHBondContact O-CG 3.5Å; S48-M52 PolarHBondContact O-N 2.67Å; L49-M52 WeakPolarHBondContact O-CB 3.38Å; L49-M52 PolarHBondContact O-N 2.83Å; Q50-M52 VanDerWaalsContact C-N 3.35Å; M52-T55 WeakPolarHBondContact CA-OG1 3.32Å; M52-T55 PolarHBondContact O-N 3.07Å; M52-T55 PolarHBondContact O-OG1 3.41Å; M52-N56 WeakPolarHBondContact O-CB 3.45Å; M52-N56 PolarHBondContact O-N 3.44Å
53Y98.3Very high98.2Very high143 Ų143101.8 Ų101.856%0.56151%0.509SS*.Hα-helixtrans-59.7-46.8175-77.9-58.5000112.2L49 Q50 Q51 T55 N56 E57L49-Y53 HydrophobicContact CD1-CD2 4.34Å; L49-Y53 HydrophobicContact CD1-CE2 3.81Å; L49-Y53 HydrophobicContact CD2-CE2 3.84Å; L49-Y53 HydrophobicContact CG-CD2 3.9Å; L49-Y53 HydrophobicContact CG-CE2 3.5Å; L49-Y53 VanDerWaalsContact CG-CE2 3.5Å; L49-Y53 WeakPolarHBondContact O-CD2 3.37Å; L49-Y53 PolarHBondContact O-N 3.04Å; Q50-Y53 PolarHBondContact O-N 3.13Å; Q51-Y53 PolarHBondContact O-N 3.13Å; Y53-T55 VanDerWaalsContact C-N 3.34Å; Y53-T55 PolarHBondContact O-N 3.27Å; Y53-N56 WeakPolarHBondContact O-CB 2.79Å; Y53-N56 PolarHBondContact O-N 2.91Å; Y53-N56 VanDerWaalsContact O-N 3.15Å; Y53-E57 WeakPolarHBondContact O-CG 3.37Å; Y53-E57 PolarHBondContact O-N 2.9Å
54S98.3Very high98.2Very high56 Ų5699.7 Ų99.739%0.39250%0.502SS..Hα-helixtrans-58.8-44.9176.8-171.50000111.8Q50 Q51 N56 E57 E58Q50-S54 PolarHBondContact O-N 3.36Å; Q51-S54 PolarHBondContact O-N 3Å; S54-N56 VanDerWaalsContact C-N 3.31Å; S54-N56 PolarHBondContact O-N 3.49Å; S54-E57 PolarHBondContact O-N 3.35Å; S54-E58 WeakPolarHBondContact O-CG 3.46Å; S54-E58 PolarHBondContact O-N 3.42Å; S54-E58 VanDerWaalsContact O-N 3.08Å
55T98.4Very high98.2Very high47 Ų4799.9 Ų99.929%0.28850%0.497SS..Hα-helixtrans-66.8-34.1177.858.50000112.4Q51 M52 Y53 E58 Q59Q51-T55 WeakPolarHBondContact O-CG2 3.35Å; Q51-T55 PolarHBondContact O-N 3.02Å; Q51-T55 PolarHBondContact O-OG1 3.24Å; M52-T55 WeakPolarHBondContact CA-OG1 3.32Å; M52-T55 PolarHBondContact O-N 3.07Å; M52-T55 PolarHBondContact O-OG1 3.41Å; Y53-T55 VanDerWaalsContact C-N 3.34Å; Y53-T55 PolarHBondContact O-N 3.27Å; T55-E58 PolarHBondContact O-N 3.11Å; T55-Q59 VanDerWaalsContact O-CG 3.26Å; T55-Q59 WeakPolarHBondContact O-CG 3.5Å; T55-Q59 PolarHBondContact O-N 3.39Å
56N98.4Very high98.3Very high88 Ų8899.1 Ų99.147%0.47149%0.493SS..Hα-helixtrans-67.7-42.3176.6-171.4-97.8000111.1M52 Y53 S54 E58 Q59 V60M52-N56 WeakPolarHBondContact O-CB 3.45Å; M52-N56 PolarHBondContact O-N 3.44Å; Y53-N56 WeakPolarHBondContact O-CB 2.79Å; Y53-N56 PolarHBondContact O-N 2.91Å; Y53-N56 VanDerWaalsContact O-N 3.15Å; S54-N56 VanDerWaalsContact C-N 3.31Å; S54-N56 PolarHBondContact O-N 3.49Å; N56-E58 PolarHBondContact O-N 2.75Å; N56-Q59 WeakPolarHBondContact O-CB 3.37Å; N56-Q59 PolarHBondContact O-N 3.26Å; N56-V60 WeakPolarHBondContact O-CG2 3.29Å; N56-V60 PolarHBondContact O-N 2.71Å
57E98.4Very high98.3Very high119 Ų11997.3 Ų97.356%0.55649%0.489SS*.Hα-helixtrans-60.3-43.5174.7-72.4176.4-176.500112Y53 S54 Q59 V60 Q61Y53-E57 WeakPolarHBondContact O-CG 3.37Å; Y53-E57 PolarHBondContact O-N 2.9Å; S54-E57 PolarHBondContact O-N 3.35Å; E57-Q59 PolarHBondContact O-N 3.12Å; E57-V60 PolarHBondContact O-N 2.79Å; E57-Q61 WeakPolarHBondContact O-CG 3.37Å; E57-Q61 PolarHBondContact O-N 3.15Å
58E98.1Very high98.3Very high114 Ų114101.7 Ų101.753%0.53350%0.499SS..Hα-helixtrans-61-43.6175-71.8171.5-172.300111.9S54 T55 N56 V60 Q61 E62S54-E58 WeakPolarHBondContact O-CG 3.46Å; S54-E58 PolarHBondContact O-N 3.42Å; S54-E58 VanDerWaalsContact O-N 3.08Å; T55-E58 PolarHBondContact O-N 3.11Å; N56-E58 PolarHBondContact O-N 2.75Å; E58-V60 PolarHBondContact O-N 3.23Å; E58-Q61 PolarHBondContact O-N 3.3Å; E58-E62 PolarHBondContact O-N 3.44Å
59Q98.4Very high98.3Very high108 Ų108102.7 Ų102.751%0.50550%0.497SS..Hα-helixtrans-63.1-40.5176.6-74.5173.6-11.100112.2T55 N56 E57 Q61 E62 I63T55-Q59 VanDerWaalsContact O-CG 3.26Å; T55-Q59 WeakPolarHBondContact O-CG 3.5Å; T55-Q59 PolarHBondContact O-N 3.39Å; N56-Q59 WeakPolarHBondContact O-CB 3.37Å; N56-Q59 PolarHBondContact O-N 3.26Å; E57-Q59 PolarHBondContact O-N 3.12Å; Q59-Q61 VanDerWaalsContact C-N 3.34Å; Q59-E62 PolarHBondContact O-N 3.49Å; Q59-I63 VanDerWaalsContact O-CG1 3.28Å; Q59-I63 WeakPolarHBondContact O-CG1 3.41Å; Q59-I63 PolarHBondContact O-N 3.47Å
60V98.5Very high98.3Very high63 Ų63102.9 Ų102.938%0.38250%0.498SS..Hα-helixtrans-61.8-44.5175.51710000110.3N56 E57 E58 E62 I63 E64N56-V60 WeakPolarHBondContact O-CG2 3.29Å; N56-V60 PolarHBondContact O-N 2.71Å; E57-V60 PolarHBondContact O-N 2.79Å; E58-V60 PolarHBondContact O-N 3.23Å; V60-E62 VanDerWaalsContact C-N 3.32Å; V60-E62 PolarHBondContact O-N 2.76Å; V60-I63 PolarHBondContact O-N 2.82Å; V60-E64 WeakPolarHBondContact O-CG 3.18Å; V60-E64 PolarHBondContact O-N 3.17Å
61Q98.3Very high98.4Very high123 Ų123100 Ų10058%0.57549%0.487SS*.Hα-helixtrans-62.7-37.9176.7-68.4171.121.500112.5E57 E58 Q59 E64 Y65E57-Q61 WeakPolarHBondContact O-CG 3.37Å; E57-Q61 PolarHBondContact O-N 3.15Å; E58-Q61 PolarHBondContact O-N 3.3Å; Q59-Q61 VanDerWaalsContact C-N 3.34Å; Q61-E64 PolarHBondContact O-N 2.95Å; Q61-Y65 WeakPolarHBondContact O-CB 3.33Å; Q61-Y65 PolarHBondContact O-N 3.07Å
62E98.4Very high98.3Very high122 Ų12297.7 Ų97.757%0.5748%0.482SS*.Hα-helixtrans-64.7-45174.5-176.2175-170.400111.6E58 Q59 V60 E64 Y65 L66E58-E62 PolarHBondContact O-N 3.44Å; Q59-E62 PolarHBondContact O-N 3.49Å; V60-E62 VanDerWaalsContact C-N 3.32Å; V60-E62 PolarHBondContact O-N 2.76Å; E62-E64 VanDerWaalsContact C-N 3.32Å; E62-E64 PolarHBondContact O-N 2.91Å; E62-Y65 PolarHBondContact O-N 3.45Å; E62-L66 HydrophobicContact CG-CD1 4.06Å; E62-L66 HydrophobicContact CG-CG 4.39Å; E62-L66 WeakPolarHBondContact O-CB 3.37Å; E62-L66 WeakPolarHBondContact O-CG 3.45Å; E62-L66 PolarHBondContact O-N 3.37Å
63I98.2Very high98.4Very high105 Ų10597 Ų9754%0.53848%0.48SS..Hα-helixtrans-59.3-44.9176.3-69.3165.4000110.4Q59 V60 Y65 L66 T67Q59-I63 VanDerWaalsContact O-CG1 3.28Å; Q59-I63 WeakPolarHBondContact O-CG1 3.41Å; Q59-I63 PolarHBondContact O-N 3.47Å; V60-I63 PolarHBondContact O-N 2.82Å; I63-Y65 VanDerWaalsContact C-N 3.34Å; I63-Y65 PolarHBondContact O-N 3.14Å; I63-L66 PolarHBondContact O-N 3.37Å; I63-T67 WeakPolarHBondContact O-CB 3.41Å; I63-T67 PolarHBondContact O-N 2.97Å; I63-T67 PolarHBondContact O-OG1 3.42Å
64E98.5Very high98.4Very high95 Ų9597 Ų9744%0.44448%0.479SS..Hα-helixtrans-61.7-41.8176.7-73.7178.6-165.200112.3V60 Q61 E62 T67 K68V60-E64 WeakPolarHBondContact O-CG 3.18Å; V60-E64 PolarHBondContact O-N 3.17Å; Q61-E64 PolarHBondContact O-N 2.95Å; E62-E64 VanDerWaalsContact C-N 3.32Å; E62-E64 PolarHBondContact O-N 2.91Å; E64-T67 PolarHBondContact O-N 3.44Å; E64-K68 VanDerWaalsContact O-CG 3.3Å; E64-K68 WeakPolarHBondContact O-CG 3.49Å; E64-K68 PolarHBondContact O-N 2.98Å; E64-K68 IonicContact OE2-NZ 2.84Å
65Y98.6Very high98.4Very high140 Ų14099.2 Ų99.255%0.54948%0.483SS..Hα-helixtrans-64.5-46.8177.7177.1-101.3000111.7Q61 E62 I63 T67 K68 Q69Q61-Y65 WeakPolarHBondContact O-CB 3.33Å; Q61-Y65 PolarHBondContact O-N 3.07Å; E62-Y65 PolarHBondContact O-N 3.45Å; I63-Y65 VanDerWaalsContact C-N 3.34Å; I63-Y65 PolarHBondContact O-N 3.14Å; Y65-T67 VanDerWaalsContact C-N 3.29Å; Y65-T67 PolarHBondContact O-N 3.17Å; Y65-K68 PolarHBondContact O-N 2.87Å; Y65-Q69 HydrophobicContact CD1-CG 4.4Å; Y65-Q69 HydrophobicContact CE1-CG 4.01Å; Y65-Q69 WeakPolarHBondContact O-CG 3.38Å; Y65-Q69 PolarHBondContact O-N 3.4Å; Y65-Q69 PolarHBondContact OH-NE2 2.97Å
66L98.7Very high98.4Very high77 Ų77100.2 Ų100.240%0.40349%0.489SS..Hα-helixtrans-63-37.6176.5-69.2174.9000111.6E62 I63 Q69 L70E62-L66 HydrophobicContact CG-CD1 4.06Å; E62-L66 HydrophobicContact CG-CG 4.39Å; E62-L66 WeakPolarHBondContact O-CB 3.37Å; E62-L66 WeakPolarHBondContact O-CG 3.45Å; E62-L66 PolarHBondContact O-N 3.37Å; I63-L66 PolarHBondContact O-N 3.37Å; L66-Q69 WeakPolarHBondContact O-CB 3.41Å; L66-Q69 PolarHBondContact O-N 3.13Å; L66-L70 WeakPolarHBondContact O-CG 3.36Å; L66-L70 PolarHBondContact O-N 3.18Å
67T98.4Very high98.4Very high64 Ų64101.3 Ų101.339%0.39350%0.495SS..Hα-helixtrans-62.7-48.3175.6-56.40000110.6I63 E64 Y65 Q69 L70 D71I63-T67 WeakPolarHBondContact O-CB 3.41Å; I63-T67 PolarHBondContact O-N 2.97Å; I63-T67 PolarHBondContact O-OG1 3.42Å; E64-T67 PolarHBondContact O-N 3.44Å; Y65-T67 VanDerWaalsContact C-N 3.29Å; Y65-T67 PolarHBondContact O-N 3.17Å; T67-Q69 VanDerWaalsContact C-N 3.29Å; T67-Q69 PolarHBondContact O-N 3.46Å; T67-L70 WeakPolarHBondContact O-CB 3.33Å; T67-L70 PolarHBondContact O-N 3.46Å; T67-D71 PolarHBondContact O-N 2.94Å
68K98.5Very high98.4Very high126 Ų126100 Ų10055%0.54849%0.489SS..Hα-helixtrans-58-41174.6-70.9164.6-174.31610111.9E64 Y65 D71 T72E64-K68 VanDerWaalsContact O-CG 3.3Å; E64-K68 WeakPolarHBondContact O-CG 3.49Å; E64-K68 PolarHBondContact O-N 2.98Å; E64-K68 IonicContact OE2-NZ 2.84Å; Y65-K68 PolarHBondContact O-N 2.87Å; K68-D71 PolarHBondContact O-N 3.44Å; K68-T72 WeakPolarHBondContact O-CG2 3.42Å; K68-T72 PolarHBondContact O-N 2.86Å; K68-T72 VanDerWaalsContact O-N 3.08Å
69Q98.5Very high98.4Very high78 Ų7898.1 Ų98.136%0.36448%0.48SS..Hα-helixtrans-62.6-44174.4-72.3-170.6-32.300111.8Y65 L66 T67 D71 T72 L73Y65-Q69 HydrophobicContact CD1-CG 4.4Å; Y65-Q69 HydrophobicContact CE1-CG 4.01Å; Y65-Q69 WeakPolarHBondContact O-CG 3.38Å; Y65-Q69 PolarHBondContact O-N 3.4Å; Y65-Q69 PolarHBondContact OH-NE2 2.97Å; L66-Q69 WeakPolarHBondContact O-CB 3.41Å; L66-Q69 PolarHBondContact O-N 3.13Å; T67-Q69 VanDerWaalsContact C-N 3.29Å; T67-Q69 PolarHBondContact O-N 3.46Å; Q69-D71 PolarHBondContact O-N 2.96Å; Q69-T72 PolarHBondContact O-N 3.41Å; Q69-T72 PolarHBondContact O-OG1 3.08Å; Q69-L73 WeakPolarHBondContact O-CG 3.49Å; Q69-L73 PolarHBondContact O-N 3.44Å
70L98.5Very high98.4Very high97 Ų9797.5 Ų97.551%0.50848%0.477SS..Hα-helixtrans-61.8-41.2176.4-73.6173.1000112.2L66 T67 T72 L73 R74L66-L70 WeakPolarHBondContact O-CG 3.36Å; L66-L70 PolarHBondContact O-N 3.18Å; T67-L70 WeakPolarHBondContact O-CB 3.33Å; T67-L70 PolarHBondContact O-N 3.46Å; L70-T72 PolarHBondContact O-N 3.04Å; L70-L73 WeakPolarHBondContact O-CB 3.24Å; L70-L73 PolarHBondContact O-N 3.15Å; L70-L73 VanDerWaalsContact O-N 3.17Å; L70-R74 WeakPolarHBondContact O-CG 3.32Å; L70-R74 PolarHBondContact O-N 3.13Å
71D98.3Very high98.4Very high72 Ų7296.5 Ų96.539%0.38548%0.476SS..Hα-helixtrans-66-38.8178.2-64.6-29.4000112.1T67 K68 Q69 L73 R74 H75T67-D71 PolarHBondContact O-N 2.94Å; K68-D71 PolarHBondContact O-N 3.44Å; Q69-D71 PolarHBondContact O-N 2.96Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 3.37Å; D71-R74 WeakPolarHBondContact O-CB 3.43Å; D71-R74 PolarHBondContact O-N 3.27Å; D71-R74 IonicContact OD1-CZ 3.88Å; D71-R74 IonicContact OD1-NH1 3.88Å; D71-R74 PolarHBondContact OD1-NH1 3.3Å; D71-H75 PolarHBondContact O-N 3.31Å
72T97.9Very high98.4Very high87 Ų8795.9 Ų95.953%0.53447%0.471SS..Hα-helixtrans-63.9-38172.462.10000112.1K68 Q69 L70 H75 V76K68-T72 WeakPolarHBondContact O-CG2 3.42Å; K68-T72 PolarHBondContact O-N 2.86Å; K68-T72 VanDerWaalsContact O-N 3.08Å; Q69-T72 PolarHBondContact O-N 3.41Å; Q69-T72 PolarHBondContact O-OG1 3.08Å; L70-T72 PolarHBondContact O-N 3.04Å; T72-H75 PolarHBondContact O-N 3.34Å; T72-V76 WeakPolarHBondContact O-CG2 3.27Å; T72-V76 PolarHBondContact O-N 3.34Å
73L98.4Very high98.4Very high112 Ų11294.5 Ų94.559%0.58647%0.471SS*.Hα-helixtrans-67.4-38.9175.3-72.4173.6000112.1Q69 L70 D71 V76 N77Q69-L73 WeakPolarHBondContact O-CG 3.49Å; Q69-L73 PolarHBondContact O-N 3.44Å; L70-L73 WeakPolarHBondContact O-CB 3.24Å; L70-L73 PolarHBondContact O-N 3.15Å; L70-L73 VanDerWaalsContact O-N 3.17Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 3.37Å; L73-V76 PolarHBondContact O-N 3.29Å; L73-N77 WeakPolarHBondContact O-CB 3.34Å; L73-N77 PolarHBondContact O-N 2.82Å
74R98.6Very high98.4Very high143 Ų14396.7 Ų96.754%0.5447%0.473SS..Hα-helixtrans-59.7-48.5172.4-73.6169.1175.3169.7-12.2110.7L70 D71 V76 N77 E78L70-R74 WeakPolarHBondContact O-CG 3.32Å; L70-R74 PolarHBondContact O-N 3.13Å; D71-R74 WeakPolarHBondContact O-CB 3.43Å; D71-R74 PolarHBondContact O-N 3.27Å; D71-R74 IonicContact OD1-CZ 3.88Å; D71-R74 IonicContact OD1-NH1 3.88Å; D71-R74 PolarHBondContact OD1-NH1 3.3Å; R74-V76 PolarHBondContact O-N 3.33Å; R74-N77 WeakPolarHBondContact O-CB 3.44Å; R74-N77 PolarHBondContact O-N 2.95Å; R74-N77 VanDerWaalsContact O-N 3.13Å; R74-E78 WeakPolarHBondContact O-CG 3.39Å; R74-E78 PolarHBondContact O-N 2.86Å
75H98.3Very high98.4Very high103 Ų10398 Ų9848%0.47748%0.479SS..Hα-helixtrans-59.1-46.1177.4-170.870.2000112.2D71 T72 N77 E78 Q79D71-H75 PolarHBondContact O-N 3.31Å; T72-H75 PolarHBondContact O-N 3.34Å; H75-N77 VanDerWaalsContact C-N 3.31Å; H75-N77 PolarHBondContact O-N 2.98Å; H75-E78 WeakPolarHBondContact O-CB 3.34Å; H75-E78 PolarHBondContact O-N 3.47Å; H75-Q79 PolarHBondContact CE1-NE2 2.92Å; H75-Q79 PolarHBondContact NE2-NE2 2.97Å; H75-Q79 WeakPolarHBondContact O-CG 3.49Å; H75-Q79 PolarHBondContact O-N 2.92Å
76V98.4Very high98.4Very high68 Ų6896.8 Ų96.841%0.41248%0.479SS..Hα-helixtrans-60.8-42176.4169.70000111.2T72 L73 R74 Q79 H80T72-V76 WeakPolarHBondContact O-CG2 3.27Å; T72-V76 PolarHBondContact O-N 3.34Å; L73-V76 PolarHBondContact O-N 3.29Å; R74-V76 PolarHBondContact O-N 3.33Å; V76-Q79 PolarHBondContact O-N 3.4Å; V76-H80 WeakPolarHBondContact CG1-NE2 3.47Å; V76-H80 PolarHBondContact O-CD2 3.41Å; V76-H80 VanDerWaalsContact O-CG 3.28Å; V76-H80 PolarHBondContact O-N 3.42Å
77N98.1Very high98.4Very high112 Ų11298 Ų9860%0.59949%0.485SS*.Hα-helixtrans-64.4-39.7177.7-16941.9000112.3L73 R74 H75 H80 A81L73-N77 WeakPolarHBondContact O-CB 3.34Å; L73-N77 PolarHBondContact O-N 2.82Å; R74-N77 WeakPolarHBondContact O-CB 3.44Å; R74-N77 PolarHBondContact O-N 2.95Å; R74-N77 VanDerWaalsContact O-N 3.13Å; H75-N77 VanDerWaalsContact C-N 3.31Å; H75-N77 PolarHBondContact O-N 2.98Å; N77-H80 WeakPolarHBondContact O-CB 3.37Å; N77-H80 PolarHBondContact O-N 3.39Å; N77-A81 PolarHBondContact O-N 2.86Å
78E98.3Very high98.4Very high92 Ų9298.5 Ų98.543%0.4349%0.485SS..Hα-helixtrans-62.7-41.2172.5-71.7167-159.800112.2R74 H75 H80 A81 K82R74-E78 WeakPolarHBondContact O-CG 3.39Å; R74-E78 PolarHBondContact O-N 2.86Å; H75-E78 WeakPolarHBondContact O-CB 3.34Å; H75-E78 PolarHBondContact O-N 3.47Å; E78-H80 VanDerWaalsContact C-N 3.34Å; E78-A81 PolarHBondContact O-N 3.19Å; E78-K82 WeakPolarHBondContact O-CG 3.36Å; E78-K82 PolarHBondContact O-N 2.94Å
79Q98.3Very high98.4Very high73 Ų7396.1 Ų96.134%0.34148%0.478SS..Hα-helixtrans-64.2-40.9174.3-62.7-53.8-29.200111.3H75 V76 A81 K82 V83H75-Q79 PolarHBondContact CE1-NE2 2.92Å; H75-Q79 PolarHBondContact NE2-NE2 2.97Å; H75-Q79 WeakPolarHBondContact O-CG 3.49Å; H75-Q79 PolarHBondContact O-N 2.92Å; V76-Q79 PolarHBondContact O-N 3.4Å; Q79-A81 VanDerWaalsContact C-N 3.35Å; Q79-A81 PolarHBondContact O-N 3.2Å; Q79-K82 PolarHBondContact O-N 3.39Å; Q79-V83 WeakPolarHBondContact O-CG2 3.37Å; Q79-V83 PolarHBondContact O-N 3.41Å
80H98.4Very high98.3Very high95 Ų9595.1 Ų95.144%0.4448%0.478SS..Hα-helixtrans-60.4-44.5174.5-69.1178.6000111.4V76 N77 E78 K82 V83 Y84V76-H80 WeakPolarHBondContact CG1-NE2 3.47Å; V76-H80 PolarHBondContact O-CD2 3.41Å; V76-H80 VanDerWaalsContact O-CG 3.28Å; V76-H80 PolarHBondContact O-N 3.42Å; N77-H80 WeakPolarHBondContact O-CB 3.37Å; N77-H80 PolarHBondContact O-N 3.39Å; E78-H80 VanDerWaalsContact C-N 3.34Å; H80-K82 PolarHBondContact O-N 2.85Å; H80-V83 PolarHBondContact O-N 2.95Å; H80-Y84 HydrophobicContact CB-CD2 4.48Å; H80-Y84 HydrophobicContact CB-CE2 4.13Å; H80-Y84 WeakPolarHBondContact O-CD2 3.41Å; H80-Y84 PolarHBondContact O-N 3.45Å
81A98.3Very high98.3Very high43 Ų4392.4 Ų92.436%0.35547%0.469SS..Hα-helixtrans-57.3-47.8175.800000111.8N77 E78 Q79 V83 Y84 E85N77-A81 PolarHBondContact O-N 2.86Å; E78-A81 PolarHBondContact O-N 3.19Å; Q79-A81 VanDerWaalsContact C-N 3.35Å; Q79-A81 PolarHBondContact O-N 3.2Å; A81-V83 VanDerWaalsContact C-N 3.34Å; A81-V83 PolarHBondContact O-N 3.17Å; A81-Y84 PolarHBondContact O-N 2.84Å; A81-E85 WeakPolarHBondContact O-CG 3.4Å; A81-E85 PolarHBondContact O-N 2.94Å
82K98.4Very high98.3Very high110 Ų11095.3 Ų95.348%0.47848%0.475SS..Hα-helixtrans-60.1-40.7176.4-70170.4-176170.40112.9E78 Q79 H80 E85 Q86E78-K82 WeakPolarHBondContact O-CG 3.36Å; E78-K82 PolarHBondContact O-N 2.94Å; Q79-K82 PolarHBondContact O-N 3.39Å; H80-K82 PolarHBondContact O-N 2.85Å; K82-E85 PolarHBondContact O-N 3.41Å; K82-Q86 WeakPolarHBondContact O-CB 3.31Å; K82-Q86 PolarHBondContact O-N 3.1Å
83V98.6Very high98.3Very high92 Ų9295.8 Ų95.856%0.55847%0.474SS*.Hα-helixtrans-67.1-39.4177.4170.80000111.1Q79 H80 A81 Q86 L87Q79-V83 WeakPolarHBondContact O-CG2 3.37Å; Q79-V83 PolarHBondContact O-N 3.41Å; H80-V83 PolarHBondContact O-N 2.95Å; A81-V83 VanDerWaalsContact C-N 3.34Å; A81-V83 PolarHBondContact O-N 3.17Å; V83-Q86 PolarHBondContact O-N 3.05Å; V83-L87 WeakPolarHBondContact O-CB 3.46Å; V83-L87 PolarHBondContact O-N 2.9Å
84Y98.6Very high98.3Very high151 Ų15196.1 Ų96.159%0.59248%0.475SS*.Hα-helixtrans-65-44.6175-69.6-50.6000111.9H80 A81 Q86 L87 D88H80-Y84 HydrophobicContact CB-CD2 4.48Å; H80-Y84 HydrophobicContact CB-CE2 4.13Å; H80-Y84 WeakPolarHBondContact O-CD2 3.41Å; H80-Y84 PolarHBondContact O-N 3.45Å; A81-Y84 PolarHBondContact O-N 2.84Å; Y84-Q86 VanDerWaalsContact C-N 3.33Å; Y84-Q86 PolarHBondContact O-N 3.45Å; Y84-L87 PolarHBondContact O-N 3.22Å; Y84-D88 PolarHBondContact O-N 3.38Å
85E97.9Very high98.3Very high123 Ų12395 Ų9558%0.57548%0.476SS*.Hα-helixtrans-58.3-45.9174.4-72.5170.5-175.600111.4A81 K82 L87 D88 L89A81-E85 WeakPolarHBondContact O-CG 3.4Å; A81-E85 PolarHBondContact O-N 2.94Å; K82-E85 PolarHBondContact O-N 3.41Å; E85-L87 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 2.92Å; E85-D88 PolarHBondContact O-N 3.06Å; E85-L89 WeakPolarHBondContact O-CG 3.4Å; E85-L89 PolarHBondContact O-N 2.7Å
86Q98.5Very high98.3Very high115 Ų11595.8 Ų95.854%0.53748%0.483SS..Hα-helixtrans-62.5-41.8176.7-173.563.22500111.9K82 V83 Y84 D88 L89 T90K82-Q86 WeakPolarHBondContact O-CB 3.31Å; K82-Q86 PolarHBondContact O-N 3.1Å; V83-Q86 PolarHBondContact O-N 3.05Å; Y84-Q86 VanDerWaalsContact C-N 3.33Å; Y84-Q86 PolarHBondContact O-N 3.45Å; Q86-D88 VanDerWaalsContact C-N 3.34Å; Q86-L89 PolarHBondContact O-N 3.38Å; Q86-T90 VanDerWaalsContact O-CG2 3.31Å; Q86-T90 WeakPolarHBondContact O-CG2 3.31Å; Q86-T90 PolarHBondContact O-N 3Å; Q86-T90 PolarHBondContact O-OG1 3.14Å
87L98.6Very high98.3Very high102 Ų10296 Ų9653%0.53449%0.485SS..Hα-helixtrans-62.7-43.1177-173.9122.8000110.9V83 Y84 E85 L89 T90 A91V83-L87 WeakPolarHBondContact O-CB 3.46Å; V83-L87 PolarHBondContact O-N 2.9Å; Y84-L87 PolarHBondContact O-N 3.22Å; E85-L87 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 2.92Å; L87-L89 PolarHBondContact O-N 3.41Å; L87-T90 WeakPolarHBondContact CA-OG1 3.46Å; L87-T90 PolarHBondContact O-N 3.25Å; L87-T90 PolarHBondContact O-OG1 3.32Å; L87-A91 WeakPolarHBondContact O-CB 3.17Å; L87-A91 PolarHBondContact O-N 2.96Å
88D98.3Very high98.3Very high75 Ų7595.4 Ų95.440%0.40148%0.482SS..Hα-helixtrans-62.1-42.1176.8-77.4-12000112.2Y84 E85 Q86 A91 R92Y84-D88 PolarHBondContact O-N 3.38Å; E85-D88 PolarHBondContact O-N 3.06Å; Q86-D88 VanDerWaalsContact C-N 3.34Å; D88-A91 PolarHBondContact O-N 2.88Å; D88-R92 VanDerWaalsContact O-CG 3.31Å; D88-R92 WeakPolarHBondContact O-CG 3.37Å; D88-R92 PolarHBondContact O-N 2.96Å
89L98.4Very high98.3Very high76 Ų7697.1 Ų97.140%0.39849%0.489SS..Hα-helixtrans-60.6-50173.6-69.4173000111.1E85 Q86 L87 A91 R92 D93E85-L89 WeakPolarHBondContact O-CG 3.4Å; E85-L89 PolarHBondContact O-N 2.7Å; Q86-L89 PolarHBondContact O-N 3.38Å; L87-L89 PolarHBondContact O-N 3.41Å; L89-A91 VanDerWaalsContact C-N 3.31Å; L89-A91 PolarHBondContact O-N 2.96Å; L89-R92 PolarHBondContact O-N 3.42Å; L89-D93 PolarHBondContact O-N 2.81Å
90T97.9Very high98.3Very high57 Ų57101.6 Ų101.635%0.3550%0.503SS..Hα-helixtrans-63.5-35.9179.462.40000112.8Q86 L87 D93 L94Q86-T90 VanDerWaalsContact O-CG2 3.31Å; Q86-T90 WeakPolarHBondContact O-CG2 3.31Å; Q86-T90 PolarHBondContact O-N 3Å; Q86-T90 PolarHBondContact O-OG1 3.14Å; L87-T90 WeakPolarHBondContact CA-OG1 3.46Å; L87-T90 PolarHBondContact O-N 3.25Å; L87-T90 PolarHBondContact O-OG1 3.32Å; T90-D93 PolarHBondContact O-N 3.2Å; T90-L94 WeakPolarHBondContact O-CB 3.35Å; T90-L94 VanDerWaalsContact O-CG 3.23Å; T90-L94 WeakPolarHBondContact O-CG 3.34Å; T90-L94 PolarHBondContact O-N 2.93Å
91A97.6Very high98.3Very high39 Ų39102.1 Ų102.132%0.32251%0.509SS..Hα-helixtrans-63.6-45.7176.200000110.9L87 D88 L89 L94 E95L87-A91 WeakPolarHBondContact O-CB 3.17Å; L87-A91 PolarHBondContact O-N 2.96Å; D88-A91 PolarHBondContact O-N 2.88Å; L89-A91 VanDerWaalsContact C-N 3.31Å; L89-A91 PolarHBondContact O-N 2.96Å; A91-L94 PolarHBondContact O-N 3.1Å; A91-E95 WeakPolarHBondContact O-CG 3.37Å; A91-E95 PolarHBondContact O-N 3.18Å
92R98.1Very high98.3Very high134 Ų134103 Ų10351%0.50651%0.509SS..Hα-helixtrans-62.3-43.1175.8-69173.6-166.7128.37.6112D88 L89 L94 E95 L96D88-R92 VanDerWaalsContact O-CG 3.31Å; D88-R92 WeakPolarHBondContact O-CG 3.37Å; D88-R92 PolarHBondContact O-N 2.96Å; L89-R92 PolarHBondContact O-N 3.42Å; R92-L94 VanDerWaalsContact C-N 3.33Å; R92-L94 PolarHBondContact O-N 3.04Å; R92-E95 WeakPolarHBondContact O-CB 3.26Å; R92-E95 PolarHBondContact O-N 3.36Å; R92-L96 WeakPolarHBondContact O-CG 3.44Å; R92-L96 PolarHBondContact O-N 2.65Å
93D98.3Very high98.3Very high96 Ų96103.2 Ų103.251%0.51352%0.515SS..Hα-helixtrans-61.9-41.6176.4-72.8-19.6000112L89 T90 L96 T97L89-D93 PolarHBondContact O-N 2.81Å; T90-D93 PolarHBondContact O-N 3.2Å; D93-L96 PolarHBondContact O-N 3.44Å; D93-T97 WeakPolarHBondContact O-CB 3.41Å; D93-T97 VanDerWaalsContact O-CG2 3.28Å; D93-T97 WeakPolarHBondContact O-CG2 3.38Å; D93-T97 PolarHBondContact O-N 3.1Å; D93-T97 PolarHBondContact O-OG1 3.33Å
94L98.1Very high98.3Very high119 Ų119103.1 Ų103.162%0.62351%0.509SS*.Hα-helixtrans-65.4-38.7174.9-72.1174.6000111.9T90 A91 R92 T97 N98T90-L94 WeakPolarHBondContact O-CB 3.35Å; T90-L94 VanDerWaalsContact O-CG 3.23Å; T90-L94 WeakPolarHBondContact O-CG 3.34Å; T90-L94 PolarHBondContact O-N 2.93Å; A91-L94 PolarHBondContact O-N 3.1Å; R92-L94 VanDerWaalsContact C-N 3.33Å; R92-L94 PolarHBondContact O-N 3.04Å; L94-T97 WeakPolarHBondContact CA-OG1 3.5Å; L94-T97 PolarHBondContact O-OG1 2.79Å; L94-N98 WeakPolarHBondContact O-CB 3.24Å; L94-N98 PolarHBondContact O-N 3.3Å
95E98.2Very high98.3Very high119 Ų11998.8 Ų98.856%0.55650%0.501SS*.Hα-helixtrans-63.2-46.6174-74.9175.2-179.400111.4A91 R92 N98 H99A91-E95 WeakPolarHBondContact O-CG 3.37Å; A91-E95 PolarHBondContact O-N 3.18Å; R92-E95 WeakPolarHBondContact O-CB 3.26Å; R92-E95 PolarHBondContact O-N 3.36Å; E95-N98 PolarHBondContact O-N 2.86Å; E95-H99 PolarHBondContact O-N 3.42Å; E95-H99 PolarHBondContact O-ND1 2.92Å
96L98.4Very high98.3Very high120 Ų12098.4 Ų98.463%0.62850%0.497SS*.Hα-helixtrans-62.4-46.7178.5-71.7174.1000112R92 D93 N98 H99 R100R92-L96 WeakPolarHBondContact O-CG 3.44Å; R92-L96 PolarHBondContact O-N 2.65Å; D93-L96 PolarHBondContact O-N 3.44Å; L96-N98 VanDerWaalsContact C-N 3.33Å; L96-N98 PolarHBondContact O-N 3.37Å; L96-H99 PolarHBondContact O-N 3.12Å; L96-R100 WeakPolarHBondContact O-CB 3.26Å; L96-R100 PolarHBondContact O-N 2.89Å
97T98.2Very high98.3Very high74 Ų7495.5 Ų95.545%0.45449%0.493SS..Hα-helixtrans-64.3-38.8177.354.30000111.7D93 L94 R100 L101D93-T97 WeakPolarHBondContact O-CB 3.41Å; D93-T97 VanDerWaalsContact O-CG2 3.28Å; D93-T97 WeakPolarHBondContact O-CG2 3.38Å; D93-T97 PolarHBondContact O-N 3.1Å; D93-T97 PolarHBondContact O-OG1 3.33Å; L94-T97 WeakPolarHBondContact CA-OG1 3.5Å; L94-T97 PolarHBondContact O-OG1 2.79Å; T97-R100 PolarHBondContact O-N 2.92Å; T97-L101 WeakPolarHBondContact O-CB 3.45Å; T97-L101 VanDerWaalsContact O-CG 3.31Å; T97-L101 WeakPolarHBondContact O-CG 3.35Å; T97-L101 PolarHBondContact O-N 3.27Å
98N98.2Very high98.3Very high98 Ų9893 Ų9352%0.52449%0.487SS..Hα-helixtrans-63.1-47.5174.3-168.8-33.5000111.4L94 E95 L96 R100 L101 V102L94-N98 WeakPolarHBondContact O-CB 3.24Å; L94-N98 PolarHBondContact O-N 3.3Å; E95-N98 PolarHBondContact O-N 2.86Å; L96-N98 VanDerWaalsContact C-N 3.33Å; L96-N98 PolarHBondContact O-N 3.37Å; N98-R100 VanDerWaalsContact C-N 3.29Å; N98-R100 PolarHBondContact O-N 3.33Å; N98-L101 PolarHBondContact O-N 3.34Å; N98-V102 WeakPolarHBondContact O-CG2 3.37Å; N98-V102 PolarHBondContact O-N 3.5Å
99H98.4Very high98.3Very high128 Ų12894.1 Ų94.159%0.59349%0.49SS*.Hα-helixtrans-56.6-44.6175.5-8071000111.5E95 L96 V102 L103E95-H99 PolarHBondContact O-N 3.42Å; E95-H99 PolarHBondContact O-ND1 2.92Å; L96-H99 PolarHBondContact O-N 3.12Å; H99-V102 PolarHBondContact O-N 3.41Å; H99-L103 WeakPolarHBondContact O-CG 3.37Å; H99-L103 PolarHBondContact O-N 3.37Å
100R98.6Very high98.3Very high167 Ų16797.3 Ų97.363%0.6350%0.503SS*.Hα-helixtrans-60-49.3175.6-179.7179173.7170.31.6112L96 T97 N98 V102 L103 E104L96-R100 WeakPolarHBondContact O-CB 3.26Å; L96-R100 PolarHBondContact O-N 2.89Å; T97-R100 PolarHBondContact O-N 2.92Å; N98-R100 VanDerWaalsContact C-N 3.29Å; N98-R100 PolarHBondContact O-N 3.33Å; R100-V102 VanDerWaalsContact C-N 3.28Å; R100-V102 PolarHBondContact O-N 2.61Å; R100-L103 PolarHBondContact O-N 3.02Å; R100-L103 VanDerWaalsContact O-N 3.12Å; R100-E104 HydrophobicContact CG-CG 4.5Å; R100-E104 WeakPolarHBondContact CG-OE1 3.47Å; R100-E104 IonicContact CZ-OE1 3.63Å; R100-E104 IonicContact NE-OE1 3.19Å; R100-E104 PolarHBondContact NE-OE1 3.27Å; R100-E104 IonicContact NH2-OE1 3.99Å; R100-E104 WeakPolarHBondContact O-CG 3.38Å; R100-E104 PolarHBondContact O-N 3.32Å
101L98.6Very high98.3Very high107 Ų107102 Ų10256%0.5652%0.518SS*.Hα-helixtrans-61.3-36.6178.1-72.7173.1000112.2T97 N98 E104 S105T97-L101 WeakPolarHBondContact O-CB 3.45Å; T97-L101 VanDerWaalsContact O-CG 3.31Å; T97-L101 WeakPolarHBondContact O-CG 3.35Å; T97-L101 PolarHBondContact O-N 3.27Å; N98-L101 PolarHBondContact O-N 3.34Å; L101-E104 PolarHBondContact O-N 3.45Å; L101-S105 WeakPolarHBondContact O-CB 3.38Å; L101-S105 PolarHBondContact O-N 3.38Å
102V98.8Very high98.3Very high60 Ų60104.9 Ų104.936%0.36453%0.527SS..Hα-helixtrans-64.3-42.1174.5168.80000111.1N98 H99 R100 S105 K106N98-V102 WeakPolarHBondContact O-CG2 3.37Å; N98-V102 PolarHBondContact O-N 3.5Å; H99-V102 PolarHBondContact O-N 3.41Å; R100-V102 VanDerWaalsContact C-N 3.28Å; R100-V102 PolarHBondContact O-N 2.61Å; V102-S105 PolarHBondContact O-N 2.87Å; V102-K106 HydrophobicContact CG1-CD 4.31Å; V102-K106 VanDerWaalsContact O-CG 3.31Å; V102-K106 WeakPolarHBondContact O-CG 3.3Å; V102-K106 PolarHBondContact O-N 3.16Å
103L98.4Very high98.3Very high115 Ų115104.1 Ų104.160%0.60253%0.529SS*.Hα-helixtrans-66.1-44.7176.4-67.9175.1000111.7H99 R100 S105 K106 A107H99-L103 WeakPolarHBondContact O-CG 3.37Å; H99-L103 PolarHBondContact O-N 3.37Å; R100-L103 PolarHBondContact O-N 3.02Å; R100-L103 VanDerWaalsContact O-N 3.12Å; L103-S105 VanDerWaalsContact C-N 3.34Å; L103-S105 PolarHBondContact O-N 2.97Å; L103-K106 PolarHBondContact O-N 3.28Å; L103-A107 PolarHBondContact O-N 3Å
104E98.5Very high98.3Very high90 Ų90101 Ų10142%0.42152%0.52SS..Hα-helixtrans-62.5-41.2176-70.9175.8-173.900111.5R100 L101 A107 A108R100-E104 HydrophobicContact CG-CG 4.5Å; R100-E104 WeakPolarHBondContact CG-OE1 3.47Å; R100-E104 IonicContact CZ-OE1 3.63Å; R100-E104 IonicContact NE-OE1 3.19Å; R100-E104 PolarHBondContact NE-OE1 3.27Å; R100-E104 IonicContact NH2-OE1 3.99Å; R100-E104 WeakPolarHBondContact O-CG 3.38Å; R100-E104 PolarHBondContact O-N 3.32Å; L101-E104 PolarHBondContact O-N 3.45Å; E104-A107 PolarHBondContact O-N 3.3Å; E104-A108 WeakPolarHBondContact O-CB 3.44Å; E104-A108 PolarHBondContact O-N 2.92Å
105S98.1Very high98.3Very high61 Ų61100 Ų10043%0.42751%0.514SS..Hα-helixtrans-61.1-45.1173.9-179.50000111.9L101 V102 L103 A107 A108 Q109L101-S105 WeakPolarHBondContact O-CB 3.38Å; L101-S105 PolarHBondContact O-N 3.38Å; V102-S105 PolarHBondContact O-N 2.87Å; L103-S105 VanDerWaalsContact C-N 3.34Å; L103-S105 PolarHBondContact O-N 2.97Å; S105-A107 PolarHBondContact O-N 2.93Å; S105-A108 PolarHBondContact O-N 2.87Å; S105-Q109 WeakPolarHBondContact O-CB 3.29Å; S105-Q109 VanDerWaalsContact O-CG 3.29Å; S105-Q109 WeakPolarHBondContact O-CG 3.42Å; S105-Q109 PolarHBondContact O-N 3.49Å
106K98.5Very high98.3Very high114 Ų11497.2 Ų97.250%0.49651%0.505SS..Hα-helixtrans-61.6-42.6174.8-75.5173.8-179.1177.60112.1V102 L103 Q109 Q110V102-K106 HydrophobicContact CG1-CD 4.31Å; V102-K106 VanDerWaalsContact O-CG 3.31Å; V102-K106 WeakPolarHBondContact O-CG 3.3Å; V102-K106 PolarHBondContact O-N 3.16Å; L103-K106 PolarHBondContact O-N 3.28Å; K106-Q109 WeakPolarHBondContact O-CB 3.45Å; K106-Q109 PolarHBondContact O-N 3.27Å; K106-Q110 WeakPolarHBondContact O-CG 3.37Å; K106-Q110 PolarHBondContact O-N 2.83Å
107A98.3Very high98.3Very high54 Ų5495.7 Ų95.745%0.44650%0.495SS..Hα-helixtrans-64.5-42.8177.100000111.7L103 E104 S105 Q110 K111L103-A107 PolarHBondContact O-N 3Å; E104-A107 PolarHBondContact O-N 3.3Å; S105-A107 PolarHBondContact O-N 2.93Å; A107-Q110 PolarHBondContact O-N 3.48Å; A107-K111 PolarHBondContact O-N 3.33Å
108A97.8Very high98.3Very high50 Ų5095.2 Ų95.241%0.41349%0.492SS..Hα-helixtrans-63-42.5174.500000111.6E104 S105 K111 I112E104-A108 WeakPolarHBondContact O-CB 3.44Å; E104-A108 PolarHBondContact O-N 2.92Å; S105-A108 PolarHBondContact O-N 2.87Å; A108-K111 WeakPolarHBondContact O-CB 3.35Å; A108-K111 PolarHBondContact O-N 3.34Å; A108-I112 WeakPolarHBondContact O-CG1 3.4Å; A108-I112 PolarHBondContact O-N 3.11Å
109Q98.4Very high98.3Very high99 Ų9994.7 Ų94.746%0.46349%0.489SS..Hα-helixtrans-58.4-49.3173.7-77174.4-10.900111.1S105 K106 K111 I112 H113S105-Q109 WeakPolarHBondContact O-CB 3.29Å; S105-Q109 VanDerWaalsContact O-CG 3.29Å; S105-Q109 WeakPolarHBondContact O-CG 3.42Å; S105-Q109 PolarHBondContact O-N 3.49Å; K106-Q109 WeakPolarHBondContact O-CB 3.45Å; K106-Q109 PolarHBondContact O-N 3.27Å; Q109-K111 VanDerWaalsContact C-N 3.27Å; Q109-K111 PolarHBondContact O-N 2.88Å; Q109-I112 PolarHBondContact O-N 2.99Å; Q109-I112 VanDerWaalsContact O-N 3.11Å; Q109-H113 PolarHBondContact O-N 2.93Å; Q109-H113 PolarHBondContact O-ND1 2.72Å
110Q98.3Very high98.3Very high143 Ų14393.8 Ų93.867%0.66849%0.485SS*.Hα-helixtrans-57.4-41.1177.4-72.5170.2-3.300112K106 A107 H113 G114K106-Q110 WeakPolarHBondContact O-CG 3.37Å; K106-Q110 PolarHBondContact O-N 2.83Å; A107-Q110 PolarHBondContact O-N 3.48Å; Q110-H113 PolarHBondContact O-N 3.35Å; Q110-G114 PolarHBondContact O-N 2.95Å
111K98.4Very high98.3Very high154 Ų15492.4 Ų92.467%0.6748%0.479SS*.Hα-helixtrans-64.1-42.8175.4-171.9175.8-177.6178.50112.3A107 A108 Q109 G114 L115A107-K111 PolarHBondContact O-N 3.33Å; A108-K111 WeakPolarHBondContact O-CB 3.35Å; A108-K111 PolarHBondContact O-N 3.34Å; Q109-K111 VanDerWaalsContact C-N 3.27Å; Q109-K111 PolarHBondContact O-N 2.88Å; K111-G114 PolarHBondContact O-N 3.36Å; K111-L115 HydrophobicContact CG-CD1 4.47Å; K111-L115 WeakPolarHBondContact O-CG 2.97Å; K111-L115 PolarHBondContact O-N 2.9Å
112I98.3Very high98.3Very high101 Ų10192.1 Ų92.152%0.51848%0.478SS..Hα-helixtrans-60.6-47.7175.1-69.3165.2000109.9A108 Q109 G114 L115 T116A108-I112 WeakPolarHBondContact O-CG1 3.4Å; A108-I112 PolarHBondContact O-N 3.11Å; Q109-I112 PolarHBondContact O-N 2.99Å; Q109-I112 VanDerWaalsContact O-N 3.11Å; I112-G114 PolarHBondContact O-N 3.39Å; I112-L115 PolarHBondContact O-N 3.32Å; I112-T116 PolarHBondContact O-N 2.92Å; I112-T116 PolarHBondContact O-OG1 2.95Å
113H98.4Very high98.2Very high118 Ų11894.3 Ų94.355%0.54648%0.484SS..Hα-helixtrans-58.9-46.4178.3-72.478.3000111.3Q109 Q110 L115 T116 E117Q109-H113 PolarHBondContact O-N 2.93Å; Q109-H113 PolarHBondContact O-ND1 2.72Å; Q110-H113 PolarHBondContact O-N 3.35Å; H113-L115 VanDerWaalsContact C-N 3.33Å; H113-L115 PolarHBondContact O-N 2.97Å; H113-T116 PolarHBondContact O-N 2.88Å; H113-E117 WeakPolarHBondContact O-CG 3.4Å; H113-E117 PolarHBondContact O-N 3.48Å
114G98.4Very high98.2Very high30 Ų3091.4 Ų91.431%0.30948%0.476SS..Hα-helixtrans-58.5-42.6175.900000113Q110 K111 I112 T118Q110-G114 PolarHBondContact O-N 2.95Å; K111-G114 PolarHBondContact O-N 3.36Å; I112-G114 PolarHBondContact O-N 3.39Å; G114-T118 WeakPolarHBondContact O-CG2 3.4Å; G114-T118 PolarHBondContact O-N 2.97Å; G114-T118 VanDerWaalsContact O-N 3.12Å
115L98.1Very high98.2Very high97 Ų9792.4 Ų92.451%0.50848%0.481SS..Hα-helixtrans-66.9-42.4175.4-69.1175.4000112.1K111 I112 H113 E117 T118 I119K111-L115 HydrophobicContact CG-CD1 4.47Å; K111-L115 WeakPolarHBondContact O-CG 2.97Å; K111-L115 PolarHBondContact O-N 2.9Å; I112-L115 PolarHBondContact O-N 3.32Å; H113-L115 VanDerWaalsContact C-N 3.33Å; H113-L115 PolarHBondContact O-N 2.97Å; L115-E117 VanDerWaalsContact C-N 3.33Å; L115-E117 PolarHBondContact O-N 3.33Å; L115-T118 WeakPolarHBondContact CA-OG1 3.33Å; L115-T118 PolarHBondContact O-N 2.84Å; L115-T118 VanDerWaalsContact O-N 3.1Å; L115-T118 PolarHBondContact O-OG1 2.94Å; L115-I119 WeakPolarHBondContact O-CG1 3.41Å; L115-I119 PolarHBondContact O-N 3.19Å
116T98.1Very high98.2Very high61 Ų6193.3 Ų93.337%0.37448%0.484SS..Hα-helixtrans-57.9-46.5175.7-59.40000110.9I112 H113 T118 I119 E120I112-T116 PolarHBondContact O-N 2.92Å; I112-T116 PolarHBondContact O-OG1 2.95Å; H113-T116 PolarHBondContact O-N 2.88Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 3.33Å; T116-I119 WeakPolarHBondContact O-CB 3.5Å; T116-I119 PolarHBondContact O-N 2.91Å; T116-I119 VanDerWaalsContact O-N 3.1Å; T116-E120 WeakPolarHBondContact O-CG 3.41Å; T116-E120 PolarHBondContact O-N 3.18Å
117E98.4Very high98.2Very high89 Ų8994.2 Ų94.242%0.41649%0.49SS..Hα-helixtrans-62.7-35176.1-65.9177.6-165.400112.4H113 L115 R121H113-E117 WeakPolarHBondContact O-CG 3.4Å; H113-E117 PolarHBondContact O-N 3.48Å; L115-E117 VanDerWaalsContact C-N 3.33Å; L115-E117 PolarHBondContact O-N 3.33Å; E117-R121 VanDerWaalsContact CB-NH1 3.26Å; E117-R121 VanDerWaalsContact O-CG 3.29Å; E117-R121 WeakPolarHBondContact O-CG 3.34Å; E117-R121 PolarHBondContact O-N 3.12Å; E117-R121 VanDerWaalsContact O-N 3.08Å; E117-R121 PolarHBondContact O-NH1 3.33Å; E117-R121 VanDerWaalsContact O-NH1 3.13Å; E117-R121 IonicContact OE2-CZ 2.91Å; E117-R121 IonicContact OE2-NH1 3.79Å; E117-R121 IonicContact OE2-NH2 3.77Å; E117-R121 PolarHBondContact OE2-NH2 2.82Å
118T98.1Very high98.1Very high63 Ų6397.4 Ų97.439%0.38750%0.496SS..Hα-helixtrans-67.3-38.1174.160.60000112G114 L115 T116 R121 L122G114-T118 WeakPolarHBondContact O-CG2 3.4Å; G114-T118 PolarHBondContact O-N 2.97Å; G114-T118 VanDerWaalsContact O-N 3.12Å; L115-T118 WeakPolarHBondContact CA-OG1 3.33Å; L115-T118 PolarHBondContact O-N 2.84Å; L115-T118 VanDerWaalsContact O-N 3.1Å; L115-T118 PolarHBondContact O-OG1 2.94Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 3.33Å; T118-R121 PolarHBondContact O-N 3.36Å; T118-L122 VanDerWaalsContact O-CG 3.31Å; T118-L122 WeakPolarHBondContact O-CG 3.37Å; T118-L122 PolarHBondContact O-N 3.49Å
119I98.3Very high98.1Very high88 Ų88100 Ų10045%0.45150%0.502SS..Hα-helixtrans-64.8-46176.1-69166.5000110.1L115 T116 R121 L122 Q123L115-I119 WeakPolarHBondContact O-CG1 3.41Å; L115-I119 PolarHBondContact O-N 3.19Å; T116-I119 WeakPolarHBondContact O-CB 3.5Å; T116-I119 PolarHBondContact O-N 2.91Å; T116-I119 VanDerWaalsContact O-N 3.1Å; I119-R121 PolarHBondContact O-N 2.9Å; I119-L122 PolarHBondContact O-N 3.48Å; I119-Q123 HydrophobicContact CG2-CG 4.21Å; I119-Q123 WeakPolarHBondContact O-CB 3.31Å; I119-Q123 VanDerWaalsContact O-CG 3.3Å; I119-Q123 WeakPolarHBondContact O-CG 3.41Å; I119-Q123 PolarHBondContact O-N 3.02Å
120E98.2Very high98.1Very high109 Ų109100.5 Ų100.551%0.50950%0.504SS..Hα-helixtrans-60.5-42.8177.6-72173.2-179.500111.9T116 L122 Q123 A124T116-E120 WeakPolarHBondContact O-CG 3.41Å; T116-E120 PolarHBondContact O-N 3.18Å; E120-L122 VanDerWaalsContact C-N 3.35Å; E120-L122 PolarHBondContact O-N 2.76Å; E120-Q123 PolarHBondContact O-N 3.33Å; E120-A124 PolarHBondContact O-N 2.87Å
121R98.3Very high98Very high138 Ų13895.7 Ų95.752%0.52149%0.489SS..Hα-helixtrans-61.5-42.2174.6-71.7178.9-162.598.1-0.3112E117 T118 I119 Q125E117-R121 VanDerWaalsContact CB-NH1 3.26Å; E117-R121 VanDerWaalsContact O-CG 3.29Å; E117-R121 WeakPolarHBondContact O-CG 3.34Å; E117-R121 PolarHBondContact O-N 3.12Å; E117-R121 VanDerWaalsContact O-N 3.08Å; E117-R121 PolarHBondContact O-NH1 3.33Å; E117-R121 VanDerWaalsContact O-NH1 3.13Å; E117-R121 IonicContact OE2-CZ 2.91Å; E117-R121 IonicContact OE2-NH1 3.79Å; E117-R121 IonicContact OE2-NH2 3.77Å; E117-R121 PolarHBondContact OE2-NH2 2.82Å; T118-R121 PolarHBondContact O-N 3.36Å; I119-R121 PolarHBondContact O-N 2.9Å; R121-Q125 WeakPolarHBondContact O-CG 3.33Å; R121-Q125 PolarHBondContact O-N 3.36Å; R121-Q125 VanDerWaalsContact O-N 3.15Å
122L97.9Very high97.9Very high101 Ų10192.7 Ų92.753%0.52948%0.478SS..Hα-helixtrans-67.9-39.3176.5-71.2172.4000111.9T118 I119 E120 Q125 V126T118-L122 VanDerWaalsContact O-CG 3.31Å; T118-L122 WeakPolarHBondContact O-CG 3.37Å; T118-L122 PolarHBondContact O-N 3.49Å; I119-L122 PolarHBondContact O-N 3.48Å; E120-L122 VanDerWaalsContact C-N 3.35Å; E120-L122 PolarHBondContact O-N 2.76Å; L122-Q125 PolarHBondContact O-N 2.89Å; L122-V126 WeakPolarHBondContact O-CG2 3.45Å; L122-V126 PolarHBondContact O-N 3.42Å
123Q97.9Very high97.8Very high106 Ų10691.1 Ų91.150%0.49547%0.472SS..Hα-helixtrans-61-45.8175-76.4171.9-19.500111.1I119 E120 Q125 V126 E127I119-Q123 HydrophobicContact CG2-CG 4.21Å; I119-Q123 WeakPolarHBondContact O-CB 3.31Å; I119-Q123 VanDerWaalsContact O-CG 3.3Å; I119-Q123 WeakPolarHBondContact O-CG 3.41Å; I119-Q123 PolarHBondContact O-N 3.02Å; E120-Q123 PolarHBondContact O-N 3.33Å; Q123-Q125 VanDerWaalsContact C-N 3.31Å; Q123-Q125 PolarHBondContact O-N 2.88Å; Q123-V126 PolarHBondContact O-N 3.32Å; Q123-V126 VanDerWaalsContact O-N 3.13Å; Q123-E127 WeakPolarHBondContact O-CG 3.49Å; Q123-E127 PolarHBondContact O-N 3.03Å
124A97.9Very high97.8Very high53 Ų5391 Ų9144%0.43847%0.472SS..Hα-helixtrans-59.5-40.7175.600000112.3E120 E127 E128E120-A124 PolarHBondContact O-N 2.87Å; A124-E127 PolarHBondContact O-N 3.49Å; A124-E128 WeakPolarHBondContact O-CB 3.34Å; A124-E128 PolarHBondContact O-N 3.18Å
125Q97.9Very high97.6Very high111 Ų11196 Ų9652%0.51949%0.487SS..Hα-helixtrans-64.7-40.5174.6-72.1176.21.900112.4R121 L122 Q123 E128 L129R121-Q125 WeakPolarHBondContact O-CG 3.33Å; R121-Q125 PolarHBondContact O-N 3.36Å; R121-Q125 VanDerWaalsContact O-N 3.15Å; L122-Q125 PolarHBondContact O-N 2.89Å; Q123-Q125 VanDerWaalsContact C-N 3.31Å; Q123-Q125 PolarHBondContact O-N 2.88Å; Q125-E128 PolarHBondContact O-N 2.93Å; Q125-L129 WeakPolarHBondContact O-CB 3.43Å; Q125-L129 VanDerWaalsContact O-CG 3.31Å; Q125-L129 WeakPolarHBondContact O-CG 3.32Å; Q125-L129 PolarHBondContact O-N 3.18Å
126V97.9Very high97.5Very high80 Ų8096.6 Ų96.649%0.48549%0.491SS..Hα-helixtrans-64.5-44.7176170.50000110.6L122 Q123 E128 L129 Q130L122-V126 WeakPolarHBondContact O-CG2 3.45Å; L122-V126 PolarHBondContact O-N 3.42Å; Q123-V126 PolarHBondContact O-N 3.32Å; Q123-V126 VanDerWaalsContact O-N 3.13Å; V126-E128 VanDerWaalsContact C-N 3.34Å; V126-E128 PolarHBondContact O-N 2.95Å; V126-L129 PolarHBondContact O-N 2.92Å; V126-Q130 WeakPolarHBondContact O-CB 3.48Å; V126-Q130 PolarHBondContact O-N 2.86Å
127E98.1Very high97.3Very high133 Ų133100.6 Ų100.662%0.62150%0.499SS*.Hα-helixtrans-60.8-42176.2-72.2172.9-173.700111.9Q123 A124 Q130 A131Q123-E127 WeakPolarHBondContact O-CG 3.49Å; Q123-E127 PolarHBondContact O-N 3.03Å; A124-E127 PolarHBondContact O-N 3.49Å; E127-Q130 PolarHBondContact O-N 3.43Å; E127-A131 WeakPolarHBondContact O-CB 3.18Å; E127-A131 PolarHBondContact O-N 3.44Å
128E97.8Very high97.1Very high121 Ų12197.7 Ų97.757%0.56549%0.493SS*.Hα-helixtrans-63.7-47.2175.7-176.7171.1-160.500111.9A124 Q125 V126 Q130 A131 Q132A124-E128 WeakPolarHBondContact O-CB 3.34Å; A124-E128 PolarHBondContact O-N 3.18Å; Q125-E128 PolarHBondContact O-N 2.93Å; V126-E128 VanDerWaalsContact C-N 3.34Å; V126-E128 PolarHBondContact O-N 2.95Å; E128-Q130 VanDerWaalsContact C-N 3.28Å; E128-Q130 PolarHBondContact O-N 2.96Å; E128-A131 PolarHBondContact O-N 2.89Å; E128-Q132 WeakPolarHBondContact O-CG 3.42Å; E128-Q132 PolarHBondContact O-N 3.48Å
129L97.3Very high96.8Very high104 Ų10499.5 Ų99.555%0.54550%0.499SS..Hα-helixtrans-61.6-39.1175.1-73172.6000111.6Q125 V126 Q132 V133Q125-L129 WeakPolarHBondContact O-CB 3.43Å; Q125-L129 VanDerWaalsContact O-CG 3.31Å; Q125-L129 WeakPolarHBondContact O-CG 3.32Å; Q125-L129 PolarHBondContact O-N 3.18Å; V126-L129 PolarHBondContact O-N 2.92Å; L129-Q132 PolarHBondContact O-N 3.07Å; L129-V133 WeakPolarHBondContact O-CG2 3.34Å; L129-V133 PolarHBondContact O-N 3.26Å
130Q97.2Very high96.4Very high110 Ų110101.1 Ų101.151%0.51451%0.505SS..Hα-helixtrans-67.4-40.3179-163.3154.6-10.700111.1V126 E127 E128 V133 E134V126-Q130 WeakPolarHBondContact O-CB 3.48Å; V126-Q130 PolarHBondContact O-N 2.86Å; E127-Q130 PolarHBondContact O-N 3.43Å; E128-Q130 VanDerWaalsContact C-N 3.28Å; E128-Q130 PolarHBondContact O-N 2.96Å; Q130-V133 PolarHBondContact O-N 2.96Å; Q130-E134 WeakPolarHBondContact O-CG 3.48Å; Q130-E134 PolarHBondContact O-N 3.01Å
131A96.9Very high96Very high43 Ų43102.1 Ų102.136%0.35551%0.51SS..Hα-helixtrans-61.6-42.3171.500000112.1E127 E128 E134 Q135E127-A131 WeakPolarHBondContact O-CB 3.18Å; E127-A131 PolarHBondContact O-N 3.44Å; E128-A131 PolarHBondContact O-N 2.89Å; A131-E134 PolarHBondContact O-N 2.92Å; A131-Q135 VanDerWaalsContact O-CG 3.27Å; A131-Q135 WeakPolarHBondContact O-CG 3.34Å; A131-Q135 PolarHBondContact O-N 3.2Å
132Q97.1Very high95.5Very high91 Ų91100.1 Ų100.143%0.42551%0.509SS..Hα-helixtrans-62.4-42.2175.3-69.7175.520.500111.9E128 L129 Q135 L136E128-Q132 WeakPolarHBondContact O-CG 3.42Å; E128-Q132 PolarHBondContact O-N 3.48Å; L129-Q132 PolarHBondContact O-N 3.07Å; Q132-Q135 PolarHBondContact O-N 3.34Å; Q132-L136 WeakPolarHBondContact O-CG 3.29Å; Q132-L136 PolarHBondContact O-N 2.93Å
133V96.7Very high95Very high67 Ų67100.9 Ų100.941%0.40651%0.51SS..Hα-helixtrans-64.3-41.6176.1169.90000111.4L129 Q130 L136 R137L129-V133 WeakPolarHBondContact O-CG2 3.34Å; L129-V133 PolarHBondContact O-N 3.26Å; Q130-V133 PolarHBondContact O-N 2.96Å; V133-L136 PolarHBondContact O-N 2.89Å; V133-R137 WeakPolarHBondContact O-CB 3.42Å; V133-R137 WeakPolarHBondContact O-CG 3.37Å; V133-R137 PolarHBondContact O-N 3.35Å
134E96.3Very high94.4Very high117 Ų11799 Ų9955%0.54751%0.505SS..Hα-helixtrans-65.1-39.4176.3-73.9176-174.500112.2Q130 A131 R137 G138Q130-E134 WeakPolarHBondContact O-CG 3.48Å; Q130-E134 PolarHBondContact O-N 3.01Å; A131-E134 PolarHBondContact O-N 2.92Å; E134-R137 PolarHBondContact O-N 3.23Å; E134-G138 PolarHBondContact O-N 3.5Å
135Q96.1Very high93.8Very high134 Ų134101.2 Ų101.263%0.62651%0.51SS*.Hα-helixtrans-60.8-47.7173-73.91756.700111.7A131 Q132 G138 L139A131-Q135 VanDerWaalsContact O-CG 3.27Å; A131-Q135 WeakPolarHBondContact O-CG 3.34Å; A131-Q135 PolarHBondContact O-N 3.2Å; Q132-Q135 PolarHBondContact O-N 3.34Å; Q135-G138 PolarHBondContact O-N 3.4Å; Q135-L139 WeakPolarHBondContact O-CG 3.39Å; Q135-L139 PolarHBondContact O-N 3.4Å
136L94.5Very high93Very high110 Ų110104.5 Ų104.558%0.57652%0.517SS*.Hα-helixtrans-61.6-43.9176.8-70.9174.2000111.8Q132 V133 G138 L139 E140Q132-L136 WeakPolarHBondContact O-CG 3.29Å; Q132-L136 PolarHBondContact O-N 2.93Å; V133-L136 PolarHBondContact O-N 2.89Å; L136-G138 VanDerWaalsContact C-N 3.31Å; L136-G138 PolarHBondContact O-N 3.43Å; L136-L139 PolarHBondContact O-N 2.9Å; L136-E140 PolarHBondContact O-N 3.13Å
137R94.9Very high92Very high145 Ų145104.8 Ų104.855%0.54751%0.513SS..Hα-helixtrans-60.4-39.4173.6-76.1176.6177.5170.21.3112.2V133 E134 E140 Q141V133-R137 WeakPolarHBondContact O-CB 3.42Å; V133-R137 WeakPolarHBondContact O-CG 3.37Å; V133-R137 PolarHBondContact O-N 3.35Å; E134-R137 PolarHBondContact O-N 3.23Å; R137-E140 PolarHBondContact O-N 3.45Å; R137-Q141 VanDerWaalsContact O-CG 3.26Å; R137-Q141 WeakPolarHBondContact O-CG 3.49Å; R137-Q141 PolarHBondContact O-N 2.97Å
138G93.4Very high91Very high28 Ų28104.2 Ų104.229%0.28951%0.508SS..Hα-helixtrans-63.2-41.917500000112.4E134 Q135 L136 Q141 L142E134-G138 PolarHBondContact O-N 3.5Å; Q135-G138 PolarHBondContact O-N 3.4Å; L136-G138 VanDerWaalsContact C-N 3.31Å; L136-G138 PolarHBondContact O-N 3.43Å; G138-Q141 PolarHBondContact O-N 2.97Å; G138-L142 WeakPolarHBondContact O-CG 3.47Å; G138-L142 PolarHBondContact O-N 3.03Å
139L92.8Very high89.7Confident100 Ų100107 Ų10752%0.52451%0.514SS..Hα-helixtrans-64.4-44.3174.8-68.4174.4000111.9Q135 L136 Q141 L142 Q143Q135-L139 WeakPolarHBondContact O-CG 3.39Å; Q135-L139 PolarHBondContact O-N 3.4Å; L136-L139 PolarHBondContact O-N 2.9Å; L139-Q141 PolarHBondContact O-N 3.49Å; L139-L142 PolarHBondContact O-N 2.84Å; L139-Q143 WeakPolarHBondContact O-CG 3.3Å; L139-Q143 PolarHBondContact O-N 2.88Å
140E90.4Very high88.2Confident122 Ų122107.7 Ų107.757%0.5751%0.514SS*.Hα-helixtrans-59.3-44.7174.4-79.7-177.7160.200111.9L136 R137 L142 Q143 V144L136-E140 PolarHBondContact O-N 3.13Å; R137-E140 PolarHBondContact O-N 3.45Å; E140-L142 VanDerWaalsContact C-N 3.32Å; E140-L142 PolarHBondContact O-N 3.28Å; E140-Q143 WeakPolarHBondContact O-CB 3.37Å; E140-Q143 PolarHBondContact O-N 3.35Å; E140-Q143 VanDerWaalsContact O-N 3.15Å; E140-V144 WeakPolarHBondContact O-CG2 3.47Å; E140-V144 PolarHBondContact O-N 3.3Å
141Q88.7Confident86.6Confident130 Ų130110.1 Ų110.161%0.60752%0.519SS*.Hα-helixtrans-61.6-40.6177-72.6172.324.200112.1R137 G138 L139 V144 L145R137-Q141 VanDerWaalsContact O-CG 3.26Å; R137-Q141 WeakPolarHBondContact O-CG 3.49Å; R137-Q141 PolarHBondContact O-N 2.97Å; G138-Q141 PolarHBondContact O-N 2.97Å; L139-Q141 PolarHBondContact O-N 3.49Å; Q141-V144 PolarHBondContact O-N 3.07Å; Q141-L145 WeakPolarHBondContact O-CG 3.47Å; Q141-L145 PolarHBondContact O-N 3.27Å
142L88.9Confident85Confident96 Ų96117.8 Ų117.850%0.50354%0.539SS..Hα-helixtrans-64.9-39174.2-72.5172.9000111.9G138 L139 E140 L145 R146G138-L142 WeakPolarHBondContact O-CG 3.47Å; G138-L142 PolarHBondContact O-N 3.03Å; L139-L142 PolarHBondContact O-N 2.84Å; E140-L142 VanDerWaalsContact C-N 3.32Å; E140-L142 PolarHBondContact O-N 3.28Å; L142-L145 PolarHBondContact O-N 3.43Å; L142-R146 WeakPolarHBondContact O-CB 3.41Å; L142-R146 VanDerWaalsContact O-CG 3.32Å; L142-R146 WeakPolarHBondContact O-CG 3.42Å; L142-R146 PolarHBondContact O-N 3.22Å
143Q86.3Confident83.1Confident117 Ų117122.5 Ų122.555%0.54755%0.552SS.*Hα-helixtrans-61.8-47.9173.3-72.5174.64.800111L139 E140 L145 R146 E147L139-Q143 WeakPolarHBondContact O-CG 3.3Å; L139-Q143 PolarHBondContact O-N 2.88Å; E140-Q143 WeakPolarHBondContact O-CB 3.37Å; E140-Q143 PolarHBondContact O-N 3.35Å; E140-Q143 VanDerWaalsContact O-N 3.15Å; Q143-L145 VanDerWaalsContact C-N 3.32Å; Q143-L145 PolarHBondContact O-N 3.38Å; Q143-R146 CarbonylContact O-C 3.59Å; Q143-R146 WeakPolarHBondContact O-CB 3.28Å; Q143-R146 PolarHBondContact O-N 3.48Å; Q143-R146 VanDerWaalsContact O-N 3.12Å; Q143-E147 PolarHBondContact O-N 2.95Å
144V85.8Confident80.9Confident66 Ų66123.1 Ų123.140%0.456%0.556SS.*Hα-helixtrans-61.2-38.7177.11720000111.8E140 Q141 K148E140-V144 WeakPolarHBondContact O-CG2 3.47Å; E140-V144 PolarHBondContact O-N 3.3Å; Q141-V144 PolarHBondContact O-N 3.07Å; V144-K148 HydrophobicContact CG1-CD 4.1Å; V144-K148 HydrophobicContact CG1-CG 4.5Å; V144-K148 WeakPolarHBondContact O-CB 3.17Å; V144-K148 VanDerWaalsContact O-CG 3.24Å; V144-K148 WeakPolarHBondContact O-CG 3.47Å; V144-K148 PolarHBondContact O-N 2.86Å
145L85.2Confident78.9Confident101 Ų101124.4 Ų124.453%0.52957%0.566SS.*Hα-helixtrans-68.2-38.9174.9-74.1174.5000112.4Q141 L142 Q143 K148 R149Q141-L145 WeakPolarHBondContact O-CG 3.47Å; Q141-L145 PolarHBondContact O-N 3.27Å; L142-L145 PolarHBondContact O-N 3.43Å; Q143-L145 VanDerWaalsContact C-N 3.32Å; Q143-L145 PolarHBondContact O-N 3.38Å; L145-K148 PolarHBondContact O-N 2.97Å; L145-R149 WeakPolarHBondContact O-CG 3.31Å; L145-R149 PolarHBondContact O-N 3.45Å
146R80.6Confident76.6Confident180 Ų180126.4 Ų126.468%0.67957%0.574SS**Hα-helixtrans-63.1-47.6173-76.4178.8-176.5-168.42.8110.7L142 Q143 K148 R149 E150L142-R146 WeakPolarHBondContact O-CB 3.41Å; L142-R146 VanDerWaalsContact O-CG 3.32Å; L142-R146 WeakPolarHBondContact O-CG 3.42Å; L142-R146 PolarHBondContact O-N 3.22Å; Q143-R146 CarbonylContact O-C 3.59Å; Q143-R146 WeakPolarHBondContact O-CB 3.28Å; Q143-R146 PolarHBondContact O-N 3.48Å; Q143-R146 VanDerWaalsContact O-N 3.12Å; R146-K148 VanDerWaalsContact C-N 3.34Å; R146-K148 PolarHBondContact O-N 2.88Å; R146-R149 CarbonylContact O-C 3.54Å; R146-R149 WeakPolarHBondContact O-CB 3.5Å; R146-R149 PolarHBondContact O-N 2.85Å; R146-R149 VanDerWaalsContact O-N 3.11Å; R146-E150 WeakPolarHBondContact O-CB 3.31Å; R146-E150 PolarHBondContact O-N 3.21Å
147E77.8Confident74.5Confident86 Ų86125.9 Ų125.940%0.40258%0.576SS.*Hα-helixtrans-60-41.8174.3-78.3-169.2-160.100112Q143 R149 E150 R151Q143-E147 PolarHBondContact O-N 2.95Å; E147-R149 VanDerWaalsContact C-N 3.31Å; E147-R149 PolarHBondContact O-N 3.4Å; E147-E150 PolarHBondContact O-N 3.44Å; E147-R151 VanDerWaalsContact O-CB 3.24Å; E147-R151 WeakPolarHBondContact O-CB 3.35Å; E147-R151 WeakPolarHBondContact O-CG 3.37Å; E147-R151 PolarHBondContact O-N 3.39Å; E147-R151 IonicContact OE2-CZ 2.88Å; E147-R151 IonicContact OE2-NE 3.89Å; E147-R151 IonicContact OE2-NH2 3.86Å; E147-R151 PolarHBondContact OE2-NH2 3.14Å
148K76.3Confident71.8Confident120 Ų120128.6 Ų128.652%0.52259%0.592SS.*Hα-helixtrans-64.5-35.7175.5-76.8172.8-179.3177.20112V144 L145 R146 R152V144-K148 HydrophobicContact CG1-CD 4.1Å; V144-K148 HydrophobicContact CG1-CG 4.5Å; V144-K148 WeakPolarHBondContact O-CB 3.17Å; V144-K148 VanDerWaalsContact O-CG 3.24Å; V144-K148 WeakPolarHBondContact O-CG 3.47Å; V144-K148 PolarHBondContact O-N 2.86Å; L145-K148 PolarHBondContact O-N 2.97Å; R146-K148 VanDerWaalsContact C-N 3.34Å; R146-K148 PolarHBondContact O-N 2.88Å; K148-R152 VanDerWaalsContact O-CG 3.26Å; K148-R152 WeakPolarHBondContact O-CG 3.4Å; K148-R152 PolarHBondContact O-N 3.47Å; K148-R152 VanDerWaalsContact O-N 3.17Å
149R71.3Confident70.1Confident180 Ų180133.8 Ų133.868%0.67962%0.621SS**Hα-helixtrans-71.7-38.7173.4-79.3-178.9176.8170.60.7112L145 R146 E147 R152 R153L145-R149 WeakPolarHBondContact O-CG 3.31Å; L145-R149 PolarHBondContact O-N 3.45Å; R146-R149 CarbonylContact O-C 3.54Å; R146-R149 WeakPolarHBondContact O-CB 3.5Å; R146-R149 PolarHBondContact O-N 2.85Å; R146-R149 VanDerWaalsContact O-N 3.11Å; E147-R149 VanDerWaalsContact C-N 3.31Å; E147-R149 PolarHBondContact O-N 3.4Å; R149-R152 PolarHBondContact O-N 2.95Å; R149-R153 WeakPolarHBondContact O-CG 3.31Å; R149-R153 PolarHBondContact O-N 3.23Å; R149-R153 VanDerWaalsContact O-N 3.17Å
150E64.7Low68.2Low118 Ų118133.7 Ų133.755%0.55163%0.628SS**Hα-helixtrans-67.3-46.4174.1-87.3-179.515700111.3R146 E147 R152 R153 T154R146-E150 WeakPolarHBondContact O-CB 3.31Å; R146-E150 PolarHBondContact O-N 3.21Å; E147-E150 PolarHBondContact O-N 3.44Å; E150-R152 PolarHBondContact O-N 3.14Å; E150-R153 CarbonylContact O-C 3.44Å; E150-R153 WeakPolarHBondContact O-CA 3.46Å; E150-R153 WeakPolarHBondContact O-CB 3.36Å; E150-R153 PolarHBondContact O-N 2.94Å; E150-T154 WeakPolarHBondContact O-CG2 3.23Å; E150-T154 PolarHBondContact O-N 3.31Å; E150-T154 PolarHBondContact O-OG1 2.97Å; E150-T154 VanDerWaalsContact O-OG1 3.13Å
151R63.9Low66.5Low162 Ų162135.3 Ų135.361%0.61164%0.639SS**Hα-helixtrans-57.2-35.3174-72.8176.7-165.7-149.39.2112.3E147 R153 T154 I155E147-R151 VanDerWaalsContact O-CB 3.24Å; E147-R151 WeakPolarHBondContact O-CB 3.35Å; E147-R151 WeakPolarHBondContact O-CG 3.37Å; E147-R151 PolarHBondContact O-N 3.39Å; E147-R151 IonicContact OE2-CZ 2.88Å; E147-R151 IonicContact OE2-NE 3.89Å; E147-R151 IonicContact OE2-NH2 3.86Å; E147-R151 PolarHBondContact OE2-NH2 3.14Å; R151-R153 VanDerWaalsContact C-N 3.33Å; R151-T154 WeakPolarHBondContact CA-OG1 3.41Å; R151-T154 PolarHBondContact O-OG1 3.34Å; R151-I155 WeakPolarHBondContact O-CG1 3.46Å; R151-I155 PolarHBondContact O-N 3.04Å
152R63.3Low64.6Low204 Ų204138.7 Ų138.777%0.7765%0.652SS**Hα-helixtrans-72.6-22.2172.5-73.8173.9-175.6-93.42113.4K148 R149 E150K148-R152 VanDerWaalsContact O-CG 3.26Å; K148-R152 WeakPolarHBondContact O-CG 3.4Å; K148-R152 PolarHBondContact O-N 3.47Å; K148-R152 VanDerWaalsContact O-N 3.17Å; R149-R152 PolarHBondContact O-N 2.95Å; E150-R152 PolarHBondContact O-N 3.14Å
153R56.5Low62.9Low190 Ų190143.1 Ų143.172%0.71767%0.67SS**Hα-helixtrans-87.8-31.6173.4-69.6170.7179.4179.2-2.1112.4R149 E150 R151 I155R149-R153 WeakPolarHBondContact O-CG 3.31Å; R149-R153 PolarHBondContact O-N 3.23Å; R149-R153 VanDerWaalsContact O-N 3.17Å; E150-R153 CarbonylContact O-C 3.44Å; E150-R153 WeakPolarHBondContact O-CA 3.46Å; E150-R153 WeakPolarHBondContact O-CB 3.36Å; E150-R153 PolarHBondContact O-N 2.94Å; R151-R153 VanDerWaalsContact C-N 3.33Å; R153-I155 VanDerWaalsContact C-N 3.35Å; R153-I155 PolarHBondContact O-N 3.34Å
154T52.2Low61.2Low79 Ų79145.2 Ų145.249%0.48568%0.684SS.*G310 helixtrans-86.73.9-178.257.90000114.2E150 R151 H156 T157E150-T154 WeakPolarHBondContact O-CG2 3.23Å; E150-T154 PolarHBondContact O-N 3.31Å; E150-T154 PolarHBondContact O-OG1 2.97Å; E150-T154 VanDerWaalsContact O-OG1 3.13Å; R151-T154 WeakPolarHBondContact CA-OG1 3.41Å; R151-T154 PolarHBondContact O-OG1 3.34Å; T154-H156 PolarHBondContact O-N 3.4Å; T154-H156 VanDerWaalsContact O-N 3.13Å; T154-T157 PolarHBondContact O-N 2.88Å
155I52.6Low59.5Low145 Ų145148 Ų14874%0.74471%0.705SS**G310 helixtrans-59-19.6162.9-62.1172.4000110.3R151 R153R151-I155 WeakPolarHBondContact O-CG1 3.46Å; R151-I155 PolarHBondContact O-N 3.04Å; R153-I155 VanDerWaalsContact C-N 3.35Å; R153-I155 PolarHBondContact O-N 3.34Å
156H48.4Very low57.7Low175 Ų175149.7 Ų149.781%0.8172%0.72SS**G310 helixtrans-112.616.1176.7-114.6-55.9000116.3T154T154-H156 PolarHBondContact O-N 3.4Å; T154-H156 VanDerWaalsContact O-N 3.13Å
157T50Low55.7Low100 Ų100146 Ų14661%0.61372%0.721SS**SBendtrans-157.8131.6170.1-4.60000113.2T154T154-T157 PolarHBondContact O-N 2.88Å
158F38.9Very low54.5Low201 Ų201147.7 Ų147.788%0.88274%0.74SS**  trans-51.2140.4-174.3-80.8-97.5000115C160F158-C160 PolarHBondContact O-N 3.46Å
159P58.6Low53Low137 Ų137151.4 Ų151.489%0.8975%0.751SS**  trans-75.5101.1168.2-6.123000110.2
160C52.9Low51.8Low99 Ų99149 Ų14967%0.66976%0.76SS**  trans-128.4108.7173.2176.60000108.8F158F158-C160 PolarHBondContact O-N 3.46Å
161L53.6Low50.7Low155 Ų155152.7 Ų152.781%0.81277%0.774SS**  trans51.478.8146.2-55.6175.4000116.6
162K48.3Very low49.7Very low201 Ų201148.9 Ų148.987%0.87477%0.766SS**  trans-132.334.2163.7-150.2172.9-177.9179.80113.5
163E53.6Low48.9Very low189 Ų189142.5 Ų142.588%0.88376%0.757SS**SBendtrans-117.58.5174.1-82.3-166.9168.800114.5
164L50.1Low48.4Very low161 Ų161143.3 Ų143.384%0.84377%0.767SS**SBendtrans-116.99.9-179.1-70174.6000116
165C50.9Low48.1Very low124 Ų124149.3 Ų149.384%0.83878%0.78SS**  trans-135.754.5-179.7-69.30000113.3
166T48.2Very low47.7Very low137 Ų137147.9 Ų147.984%0.8477%0.774SS**SBendtrans-146.975.9162.4-9.30000111.5
167S36.8Very low47.4Very low102 Ų102147.3 Ų147.371%0.71377%0.771SS**  160.4106.1128.7-1760000111R169S167-R169 PolarHBondContact O-N 2.95Å
168P53.8Low47.1Very low123 Ų123147.2 Ų147.280%0.79977%0.774SS**  trans-86.495.2162.831.9-23.3000108.2
169R44.3Very low47.2Very low197 Ų197141.5 Ų141.574%0.74376%0.759SS**  trans-172.639.5158.5-107.1173.5-139.2-139.610.2114.8S167 K171S167-R169 PolarHBondContact O-N 2.95Å; R169-K171 PolarHBondContact O-N 3.44Å
170C46.4Very low46.6Very low130 Ų130139.3 Ų139.388%0.87875%0.747SS**THydrogen-bonded Turntrans-82.764.8159.7-158.50000109.6
171K41.6Very low46.5Very low195 Ų195142 Ų14285%0.84875%0.754SS**THydrogen-bonded Turntrans-143.99.2168.4-80.7-161177.9-1790114.1R169R169-K171 PolarHBondContact O-N 3.44Å
172D42.9Very low46.2Very low82 Ų82143 Ų14344%0.43976%0.755SS.*  trans-108.713.5178.3-76.1-28000114.1
173A46.3Very low46.3Very low71 Ų71139.1 Ų139.159%0.58774%0.743SS**THydrogen-bonded Turntrans-80.1-15.4177.800000114.2
174F45.7Very low46.2Very low207 Ų207132 Ų13291%0.90872%0.72SS**THydrogen-bonded Turntrans-110.29.1-179.3-75.2-79.2000114.4
175R45.3Very low46.7Very low205 Ų205128.4 Ų128.477%0.77471%0.706SS**SBendtrans-119.63.4174.1-151.6-176.4-78.7-154.8-2.9114.1
176L45.2Very low47.4Very low115 Ų115132.3 Ų132.360%0.60270%0.703SS**SBendtrans-10214.1176.4-70.5172.8000113.7
177H42.6Very low48.6Very low163 Ų163128.4 Ų128.476%0.75568%0.681SS**SBendtrans-112.710.3171-73.4-8.2000113.9
178S42.8Very low50.5Low97 Ų97128.9 Ų128.968%0.67867%0.674SS**SBendtrans-101.2-4.9164.9-56.20000113.2
179S41Very low52Low82 Ų82127.9 Ų127.957%0.57366%0.659SS**SBendtrans-93.2-3.1174.453.20000113.7L181S179-L181 VanDerWaalsContact C-N 3.35Å
180S46.1Very low54.1Low91 Ų91123.2 Ų123.264%0.63665%0.646SS**SBendtrans-89.61.5174.2-1660000113.6
181L50.4Low56.1Low156 Ų156122.1 Ų122.182%0.81763%0.628SS**SBendtrans-104.50.2174.9-88.2156.8000113.4S179S179-L181 VanDerWaalsContact C-N 3.35Å
182E48.3Very low58.3Low175 Ų175117 Ų11782%0.81861%0.61SS**  trans-109.751.3169.8-67.6-167.1179.900111.2G184E182-G184 PolarHBondContact O-N 3.44Å
183L50.3Low60.7Low119 Ų119119.1 Ų119.162%0.62362%0.617SS**  trans-67.290.5140.6-77.3158.6000104.7P187L183-P187 HydrophobicContact CD2-CB 4.33Å; L183-P187 HydrophobicContact CD2-CG 3.86Å
184G50.9Low63Low39 Ų39122.4 Ų122.440%0.40261%0.614SS.*  trans-51159.6171.500000110E182 R186 P187E182-G184 PolarHBondContact O-N 3.44Å; G184-R186 PolarHBondContact O-N 2.89Å; G184-P187 WeakPolarHBondContact O-CD 3.31Å
185P61.2Low65.4Low87 Ų87117.5 Ų117.557%0.56560%0.597SS**SBendtrans-48.7-24.1-168.3-29.233.7000116.7L188 E189P185-L188 PolarHBondContact O-N 3.48Å; P185-E189 HydrophobicContact CB-CG 4.3Å; P185-E189 WeakPolarHBondContact CB-OE1 3.32Å; P185-E189 WeakPolarHBondContact O-CB 3.44Å; P185-E189 WeakPolarHBondContact O-CG 3.44Å; P185-E189 PolarHBondContact O-N 3.36Å
186R64.7Low67.8Low205 Ų205113.5 Ų113.577%0.77459%0.587SS**Hα-helixtrans-60.4-42.5-168.6-66.8-173170.5-177.6-2.6117.9G184 E189 Q190G184-R186 PolarHBondContact O-N 2.89Å; R186-E189 WeakPolarHBondContact CA-OE2 3.41Å; R186-Q190 WeakPolarHBondContact O-CB 3.41Å; R186-Q190 PolarHBondContact O-N 3.2Å
187P73.4Confident70.3Confident56 Ų56111.7 Ų111.736%0.36458%0.584SS.*Hα-helixtrans-71.1-38.7178.1-17.232.9000111.7L183 G184 Q190 E191L183-P187 HydrophobicContact CD2-CB 4.33Å; L183-P187 HydrophobicContact CD2-CG 3.86Å; G184-P187 WeakPolarHBondContact O-CD 3.31Å; P187-Q190 PolarHBondContact O-N 2.92Å; P187-E191 WeakPolarHBondContact O-CG 3.38Å; P187-E191 PolarHBondContact O-N 3.18Å
188L78.3Confident72.9Confident111 Ų111108.6 Ų108.658%0.58157%0.573SS**Hα-helixtrans-69.1-38.4175.4-68.4172.4000111.3P185 E191 N192P185-L188 PolarHBondContact O-N 3.48Å; L188-E191 PolarHBondContact O-N 2.92Å; L188-N192 VanDerWaalsContact O-CB 3.27Å; L188-N192 WeakPolarHBondContact O-CB 3.4Å; L188-N192 PolarHBondContact O-N 3.31Å
189E84.3Confident75.5Confident102 Ų102107.1 Ų107.148%0.47756%0.559SS.*Hα-helixtrans-60.3-45.8172.2-76.4164.7177.300111.3P185 R186 E191 N192 E193P185-E189 HydrophobicContact CB-CG 4.3Å; P185-E189 WeakPolarHBondContact CB-OE1 3.32Å; P185-E189 WeakPolarHBondContact O-CB 3.44Å; P185-E189 WeakPolarHBondContact O-CG 3.44Å; P185-E189 PolarHBondContact O-N 3.36Å; R186-E189 WeakPolarHBondContact CA-OE2 3.41Å; E189-E191 PolarHBondContact O-N 2.8Å; E189-N192 WeakPolarHBondContact O-CB 3.31Å; E189-N192 PolarHBondContact O-N 2.89Å; E189-N192 VanDerWaalsContact O-N 3.16Å; E189-E193 WeakPolarHBondContact O-CG 3.4Å; E189-E193 PolarHBondContact O-N 3.24Å
190Q88.1Confident78.3Confident99 Ų99105 Ų10546%0.46355%0.55SS.*Hα-helixtrans-66.1-38.4178.1-169174.746.400112.5R186 P187 N192 R194R186-Q190 WeakPolarHBondContact O-CB 3.41Å; R186-Q190 PolarHBondContact O-N 3.2Å; P187-Q190 PolarHBondContact O-N 2.92Å; Q190-N192 VanDerWaalsContact C-N 3.34Å; Q190-R194 WeakPolarHBondContact O-CB 3.31Å; Q190-R194 VanDerWaalsContact O-CG 3.26Å; Q190-R194 WeakPolarHBondContact O-CG 3.38Å; Q190-R194 PolarHBondContact O-N 3.29Å
191E88.8Confident80.7Confident107 Ų107103.1 Ų103.150%0.554%0.54SS..Hα-helixtrans-66-37.9171.7-74.4-172.7170.700111.9P187 L188 E189 R194 L195P187-E191 WeakPolarHBondContact O-CG 3.38Å; P187-E191 PolarHBondContact O-N 3.18Å; L188-E191 PolarHBondContact O-N 2.92Å; E189-E191 PolarHBondContact O-N 2.8Å; E191-R194 PolarHBondContact O-N 2.99Å; E191-L195 WeakPolarHBondContact O-CB 3.46Å; E191-L195 VanDerWaalsContact O-CG 3.26Å; E191-L195 WeakPolarHBondContact O-CG 3.35Å; E191-L195 PolarHBondContact O-N 3.34Å
192N88.8Confident82.9Confident88 Ų8899.9 Ų99.947%0.47152%0.523SS..Hα-helixtrans-65.8-41.4176.6-152.2-28.4000111.4L188 E189 Q190 L195 Q196L188-N192 VanDerWaalsContact O-CB 3.27Å; L188-N192 WeakPolarHBondContact O-CB 3.4Å; L188-N192 PolarHBondContact O-N 3.31Å; E189-N192 WeakPolarHBondContact O-CB 3.31Å; E189-N192 PolarHBondContact O-N 2.89Å; E189-N192 VanDerWaalsContact O-N 3.16Å; Q190-N192 VanDerWaalsContact C-N 3.34Å; N192-L195 PolarHBondContact O-N 2.92Å; N192-Q196 WeakPolarHBondContact O-CB 3.35Å; N192-Q196 WeakPolarHBondContact O-CG 3.44Å; N192-Q196 PolarHBondContact O-N 2.99Å; N192-Q196 PolarHBondContact OD1-NE2 2.91Å
193E93.4Very high85.3Confident127 Ų127100.4 Ų100.459%0.59352%0.518SS*.Hα-helixtrans-62.9-40.7172.1-72.4176.4174.800112.3E189 Q196 S197E189-E193 WeakPolarHBondContact O-CG 3.4Å; E189-E193 PolarHBondContact O-N 3.24Å; E193-Q196 PolarHBondContact O-N 3.37Å; E193-S197 WeakPolarHBondContact O-CB 3.48Å; E193-S197 PolarHBondContact O-N 3.03Å; E193-S197 PolarHBondContact O-OG 3Å; E193-S197 VanDerWaalsContact O-OG 3.08Å
194R94.3Very high87.5Confident139 Ų13998 Ų9853%0.52551%0.511SS..Hα-helixtrans-64.3-43.1174-74.1174-173.7151.95.3111.7Q190 E191 S197 L198Q190-R194 WeakPolarHBondContact O-CB 3.31Å; Q190-R194 VanDerWaalsContact O-CG 3.26Å; Q190-R194 WeakPolarHBondContact O-CG 3.38Å; Q190-R194 PolarHBondContact O-N 3.29Å; E191-R194 PolarHBondContact O-N 2.99Å; R194-S197 WeakPolarHBondContact CA-OG 3.36Å; R194-S197 PolarHBondContact O-N 2.98Å; R194-S197 PolarHBondContact O-OG 3.39Å; R194-L198 WeakPolarHBondContact O-CB 3.23Å; R194-L198 PolarHBondContact O-N 3.37Å
195L95.8Very high89.7Confident104 Ų104101.3 Ų101.355%0.54552%0.516SS..Hα-helixtrans-66-39.9175.7-72.1172.1000111.4E191 N192 L198 V199E191-L195 WeakPolarHBondContact O-CB 3.46Å; E191-L195 VanDerWaalsContact O-CG 3.26Å; E191-L195 WeakPolarHBondContact O-CG 3.35Å; E191-L195 PolarHBondContact O-N 3.34Å; N192-L195 PolarHBondContact O-N 2.92Å; L195-L198 PolarHBondContact O-N 2.88Å; L195-V199 WeakPolarHBondContact O-CB 3.45Å; L195-V199 WeakPolarHBondContact O-CG2 3.32Å; L195-V199 PolarHBondContact O-N 3.46Å
196Q96.2Very high91.5Very high121 Ų121100.6 Ų100.657%0.56551%0.51SS*.Hα-helixtrans-64.4-42.2175.9-74.7170.924.600111.9N192 E193 V199 G200N192-Q196 WeakPolarHBondContact O-CB 3.35Å; N192-Q196 WeakPolarHBondContact O-CG 3.44Å; N192-Q196 PolarHBondContact O-N 2.99Å; N192-Q196 PolarHBondContact OD1-NE2 2.91Å; E193-Q196 PolarHBondContact O-N 3.37Å; Q196-V199 PolarHBondContact O-N 3.27Å; Q196-G200 PolarHBondContact O-N 3.5Å
197S96.9Very high93.1Very high78 Ų7894.2 Ų94.255%0.54550%0.497SS..Hα-helixtrans-67.3-39.7175.159.50000112.2E193 R194 G200 A201E193-S197 WeakPolarHBondContact O-CB 3.48Å; E193-S197 PolarHBondContact O-N 3.03Å; E193-S197 PolarHBondContact O-OG 3Å; E193-S197 VanDerWaalsContact O-OG 3.08Å; R194-S197 WeakPolarHBondContact CA-OG 3.36Å; R194-S197 PolarHBondContact O-N 2.98Å; R194-S197 PolarHBondContact O-OG 3.39Å; S197-G200 PolarHBondContact O-N 2.87Å; S197-A201 WeakPolarHBondContact O-CB 3.47Å; S197-A201 PolarHBondContact O-N 2.96Å
198L97.8Very high94.2Very high98 Ų9896 Ų9651%0.51350%0.5SS..Hα-helixtrans-63.6-44.2173.5-175.766.6000111.8R194 L195 G200 A201 L202R194-L198 WeakPolarHBondContact O-CB 3.23Å; R194-L198 PolarHBondContact O-N 3.37Å; L195-L198 PolarHBondContact O-N 2.88Å; L198-G200 VanDerWaalsContact C-N 3.3Å; L198-G200 PolarHBondContact O-N 2.83Å; L198-A201 PolarHBondContact O-N 2.91Å; L198-L202 HydrophobicContact CG-CD1 4.23Å; L198-L202 WeakPolarHBondContact O-CB 3.48Å; L198-L202 WeakPolarHBondContact O-CG 3.34Å; L198-L202 PolarHBondContact O-N 3.35Å
199V97.6Very high95.2Very high66 Ų6695.2 Ų95.240%0.449%0.493SS..Hα-helixtrans-63-39.2175.1168.50000110.6L195 Q196 L202 R203L195-V199 WeakPolarHBondContact O-CB 3.45Å; L195-V199 WeakPolarHBondContact O-CG2 3.32Å; L195-V199 PolarHBondContact O-N 3.46Å; Q196-V199 PolarHBondContact O-N 3.27Å; V199-L202 PolarHBondContact O-N 2.92Å; V199-R203 HydrophobicContact CG1-CG 4.44Å; V199-R203 WeakPolarHBondContact O-CB 3.49Å; V199-R203 WeakPolarHBondContact O-CG 3.4Å; V199-R203 PolarHBondContact O-N 3.41Å
200G97.8Very high95.8Very high37 Ų3798.3 Ų98.338%0.38150%0.501SS..Hα-helixtrans-60.5-45.917300000112.6Q196 S197 L198 R203 S204Q196-G200 PolarHBondContact O-N 3.5Å; S197-G200 PolarHBondContact O-N 2.87Å; L198-G200 VanDerWaalsContact C-N 3.3Å; L198-G200 PolarHBondContact O-N 2.83Å; G200-R203 PolarHBondContact O-N 3.27Å; G200-S204 PolarHBondContact O-N 3.23Å
201A97.4Very high96.3Very high51 Ų5198.2 Ų98.242%0.42150%0.5SS..Hα-helixtrans-65.8-41.9176.700000112.5S197 L198 R203 S204 Q205S197-A201 WeakPolarHBondContact O-CB 3.47Å; S197-A201 PolarHBondContact O-N 2.96Å; L198-A201 PolarHBondContact O-N 2.91Å; A201-R203 VanDerWaalsContact C-N 3.34Å; A201-R203 PolarHBondContact O-N 3.12Å; A201-S204 PolarHBondContact O-N 3.08Å; A201-S204 PolarHBondContact O-OG 3.38Å; A201-Q205 WeakPolarHBondContact O-CB 3.23Å; A201-Q205 PolarHBondContact O-N 3.2Å
202L97.7Very high96.7Very high89 Ų8998.6 Ų98.647%0.46650%0.497SS..Hα-helixtrans-64.6-39175-72.7173.2000111.4L198 V199 Q205 V206L198-L202 HydrophobicContact CG-CD1 4.23Å; L198-L202 WeakPolarHBondContact O-CB 3.48Å; L198-L202 WeakPolarHBondContact O-CG 3.34Å; L198-L202 PolarHBondContact O-N 3.35Å; V199-L202 PolarHBondContact O-N 2.92Å; L202-Q205 PolarHBondContact O-N 2.95Å; L202-V206 WeakPolarHBondContact O-CB 3.29Å; L202-V206 VanDerWaalsContact O-CG2 3.24Å; L202-V206 WeakPolarHBondContact O-CG2 3.37Å; L202-V206 PolarHBondContact O-N 3.25Å
203R98.1Very high97.1Very high186 Ų186100.7 Ų100.770%0.70250%0.502SS*.Hα-helixtrans-64.2-43.6175.3-76.1174.7-177.5-158.92.7112V199 G200 A201 V206 S207V199-R203 HydrophobicContact CG1-CG 4.44Å; V199-R203 WeakPolarHBondContact O-CB 3.49Å; V199-R203 WeakPolarHBondContact O-CG 3.4Å; V199-R203 PolarHBondContact O-N 3.41Å; G200-R203 PolarHBondContact O-N 3.27Å; A201-R203 VanDerWaalsContact C-N 3.34Å; A201-R203 PolarHBondContact O-N 3.12Å; R203-V206 PolarHBondContact O-N 3.34Å; R203-S207 PolarHBondContact O-N 3.23Å
204S96.8Very high97.4Very high69 Ų6998.7 Ų98.748%0.48349%0.493SS..Hα-helixtrans-66.4-41176.767.80000111.4G200 A201 S207 Q208G200-S204 PolarHBondContact O-N 3.23Å; A201-S204 PolarHBondContact O-N 3.08Å; A201-S204 PolarHBondContact O-OG 3.38Å; S204-S207 WeakPolarHBondContact CA-OG 3.49Å; S204-S207 PolarHBondContact O-N 3.39Å; S204-S207 PolarHBondContact O-OG 3.41Å; S204-Q208 PolarHBondContact O-N 3.13Å
205Q97.5Very high97.5Very high107 Ų10798.1 Ų98.150%0.549%0.491SS..Hα-helixtrans-61-46.3174.7-172.7177.6-4.300111.8A201 L202 S207 Q208 E209A201-Q205 WeakPolarHBondContact O-CB 3.23Å; A201-Q205 PolarHBondContact O-N 3.2Å; L202-Q205 PolarHBondContact O-N 2.95Å; Q205-S207 VanDerWaalsContact C-N 3.3Å; Q205-S207 PolarHBondContact O-N 3.49Å; Q205-Q208 PolarHBondContact O-N 2.9Å; Q205-E209 WeakPolarHBondContact O-CG 3.49Å; Q205-E209 PolarHBondContact O-N 3.27Å
206V97.9Very high97.5Very high73 Ų7395.6 Ų95.644%0.44249%0.485SS..Hα-helixtrans-61.1-39.2175.11690000111.4L202 R203 Q208 E209 R210L202-V206 WeakPolarHBondContact O-CB 3.29Å; L202-V206 VanDerWaalsContact O-CG2 3.24Å; L202-V206 WeakPolarHBondContact O-CG2 3.37Å; L202-V206 PolarHBondContact O-N 3.25Å; R203-V206 PolarHBondContact O-N 3.34Å; V206-Q208 VanDerWaalsContact C-N 3.35Å; V206-E209 PolarHBondContact O-N 2.97Å; V206-R210 VanDerWaalsContact O-CG 3.29Å; V206-R210 WeakPolarHBondContact O-CG 3.35Å; V206-R210 PolarHBondContact O-N 3.47Å
207S97.4Very high97.6Very high71 Ų7194.4 Ų94.450%0.49748%0.48SS..Hα-helixtrans-66-37.2176.175.50000112.6R203 S204 Q205 R210 Q211R203-S207 PolarHBondContact O-N 3.23Å; S204-S207 WeakPolarHBondContact CA-OG 3.49Å; S204-S207 PolarHBondContact O-N 3.39Å; S204-S207 PolarHBondContact O-OG 3.41Å; Q205-S207 VanDerWaalsContact C-N 3.3Å; Q205-S207 PolarHBondContact O-N 3.49Å; S207-R210 PolarHBondContact O-N 3.42Å; S207-Q211 PolarHBondContact O-N 2.89Å
208Q97.9Very high97.7Very high94 Ų9497.1 Ų97.144%0.43948%0.478SS..Hα-helixtrans-69.1-41.5176.6-170.2175.646.500111.3S204 Q205 V206 Q211 R212S204-Q208 PolarHBondContact O-N 3.13Å; Q205-Q208 PolarHBondContact O-N 2.9Å; V206-Q208 VanDerWaalsContact C-N 3.35Å; Q208-Q211 PolarHBondContact O-N 3.5Å; Q208-R212 WeakPolarHBondContact O-CG 3.35Å; Q208-R212 PolarHBondContact O-N 3.32Å
209E97.9Very high97.7Very high93 Ų9398.6 Ų98.644%0.43548%0.482SS..Hα-helixtrans-63.7-40.7174.1-72.5-53.6141.500112.1Q205 V206 Q211 R212 K213Q205-E209 WeakPolarHBondContact O-CG 3.49Å; Q205-E209 PolarHBondContact O-N 3.27Å; V206-E209 PolarHBondContact O-N 2.97Å; E209-Q211 VanDerWaalsContact C-N 3.34Å; E209-Q211 PolarHBondContact O-N 2.87Å; E209-R212 PolarHBondContact O-N 2.91Å; E209-R212 IonicContact OE1-CZ 3.77Å; E209-R212 IonicContact OE1-NH1 2.88Å; E209-R212 PolarHBondContact OE1-NH1 2.88Å; E209-K213 WeakPolarHBondContact O-CB 3.44Å; E209-K213 PolarHBondContact O-N 3.43Å
210R98Very high97.6Very high168 Ų168102.7 Ų102.763%0.63449%0.491SS*.Hα-helixtrans-59.6-45.3173-74.8175.1-175.5-165.20.7111.5V206 S207 R212 K213 E214V206-R210 VanDerWaalsContact O-CG 3.29Å; V206-R210 WeakPolarHBondContact O-CG 3.35Å; V206-R210 PolarHBondContact O-N 3.47Å; S207-R210 PolarHBondContact O-N 3.42Å; R210-R212 PolarHBondContact O-N 2.93Å; R210-K213 PolarHBondContact O-N 2.92Å; R210-E214 WeakPolarHBondContact O-CG 3.48Å; R210-E214 PolarHBondContact O-N 2.92Å
211Q98.1Very high97.7Very high96 Ų96104.4 Ų104.445%0.44949%0.494SS..Hα-helixtrans-64.9-40.3177.9-168.9-178.626.200112.3S207 Q208 E209 E214 R215S207-Q211 PolarHBondContact O-N 2.89Å; Q208-Q211 PolarHBondContact O-N 3.5Å; E209-Q211 VanDerWaalsContact C-N 3.34Å; E209-Q211 PolarHBondContact O-N 2.87Å; Q211-E214 PolarHBondContact O-N 3.45Å; Q211-R215 VanDerWaalsContact O-CG 3.32Å; Q211-R215 WeakPolarHBondContact O-CG 3.46Å; Q211-R215 PolarHBondContact O-N 3.49Å
212R97.8Very high97.7Very high116 Ų116103.8 Ų103.844%0.43849%0.489SS..Hα-helixtrans-60.7-46.2174-74.5175.5-178.8143.74.4111Q208 E209 R210 R215 A216Q208-R212 WeakPolarHBondContact O-CG 3.35Å; Q208-R212 PolarHBondContact O-N 3.32Å; E209-R212 PolarHBondContact O-N 2.91Å; E209-R212 IonicContact OE1-CZ 3.77Å; E209-R212 IonicContact OE1-NH1 2.88Å; E209-R212 PolarHBondContact OE1-NH1 2.88Å; R210-R212 PolarHBondContact O-N 2.93Å; R212-R215 PolarHBondContact O-N 3.09Å; R212-A216 PolarHBondContact O-N 3.21Å
213K97.9Very high97.7Very high132 Ų132103.6 Ų103.657%0.57449%0.491SS*.Hα-helixtrans-58.7-49.1176.1-180178.5166.3178.10111.6E209 R210 R215 A216 E217E209-K213 WeakPolarHBondContact O-CB 3.44Å; E209-K213 PolarHBondContact O-N 3.43Å; R210-K213 PolarHBondContact O-N 2.92Å; K213-R215 VanDerWaalsContact C-N 3.28Å; K213-R215 PolarHBondContact O-N 3Å; K213-A216 PolarHBondContact O-N 3.37Å; K213-E217 WeakPolarHBondContact CE-OE1 3.39Å; K213-E217 HydrophobicContact CG-CG 4.42Å; K213-E217 IonicContact NZ-OE1 3.57Å; K213-E217 WeakPolarHBondContact O-CB 3.17Å; K213-E217 WeakPolarHBondContact O-CG 3.49Å; K213-E217 PolarHBondContact O-N 2.92Å
214E98.3Very high97.7Very high85 Ų8598.5 Ų98.540%0.39748%0.478SS..Hα-helixtrans-63.6-32.6178.8-70.3175.7-161.600112.9R210 Q211 R218R210-E214 WeakPolarHBondContact O-CG 3.48Å; R210-E214 PolarHBondContact O-N 2.92Å; Q211-E214 PolarHBondContact O-N 3.45Å; E214-R218 VanDerWaalsContact CB-NH1 3.32Å; E214-R218 VanDerWaalsContact O-CG 3.29Å; E214-R218 WeakPolarHBondContact O-CG 3.38Å; E214-R218 PolarHBondContact O-N 3.36Å; E214-R218 PolarHBondContact O-NH1 2.88Å; E214-R218 IonicContact OE2-CZ 3.71Å; E214-R218 IonicContact OE2-NH1 3.67Å; E214-R218 IonicContact OE2-NH2 2.61Å; E214-R218 PolarHBondContact OE2-NH2 2.9Å
215R97.8Very high97.8Very high126 Ų126100.9 Ų100.948%0.47548%0.481SS..Hα-helixtrans-67.3-47.6175.1-72.4173.8-169.6172.63.7110.7Q211 R212 K213 E217 R218 E219Q211-R215 VanDerWaalsContact O-CG 3.32Å; Q211-R215 WeakPolarHBondContact O-CG 3.46Å; Q211-R215 PolarHBondContact O-N 3.49Å; R212-R215 PolarHBondContact O-N 3.09Å; K213-R215 VanDerWaalsContact C-N 3.28Å; K213-R215 PolarHBondContact O-N 3Å; R215-E217 VanDerWaalsContact C-N 3.29Å; R215-E217 PolarHBondContact O-N 3.43Å; R215-R218 PolarHBondContact O-N 2.84Å; R215-R218 VanDerWaalsContact O-N 3.15Å; R215-E219 WeakPolarHBondContact O-CG 3.04Å; R215-E219 PolarHBondContact O-N 3.48Å
216A95.9Very high97.8Very high52 Ų52101.4 Ų101.443%0.4348%0.484SS..Hα-helixtrans-61-37.817500000112.2R212 K213 E219 Y220R212-A216 PolarHBondContact O-N 3.21Å; K213-A216 PolarHBondContact O-N 3.37Å; A216-E219 PolarHBondContact O-N 2.92Å; A216-Y220 WeakPolarHBondContact O-CB 3.23Å; A216-Y220 PolarHBondContact O-N 3.27Å
217E98Very high97.8Very high96 Ų96104.6 Ų104.645%0.44949%0.489SS..Hα-helixtrans-63.8-41.2174.5-76.5175.7169.700111.9K213 R215 Y220 T221K213-E217 WeakPolarHBondContact CE-OE1 3.39Å; K213-E217 HydrophobicContact CG-CG 4.42Å; K213-E217 IonicContact NZ-OE1 3.57Å; K213-E217 WeakPolarHBondContact O-CB 3.17Å; K213-E217 WeakPolarHBondContact O-CG 3.49Å; K213-E217 PolarHBondContact O-N 2.92Å; R215-E217 VanDerWaalsContact C-N 3.29Å; R215-E217 PolarHBondContact O-N 3.43Å; E217-Y220 PolarHBondContact O-N 3.36Å; E217-T221 WeakPolarHBondContact O-CG2 3.47Å; E217-T221 PolarHBondContact O-N 2.93Å; E217-T221 PolarHBondContact O-OG1 3Å
218R98.4Very high97.8Very high135 Ų135104.2 Ų104.251%0.50949%0.486SS..Hα-helixtrans-63.8-43.8175.3-71.1174.9-163.498.41.1111.8E214 R215 T221 A222E214-R218 VanDerWaalsContact CB-NH1 3.32Å; E214-R218 VanDerWaalsContact O-CG 3.29Å; E214-R218 WeakPolarHBondContact O-CG 3.38Å; E214-R218 PolarHBondContact O-N 3.36Å; E214-R218 PolarHBondContact O-NH1 2.88Å; E214-R218 IonicContact OE2-CZ 3.71Å; E214-R218 IonicContact OE2-NH1 3.67Å; E214-R218 IonicContact OE2-NH2 2.61Å; E214-R218 PolarHBondContact OE2-NH2 2.9Å; R215-R218 PolarHBondContact O-N 2.84Å; R215-R218 VanDerWaalsContact O-N 3.15Å; R218-T221 WeakPolarHBondContact CA-OG1 3.43Å; R218-T221 PolarHBondContact O-N 2.88Å; R218-T221 PolarHBondContact O-OG1 3.32Å; R218-A222 PolarHBondContact O-N 3.45Å
219E98Very high97.8Very high128 Ų128104.9 Ų104.960%0.59849%0.489SS*.Hα-helixtrans-60.8-45.8175.6-70.4164.4-166.400110.8R215 A216 T221 A222 V223R215-E219 WeakPolarHBondContact O-CG 3.04Å; R215-E219 PolarHBondContact O-N 3.48Å; A216-E219 PolarHBondContact O-N 2.92Å; E219-T221 PolarHBondContact O-N 3.27Å; E219-A222 PolarHBondContact O-N 2.93Å; E219-A222 VanDerWaalsContact O-N 3.17Å; E219-V223 WeakPolarHBondContact O-CG2 3.27Å; E219-V223 PolarHBondContact O-N 3.32Å
220Y96.2Very high97.8Very high153 Ų153105 Ų10560%0.649%0.492SS*.Hα-helixtrans-59.6-43.5175.1179.4-105.8000112.3A216 E217 A222 V223 L224A216-Y220 WeakPolarHBondContact O-CB 3.23Å; A216-Y220 PolarHBondContact O-N 3.27Å; E217-Y220 PolarHBondContact O-N 3.36Å; Y220-A222 VanDerWaalsContact C-N 3.32Å; Y220-A222 PolarHBondContact O-N 2.94Å; Y220-V223 PolarHBondContact O-N 3.29Å; Y220-L224 HydrophobicContact CD1-CD1 3.9Å; Y220-L224 HydrophobicContact CD1-CG 4.41Å; Y220-L224 HydrophobicContact CE1-CD1 3.33Å; Y220-L224 HydrophobicContact CE1-CG 4.01Å; Y220-L224 HydrophobicContact CE2-CD2 4.5Å; Y220-L224 HydrophobicContact CE2-CG 4.34Å; Y220-L224 WeakPolarHBondContact O-CG 3.41Å; Y220-L224 PolarHBondContact O-N 3.43Å
221T98.2Very high97.8Very high72 Ų72101.2 Ų101.244%0.44248%0.482SS..Hα-helixtrans-65.2-34.3176.554.80000113E217 R218 E219 Q225E217-T221 WeakPolarHBondContact O-CG2 3.47Å; E217-T221 PolarHBondContact O-N 2.93Å; E217-T221 PolarHBondContact O-OG1 3Å; R218-T221 WeakPolarHBondContact CA-OG1 3.43Å; R218-T221 PolarHBondContact O-N 2.88Å; R218-T221 PolarHBondContact O-OG1 3.32Å; E219-T221 PolarHBondContact O-N 3.27Å; T221-Q225 WeakPolarHBondContact O-CG 3.36Å; T221-Q225 PolarHBondContact O-N 3.02Å; T221-Q225 VanDerWaalsContact O-N 3.14Å
222A98Very high97.8Very high38 Ų38102.6 Ų102.631%0.31448%0.483SS..Hα-helixtrans-67.6-45.2175.700000111R218 E219 Y220 L224 Q225 E226R218-A222 PolarHBondContact O-N 3.45Å; E219-A222 PolarHBondContact O-N 2.93Å; E219-A222 VanDerWaalsContact O-N 3.17Å; Y220-A222 VanDerWaalsContact C-N 3.32Å; Y220-A222 PolarHBondContact O-N 2.94Å; A222-L224 VanDerWaalsContact C-N 3.3Å; A222-L224 PolarHBondContact O-N 3.05Å; A222-Q225 WeakPolarHBondContact O-CB 3.17Å; A222-Q225 PolarHBondContact O-N 3.08Å; A222-E226 WeakPolarHBondContact O-CG 3.47Å; A222-E226 PolarHBondContact O-N 2.97Å
223V98.2Very high97.8Very high85 Ų85101.5 Ų101.552%0.51548%0.483SS..Hα-helixtrans-61.2-39.2175.9173.80000111.6E219 Y220 Q225 E226 Y227E219-V223 WeakPolarHBondContact O-CG2 3.27Å; E219-V223 PolarHBondContact O-N 3.32Å; Y220-V223 PolarHBondContact O-N 3.29Å; V223-Q225 VanDerWaalsContact C-N 3.31Å; V223-Q225 PolarHBondContact O-N 2.9Å; V223-E226 PolarHBondContact O-N 3.16Å; V223-Y227 WeakPolarHBondContact O-CB 3.44Å; V223-Y227 PolarHBondContact O-N 2.92Å
224L98.3Very high97.8Very high79 Ų79100.4 Ų100.441%0.41448%0.483SS..Hα-helixtrans-63.1-36.8174.4-76.1179.8000112.7Y220 A222 S228Y220-L224 HydrophobicContact CD1-CD1 3.9Å; Y220-L224 HydrophobicContact CD1-CG 4.41Å; Y220-L224 HydrophobicContact CE1-CD1 3.33Å; Y220-L224 HydrophobicContact CE1-CG 4.01Å; Y220-L224 HydrophobicContact CE2-CD2 4.5Å; Y220-L224 HydrophobicContact CE2-CG 4.34Å; Y220-L224 WeakPolarHBondContact O-CG 3.41Å; Y220-L224 PolarHBondContact O-N 3.43Å; A222-L224 VanDerWaalsContact C-N 3.3Å; A222-L224 PolarHBondContact O-N 3.05Å; L224-S228 PolarHBondContact O-N 2.88Å
225Q98.3Very high97.8Very high120 Ų120100.1 Ų100.156%0.56149%0.489SS*.Hα-helixtrans-65.9-48.4175.3-72168.9-600110.6T221 A222 V223 Y227 S228 E229T221-Q225 WeakPolarHBondContact O-CG 3.36Å; T221-Q225 PolarHBondContact O-N 3.02Å; T221-Q225 VanDerWaalsContact O-N 3.14Å; A222-Q225 WeakPolarHBondContact O-CB 3.17Å; A222-Q225 PolarHBondContact O-N 3.08Å; V223-Q225 VanDerWaalsContact C-N 3.31Å; V223-Q225 PolarHBondContact O-N 2.9Å; Q225-Y227 VanDerWaalsContact C-N 3.31Å; Q225-Y227 PolarHBondContact O-N 3.3Å; Q225-S228 PolarHBondContact O-N 3.49Å; Q225-S228 VanDerWaalsContact O-N 3.14Å; Q225-S228 PolarHBondContact O-OG 3.42Å; Q225-E229 WeakPolarHBondContact O-CG 3.23Å; Q225-E229 PolarHBondContact O-N 2.98Å
226E98.3Very high97.8Very high118 Ų11898.6 Ų98.655%0.55149%0.487SS*.Hα-helixtrans-57.5-43.6175.8-68.8173.6-177.800111.6A222 V223 S228 E229 L230A222-E226 WeakPolarHBondContact O-CG 3.47Å; A222-E226 PolarHBondContact O-N 2.97Å; V223-E226 PolarHBondContact O-N 3.16Å; E226-S228 PolarHBondContact O-N 3.17Å; E226-E229 PolarHBondContact O-N 3.41Å; E226-L230 WeakPolarHBondContact O-CG 3.41Å; E226-L230 PolarHBondContact O-N 3.44Å
227Y96.8Very high97.8Very high140 Ų140102.4 Ų102.455%0.54950%0.498SS..Hα-helixtrans-59.4-46.1175.7-173.5-104.2000111.9V223 Q225 E229 L230 E231V223-Y227 WeakPolarHBondContact O-CB 3.44Å; V223-Y227 PolarHBondContact O-N 2.92Å; Q225-Y227 VanDerWaalsContact C-N 3.31Å; Q225-Y227 PolarHBondContact O-N 3.3Å; Y227-E229 VanDerWaalsContact C-N 3.3Å; Y227-E229 PolarHBondContact O-N 3.42Å; Y227-L230 PolarHBondContact O-N 3.27Å; Y227-E231 HydrophobicContact CD1-CG 4.25Å; Y227-E231 HydrophobicContact CE1-CG 3.99Å; Y227-E231 WeakPolarHBondContact CE1-OE1 3.37Å; Y227-E231 WeakPolarHBondContact O-CG 3.46Å; Y227-E231 PolarHBondContact O-N 2.94Å
228S98.1Very high97.8Very high62 Ų62103.1 Ų103.143%0.43450%0.501SS..Hα-helixtrans-65.3-32177.672.40000113.4L224 Q225 E226 R232L224-S228 PolarHBondContact O-N 2.88Å; Q225-S228 PolarHBondContact O-N 3.49Å; Q225-S228 VanDerWaalsContact O-N 3.14Å; Q225-S228 PolarHBondContact O-OG 3.42Å; E226-S228 PolarHBondContact O-N 3.17Å; S228-R232 PolarHBondContact O-N 2.83Å; S228-R232 VanDerWaalsContact O-N 3.1Å
229E98.2Very high97.8Very high108 Ų10899.5 Ų99.551%0.50550%0.5SS..Hα-helixtrans-70.3-41175.3-72.5178-173.600111.6Q225 E226 Y227 R232 Q233Q225-E229 WeakPolarHBondContact O-CG 3.23Å; Q225-E229 PolarHBondContact O-N 2.98Å; E226-E229 PolarHBondContact O-N 3.41Å; Y227-E229 VanDerWaalsContact C-N 3.3Å; Y227-E229 PolarHBondContact O-N 3.42Å; E229-R232 PolarHBondContact O-N 2.88Å; E229-Q233 WeakPolarHBondContact O-CG 3.48Å; E229-Q233 PolarHBondContact O-N 3.23Å
230L97.8Very high97.8Very high96 Ų9697 Ų9750%0.50350%0.496SS..Hα-helixtrans-64.6-43.6174.6-70.3172000111.5E226 Y227 R232 Q233 L234E226-L230 WeakPolarHBondContact O-CG 3.41Å; E226-L230 PolarHBondContact O-N 3.44Å; Y227-L230 PolarHBondContact O-N 3.27Å; L230-R232 VanDerWaalsContact C-N 3.31Å; L230-R232 PolarHBondContact O-N 3.37Å; L230-Q233 PolarHBondContact O-N 3.47Å; L230-Q233 VanDerWaalsContact O-N 3.16Å; L230-L234 WeakPolarHBondContact O-CG 3.28Å; L230-L234 PolarHBondContact O-N 3.16Å
231E97.8Very high97.9Very high89 Ų8995.9 Ų95.942%0.41649%0.491SS..Hα-helixtrans-57-45.4173.9-74.6-177.7146.100111.5Y227 Q233 L234 C235Y227-E231 HydrophobicContact CD1-CG 4.25Å; Y227-E231 HydrophobicContact CE1-CG 3.99Å; Y227-E231 WeakPolarHBondContact CE1-OE1 3.37Å; Y227-E231 WeakPolarHBondContact O-CG 3.46Å; Y227-E231 PolarHBondContact O-N 2.94Å; E231-Q233 VanDerWaalsContact C-N 3.35Å; E231-Q233 PolarHBondContact O-N 3.35Å; E231-L234 PolarHBondContact O-N 3.17Å; E231-C235 PolarHBondContact O-N 2.89Å; E231-C235 PolarHBondContact O-SG 3.17Å; E231-C235 VanDerWaalsContact O-SG 3.33Å
232R98.1Very high97.9Very high125 Ų12596.5 Ų96.547%0.47249%0.491SS..Hα-helixtrans-59.9-44.9175.6-175.9-171.162.578.47.7111.6S228 E229 L230 L234 C235 E236S228-R232 PolarHBondContact O-N 2.83Å; S228-R232 VanDerWaalsContact O-N 3.1Å; E229-R232 PolarHBondContact O-N 2.88Å; L230-R232 VanDerWaalsContact C-N 3.31Å; L230-R232 PolarHBondContact O-N 3.37Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-L234 PolarHBondContact O-N 3.01Å; R232-C235 PolarHBondContact O-N 2.68Å; R232-E236 IonicContact CZ-OE1 2.88Å; R232-E236 IonicContact CZ-OE2 3.62Å; R232-E236 IonicContact NH1-OE1 2.68Å; R232-E236 PolarHBondContact NH1-OE1 3.05Å; R232-E236 IonicContact NH1-OE2 2.67Å; R232-E236 PolarHBondContact NH1-OE2 2.8Å; R232-E236 WeakPolarHBondContact O-CG 2.97Å; R232-E236 PolarHBondContact O-N 3.42Å
233Q98.1Very high97.8Very high92 Ų92100.1 Ų100.143%0.4350%0.496SS..Hα-helixtrans-62.8-40.4178-72.5174.84.500111.9E229 L230 E231 E236 M237E229-Q233 WeakPolarHBondContact O-CG 3.48Å; E229-Q233 PolarHBondContact O-N 3.23Å; L230-Q233 PolarHBondContact O-N 3.47Å; L230-Q233 VanDerWaalsContact O-N 3.16Å; E231-Q233 VanDerWaalsContact C-N 3.35Å; E231-Q233 PolarHBondContact O-N 3.35Å; Q233-E236 PolarHBondContact O-N 2.89Å; Q233-M237 WeakPolarHBondContact O-CG 3.38Å; Q233-M237 PolarHBondContact O-N 2.8Å
234L97.6Very high97.8Very high110 Ų11099.6 Ų99.658%0.57649%0.493SS*.Hα-helixtrans-62.4-46.4175.2-72.3174000111.3L230 E231 R232 E236 M237 E238L230-L234 WeakPolarHBondContact O-CG 3.28Å; L230-L234 PolarHBondContact O-N 3.16Å; E231-L234 PolarHBondContact O-N 3.17Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-L234 PolarHBondContact O-N 3.01Å; L234-E236 VanDerWaalsContact C-N 3.27Å; L234-E236 PolarHBondContact O-N 2.91Å; L234-M237 PolarHBondContact O-N 3.31Å; L234-E238 WeakPolarHBondContact O-CB 3.5Å; L234-E238 WeakPolarHBondContact O-CG 3.5Å; L234-E238 PolarHBondContact O-N 3.44Å
235C97.9Very high97.8Very high78 Ų78100.2 Ų100.253%0.52749%0.494SS..Hα-helixtrans-58.5-38.9175.3-67.60000112.3E231 R232 A239E231-C235 PolarHBondContact O-N 2.89Å; E231-C235 PolarHBondContact O-SG 3.17Å; E231-C235 VanDerWaalsContact O-SG 3.33Å; R232-C235 PolarHBondContact O-N 2.68Å; C235-A239 WeakPolarHBondContact O-CB 3.33Å; C235-A239 PolarHBondContact O-N 2.77Å
236E98.1Very high97.7Very high95 Ų9599.2 Ų99.244%0.44449%0.489SS..Hα-helixtrans-66.4-43.9176.1-74.3170-178.400112R232 Q233 L234 A239 C240R232-E236 IonicContact CZ-OE1 2.88Å; R232-E236 IonicContact CZ-OE2 3.62Å; R232-E236 IonicContact NH1-OE1 2.68Å; R232-E236 PolarHBondContact NH1-OE1 3.05Å; R232-E236 IonicContact NH1-OE2 2.67Å; R232-E236 PolarHBondContact NH1-OE2 2.8Å; R232-E236 WeakPolarHBondContact O-CG 2.97Å; R232-E236 PolarHBondContact O-N 3.42Å; Q233-E236 PolarHBondContact O-N 2.89Å; L234-E236 VanDerWaalsContact C-N 3.27Å; L234-E236 PolarHBondContact O-N 2.91Å; E236-A239 PolarHBondContact O-N 2.84Å; E236-C240 PolarHBondContact O-N 2.95Å; E236-C240 PolarHBondContact O-SG 2.84Å; E236-C240 VanDerWaalsContact O-SG 3.33Å
237M96.2Very high97.7Very high131 Ų13197 Ų9765%0.64548%0.481SS*.Hα-helixtrans-64.9-39.8176.3-71.1-59.5-64.400112.1Q233 L234 C240 R241Q233-M237 WeakPolarHBondContact O-CG 3.38Å; Q233-M237 PolarHBondContact O-N 2.8Å; L234-M237 PolarHBondContact O-N 3.31Å; M237-C240 PolarHBondContact O-N 2.96Å; M237-R241 WeakPolarHBondContact O-CB 3.47Å; M237-R241 PolarHBondContact O-N 3.49Å
238E98.1Very high97.7Very high111 Ų11195.3 Ų95.352%0.51948%0.478SS..Hα-helixtrans-63.4-42.3174.1-74.3176.7173.100111.8L234 R241 L242L234-E238 WeakPolarHBondContact O-CB 3.5Å; L234-E238 WeakPolarHBondContact O-CG 3.5Å; L234-E238 PolarHBondContact O-N 3.44Å; E238-R241 WeakPolarHBondContact O-CB 3.36Å; E238-R241 PolarHBondContact O-N 2.88Å; E238-L242 WeakPolarHBondContact O-CG 3.39Å; E238-L242 PolarHBondContact O-N 3.37Å
239A97.9Very high97.6Very high59 Ų5994.5 Ų94.549%0.48848%0.475SS..Hα-helixtrans-62.3-43.4174.800000111.8C235 E236 L242 R243C235-A239 WeakPolarHBondContact O-CB 3.33Å; C235-A239 PolarHBondContact O-N 2.77Å; E236-A239 PolarHBondContact O-N 2.84Å; A239-L242 PolarHBondContact O-N 3.34Å; A239-R243 PolarHBondContact O-N 3.01Å
240C97.6Very high97.5Very high76 Ų7693.6 Ų93.651%0.51447%0.471SS..Hα-helixtrans-60.8-43.9173.4-71.60000111.8E236 M237 L242 R243 V244E236-C240 PolarHBondContact O-N 2.95Å; E236-C240 PolarHBondContact O-SG 2.84Å; E236-C240 VanDerWaalsContact O-SG 3.33Å; M237-C240 PolarHBondContact O-N 2.96Å; C240-L242 PolarHBondContact O-N 3.47Å; C240-R243 PolarHBondContact O-N 3.31Å; C240-V244 WeakPolarHBondContact O-CG2 3.36Å; C240-V244 PolarHBondContact O-N 3.2Å
241R97.9Very high97.4Very high130 Ų13094.3 Ų94.349%0.49148%0.475SS..Hα-helixtrans-60-45.6177.4-172.5-173.667.372.13111.5M237 E238 R243 V244 Q245M237-R241 WeakPolarHBondContact O-CB 3.47Å; M237-R241 PolarHBondContact O-N 3.49Å; E238-R241 WeakPolarHBondContact O-CB 3.36Å; E238-R241 PolarHBondContact O-N 2.88Å; R241-R243 VanDerWaalsContact C-N 3.32Å; R241-R243 PolarHBondContact O-N 3.35Å; R241-V244 PolarHBondContact O-N 3.3Å; R241-Q245 WeakPolarHBondContact O-CG 3.48Å; R241-Q245 PolarHBondContact O-N 3.19Å
242L97.7Very high97.3Very high84 Ų8494.8 Ų94.844%0.4448%0.479SS..Hα-helixtrans-62-41.5175.8-70.1173.6000111.2E238 A239 C240 V244 Q245 E246E238-L242 WeakPolarHBondContact O-CG 3.39Å; E238-L242 PolarHBondContact O-N 3.37Å; A239-L242 PolarHBondContact O-N 3.34Å; C240-L242 PolarHBondContact O-N 3.47Å; L242-V244 VanDerWaalsContact C-N 3.33Å; L242-V244 PolarHBondContact O-N 3.03Å; L242-Q245 WeakPolarHBondContact O-CB 3.47Å; L242-Q245 PolarHBondContact O-N 3.32Å; L242-E246 WeakPolarHBondContact O-CG 3.35Å; L242-E246 PolarHBondContact O-N 3.23Å
243R97.8Very high97.2Very high115 Ų11594.7 Ų94.743%0.43449%0.485SS..Hα-helixtrans-63.2-38.5177.3-17657.3-177.1156.39112.7A239 C240 R241 E246 L247 E250A239-R243 PolarHBondContact O-N 3.01Å; C240-R243 PolarHBondContact O-N 3.31Å; R241-R243 VanDerWaalsContact C-N 3.32Å; R241-R243 PolarHBondContact O-N 3.35Å; R243-E246 WeakPolarHBondContact CD-OE2 3.4Å; R243-E246 IonicContact CZ-OE2 3.84Å; R243-E246 IonicContact NH1-OE2 3.07Å; R243-E246 PolarHBondContact NH1-OE2 3.17Å; R243-E246 PolarHBondContact O-N 3.3Å; R243-L247 HydrophobicContact CG-CD1 4.37Å; R243-L247 VanDerWaalsContact O-CG 3.3Å; R243-L247 WeakPolarHBondContact O-CG 3.25Å; R243-L247 PolarHBondContact O-N 3.03Å; R243-E250 IonicContact NH1-OE1 2.75Å
244V97.3Very high97Very high74 Ų7495.9 Ų95.945%0.44849%0.493SS..Hα-helixtrans-63.3-44.5174.2172.30000110.5C240 R241 L242 E246 L247 E248C240-V244 WeakPolarHBondContact O-CG2 3.36Å; C240-V244 PolarHBondContact O-N 3.2Å; R241-V244 PolarHBondContact O-N 3.3Å; L242-V244 VanDerWaalsContact C-N 3.33Å; L242-V244 PolarHBondContact O-N 3.03Å; V244-E246 VanDerWaalsContact C-N 3.33Å; V244-E246 PolarHBondContact O-N 2.68Å; V244-L247 PolarHBondContact O-N 3.43Å; V244-L247 VanDerWaalsContact O-N 3.13Å; V244-E248 HydrophobicContact CG1-CG 4.33Å; V244-E248 WeakPolarHBondContact CG1-OE1 3.45Å; V244-E248 WeakPolarHBondContact O-CG 3.2Å; V244-E248 PolarHBondContact O-N 3.08Å
245Q97.4Very high96.7Very high91 Ų9194.2 Ų94.243%0.42548%0.482SS..Hα-helixtrans-61.9-38.9177-69.9-178.7-2800112.8R241 L242 E248 A249R241-Q245 WeakPolarHBondContact O-CG 3.48Å; R241-Q245 PolarHBondContact O-N 3.19Å; L242-Q245 WeakPolarHBondContact O-CB 3.47Å; L242-Q245 PolarHBondContact O-N 3.32Å; Q245-E248 PolarHBondContact O-N 3.42Å; Q245-A249 PolarHBondContact O-N 2.97Å
246E97.8Very high96.3Very high99 Ų9996.3 Ų96.346%0.46349%0.485SS..Hα-helixtrans-61.2-46.5172.2-70.9171.8179.100111.5L242 R243 V244 E248 A249 E250L242-E246 WeakPolarHBondContact O-CG 3.35Å; L242-E246 PolarHBondContact O-N 3.23Å; R243-E246 WeakPolarHBondContact CD-OE2 3.4Å; R243-E246 IonicContact CZ-OE2 3.84Å; R243-E246 IonicContact NH1-OE2 3.07Å; R243-E246 PolarHBondContact NH1-OE2 3.17Å; R243-E246 PolarHBondContact O-N 3.3Å; V244-E246 VanDerWaalsContact C-N 3.33Å; V244-E246 PolarHBondContact O-N 2.68Å; E246-E248 PolarHBondContact O-N 3.41Å; E246-A249 WeakPolarHBondContact O-CB 3.43Å; E246-A249 PolarHBondContact O-N 2.85Å; E246-E250 WeakPolarHBondContact O-CG 3.2Å; E246-E250 PolarHBondContact O-N 2.9Å
247L97.8Very high95.8Very high72 Ų7298.2 Ų98.238%0.37750%0.495SS..Hα-helixtrans-65.2-38.4178.9-71.1171.9000112.3R243 V244 A249 E250 L251R243-L247 HydrophobicContact CG-CD1 4.37Å; R243-L247 VanDerWaalsContact O-CG 3.3Å; R243-L247 WeakPolarHBondContact O-CG 3.25Å; R243-L247 PolarHBondContact O-N 3.03Å; V244-L247 PolarHBondContact O-N 3.43Å; V244-L247 VanDerWaalsContact O-N 3.13Å; L247-A249 VanDerWaalsContact C-N 3.33Å; L247-E250 PolarHBondContact O-N 3.05Å; L247-L251 WeakPolarHBondContact O-CB 3.15Å; L247-L251 VanDerWaalsContact O-CG 3.31Å; L247-L251 WeakPolarHBondContact O-CG 3.27Å; L247-L251 PolarHBondContact O-N 3.34Å
248E96.2Very high95.3Very high104 Ų10499.3 Ų99.349%0.48650%0.496SS..Hα-helixtrans-61.2-42.8173.1-73.8169.9177.600111.2V244 Q245 E246 L251 L252V244-E248 HydrophobicContact CG1-CG 4.33Å; V244-E248 WeakPolarHBondContact CG1-OE1 3.45Å; V244-E248 WeakPolarHBondContact O-CG 3.2Å; V244-E248 PolarHBondContact O-N 3.08Å; Q245-E248 PolarHBondContact O-N 3.42Å; E246-E248 PolarHBondContact O-N 3.41Å; E248-L251 PolarHBondContact O-N 3.03Å; E248-L252 VanDerWaalsContact O-CG 3.31Å; E248-L252 WeakPolarHBondContact O-CG 3.14Å; E248-L252 PolarHBondContact O-N 3.31Å
249A96.3Very high94.5Very high46 Ų4696.6 Ų96.638%0.3848%0.483SS..Hα-helixtrans-63.4-45.4174.700000111.8Q245 E246 L247 L251 L252 E253Q245-A249 PolarHBondContact O-N 2.97Å; E246-A249 WeakPolarHBondContact O-CB 3.43Å; E246-A249 PolarHBondContact O-N 2.85Å; L247-A249 VanDerWaalsContact C-N 3.33Å; A249-L251 VanDerWaalsContact C-N 3.32Å; A249-L251 PolarHBondContact O-N 3.47Å; A249-L252 PolarHBondContact O-N 3.42Å; A249-E253 WeakPolarHBondContact O-CG 3.5Å; A249-E253 PolarHBondContact O-N 2.95Å
250E96.4Very high93.8Very high88 Ų8895.8 Ų95.841%0.41148%0.477SS..Hα-helixtrans-58.9-41.3175-71.8174.7-162.900111.6R243 E246 L247 E253 L254R243-E250 IonicContact NH1-OE1 2.75Å; E246-E250 WeakPolarHBondContact O-CG 3.2Å; E246-E250 PolarHBondContact O-N 2.9Å; L247-E250 PolarHBondContact O-N 3.05Å; E250-E253 PolarHBondContact O-N 2.88Å; E250-L254 VanDerWaalsContact O-CG 3.32Å; E250-L254 WeakPolarHBondContact O-CG 3.22Å; E250-L254 PolarHBondContact O-N 3.17Å
251L95.9Very high92.9Very high112 Ų11298.6 Ų98.659%0.58648%0.48SS*.Hα-helixtrans-64.3-42.9176.3-76174.9000112.1L247 E248 A249 E253 L254 Q255L247-L251 WeakPolarHBondContact O-CB 3.15Å; L247-L251 VanDerWaalsContact O-CG 3.31Å; L247-L251 WeakPolarHBondContact O-CG 3.27Å; L247-L251 PolarHBondContact O-N 3.34Å; E248-L251 PolarHBondContact O-N 3.03Å; A249-L251 VanDerWaalsContact C-N 3.32Å; A249-L251 PolarHBondContact O-N 3.47Å; L251-E253 VanDerWaalsContact C-N 3.34Å; L251-L254 PolarHBondContact O-N 3Å; L251-Q255 WeakPolarHBondContact O-CB 3.12Å; L251-Q255 PolarHBondContact O-N 2.73Å
252L94.9Very high91.9Very high98 Ų9895.4 Ų95.451%0.51348%0.475SS..Hα-helixtrans-62.3-42.4176-72172.6000111.3E248 A249 Q255 Q256E248-L252 VanDerWaalsContact O-CG 3.31Å; E248-L252 WeakPolarHBondContact O-CG 3.14Å; E248-L252 PolarHBondContact O-N 3.31Å; A249-L252 PolarHBondContact O-N 3.42Å; L252-Q255 PolarHBondContact O-N 3.28Å; L252-Q256 VanDerWaalsContact O-CG 3.29Å; L252-Q256 WeakPolarHBondContact O-CG 3.33Å; L252-Q256 PolarHBondContact O-N 3.27Å
253E95.4Very high90.5Very high124 Ų12495.4 Ų95.458%0.57947%0.47SS*.Hα-helixtrans-61.4-46.6174.5-72-179-178.400111.4A249 E250 L251 Q255 Q256 M257A249-E253 WeakPolarHBondContact O-CG 3.5Å; A249-E253 PolarHBondContact O-N 2.95Å; E250-E253 PolarHBondContact O-N 2.88Å; L251-E253 VanDerWaalsContact C-N 3.34Å; E253-Q255 VanDerWaalsContact C-N 3.31Å; E253-Q255 PolarHBondContact O-N 3.07Å; E253-Q256 PolarHBondContact O-N 3.17Å; E253-M257 WeakPolarHBondContact O-CB 3.44Å; E253-M257 VanDerWaalsContact O-CG 3.23Å; E253-M257 WeakPolarHBondContact O-CG 3.42Å; E253-M257 PolarHBondContact O-N 3.49Å
254L94.3Very high89.3Confident117 Ų11796.9 Ų96.961%0.61349%0.486SS*.Hα-helixtrans-62.3-37.5177.2-72.1174.6000112.5E250 L251 M257 K258E250-L254 VanDerWaalsContact O-CG 3.32Å; E250-L254 WeakPolarHBondContact O-CG 3.22Å; E250-L254 PolarHBondContact O-N 3.17Å; L251-L254 PolarHBondContact O-N 3Å; L254-M257 PolarHBondContact O-N 2.75Å; L254-K258 WeakPolarHBondContact O-CB 3.37Å; L254-K258 PolarHBondContact O-N 3.09Å
255Q92.1Very high87.8Confident74 Ų7499.6 Ų99.635%0.34650%0.497SS..Hα-helixtrans-65.4-44175.1-178.4173.1-12.800111.6L251 L252 E253 M257 K258 Q259L251-Q255 WeakPolarHBondContact O-CB 3.12Å; L251-Q255 PolarHBondContact O-N 2.73Å; L252-Q255 PolarHBondContact O-N 3.28Å; E253-Q255 VanDerWaalsContact C-N 3.31Å; E253-Q255 PolarHBondContact O-N 3.07Å; Q255-M257 VanDerWaalsContact C-N 3.34Å; Q255-M257 PolarHBondContact O-N 3.31Å; Q255-K258 WeakPolarHBondContact O-CB 3.48Å; Q255-K258 PolarHBondContact O-N 3.46Å; Q255-Q259 WeakPolarHBondContact O-CG 3.39Å; Q255-Q259 PolarHBondContact O-N 2.85Å
256Q89.9Confident86Confident123 Ų12396.5 Ų96.558%0.57549%0.49SS*.Hα-helixtrans-61.7-42.9174.4-71172.728.700111.3L252 E253 K258 Q259 A260L252-Q256 VanDerWaalsContact O-CG 3.29Å; L252-Q256 WeakPolarHBondContact O-CG 3.33Å; L252-Q256 PolarHBondContact O-N 3.27Å; E253-Q256 PolarHBondContact O-N 3.17Å; Q256-K258 VanDerWaalsContact C-N 3.34Å; Q256-K258 PolarHBondContact O-N 2.99Å; Q256-Q259 PolarHBondContact O-N 2.89Å; Q256-A260 WeakPolarHBondContact O-CB 3.12Å; Q256-A260 PolarHBondContact O-N 2.99Å
257M86.9Confident84.1Confident135 Ų13596.1 Ų96.167%0.66550%0.496SS*.Hα-helixtrans-64-38.6176.5-68.9-61.1-73.100112E253 L254 Q255 K261E253-M257 WeakPolarHBondContact O-CB 3.44Å; E253-M257 VanDerWaalsContact O-CG 3.23Å; E253-M257 WeakPolarHBondContact O-CG 3.42Å; E253-M257 PolarHBondContact O-N 3.49Å; L254-M257 PolarHBondContact O-N 2.75Å; Q255-M257 VanDerWaalsContact C-N 3.34Å; Q255-M257 PolarHBondContact O-N 3.31Å; M257-K261 WeakPolarHBondContact O-CB 3.21Å; M257-K261 PolarHBondContact O-N 2.87Å
258K85.8Confident82.1Confident153 Ų153100.3 Ų100.367%0.66552%0.519SS*.Hα-helixtrans-63-46.9173.3-177.8-175.2174.5-173.20111.1L254 Q255 Q256 K261 T262L254-K258 WeakPolarHBondContact O-CB 3.37Å; L254-K258 PolarHBondContact O-N 3.09Å; Q255-K258 WeakPolarHBondContact O-CB 3.48Å; Q255-K258 PolarHBondContact O-N 3.46Å; Q256-K258 VanDerWaalsContact C-N 3.34Å; Q256-K258 PolarHBondContact O-N 2.99Å; K258-K261 WeakPolarHBondContact O-CB 3.47Å; K258-K261 PolarHBondContact O-N 3.02Å; K258-T262 PolarHBondContact O-N 3.36Å; K258-T262 PolarHBondContact O-OG1 2.89Å
259Q81.9Confident80.1Confident54 Ų54102.2 Ų102.225%0.25253%0.532SS..Hα-helixtrans-60.3-49.4176.5-72.3174.9-2.300111.1Q255 Q256 K261 T262 Y263Q255-Q259 WeakPolarHBondContact O-CG 3.39Å; Q255-Q259 PolarHBondContact O-N 2.85Å; Q256-Q259 PolarHBondContact O-N 2.89Å; Q259-K261 VanDerWaalsContact C-N 3.28Å; Q259-K261 PolarHBondContact O-N 3.25Å; Q259-T262 WeakPolarHBondContact O-CA 3.3Å; Q259-T262 WeakPolarHBondContact O-CB 3.48Å; Q259-T262 PolarHBondContact O-N 3.43Å; Q259-Y263 VanDerWaalsContact C-CD2 3.49Å; Q259-Y263 HydrophobicContact CB-CD2 4.46Å; Q259-Y263 HydrophobicContact CB-CE2 4.11Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.38Å; Q259-Y263 PolarHBondContact O-N 3.04Å
260A81.7Confident78.2Confident42 Ų42103.7 Ų103.735%0.34753%0.531SS..Hα-helixtrans-56.5-41175.900000112.3Q256 Y263 L264Q256-A260 WeakPolarHBondContact O-CB 3.12Å; Q256-A260 PolarHBondContact O-N 2.99Å; A260-Y263 PolarHBondContact O-N 2.72Å; A260-L264 WeakPolarHBondContact O-CB 3.29Å; A260-L264 VanDerWaalsContact O-CG 3.28Å; A260-L264 WeakPolarHBondContact O-CG 3.44Å; A260-L264 PolarHBondContact O-N 2.94Å
261K80.6Confident76.4Confident136 Ų136104.3 Ų104.359%0.59154%0.537SS*.Hα-helixtrans-63.3-42.1174.3-171-176.2177.1-1800112.1M257 K258 Q259 Y263 L264 L265M257-K261 WeakPolarHBondContact O-CB 3.21Å; M257-K261 PolarHBondContact O-N 2.87Å; K258-K261 WeakPolarHBondContact O-CB 3.47Å; K258-K261 PolarHBondContact O-N 3.02Å; Q259-K261 VanDerWaalsContact C-N 3.28Å; Q259-K261 PolarHBondContact O-N 3.25Å; K261-Y263 VanDerWaalsContact C-N 3.33Å; K261-L264 PolarHBondContact O-N 3.47Å; K261-L265 HydrophobicContact CG-CD1 3.82Å; K261-L265 WeakPolarHBondContact O-CB 3.13Å; K261-L265 PolarHBondContact O-N 3.41Å
262T74.9Confident74.5Confident62 Ų62102 Ų10238%0.3853%0.534SS..Hα-helixtrans-61.2-42.6175-52.30000111.2K258 Q259 L264 G266K258-T262 PolarHBondContact O-N 3.36Å; K258-T262 PolarHBondContact O-OG1 2.89Å; Q259-T262 WeakPolarHBondContact O-CA 3.3Å; Q259-T262 WeakPolarHBondContact O-CB 3.48Å; Q259-T262 PolarHBondContact O-N 3.43Å; T262-L264 VanDerWaalsContact C-N 3.32Å; T262-L264 PolarHBondContact O-N 3.43Å; T262-G266 WeakPolarHBondContact O-CA 3.17Å; T262-G266 PolarHBondContact O-N 3.24Å
263Y69.1Low72.9Confident85 Ų85103.5 Ų103.533%0.33354%0.538SS..Hα-helixtrans-65.4-31.4176.3-69.4-64000113.7Q259 A260 K261 L271 A274 L275Q259-Y263 VanDerWaalsContact C-CD2 3.49Å; Q259-Y263 HydrophobicContact CB-CD2 4.46Å; Q259-Y263 HydrophobicContact CB-CE2 4.11Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.38Å; Q259-Y263 PolarHBondContact O-N 3.04Å; A260-Y263 PolarHBondContact O-N 2.72Å; K261-Y263 VanDerWaalsContact C-N 3.33Å; Y263-L271 HydrophobicContact CD1-CD1 3.56Å; Y263-L271 HydrophobicContact CE1-CD1 3.75Å; Y263-A274 HydrophobicContact CD1-CB 3.76Å; Y263-A274 HydrophobicContact CE1-CB 3.15Å; Y263-A274 HydrophobicContact CE2-CB 4.19Å; Y263-A274 PolarHBondContact OH-O 2.78Å; Y263-L275 PolarHBondContact OH-N 3.29Å
264L71.8Confident71.2Confident146 Ų14698.1 Ų98.176%0.76452%0.515SS*.Hα-helixtrans-91.6-22.5-177.3-68.5173.2000114.4A260 K261 T262A260-L264 WeakPolarHBondContact O-CB 3.29Å; A260-L264 VanDerWaalsContact O-CG 3.28Å; A260-L264 WeakPolarHBondContact O-CG 3.44Å; A260-L264 PolarHBondContact O-N 2.94Å; K261-L264 PolarHBondContact O-N 3.47Å; T262-L264 VanDerWaalsContact C-N 3.32Å; T262-L264 PolarHBondContact O-N 3.43Å
265L66.5Low69.5Low130 Ų13097.7 Ų97.768%0.68151%0.513SS*.Hα-helixtrans-115.5-6.9-178-80.591.6000114.5K261K261-L265 HydrophobicContact CG-CD1 3.82Å; K261-L265 WeakPolarHBondContact O-CB 3.13Å; K261-L265 PolarHBondContact O-N 3.41Å
266G59Low68Low27 Ų2799.4 Ų99.428%0.27852%0.524SS..SBendtrans-76133.6176.400000111.6T262T262-G266 WeakPolarHBondContact O-CA 3.17Å; T262-G266 PolarHBondContact O-N 3.24Å
267P59Low66.5Low91 Ų9195.2 Ų95.259%0.59151%0.51SS*.  trans-54.5149.6161.921-30.6000109.9D269 H270P267-D269 PolarHBondContact O-N 3.39Å; P267-H270 PolarHBondContact O-N 2.89Å
268D55.6Low65Low160 Ų16091.9 Ų91.986%0.85650%0.498SS*.THydrogen-bonded Turntrans-47.3-15.8-164.2-69-50000116.7
269D55.1Low63.3Low143 Ų14391.3 Ų91.377%0.76550%0.502SS*.THydrogen-bonded Turntrans-78.4-19.1177.9-63.5-33.4000114.9P267P267-D269 PolarHBondContact O-N 3.39Å
270H55.4Low61.8Low77 Ų7794.3 Ų94.336%0.35652%0.524SS..Hα-helixtrans-84.7-5.3-178.7-65-65.8000114.9P267 A272 E273 A274P267-H270 PolarHBondContact O-N 2.89Å; H270-A272 VanDerWaalsContact C-N 3.3Å; H270-A272 PolarHBondContact O-N 3.45Å; H270-E273 IonicContact CE1-OE2 2.84Å; H270-E273 IonicContact ND1-OE2 3.89Å; H270-E273 PolarHBondContact ND1-OE2 2.8Å; H270-E273 PolarHBondContact O-N 2.99Å; H270-A274 WeakPolarHBondContact O-CB 3.3Å; H270-A274 PolarHBondContact O-N 3.2Å
271L57.4Low60.1Low102 Ų10298.1 Ų98.153%0.53454%0.535SS..Hα-helixtrans-64.9-36.5176.8-176.163.4000111.4Y263 L275Y263-L271 HydrophobicContact CD1-CD1 3.56Å; Y263-L271 HydrophobicContact CE1-CD1 3.75Å; L271-L275 VanDerWaalsContact O-CG 3.31Å; L271-L275 WeakPolarHBondContact O-CG 3.31Å; L271-L275 PolarHBondContact O-N 3.21Å
272A58.1Low57.9Low63 Ų6395.1 Ų95.152%0.52154%0.535SS..Hα-helixtrans-68.4-39.1176.900000112.1H270 L276H270-A272 VanDerWaalsContact C-N 3.3Å; H270-A272 PolarHBondContact O-N 3.45Å; A272-L276 WeakPolarHBondContact O-CD1 3.37Å; A272-L276 WeakPolarHBondContact O-CG 3.49Å; A272-L276 PolarHBondContact O-N 2.94Å
273E59.8Low56.3Low130 Ų13098.1 Ų98.161%0.60756%0.556SS**Hα-helixtrans-71.7-37.4-179.4-150171.2-162.400111.6H270 L276 A277H270-E273 IonicContact CE1-OE2 2.84Å; H270-E273 IonicContact ND1-OE2 3.89Å; H270-E273 PolarHBondContact ND1-OE2 2.8Å; H270-E273 PolarHBondContact O-N 2.99Å; E273-L276 PolarHBondContact O-N 3.29Å; E273-A277 PolarHBondContact O-N 2.94Å
274A60Low54.8Low11 Ų11103 Ų1039%0.09158%0.581CS.*Hα-helixtrans-71.9-29177.900000113.4Y263 H270 P278Y263-A274 HydrophobicContact CD1-CB 3.76Å; Y263-A274 HydrophobicContact CE1-CB 3.15Å; Y263-A274 HydrophobicContact CE2-CB 4.19Å; Y263-A274 PolarHBondContact OH-O 2.78Å; H270-A274 WeakPolarHBondContact O-CB 3.3Å; H270-A274 PolarHBondContact O-N 3.2Å; A274-P278 WeakPolarHBondContact O-CD 3.3Å
275L59.1Low53Low108 Ų108100.5 Ų100.557%0.56558%0.582SS**Hα-helixtrans-75.7-21.7172.8-70.2172.3000113.5Y263 L271Y263-L275 PolarHBondContact OH-N 3.29Å; L271-L275 VanDerWaalsContact O-CG 3.31Å; L271-L275 WeakPolarHBondContact O-CG 3.31Å; L271-L275 PolarHBondContact O-N 3.21Å
276L59.6Low51.5Low110 Ų110101.9 Ų101.958%0.57659%0.59SS**Hα-helixtrans-88.7-19.6177.5-71.5168.1000113.4A272 E273 L279 T280A272-L276 WeakPolarHBondContact O-CD1 3.37Å; A272-L276 WeakPolarHBondContact O-CG 3.49Å; A272-L276 PolarHBondContact O-N 2.94Å; E273-L276 PolarHBondContact O-N 3.29Å; L276-L279 PolarHBondContact O-N 2.8Å; L276-T280 PolarHBondContact O-N 3.23Å; L276-T280 PolarHBondContact O-OG1 3.4Å
277A59.6Low50.2Low35 Ų35107.6 Ų107.629%0.28961%0.614SS.*Hα-helixtrans-66.5-39.2-178.900000114.9E273 L279 T280 Q281E273-A277 PolarHBondContact O-N 2.94Å; A277-L279 PolarHBondContact O-N 3.47Å; A277-T280 WeakPolarHBondContact CA-OG1 3.24Å; A277-T280 PolarHBondContact O-N 2.84Å; A277-T280 PolarHBondContact O-OG1 2.78Å; A277-Q281 PolarHBondContact O-N 3.24Å
278P55Low49.5Very low64 Ų64108.9 Ų108.942%0.41662%0.623SS.*Hα-helixtrans-67.6-20.5175.5-22.834.5000114.3A274A274-P278 WeakPolarHBondContact O-CD 3.3Å
279L49.3Very low48.5Very low141 Ų141109.4 Ų109.474%0.73862%0.62SS**Hα-helixtrans-84.9-20.3177.8-68.8168.5000112.7L276 A277L276-L279 PolarHBondContact O-N 2.8Å; A277-L279 PolarHBondContact O-N 3.47Å
280T50.2Low47.9Very low118 Ų118108 Ų10872%0.72462%0.618SS**Hα-helixtrans-93.8-16175.639.80000112.8L276 A277L276-T280 PolarHBondContact O-N 3.23Å; L276-T280 PolarHBondContact O-OG1 3.4Å; A277-T280 WeakPolarHBondContact CA-OG1 3.24Å; A277-T280 PolarHBondContact O-N 2.84Å; A277-T280 PolarHBondContact O-OG1 2.78Å
281Q47.5Very low46.6Very low122 Ų122107.8 Ų107.857%0.5764%0.637SS**  trans-105.560.4169.7-65.4-176-17.400110.5A277A277-Q281 PolarHBondContact O-N 3.24Å
282A34.3Very low45.4Very low72 Ų72115.1 Ų115.160%0.59566%0.658SS**  trans-63.4138.5151.800000106.9E284A282-E284 PolarHBondContact O-N 2.7Å
283P40.9Very low44.1Very low126 Ų126115.1 Ų115.182%0.81866%0.664SS**  trans-63.4107.11743.27.3000106.9A285P283-A285 PolarHBondContact O-N 2.87Å; P283-A285 VanDerWaalsContact O-N 3.08Å
284E36.9Very low43Very low186 Ų186116.9 Ų116.987%0.86968%0.677SS**  trans-56.9115.8157.3-68.6-145.4150.900105.5A282 D286A282-E284 PolarHBondContact O-N 2.7Å; E284-D286 PolarHBondContact O-N 2.86Å; E284-D286 VanDerWaalsContact O-N 3.12Å
285A34.3Very low41.9Very low94 Ų94122.3 Ų122.378%0.77771%0.705SS**PPolyproline II helixtrans-57.1118.8174.800000107.1P283 D287P283-A285 PolarHBondContact O-N 2.87Å; P283-A285 VanDerWaalsContact O-N 3.08Å; A285-D287 PolarHBondContact O-N 3.33Å; A285-D287 VanDerWaalsContact O-N 3.08Å
286D35.2Very low40.9Very low159 Ų159121.7 Ų121.785%0.8571%0.71SS**PPolyproline II helixtrans-50.8116.9167-85.7-44.9000108.7E284 P288E284-D286 PolarHBondContact O-N 2.86Å; E284-D286 VanDerWaalsContact O-N 3.12Å; D286-P288 WeakPolarHBondContact O-CD 3.43Å
287D31.8Very low39.6Very low148 Ų148119.6 Ų119.679%0.79172%0.715SS**PPolyproline II helixtrans-47124.2159.1-91.6-46.7000109.8A285A285-D287 PolarHBondContact O-N 3.33Å; A285-D287 VanDerWaalsContact O-N 3.08Å
288P44.8Very low38.5Very low118 Ų118123.8 Ų123.877%0.76674%0.737SS**  trans-99.4100.3161.232.6-21000108.7D286D286-P288 WeakPolarHBondContact O-CD 3.43Å
289Q34.2Very low37.7Very low171 Ų171128.5 Ų128.580%0.79975%0.754SS**  trans-153.6156.2158.3-93.6-153.5-84.700111.8
290P43.3Very low36.6Very low113 Ų113129 Ų12973%0.73476%0.757SS**  cis-135.3162.3-41.734.7-18.1000111.6
291G27.7Very low35.6Very low73 Ų73126.7 Ų126.775%0.75376%0.756SS**  trans146.5115.6147.300000118
292R31.1Very low34.6Very low255 Ų255127.5 Ų127.596%0.96277%0.77SS**  trans71.1108.8170-71.7179.5169.3-100.3-2.9115
293G32.5Very low34.3Very low63 Ų63129.4 Ų129.465%0.64978%0.778SS**  cis122.8123.418.800000108.1
294D36.4Very low33.7Very low167 Ų167129 Ų12989%0.89378%0.778SS**  trans75.2137.7158-58.3-9000117.1
295D36.6Very low34.4Very low125 Ų125126.1 Ų126.167%0.66878%0.776SS**  cis-172.2152.6-9.1-177.331.1000107.3
296S38.7Very low34.1Very low95 Ų95126.8 Ų126.866%0.66478%0.782SS**  trans53.6138.9147.460.70000123.1
297G32.3Very low33.8Very low67 Ų67123.5 Ų123.569%0.69178%0.776SS**  trans16928.2156.600000121.7
298T35.1Very low33.8Very low123 Ų123121.8 Ų121.876%0.75578%0.776SS**  trans48.8129.3133.6-12.80000122.4
299Q37.7Very low33.7Very low163 Ų163122.1 Ų122.176%0.76278%0.778SS**  trans114.3115.6136.7-63.7-164.7-7.200120.6
300D27.1Very low33.5Very low152 Ų152117.5 Ų117.581%0.81378%0.777SS**  60.6125.6126.1-63.8-29.7000121.9
301G28.1Very low32.9Very low68 Ų68121.3 Ų121.370%0.70178%0.784SS**  trans144.894.2136.900000117.2
302V26.8Very low33.3Very low140 Ų140123 Ų12385%0.84878%0.78SS**  trans58.2117.7140-170.20000118.6
303S29.7Very low33.3Very low112 Ų112116.8 Ų116.878%0.78377%0.769SS**  168.3123.2117.8-72.50000112.7
304S28.3Very low33.5Very low116 Ų116124.9 Ų124.981%0.81178%0.781SS**  trans-86.4-177.8148.1-61.10000108.8
305P50.2Low33.7Very low126 Ų126126.7 Ų126.782%0.81878%0.78SS**  -122.1155.2-58.233.6-19000110.5
306A28.3Very low33.5Very low109 Ų109126.1 Ų126.190%0.90179%0.786SS**  trans-137.1136166.600000111.1
307A28.9Very low33.5Very low89 Ų89127.4 Ų127.474%0.73679%0.794SS**  trans-90147.5-162.900000113.2
308S32.2Very low33.9Very low112 Ų112128.8 Ų128.878%0.78379%0.793SS**  trans76.7162.3138.1-62.80000119.5
309P43.3Very low33.9Very low126 Ų126129.5 Ų129.582%0.81879%0.792SS**  cis-139.9162.6-39.936.1-19.8000113.3
310G28.3Very low34.5Very low74 Ų74128.6 Ų128.676%0.76380%0.798SS**  trans125.888.4143.600000117.8
311H32.6Very low35.3Very low192 Ų192124.6 Ų124.689%0.88979%0.786SS**  -154.5137.9120.5-156.7-94.1000109.8
312V34.5Very low36.1Very low110 Ų110127.4 Ų127.467%0.66778%0.784SS**  trans-104.9156.6-165.1-173.20000109
313V32.3Very low37Very low123 Ų123127.5 Ų127.575%0.74578%0.78SS**  trans74.7131.1160.3-1300000115.2
314R36.8Very low37.7Very low234 Ų234126.4 Ų126.488%0.88378%0.778SS**  cis-148.3124.129.4-68.2166.4-171.4-174.94.1111
315K39Very low38.6Very low204 Ų204127.6 Ų127.689%0.88777%0.774SS**  trans-90.6114.5159-81.5-177.6173179.90107.9
316S34.4Very low38.7Very low114 Ų114127.7 Ų127.780%0.79777%0.772SS**  trans-79.5123.1167.8-172.70000108.3
317C38.2Very low39.5Very low121 Ų121126.6 Ų126.682%0.81876%0.762SS**  trans-104.3119.3172.8-66.80000108.7
318S40.6Very low40.2Very low97 Ų97131 Ų13168%0.67877%0.765SS**  trans-156.8103.6159.847.40000108.6
319D35.7Very low40.4Very low137 Ų137132.4 Ų132.473%0.73376%0.764SS**  trans179.642.4135.4-95.8-8000113.8A321D319-A321 PolarHBondContact O-N 3.31Å; D319-A321 VanDerWaalsContact O-N 3.12Å
320T50.1Low40.7Very low145 Ų145132.7 Ų132.789%0.8977%0.766SS**THydrogen-bonded Turntrans-82.655.4161.1-50.40000110.4
321A43.7Very low41.5Very low67 Ų67133.7 Ų133.755%0.55477%0.767SS**THydrogen-bonded Turntrans-122-6.4179.200000114.4D319D319-A321 PolarHBondContact O-N 3.31Å; D319-A321 VanDerWaalsContact O-N 3.12Å
322L44.7Very low41.5Very low127 Ų127130.2 Ų130.267%0.66576%0.764SS**SBendtrans-105.5-5.4-175.8-64-179.2000115.6
323N44.6Very low42.3Very low142 Ų142136.3 Ų136.376%0.75978%0.775SS**THydrogen-bonded Turntrans-86.9-4.5179-78.8-20.4000114.4
324A44.8Very low42.8Very low90 Ų90139.7 Ų139.774%0.74478%0.782SS**THydrogen-bonded Turntrans-89.9-8-179.800000114.4
325I48.4Very low42.8Very low140 Ų140133 Ų13372%0.71878%0.777SS**SBendtrans-98-14-177.8-55.6175.2000112
326V52Low43.3Very low128 Ų128126.3 Ų126.378%0.77677%0.767SS**SBendtrans-87.6-11.9-174.6-179.30000113.2
327A45.6Very low44Very low86 Ų86128.4 Ų128.471%0.71177%0.769SS**SBendtrans-112.361.4-175.400000112.9
328K43.3Very low44.4Very low181 Ų181130.3 Ų130.379%0.78777%0.77SS**SBendtrans-157.6128.4155.5-146.5139.9177.4176.90113.9
329D35.1Very low44.8Very low142 Ų142130 Ų13076%0.75976%0.764SS**  trans85.7112.3162.5-65.4-16.8000121.3
330P49.2Very low45.4Very low132 Ų132130.7 Ų130.786%0.85777%0.767SS**  trans-9972.716738.2-28.2000110.5
331A46.8Very low45.1Very low95 Ų95131.1 Ų131.179%0.78576%0.758SS**  trans-172.492.4163.600000111.6
332S31.5Very low45.2Very low120 Ų120129.8 Ų129.884%0.83975%0.747SS**  trans-157.8113.6143.5-163.50000110.4
333R51.1Low45.4Very low237 Ų237128 Ų12889%0.89474%0.739SS**  trans-75.3148167.7-65.6176.3-177.9170.10.6107.6
334H43.9Very low45.5Very low194 Ų194124.2 Ų124.290%0.89872%0.724SS**  trans87.382.5160.6-129.470.9000117.4
335A35.2Very low45.6Very low94 Ų94125 Ų12578%0.77772%0.718SS**  trans-162.180.9141.900000108.7
336G51Low45.7Very low64 Ų64125.8 Ų125.866%0.6671%0.713SS**  trans-69.8149.516200000109.8
337N47.7Very low45.8Very low157 Ų157126.9 Ų126.984%0.8471%0.707SS**SBendtrans100.622.6170.3-56-48.8000119.8
338L48.5Very low46.4Very low162 Ų162134.3 Ų134.385%0.84872%0.717SS**SBendtrans-129.312.7165.9-89.1144.4000114.7
339T47.2Very low46.8Very low91 Ų91129.2 Ų129.256%0.55872%0.715SS**SBendtrans-99.5-3.2-174.7-15.60000114.7
340L48.3Very low47.8Very low150 Ų150124.7 Ų124.779%0.78569%0.69SS**SBendtrans-88-28.7-178.8-66.4177.8000113.4
341H44.9Very low48.8Very low154 Ų154121.9 Ų121.971%0.71367%0.673SS**Hα-helixtrans-82.7-22.6175.9-91.5-81.2000113.9N343 S344 V345H341-N343 VanDerWaalsContact C-N 3.31Å; H341-N343 PolarHBondContact O-N 2.86Å; H341-S344 PolarHBondContact O-OG 3.18Å; H341-V345 VanDerWaalsContact O-CG2 3.29Å; H341-V345 WeakPolarHBondContact O-CG2 3.33Å; H341-V345 PolarHBondContact O-N 3.41Å
342A45.3Very low50.1Low39 Ų39123.5 Ų123.532%0.32267%0.668SS.*Hα-helixtrans-76-17.5178.200000113.6R346A342-R346 WeakPolarHBondContact O-CG 3.35Å; A342-R346 PolarHBondContact O-NE 2.86Å
343N48.3Very low52.6Low90 Ų90123.8 Ų123.848%0.48166%0.659SS.*Hα-helixtrans-93.3-28.8177.4-70.9-10000112.3H341 K347H341-N343 VanDerWaalsContact C-N 3.31Å; H341-N343 PolarHBondContact O-N 2.86Å; N343-K347 WeakPolarHBondContact O-CG 3.42Å
344S48.1Very low54.1Low63 Ų63119.8 Ų119.844%0.44164%0.644SS.*Hα-helixtrans-76-35.1173.653.70000112.4H341 K347H341-S344 PolarHBondContact O-OG 3.18Å; S344-K347 PolarHBondContact O-N 2.8Å
345V46.1Very low56.2Low105 Ų105115.2 Ų115.264%0.63662%0.623SS**Hα-helixtrans-72.7-31.7176.2176.70000112.1H341 K347 R348H341-V345 VanDerWaalsContact O-CG2 3.29Å; H341-V345 WeakPolarHBondContact O-CG2 3.33Å; H341-V345 PolarHBondContact O-N 3.41Å; V345-K347 VanDerWaalsContact C-N 3.31Å; V345-K347 PolarHBondContact O-N 3.4Å; V345-R348 PolarHBondContact O-N 2.83Å
346R51.8Low58.8Low158 Ų158114.5 Ų114.560%0.59661%0.608SS**Hα-helixtrans-65.9-29.3174.3-87.8-176.2-95.9-127.14.8113.7A342 R348 G349 M350A342-R346 WeakPolarHBondContact O-CG 3.35Å; A342-R346 PolarHBondContact O-NE 2.86Å; R346-R348 PolarHBondContact O-N 3.25Å; R346-G349 PolarHBondContact O-N 3.32Å; R346-M350 WeakPolarHBondContact O-CG 3.48Å; R346-M350 VanDerWaalsContact O-SD 3.34Å
347K53.4Low60.7Low151 Ų151115.3 Ų115.366%0.65760%0.598SS**G310 helixtrans-68.9-18176.2-70.4-176.4178-161.90114.2N343 S344 V345 G349 M350N343-K347 WeakPolarHBondContact O-CG 3.42Å; S344-K347 PolarHBondContact O-N 2.8Å; V345-K347 VanDerWaalsContact C-N 3.31Å; V345-K347 PolarHBondContact O-N 3.4Å; K347-G349 VanDerWaalsContact C-N 3.31Å; K347-M350 HydrophobicContact CG-SD 4.45Å
348R57.1Low62.7Low242 Ų242112.4 Ų112.491%0.91358%0.579SS**G310 helixtrans-85-4.3179.2-146.5172.9-169.8170.51.8113.7V345 R346V345-R348 PolarHBondContact O-N 2.83Å; R346-R348 PolarHBondContact O-N 3.25Å
349G52.4Low64.7Low73 Ų73110.2 Ų110.275%0.75357%0.565SS**G310 helixtrans-132.318.4178.900000113.8R346 K347R346-G349 PolarHBondContact O-N 3.32Å; K347-G349 VanDerWaalsContact C-N 3.31Å
350M55.9Low66.8Low48 Ų48112.4 Ų112.424%0.23656%0.564CS.*SBendtrans-91.9129.3173.4-74.7160.874.600108.5R346 K347 R354 E358R346-M350 WeakPolarHBondContact O-CG 3.48Å; R346-M350 VanDerWaalsContact O-SD 3.34Å; K347-M350 HydrophobicContact CG-SD 4.45Å; M350-R354 HydrophobicContact CE-CG 4.06Å; M350-E358 WeakPolarHBondContact CE-OE1 3.43Å; M350-E358 WeakPolarHBondContact CE-OE2 3.23Å
351S70.6Confident68.9Low72 Ų72110.4 Ų110.450%0.50355%0.55SS..  trans-54.4139.8174173.10000109.9L353 R354 E355S351-L353 PolarHBondContact O-N 3.48Å; S351-L353 PolarHBondContact OG-N 3.49Å; S351-R354 WeakPolarHBondContact O-CA 3.24Å; S351-R354 PolarHBondContact O-N 2.81Å; S351-E355 PolarHBondContact O-N 3.08Å
352I74.3Confident71.2Confident130 Ų130105 Ų10567%0.66753%0.532SS*.Hα-helixtrans-49.3-34.7176.6-63.5167.2000110.7R354 E355 V356I352-R354 PolarHBondContact O-N 3.03Å; I352-E355 PolarHBondContact O-N 2.93Å; I352-V356 HydrophobicContact CG2-CG2 4.21Å; I352-V356 WeakPolarHBondContact O-CB 3.38Å; I352-V356 VanDerWaalsContact O-CG2 3.24Å; I352-V356 WeakPolarHBondContact O-CG2 3.49Å; I352-V356 PolarHBondContact O-N 3.27Å
353L82.8Confident73.6Confident125 Ų125107.3 Ų107.365%0.65454%0.538SS*.Hα-helixtrans-61.8-41174.7-78.4112.6000113.3S351 E355 V356 D357S351-L353 PolarHBondContact O-N 3.48Å; S351-L353 PolarHBondContact OG-N 3.49Å; L353-E355 VanDerWaalsContact C-N 3.35Å; L353-V356 PolarHBondContact O-N 3.31Å; L353-D357 VanDerWaalsContact O-CB 3.32Å; L353-D357 WeakPolarHBondContact O-CB 3.27Å; L353-D357 PolarHBondContact O-N 3.5Å
354R84.1Confident75.6Confident154 Ų154105.9 Ų105.958%0.58153%0.531SS*.Hα-helixtrans-70.2-34.1178.1-176.3179.1-89.2179.6-8.6111.5M350 S351 I352 E358M350-R354 HydrophobicContact CE-CG 4.06Å; S351-R354 WeakPolarHBondContact O-CA 3.24Å; S351-R354 PolarHBondContact O-N 2.81Å; I352-R354 PolarHBondContact O-N 3.03Å; R354-E358 WeakPolarHBondContact O-CB 3.38Å; R354-E358 WeakPolarHBondContact O-CG 3.28Å; R354-E358 PolarHBondContact O-N 3.37Å
355E87.8Confident77.7Confident98 Ų98108.8 Ų108.846%0.45854%0.537SS..Hα-helixtrans-68.8-42.2173.7-176171.3-170.100111.3S351 I352 L353 D357 E358 Q359S351-E355 PolarHBondContact O-N 3.08Å; I352-E355 PolarHBondContact O-N 2.93Å; L353-E355 VanDerWaalsContact C-N 3.35Å; E355-D357 VanDerWaalsContact C-N 3.34Å; E355-E358 PolarHBondContact O-N 2.95Å; E355-Q359 WeakPolarHBondContact O-CB 3.34Å; E355-Q359 VanDerWaalsContact O-CG 3.25Å; E355-Q359 WeakPolarHBondContact O-CG 3.49Å; E355-Q359 PolarHBondContact O-N 3.3Å
356V88.8Confident80Confident78 Ų78110.4 Ų110.447%0.47354%0.536SS..Hα-helixtrans-63.3-41.3173.11710000110.9I352 L353 Q359 Y360I352-V356 HydrophobicContact CG2-CG2 4.21Å; I352-V356 WeakPolarHBondContact O-CB 3.38Å; I352-V356 VanDerWaalsContact O-CG2 3.24Å; I352-V356 WeakPolarHBondContact O-CG2 3.49Å; I352-V356 PolarHBondContact O-N 3.27Å; L353-V356 PolarHBondContact O-N 3.31Å; V356-Q359 CarbonylContact O-C 3.41Å; V356-Q359 PolarHBondContact O-N 2.91Å; V356-Y360 WeakPolarHBondContact O-CB 3.5Å; V356-Y360 PolarHBondContact O-N 2.89Å
357D90.6Very high81.9Confident82 Ų82109.7 Ų109.744%0.43953%0.534SS..Hα-helixtrans-63.3-45.3174.6-74.4-29.1000110.7L353 E355 Q359 Y360 H361L353-D357 VanDerWaalsContact O-CB 3.32Å; L353-D357 WeakPolarHBondContact O-CB 3.27Å; L353-D357 PolarHBondContact O-N 3.5Å; E355-D357 VanDerWaalsContact C-N 3.34Å; D357-Q359 VanDerWaalsContact C-N 3.3Å; D357-Q359 PolarHBondContact O-N 2.89Å; D357-Y360 PolarHBondContact O-N 3.36Å; D357-H361 WeakPolarHBondContact O-CB 3.32Å; D357-H361 PolarHBondContact O-N 3.13Å; D357-H361 PolarHBondContact O-ND1 2.75Å
358E90Very high83.8Confident95 Ų95108 Ų10844%0.44453%0.528SS..Hα-helixtrans-61.5-39.2175.3-83.1170.2-17400111.7M350 R354 E355 A362M350-E358 WeakPolarHBondContact CE-OE1 3.43Å; M350-E358 WeakPolarHBondContact CE-OE2 3.23Å; R354-E358 WeakPolarHBondContact O-CB 3.38Å; R354-E358 WeakPolarHBondContact O-CG 3.28Å; R354-E358 PolarHBondContact O-N 3.37Å; E355-E358 PolarHBondContact O-N 2.95Å; E358-A362 WeakPolarHBondContact O-CB 3.25Å; E358-A362 PolarHBondContact O-N 3.09Å
359Q91.1Very high85.4Confident117 Ų117101.6 Ų101.655%0.54751%0.509SS..Hα-helixtrans-67.2-38.4174.2-72-179.710.300112E355 V356 D357 L363E355-Q359 WeakPolarHBondContact O-CB 3.34Å; E355-Q359 VanDerWaalsContact O-CG 3.25Å; E355-Q359 WeakPolarHBondContact O-CG 3.49Å; E355-Q359 PolarHBondContact O-N 3.3Å; V356-Q359 CarbonylContact O-C 3.41Å; V356-Q359 PolarHBondContact O-N 2.91Å; D357-Q359 VanDerWaalsContact C-N 3.3Å; D357-Q359 PolarHBondContact O-N 2.89Å; Q359-L363 VanDerWaalsContact O-CB 3.23Å; Q359-L363 WeakPolarHBondContact O-CB 3.46Å; Q359-L363 PolarHBondContact O-N 3.31Å
360Y91.9Very high87.1Confident137 Ų137103 Ų10354%0.53750%0.499SS..Hα-helixtrans-66.9-43.2175.9-178.3-104.7000111.6V356 D357 L363 L364V356-Y360 WeakPolarHBondContact O-CB 3.5Å; V356-Y360 PolarHBondContact O-N 2.89Å; D357-Y360 PolarHBondContact O-N 3.36Å; Y360-L363 PolarHBondContact O-N 3.22Å; Y360-L364 HydrophobicContact CD1-CD1 3.59Å; Y360-L364 HydrophobicContact CD1-CG 4.47Å; Y360-L364 HydrophobicContact CE1-CD1 3.23Å; Y360-L364 HydrophobicContact CE1-CG 4.13Å; Y360-L364 HydrophobicContact CG-CD1 4.44Å; Y360-L364 WeakPolarHBondContact O-CB 3.43Å; Y360-L364 PolarHBondContact O-N 2.79Å
361H92.7Very high88.4Confident107 Ų107105 Ų10550%0.49551%0.51SS..Hα-helixtrans-67.9-41175.8-71.981.4000111.4D357 L363 L364 E365D357-H361 WeakPolarHBondContact O-CB 3.32Å; D357-H361 PolarHBondContact O-N 3.13Å; D357-H361 PolarHBondContact O-ND1 2.75Å; H361-L363 VanDerWaalsContact C-N 3.29Å; H361-L363 PolarHBondContact O-N 3.34Å; H361-L364 WeakPolarHBondContact O-CB 3.4Å; H361-L364 PolarHBondContact O-N 2.77Å; H361-E365 WeakPolarHBondContact O-CG 3.38Å; H361-E365 PolarHBondContact O-N 2.71Å
362A93.3Very high88.9Confident41 Ų41104.1 Ų104.134%0.33950%0.503SS..Hα-helixtrans-64.8-33.6173.800000112.4E358 K366E358-A362 WeakPolarHBondContact O-CB 3.25Å; E358-A362 PolarHBondContact O-N 3.09Å; A362-K366 WeakPolarHBondContact O-CG 3.21Å; A362-K366 PolarHBondContact O-N 3.48Å; A362-K366 VanDerWaalsContact O-N 3.13Å
363L94.4Very high89.3Confident87 Ų87103.4 Ų103.446%0.45550%0.495SS..Hα-helixtrans-70.5-43.4173.5-17663.1000111.1Q359 Y360 H361 K366 Y367Q359-L363 VanDerWaalsContact O-CB 3.23Å; Q359-L363 WeakPolarHBondContact O-CB 3.46Å; Q359-L363 PolarHBondContact O-N 3.31Å; Y360-L363 PolarHBondContact O-N 3.22Å; H361-L363 VanDerWaalsContact C-N 3.29Å; H361-L363 PolarHBondContact O-N 3.34Å; L363-K366 WeakPolarHBondContact O-CB 3.36Å; L363-K366 PolarHBondContact O-N 2.94Å; L363-Y367 HydrophobicContact CD1-CD2 4.03Å; L363-Y367 HydrophobicContact CD1-CE2 3.67Å; L363-Y367 HydrophobicContact CD2-CE2 4.12Å; L363-Y367 HydrophobicContact CG-CD2 3.83Å; L363-Y367 HydrophobicContact CG-CE2 3.67Å; L363-Y367 VanDerWaalsContact O-CD2 3.24Å; L363-Y367 WeakPolarHBondContact O-CD2 3.33Å; L363-Y367 PolarHBondContact O-N 3.45Å
364L91Very high88.9Confident61 Ų61101.1 Ų101.132%0.31949%0.489SS..Hα-helixtrans-56.5-48.4172.3-89.6163.9000111.4Y360 H361 K366 Y367 E368Y360-L364 HydrophobicContact CD1-CD1 3.59Å; Y360-L364 HydrophobicContact CD1-CG 4.47Å; Y360-L364 HydrophobicContact CE1-CD1 3.23Å; Y360-L364 HydrophobicContact CE1-CG 4.13Å; Y360-L364 HydrophobicContact CG-CD1 4.44Å; Y360-L364 WeakPolarHBondContact O-CB 3.43Å; Y360-L364 PolarHBondContact O-N 2.79Å; H361-L364 WeakPolarHBondContact O-CB 3.4Å; H361-L364 PolarHBondContact O-N 2.77Å; L364-K366 VanDerWaalsContact C-N 3.3Å; L364-K366 PolarHBondContact O-N 3.49Å; L364-Y367 CarbonylContact O-C 3.59Å; L364-Y367 PolarHBondContact O-N 3.15Å; L364-Y367 VanDerWaalsContact O-N 3.09Å; L364-E368 WeakPolarHBondContact O-CB 3.4Å; L364-E368 WeakPolarHBondContact O-CG 3.4Å; L364-E368 PolarHBondContact O-N 3.36Å
365E92.8Very high88.6Confident123 Ų123102.6 Ų102.658%0.57550%0.495SS*.Hα-helixtrans-58.2-42.1176.1-75.2175.8176.200111.5H361 E368 E369H361-E365 WeakPolarHBondContact O-CG 3.38Å; H361-E365 PolarHBondContact O-N 2.71Å; E365-E368 PolarHBondContact O-N 2.83Å; E365-E369 WeakPolarHBondContact O-CB 3.4Å; E365-E369 WeakPolarHBondContact O-CG 3.38Å; E365-E369 PolarHBondContact O-N 3.43Å
366K93.3Very high87.5Confident139 Ų139104.3 Ų104.360%0.60450%0.503SS*.Hα-helixtrans-64.9-39.1174.5-74.7176.6-177176.20112.8A362 L363 L364 L370A362-K366 WeakPolarHBondContact O-CG 3.21Å; A362-K366 PolarHBondContact O-N 3.48Å; A362-K366 VanDerWaalsContact O-N 3.13Å; L363-K366 WeakPolarHBondContact O-CB 3.36Å; L363-K366 PolarHBondContact O-N 2.94Å; L364-K366 VanDerWaalsContact C-N 3.3Å; L364-K366 PolarHBondContact O-N 3.49Å; K366-L370 WeakPolarHBondContact O-CB 3.44Å; K366-L370 PolarHBondContact O-N 3.25Å
367Y92.3Very high85.7Confident143 Ų143108 Ų10856%0.56152%0.515SS*.Hα-helixtrans-67.5-40.7174.2-86.7-70.2000111.6L363 L364 L370 L371L363-Y367 HydrophobicContact CD1-CD2 4.03Å; L363-Y367 HydrophobicContact CD1-CE2 3.67Å; L363-Y367 HydrophobicContact CD2-CE2 4.12Å; L363-Y367 HydrophobicContact CG-CD2 3.83Å; L363-Y367 HydrophobicContact CG-CE2 3.67Å; L363-Y367 VanDerWaalsContact O-CD2 3.24Å; L363-Y367 WeakPolarHBondContact O-CD2 3.33Å; L363-Y367 PolarHBondContact O-N 3.45Å; L364-Y367 CarbonylContact O-C 3.59Å; L364-Y367 PolarHBondContact O-N 3.15Å; L364-Y367 VanDerWaalsContact O-N 3.09Å; Y367-L370 PolarHBondContact O-N 2.9Å; Y367-L371 WeakPolarHBondContact O-CB 3.34Å; Y367-L371 VanDerWaalsContact O-CG 3.27Å; Y367-L371 WeakPolarHBondContact O-CG 3.41Å; Y367-L371 PolarHBondContact O-N 3.03Å
368E92.4Very high83.8Confident116 Ų116105.9 Ų105.954%0.54251%0.512SS..Hα-helixtrans-66-37.8175.2-74.1-176.4174.300111.8L364 E365 L370 S372L364-E368 WeakPolarHBondContact O-CB 3.4Å; L364-E368 WeakPolarHBondContact O-CG 3.4Å; L364-E368 PolarHBondContact O-N 3.36Å; E365-E368 PolarHBondContact O-N 2.83Å; E368-L370 VanDerWaalsContact C-N 3.35Å; E368-S372 WeakPolarHBondContact O-CB 3.36Å; E368-S372 PolarHBondContact O-N 2.96Å; E368-S372 PolarHBondContact O-OG 2.77Å
369E90.3Very high81.8Confident107 Ų107104.7 Ų104.750%0.552%0.519SS..Hα-helixtrans-62.9-41170.2-81.4-173.9-165.300111.7E365 S372 K373E365-E369 WeakPolarHBondContact O-CB 3.4Å; E365-E369 WeakPolarHBondContact O-CG 3.38Å; E365-E369 PolarHBondContact O-N 3.43Å; E369-S372 CarbonylContact O-C 3.6Å; E369-S372 PolarHBondContact O-N 3.26Å; E369-K373 WeakPolarHBondContact O-CB 3.45Å; E369-K373 VanDerWaalsContact O-CG 3.22Å; E369-K373 WeakPolarHBondContact O-CG 3.49Å; E369-K373 PolarHBondContact O-N 2.86Å; E369-K373 IonicContact OE2-NZ 3.51Å
370L89.7Confident79.7Confident103 Ų103102.3 Ų102.354%0.53953%0.525SS..Hα-helixtrans-70-41.8179.7-155.6142.1000110.9K366 Y367 E368 S372 K373 C374K366-L370 WeakPolarHBondContact O-CB 3.44Å; K366-L370 PolarHBondContact O-N 3.25Å; Y367-L370 PolarHBondContact O-N 2.9Å; E368-L370 VanDerWaalsContact C-N 3.35Å; L370-S372 VanDerWaalsContact C-N 3.31Å; L370-S372 PolarHBondContact O-N 2.74Å; L370-K373 PolarHBondContact O-N 3.26Å; L370-C374 PolarHBondContact O-N 2.9Å; L370-C374 PolarHBondContact O-SG 3.03Å
371L82.1Confident77.8Confident90 Ų90101.4 Ų101.447%0.47153%0.534SS..Hα-helixtrans-62.8-38.4170-72.4172.7000111.5Y367 C374 R375Y367-L371 WeakPolarHBondContact O-CB 3.34Å; Y367-L371 VanDerWaalsContact O-CG 3.27Å; Y367-L371 WeakPolarHBondContact O-CG 3.41Å; Y367-L371 PolarHBondContact O-N 3.03Å; L371-C374 PolarHBondContact O-N 2.81Å; L371-R375 WeakPolarHBondContact O-CB 3.15Å; L371-R375 VanDerWaalsContact O-CG 3.25Å; L371-R375 WeakPolarHBondContact O-CG 3.25Å; L371-R375 PolarHBondContact O-N 3.42Å
372S81.7Confident75.4Confident53 Ų53105.5 Ų105.537%0.37155%0.545SS..Hα-helixtrans-67.4-38.6175.1-65.60000111.3E368 E369 L370 R375 Q376E368-S372 WeakPolarHBondContact O-CB 3.36Å; E368-S372 PolarHBondContact O-N 2.96Å; E368-S372 PolarHBondContact O-OG 2.77Å; E369-S372 CarbonylContact O-C 3.6Å; E369-S372 PolarHBondContact O-N 3.26Å; L370-S372 VanDerWaalsContact C-N 3.31Å; L370-S372 PolarHBondContact O-N 2.74Å; S372-R375 CarbonylContact O-C 3.57Å; S372-R375 PolarHBondContact O-N 3.31Å; S372-Q376 VanDerWaalsContact O-CB 3.26Å; S372-Q376 WeakPolarHBondContact O-CB 3.48Å; S372-Q376 WeakPolarHBondContact O-CG 3.38Å; S372-Q376 PolarHBondContact O-N 3.48Å
373K82.5Confident73Confident115 Ų115112.2 Ų112.250%0.557%0.569SS.*Hα-helixtrans-65.5-39.3172.4-74.7164-173.61600111.6E369 L370 Q376 H377E369-K373 WeakPolarHBondContact O-CB 3.45Å; E369-K373 VanDerWaalsContact O-CG 3.22Å; E369-K373 WeakPolarHBondContact O-CG 3.49Å; E369-K373 PolarHBondContact O-N 2.86Å; E369-K373 IonicContact OE2-NZ 3.51Å; L370-K373 PolarHBondContact O-N 3.26Å; K373-Q376 PolarHBondContact O-N 2.9Å; K373-H377 WeakPolarHBondContact O-CB 3.26Å; K373-H377 PolarHBondContact O-N 3.49Å
374C75Confident70.6Confident78 Ų78114.7 Ų114.753%0.52759%0.588SS.*Hα-helixtrans-66.3-39.3172.1-68.60000112.2L370 L371 H377 G378L370-C374 PolarHBondContact O-N 2.9Å; L370-C374 PolarHBondContact O-SG 3.03Å; L371-C374 PolarHBondContact O-N 2.81Å; C374-H377 PolarHBondContact O-N 3.42Å; C374-G378 PolarHBondContact O-N 3.39Å
375R77.1Confident68.1Low185 Ų185115 Ų11570%0.69861%0.606SS**Hα-helixtrans-69.6-35.7174.2-72176-157.3-125.57.7112.3L371 S372 G378 A379L371-R375 WeakPolarHBondContact O-CB 3.15Å; L371-R375 VanDerWaalsContact O-CG 3.25Å; L371-R375 WeakPolarHBondContact O-CG 3.25Å; L371-R375 PolarHBondContact O-N 3.42Å; S372-R375 CarbonylContact O-C 3.57Å; S372-R375 PolarHBondContact O-N 3.31Å; R375-G378 CarbonylContact O-C 3.58Å; R375-G378 WeakPolarHBondContact O-CA 3.5Å; R375-G378 PolarHBondContact O-N 2.9Å; R375-A379 WeakPolarHBondContact O-CB 3.34Å; R375-A379 PolarHBondContact O-N 2.96Å
376Q65.3Low65.4Low134 Ų134115 Ų11563%0.62661%0.614SS**Hα-helixtrans-70.1-38.5173.8-75.817119.800111.3S372 K373 G378 A379 G380S372-Q376 VanDerWaalsContact O-CB 3.26Å; S372-Q376 WeakPolarHBondContact O-CB 3.48Å; S372-Q376 WeakPolarHBondContact O-CG 3.38Å; S372-Q376 PolarHBondContact O-N 3.48Å; K373-Q376 PolarHBondContact O-N 2.9Å; Q376-G378 VanDerWaalsContact C-N 3.29Å; Q376-G378 PolarHBondContact O-N 3.48Å; Q376-A379 CarbonylContact O-C 3.57Å; Q376-A379 PolarHBondContact O-N 3.5Å; Q376-G380 PolarHBondContact O-N 3.38Å
377H51.1Low62.7Low156 Ų156116.6 Ų116.672%0.72262%0.624SS**Hα-helixtrans-62.3-37.2167.6-107.470000111.7K373 C374 A379 G380 V381K373-H377 WeakPolarHBondContact O-CB 3.26Å; K373-H377 PolarHBondContact O-N 3.49Å; C374-H377 PolarHBondContact O-N 3.42Å; H377-A379 PolarHBondContact O-N 2.88Å; H377-G380 PolarHBondContact O-N 3.22Å; H377-V381 PolarHBondContact O-N 3.36Å
378G49Very low60.4Low37 Ų37117 Ų11738%0.38164%0.641SS.*Hα-helixtrans-72.9-7.8170.900000115.1C374 R375 Q376 R382C374-G378 PolarHBondContact O-N 3.39Å; R375-G378 CarbonylContact O-C 3.58Å; R375-G378 WeakPolarHBondContact O-CA 3.5Å; R375-G378 PolarHBondContact O-N 2.9Å; Q376-G378 VanDerWaalsContact C-N 3.29Å; Q376-G378 PolarHBondContact O-N 3.48Å; G378-R382 VanDerWaalsContact O-CG 3.31Å; G378-R382 WeakPolarHBondContact O-CG 3.22Å; G378-R382 PolarHBondContact O-NE 3.46Å
379A48.1Very low58.1Low70 Ų70116.3 Ų116.358%0.57965%0.649SS**Hα-helixtrans-102.1-26.417400000112.3R375 Q376 H377R375-A379 WeakPolarHBondContact O-CB 3.34Å; R375-A379 PolarHBondContact O-N 2.96Å; Q376-A379 CarbonylContact O-C 3.57Å; Q376-A379 PolarHBondContact O-N 3.5Å; H377-A379 PolarHBondContact O-N 2.88Å
380G48Very low55.7Low67 Ų67123.1 Ų123.169%0.69167%0.67SS**Hα-helixtrans-78.6-16.3174.200000114.8Q376 H377Q376-G380 PolarHBondContact O-N 3.38Å; H377-G380 PolarHBondContact O-N 3.22Å
381V51.4Low54Low118 Ų118123.4 Ų123.472%0.71568%0.678SS**  trans-128.182.3175-174.30000109.3H377H377-V381 PolarHBondContact O-N 3.36Å
382R43Very low51.6Low193 Ų193127 Ų12773%0.72870%0.696SS**  trans-128.983.7168.2-75-168.6169.8-161.6-4111G378G378-R382 VanDerWaalsContact O-CG 3.31Å; G378-R382 WeakPolarHBondContact O-CG 3.22Å; G378-R382 PolarHBondContact O-NE 3.46Å
383H42.2Very low49.3Very low182 Ų182129.2 Ų129.284%0.84371%0.712SS**  trans-155.6123.3153.2-65.3-61.1000105.6
384T43.6Very low47.1Very low138 Ų138134.7 Ų134.785%0.84773%0.729SS**SBendcis-156.8144.134.243.50000112.5
385G38.9Very low45.1Very low68 Ų68138.1 Ų138.170%0.70174%0.742SS**  trans73.486.4141.700000119.1
386V35.9Very low42.9Very low122 Ų122135 Ų13574%0.73975%0.749SS**  95128.372.1169.70000113.9
387Q36.9Very low41.4Very low174 Ų174132.8 Ų132.881%0.81375%0.748SS**  trans83.696.2154.8-81.4157.3-0.800120.8
388T44.5Very low40.3Very low150 Ų150135 Ų13592%0.9275%0.75SS**  trans-88.7112.4145.1480000109.8
389S43.9Very low39.7Very low103 Ų103142.4 Ų142.472%0.7277%0.767SS**  trans-15398.2156.559.50000112.1
390R39.1Very low38.9Very low250 Ų250145.6 Ų145.694%0.94377%0.774SS**  trans60.1156.1149.6-79.8-173.1175.2175.8-0.7122
391P54.8Low38.2Very low109 Ų109149.7 Ų149.771%0.70878%0.779SS**  trans-100.8145.2-166.338-28.7000113.1
392I31.8Very low37.4Very low166 Ų166155.5 Ų155.585%0.85179%0.788SS**  trans-167.4109159.2-87.2126.8000105
393S33Very low36.7Very low99 Ų99150.1 Ų150.169%0.69279%0.793SS**  72.6130.297.6-150.70000115.8
394R36.7Very low36.1Very low229 Ų229144.6 Ų144.686%0.86479%0.786SS**  trans75.3111.7154-83.9176.5160.1167-4.2120.5
395D32.6Very low35.6Very low151 Ų151146.7 Ų146.781%0.80779%0.786SS**  52.8115.8127.7-102.6-19.3000120.1
396S32Very low35.3Very low120 Ų120152 Ų15284%0.83979%0.792SS**  trans-156.4103.2139.8-81.80000107.3
397S32.9Very low35Very low87 Ų87149.8 Ų149.861%0.60879%0.794SS**  79.9100.979.4164.60000113.2
398W27.1Very low34.7Very low201 Ų201151.3 Ų151.376%0.76180%0.801SS**  trans60.9109.7146.5-57.388.4000117.3
399R36.3Very low34Very low194 Ų194147.6 Ų147.673%0.73279%0.792SS**  56.1117.884.6-152.8-151.8-59.4-101.67112.1
400D32.2Very low33.5Very low137 Ų137152 Ų15273%0.73380%0.802SS**  trans152.2131.2154.5-86.3-1.7000108.7
401L34.3Very low33.5Very low152 Ų152145 Ų14580%0.79680%0.797SS**  cis-158.4127.914.8-76.4138.7000106.6
402R32.9Very low33Very low240 Ų240149.9 Ų149.991%0.90681%0.807SS**  20.2126.696.6-166.8-179-71.5-942.1117.7
403G28.2Very low33.5Very low80 Ų80146 Ų14683%0.82580%0.8SS**  trans116.8128.9154.300000112.4
404G29.9Very low33.9Very low67 Ų67143 Ų14369%0.69179%0.785SS**  cis171.8154.64.300000107.8
405E34.1Very low34.3Very low182 Ų182140.6 Ų140.685%0.8578%0.783SS**  trans47142.5141.9-62.4174.1154.200118.6
406E31.3Very low35.1Very low179 Ų179142.3 Ų142.384%0.83678%0.784SS**  cis-177.2166.67.3-106.3178.7168.200104.6
407G30.1Very low36.1Very low75 Ų75140.3 Ų140.377%0.77377%0.77SS**  trans132.672.3156.800000118.8
408Q31.3Very low37.1Very low207 Ų207141.5 Ų141.597%0.96777%0.769SS**  trans17.1122.6131.6-155.616913.900120.2
409G28.6Very low38.6Very low71 Ų71135.6 Ų135.673%0.73276%0.758SS**  trans153.6121.3153.600000116.9
410E35Very low39.7Very low197 Ų197133.3 Ų133.392%0.92176%0.756SS**  trans76.675.9158.1-61.4-169.5127.900120.3K412E410-K412 PolarHBondContact O-N 3.29Å
411A39.6Very low40.7Very low103 Ų103132.8 Ų132.885%0.85175%0.748SS**THydrogen-bonded Turntrans-71.599.8148.500000110.1
412K43.7Very low42Very low211 Ų211130.1 Ų130.192%0.91774%0.738SS**THydrogen-bonded Turntrans179.44.3145.2-102.6177.6-177.5-173.30116.8E410E410-K412 PolarHBondContact O-N 3.29Å
413A41.5Very low43.4Very low84 Ų84123.6 Ų123.669%0.69472%0.718SS**SBendtrans-109.96.8172.800000114.1
414G42Very low45Very low37 Ų37122.2 Ų122.238%0.38170%0.699SS.*Hα-helixtrans-81.6-38.8-17200000115.2K416 S417 L418G414-K416 PolarHBondContact O-N 2.89Å; G414-S417 PolarHBondContact O-N 3.27Å; G414-L418 VanDerWaalsContact O-CB 3.23Å; G414-L418 WeakPolarHBondContact O-CB 3.4Å; G414-L418 WeakPolarHBondContact O-CD1 3.26Å; G414-L418 WeakPolarHBondContact O-CG 3.18Å; G414-L418 PolarHBondContact O-N 2.94Å
415E44.6Very low46.4Very low177 Ų177122.4 Ų122.483%0.82769%0.687SS**Hα-helixtrans-71.2-37-170.3-78.9-178.5141.900113.6S419E415-S419 WeakPolarHBondContact O-CB 3.49Å; E415-S419 PolarHBondContact O-N 3.46Å
416K48.9Very low47.6Very low187 Ų187116.6 Ų116.681%0.81366%0.661SS**Hα-helixtrans-74.2-36.1177.5-67.3-177.2-178.2179.90112G414 Q420G414-K416 PolarHBondContact O-N 2.89Å; K416-Q420 WeakPolarHBondContact O-CB 3.4Å; K416-Q420 PolarHBondContact O-N 2.79Å
417S54.2Low49.1Very low79 Ų79114 Ų11455%0.55265%0.647SS**Hα-helixtrans-72.5-39178.1-157.10000111.5G414 H421G414-S417 PolarHBondContact O-N 3.27Å; S417-H421 WeakPolarHBondContact O-CB 3.31Å; S417-H421 PolarHBondContact O-N 3.33Å
418L53.5Low50.3Low112 Ų112120.3 Ų120.359%0.58665%0.648SS**Hα-helixtrans-70.6-41.8174.8-70.5167.9000112.3G414 H421 V422G414-L418 VanDerWaalsContact O-CB 3.23Å; G414-L418 WeakPolarHBondContact O-CB 3.4Å; G414-L418 WeakPolarHBondContact O-CD1 3.26Å; G414-L418 WeakPolarHBondContact O-CG 3.18Å; G414-L418 PolarHBondContact O-N 2.94Å; L418-H421 PolarHBondContact O-N 3.4Å; L418-V422 VanDerWaalsContact O-CB 3.27Å; L418-V422 WeakPolarHBondContact O-CB 3.22Å; L418-V422 WeakPolarHBondContact O-CG2 3.03Å; L418-V422 PolarHBondContact O-N 2.94Å
419S57.6Low51.4Low76 Ų76114.1 Ų114.153%0.53162%0.621SS.*Hα-helixtrans-67.2-38.9177.5-154.10000111.5E415 V422 E423E415-S419 WeakPolarHBondContact O-CB 3.49Å; E415-S419 PolarHBondContact O-N 3.46Å; S419-V422 PolarHBondContact O-N 3.32Å; S419-E423 VanDerWaalsContact O-CB 3.25Å; S419-E423 WeakPolarHBondContact O-CB 3.47Å; S419-E423 PolarHBondContact O-N 3.29Å
420Q60.1Low52.5Low146 Ų146117 Ų11768%0.68262%0.615SS**Hα-helixtrans-71.4-31.7175.9-162.3170.357.200112.3K416 A424K416-Q420 WeakPolarHBondContact O-CB 3.4Å; K416-Q420 PolarHBondContact O-N 2.79Å; Q420-A424 WeakPolarHBondContact O-CB 3.44Å; Q420-A424 PolarHBondContact O-N 2.75Å
421H53.1Low53.4Low126 Ų126116.1 Ų116.158%0.58361%0.611SS**Hα-helixtrans-74-39172.7-163.955.5000112.1S417 L418 A424 V425S417-H421 WeakPolarHBondContact O-CB 3.31Å; S417-H421 PolarHBondContact O-N 3.33Å; L418-H421 PolarHBondContact O-N 3.4Å; H421-A424 PolarHBondContact O-N 3.12Å; H421-V425 VanDerWaalsContact O-CB 3.3Å; H421-V425 WeakPolarHBondContact O-CB 3.4Å; H421-V425 WeakPolarHBondContact O-CG2 3.4Å; H421-V425 PolarHBondContact O-N 3.28Å
422V61.6Low54.2Low96 Ų96115.8 Ų115.858%0.58260%0.603SS**Hα-helixtrans-66-42.9174168.40000110.6L418 S419 V425 D426L418-V422 VanDerWaalsContact O-CB 3.27Å; L418-V422 WeakPolarHBondContact O-CB 3.22Å; L418-V422 WeakPolarHBondContact O-CG2 3.03Å; L418-V422 PolarHBondContact O-N 2.94Å; S419-V422 PolarHBondContact O-N 3.32Å; V422-V425 PolarHBondContact O-N 2.94Å; V422-D426 WeakPolarHBondContact O-CB 3.33Å; V422-D426 PolarHBondContact O-N 3.47Å
423E63.2Low55Low104 Ų104107.7 Ų107.749%0.48657%0.568SS.*Hα-helixtrans-70.4-33.6177.8-156.2-170.2153.200112.1S419 K427S419-E423 VanDerWaalsContact O-CB 3.25Å; S419-E423 WeakPolarHBondContact O-CB 3.47Å; S419-E423 PolarHBondContact O-N 3.29Å; E423-K427 WeakPolarHBondContact O-CB 3.48Å; E423-K427 VanDerWaalsContact O-CG 3.3Å; E423-K427 WeakPolarHBondContact O-CG 3.2Å; E423-K427 PolarHBondContact O-N 3.31Å; E423-K427 WeakPolarHBondContact OE1-CE 3.38Å; E423-K427 IonicContact OE1-NZ 2.9Å; E423-K427 PolarHBondContact OE1-NZ 2.86Å
424A61.3Low56.4Low50 Ų50106.6 Ų106.641%0.41355%0.554SS.*Hα-helixtrans-70.9-34.117200000112.6Q420 H421 R428Q420-A424 WeakPolarHBondContact O-CB 3.44Å; Q420-A424 PolarHBondContact O-N 2.75Å; H421-A424 PolarHBondContact O-N 3.12Å; A424-R428 WeakPolarHBondContact O-CB 3.38Å; A424-R428 VanDerWaalsContact O-CG 3.29Å; A424-R428 WeakPolarHBondContact O-CG 3.46Å; A424-R428 PolarHBondContact O-N 3.32Å; A424-R428 VanDerWaalsContact O-N 3.09Å
425V58.2Low57.9Low72 Ų72112.8 Ų112.844%0.43657%0.573SS.*Hα-helixtrans-72.6-38.7173.8169.30000110.9H421 V422 R428 L429H421-V425 VanDerWaalsContact O-CB 3.3Å; H421-V425 WeakPolarHBondContact O-CB 3.4Å; H421-V425 WeakPolarHBondContact O-CG2 3.4Å; H421-V425 PolarHBondContact O-N 3.28Å; V422-V425 PolarHBondContact O-N 2.94Å; V425-R428 PolarHBondContact O-N 3.41Å; V425-L429 WeakPolarHBondContact O-CB 3.46Å; V425-L429 PolarHBondContact O-N 3.46Å
426D61Low59.4Low60 Ų60111 Ų11132%0.32156%0.559SS.*Hα-helixtrans-69.5-38.4177.2-132.313.3000111.1V422 R428 L429 E430 K441V422-D426 WeakPolarHBondContact O-CB 3.33Å; V422-D426 PolarHBondContact O-N 3.47Å; D426-R428 PolarHBondContact O-N 3.45Å; D426-L429 CarbonylContact O-C 3.36Å; D426-L429 PolarHBondContact O-N 3.46Å; D426-E430 WeakPolarHBondContact O-CG 3.49Å; D426-E430 PolarHBondContact O-N 2.94Å; D426-K441 IonicContact OD2-NZ 3.68Å
427K61.8Low61Low123 Ų123106.3 Ų106.354%0.53554%0.539SS..Hα-helixtrans-66.1-33.6171.5-74.9175.1-173.7164.90113.3E423 L429E423-K427 WeakPolarHBondContact O-CB 3.48Å; E423-K427 VanDerWaalsContact O-CG 3.3Å; E423-K427 WeakPolarHBondContact O-CG 3.2Å; E423-K427 PolarHBondContact O-N 3.31Å; E423-K427 WeakPolarHBondContact OE1-CE 3.38Å; E423-K427 IonicContact OE1-NZ 2.9Å; E423-K427 PolarHBondContact OE1-NZ 2.86Å; K427-L429 VanDerWaalsContact C-N 3.34Å
428R55.9Low62.2Low209 Ų209105.4 Ų105.479%0.78954%0.536SS*.Hα-helixtrans-74.6-24.7172.2-75.5-123.4-68.2-132.5-1.4112.8A424 V425 D426A424-R428 WeakPolarHBondContact O-CB 3.38Å; A424-R428 VanDerWaalsContact O-CG 3.29Å; A424-R428 WeakPolarHBondContact O-CG 3.46Å; A424-R428 PolarHBondContact O-N 3.32Å; A424-R428 VanDerWaalsContact O-N 3.09Å; V425-R428 PolarHBondContact O-N 3.41Å; D426-R428 PolarHBondContact O-N 3.45Å
429L53.3Low63.7Low77 Ų77104.6 Ų104.640%0.40353%0.532SS..Hα-helixtrans-89.1-24.6-179.9-162.565.6000112.2V425 D426 K427 Q431 S432 Q433V425-L429 WeakPolarHBondContact O-CB 3.46Å; V425-L429 PolarHBondContact O-N 3.46Å; D426-L429 CarbonylContact O-C 3.36Å; D426-L429 PolarHBondContact O-N 3.46Å; K427-L429 VanDerWaalsContact C-N 3.34Å; L429-Q431 PolarHBondContact O-N 3.21Å; L429-S432 CarbonylContact O-C 3.58Å; L429-S432 PolarHBondContact O-N 3.36Å; L429-Q433 HydrophobicContact CG-CG 3.96Å; L429-Q433 WeakPolarHBondContact O-CG 3.32Å; L429-Q433 PolarHBondContact O-N 3.47Å
430E52.9Low65.1Low130 Ų130107.6 Ų107.661%0.60754%0.536SS*.Hα-helixtrans-57-32.8175.9-91178.4167.700113.4D426 S432D426-E430 WeakPolarHBondContact O-CG 3.49Å; D426-E430 PolarHBondContact O-N 2.94Å; E430-S432 PolarHBondContact O-N 2.88Å
431Q53.9Low66.4Low180 Ų180105.5 Ų105.584%0.84152%0.524SS*.THydrogen-bonded Turntrans-73.6-3175.2-78.7173.1-10.100113.9L429L429-Q431 PolarHBondContact O-N 3.21Å
432S56.5Low68.2Low96 Ų96103.4 Ų103.467%0.67152%0.515SS*.THydrogen-bonded Turntrans-143.516.5-177.1-50.40000113.6L429 E430L429-S432 CarbonylContact O-C 3.58Å; L429-S432 PolarHBondContact O-N 3.36Å; E430-S432 PolarHBondContact O-N 2.88Å
433Q60.4Low69.6Low41 Ų41102.7 Ų102.719%0.19251%0.507CS..  trans-79.5132.9174-65.3-146.38.700110.6L429 K437L429-Q433 HydrophobicContact CG-CG 3.96Å; L429-Q433 WeakPolarHBondContact O-CG 3.32Å; L429-Q433 PolarHBondContact O-N 3.47Å; Q433-K437 VanDerWaalsContact OE1-CD 3.23Å
434P70.1Confident70.9Confident61 Ų61104 Ų10440%0.39651%0.511SS..  trans-64.7140.3171.326-33.1000110.8Y436 K437P434-Y436 HydrophobicContact CB-CD1 3.63Å; P434-Y436 HydrophobicContact CB-CE1 3.48Å; P434-Y436 VanDerWaalsContact CB-CE1 3.48Å; P434-Y436 HydrophobicContact CG-CD1 3.81Å; P434-Y436 HydrophobicContact CG-CE1 3.19Å; P434-Y436 PolarHBondContact O-N 2.85Å; P434-K437 WeakPolarHBondContact O-CB 3.24Å; P434-K437 PolarHBondContact O-N 2.98Å
435E73.8Confident72.4Confident167 Ų167104.7 Ų104.778%0.7851%0.513SS*.Hα-helixtrans-52.2-31.4-170.1-64.8179.8173.400114.3K437 A438 L439E435-K437 PolarHBondContact O-N 3.42Å; E435-K437 VanDerWaalsContact O-N 3.17Å; E435-A438 PolarHBondContact O-N 3.46Å; E435-L439 PolarHBondContact O-N 3.36Å
436Y76.4Confident73.8Confident139 Ų139108.5 Ų108.555%0.54552%0.52SS..Hα-helixtrans-58.1-32.4177.275.9-100.3000112.2P434 L439 F440P434-Y436 HydrophobicContact CB-CD1 3.63Å; P434-Y436 HydrophobicContact CB-CE1 3.48Å; P434-Y436 VanDerWaalsContact CB-CE1 3.48Å; P434-Y436 HydrophobicContact CG-CD1 3.81Å; P434-Y436 HydrophobicContact CG-CE1 3.19Å; P434-Y436 PolarHBondContact O-N 2.85Å; Y436-L439 WeakPolarHBondContact O-CB 3.34Å; Y436-L439 PolarHBondContact O-N 3.37Å; Y436-F440 AromaticContact CD2-CD2 3.98Å; Y436-F440 HydrophobicContact CD2-CD2 3.98Å; Y436-F440 HydrophobicContact CD2-CE2 4.16Å; Y436-F440 WeakPolarHBondContact O-CD2 3.27Å; Y436-F440 PolarHBondContact O-N 3.26Å
437K81.7Confident75.3Confident89 Ų89110.4 Ų110.439%0.38753%0.529SS..Hα-helixtrans-75.3-31.6-176.8-145.8164.9172.4-168.40111.7Q433 P434 E435 K441Q433-K437 VanDerWaalsContact OE1-CD 3.23Å; P434-K437 WeakPolarHBondContact O-CB 3.24Å; P434-K437 PolarHBondContact O-N 2.98Å; E435-K437 PolarHBondContact O-N 3.42Å; E435-K437 VanDerWaalsContact O-N 3.17Å; K437-K441 PolarHBondContact O-N 3.24Å
438A80.8Confident76.5Confident60 Ų60110.2 Ų110.250%0.49653%0.53SS..Hα-helixtrans-68.7-43.7169.400000111.2E435 F440 K441 E442E435-A438 PolarHBondContact O-N 3.46Å; A438-F440 VanDerWaalsContact C-N 3.34Å; A438-F440 PolarHBondContact O-N 3.17Å; A438-K441 PolarHBondContact O-N 2.91Å; A438-K441 VanDerWaalsContact O-N 3.16Å; A438-E442 PolarHBondContact O-N 2.85Å
439L82.9Confident78.2Confident94 Ų94107.1 Ų107.149%0.49252%0.522SS..Hα-helixtrans-58.7-42.8173.4-82.2162.6000112.1E435 Y436 K441 E442 I443E435-L439 PolarHBondContact O-N 3.36Å; Y436-L439 WeakPolarHBondContact O-CB 3.34Å; Y436-L439 PolarHBondContact O-N 3.37Å; L439-K441 PolarHBondContact O-N 2.93Å; L439-E442 PolarHBondContact O-N 3.25Å; L439-I443 WeakPolarHBondContact O-CB 3.44Å; L439-I443 WeakPolarHBondContact O-CD1 3.27Å; L439-I443 WeakPolarHBondContact O-CG1 3.29Å; L439-I443 PolarHBondContact O-N 3.24Å
440F88.2Confident80Confident139 Ų139107.2 Ų107.261%0.6153%0.526SS*.Hα-helixtrans-62.8-41.1175.4-89.4-71.7000112.4Y436 A438 E442 F444Y436-F440 AromaticContact CD2-CD2 3.98Å; Y436-F440 HydrophobicContact CD2-CD2 3.98Å; Y436-F440 HydrophobicContact CD2-CE2 4.16Å; Y436-F440 WeakPolarHBondContact O-CD2 3.27Å; Y436-F440 PolarHBondContact O-N 3.26Å; A438-F440 VanDerWaalsContact C-N 3.34Å; A438-F440 PolarHBondContact O-N 3.17Å; F440-E442 VanDerWaalsContact C-N 3.34Å; F440-F444 VanDerWaalsContact O-CB 3.27Å; F440-F444 WeakPolarHBondContact O-CB 3.47Å; F440-F444 PolarHBondContact O-N 3.45Å
441K86.9Confident81.8Confident103 Ų103107.6 Ų107.645%0.44853%0.526SS..Hα-helixtrans-63-41.1174-74.1-175.5176.6-174.50111.3D426 K437 A438 L439 F444 S445D426-K441 IonicContact OD2-NZ 3.68Å; K437-K441 PolarHBondContact O-N 3.24Å; A438-K441 PolarHBondContact O-N 2.91Å; A438-K441 VanDerWaalsContact O-N 3.16Å; L439-K441 PolarHBondContact O-N 2.93Å; K441-F444 PolarHBondContact O-N 2.87Å; K441-S445 WeakPolarHBondContact O-CB 3.29Å; K441-S445 PolarHBondContact O-N 3.43Å; K441-S445 PolarHBondContact O-OG 3.41Å; K441-S445 VanDerWaalsContact O-OG 3.05Å
442E90.2Very high83.2Confident81 Ų81101.6 Ų101.638%0.37951%0.507SS..Hα-helixtrans-66.6-44.9177.5-167.3-178.6163.300112.3A438 L439 F440 F444 S445 R446A438-E442 PolarHBondContact O-N 2.85Å; L439-E442 PolarHBondContact O-N 3.25Å; F440-E442 VanDerWaalsContact C-N 3.34Å; E442-F444 PolarHBondContact O-N 3.45Å; E442-S445 WeakPolarHBondContact CA-OG 3.34Å; E442-S445 PolarHBondContact O-N 3.48Å; E442-S445 PolarHBondContact O-OG 2.86Å; E442-R446 WeakPolarHBondContact O-CB 3.45Å; E442-R446 PolarHBondContact O-N 2.92Å; E442-R446 IonicContact OE1-CZ 3.99Å; E442-R446 IonicContact OE1-NH1 3.6Å; E442-R446 PolarHBondContact OE1-NH1 3.39Å; E442-R446 IonicContact OE1-NH2 2.97Å; E442-R446 PolarHBondContact OE1-NH2 2.94Å
443I91.4Very high84.6Confident81 Ų81101.3 Ų101.342%0.41550%0.498SS..Hα-helixtrans-62-46.2176-69164.3000109.9L439 S445 R446 I447L439-I443 WeakPolarHBondContact O-CB 3.44Å; L439-I443 WeakPolarHBondContact O-CD1 3.27Å; L439-I443 WeakPolarHBondContact O-CG1 3.29Å; L439-I443 PolarHBondContact O-N 3.24Å; I443-S445 PolarHBondContact O-N 2.93Å; I443-R446 PolarHBondContact O-N 3.43Å; I443-I447 HydrophobicContact CG2-CD1 3.65Å; I443-I447 HydrophobicContact CG2-CG1 4.37Å; I443-I447 WeakPolarHBondContact O-CB 3.41Å; I443-I447 VanDerWaalsContact O-CG1 3.23Å; I443-I447 WeakPolarHBondContact O-CG1 3.41Å; I443-I447 PolarHBondContact O-N 2.88Å
444F91.6Very high85.7Confident131 Ų131103.2 Ų103.258%0.57551%0.509SS*.Hα-helixtrans-66.6-39.1-178.6-150.6-101.1000112.1F440 K441 E442 I447 Q448F440-F444 VanDerWaalsContact O-CB 3.27Å; F440-F444 WeakPolarHBondContact O-CB 3.47Å; F440-F444 PolarHBondContact O-N 3.45Å; K441-F444 PolarHBondContact O-N 2.87Å; E442-F444 PolarHBondContact O-N 3.45Å; F444-I447 PolarHBondContact O-N 3.29Å; F444-Q448 HydrophobicContact CD1-CG 4.36Å; F444-Q448 HydrophobicContact CE1-CG 4.46Å; F444-Q448 VanDerWaalsContact CE1-NE2 3.3Å; F444-Q448 WeakPolarHBondContact O-CG 3.43Å; F444-Q448 PolarHBondContact O-N 3.24Å
445S91.3Very high86.2Confident66 Ų66104.2 Ų104.246%0.46251%0.511SS..Hα-helixtrans-66.5-40.7174.5630000112.5K441 E442 I443 Q448 K449K441-S445 WeakPolarHBondContact O-CB 3.29Å; K441-S445 PolarHBondContact O-N 3.43Å; K441-S445 PolarHBondContact O-OG 3.41Å; K441-S445 VanDerWaalsContact O-OG 3.05Å; E442-S445 WeakPolarHBondContact CA-OG 3.34Å; E442-S445 PolarHBondContact O-N 3.48Å; E442-S445 PolarHBondContact O-OG 2.86Å; I443-S445 PolarHBondContact O-N 2.93Å; S445-Q448 PolarHBondContact O-N 3.18Å; S445-K449 WeakPolarHBondContact O-CB 3.47Å; S445-K449 PolarHBondContact O-N 2.97Å
446R89.6Confident86.4Confident152 Ų15299 Ų9957%0.57450%0.496SS*.Hα-helixtrans-60.9-46.5172.2-82.7-175.5175.11278.3111.6E442 I443 Q448 K449 T450E442-R446 WeakPolarHBondContact O-CB 3.45Å; E442-R446 PolarHBondContact O-N 2.92Å; E442-R446 IonicContact OE1-CZ 3.99Å; E442-R446 IonicContact OE1-NH1 3.6Å; E442-R446 PolarHBondContact OE1-NH1 3.39Å; E442-R446 IonicContact OE1-NH2 2.97Å; E442-R446 PolarHBondContact OE1-NH2 2.94Å; I443-R446 PolarHBondContact O-N 3.43Å; R446-Q448 VanDerWaalsContact C-N 3.34Å; R446-Q448 PolarHBondContact O-N 2.87Å; R446-K449 PolarHBondContact O-N 2.93Å; R446-T450 PolarHBondContact O-N 2.88Å; R446-T450 PolarHBondContact O-OG1 2.83Å
447I91.3Very high86.2Confident100 Ų10096.3 Ų96.351%0.51349%0.494SS..Hα-helixtrans-60.4-43.7177.3-69.6168000111I443 F444 T450 K451I443-I447 HydrophobicContact CG2-CD1 3.65Å; I443-I447 HydrophobicContact CG2-CG1 4.37Å; I443-I447 WeakPolarHBondContact O-CB 3.41Å; I443-I447 VanDerWaalsContact O-CG1 3.23Å; I443-I447 WeakPolarHBondContact O-CG1 3.41Å; I443-I447 PolarHBondContact O-N 2.88Å; F444-I447 PolarHBondContact O-N 3.29Å; I447-T450 PolarHBondContact O-N 3.48Å; I447-K451 WeakPolarHBondContact O-CB 3.32Å; I447-K451 PolarHBondContact O-N 3.32Å
448Q88.2Confident85.8Confident118 Ų11898 Ų9855%0.55150%0.502SS*.Hα-helixtrans-64.7-40176.7-77.2-164.415.100112.5F444 S445 R446 K451 A452F444-Q448 HydrophobicContact CD1-CG 4.36Å; F444-Q448 HydrophobicContact CE1-CG 4.46Å; F444-Q448 VanDerWaalsContact CE1-NE2 3.3Å; F444-Q448 WeakPolarHBondContact O-CG 3.43Å; F444-Q448 PolarHBondContact O-N 3.24Å; S445-Q448 PolarHBondContact O-N 3.18Å; R446-Q448 VanDerWaalsContact C-N 3.34Å; R446-Q448 PolarHBondContact O-N 2.87Å; Q448-K451 PolarHBondContact O-N 2.93Å; Q448-A452 PolarHBondContact O-N 3.43Å
449K90.6Very high85.3Confident144 Ų144100.1 Ų100.163%0.62651%0.508SS*.Hα-helixtrans-63.2-48176-169.2176.3-179.8179.70111.2S445 R446 K451 A452 D453S445-K449 WeakPolarHBondContact O-CB 3.47Å; S445-K449 PolarHBondContact O-N 2.97Å; R446-K449 PolarHBondContact O-N 2.93Å; K449-K451 VanDerWaalsContact C-N 3.29Å; K449-K451 PolarHBondContact O-N 2.72Å; K449-A452 WeakPolarHBondContact O-CB 3.42Å; K449-A452 PolarHBondContact O-N 2.85Å; K449-A452 VanDerWaalsContact O-N 3.09Å; K449-D453 VanDerWaalsContact O-CG 3.3Å; K449-D453 PolarHBondContact O-N 3.4Å
450T91.6Very high84.5Confident79 Ų79103.3 Ų103.349%0.48552%0.518SS..Hα-helixtrans-59.7-39.5174.9-54.10000111.7R446 I447 D453 I454R446-T450 PolarHBondContact O-N 2.88Å; R446-T450 PolarHBondContact O-OG1 2.83Å; I447-T450 PolarHBondContact O-N 3.48Å; T450-D453 PolarHBondContact O-N 3.4Å; T450-I454 HydrophobicContact CG2-CD1 3.91Å; T450-I454 HydrophobicContact CG2-CG1 4.46Å; T450-I454 WeakPolarHBondContact O-CB 3.33Å; T450-I454 VanDerWaalsContact O-CG1 3.23Å; T450-I454 WeakPolarHBondContact O-CG1 2.95Å; T450-I454 PolarHBondContact O-N 2.94Å
451K89.3Confident83.2Confident138 Ų138101.2 Ų101.260%0.652%0.517SS*.Hα-helixtrans-63.4-41.1174.9-174.4178.8178.41800112I447 Q448 K449 N455I447-K451 WeakPolarHBondContact O-CB 3.32Å; I447-K451 PolarHBondContact O-N 3.32Å; Q448-K451 PolarHBondContact O-N 2.93Å; K449-K451 VanDerWaalsContact C-N 3.29Å; K449-K451 PolarHBondContact O-N 2.72Å; K451-N455 WeakPolarHBondContact O-CB 3.35Å; K451-N455 PolarHBondContact O-N 3.2Å; K451-N455 PolarHBondContact O-ND2 3.48Å
452A85.3Confident81.9Confident55 Ų55103.7 Ų103.746%0.45553%0.53SS..Hα-helixtrans-66-41.817600000111.8Q448 K449 N455 A456Q448-A452 PolarHBondContact O-N 3.43Å; K449-A452 WeakPolarHBondContact O-CB 3.42Å; K449-A452 PolarHBondContact O-N 2.85Å; K449-A452 VanDerWaalsContact O-N 3.09Å; A452-N455 PolarHBondContact O-N 3.01Å; A452-A456 WeakPolarHBondContact O-CB 3.49Å; A452-A456 PolarHBondContact O-N 2.78Å
453D84.1Confident80.3Confident90 Ų90104.5 Ų104.548%0.48155%0.545SS..Hα-helixtrans-66.1-40.3178-66.2-25.1000111.9K449 T450 N455 A456 T457K449-D453 VanDerWaalsContact O-CG 3.3Å; K449-D453 PolarHBondContact O-N 3.4Å; T450-D453 PolarHBondContact O-N 3.4Å; D453-N455 VanDerWaalsContact C-N 3.34Å; D453-A456 PolarHBondContact O-N 2.96Å; D453-T457 WeakPolarHBondContact O-CG2 3.5Å; D453-T457 PolarHBondContact O-N 2.76Å; D453-T457 PolarHBondContact O-OG1 3.43Å
454I84.4Confident78.5Confident81 Ų81105.7 Ų105.742%0.41556%0.56SS.*Hα-helixtrans-63.7-40.8173.1-69.1167.1000110.8T450 T457 K458T450-I454 HydrophobicContact CG2-CD1 3.91Å; T450-I454 HydrophobicContact CG2-CG1 4.46Å; T450-I454 WeakPolarHBondContact O-CB 3.33Å; T450-I454 VanDerWaalsContact O-CG1 3.23Å; T450-I454 WeakPolarHBondContact O-CG1 2.95Å; T450-I454 PolarHBondContact O-N 2.94Å; I454-T457 WeakPolarHBondContact CA-OG1 3.37Å; I454-T457 PolarHBondContact O-OG1 2.83Å; I454-K458 HydrophobicContact CG2-CD 4.28Å; I454-K458 WeakPolarHBondContact O-CB 3.29Å; I454-K458 VanDerWaalsContact O-CG 3.31Å; I454-K458 WeakPolarHBondContact O-CG 3.38Å; I454-K458 PolarHBondContact O-N 3.01Å
455N80.3Confident76.4Confident81 Ų81111.6 Ų111.643%0.43359%0.585SS.*Hα-helixtrans-68.2-39.8176.9-71.7-19.6000111.7K451 A452 D453 K458 V459K451-N455 WeakPolarHBondContact O-CB 3.35Å; K451-N455 PolarHBondContact O-N 3.2Å; K451-N455 PolarHBondContact O-ND2 3.48Å; A452-N455 PolarHBondContact O-N 3.01Å; D453-N455 VanDerWaalsContact C-N 3.34Å; N455-K458 PolarHBondContact O-N 2.9Å; N455-V459 VanDerWaalsContact O-CG2 3.32Å; N455-V459 WeakPolarHBondContact O-CG2 3.46Å; N455-V459 PolarHBondContact O-N 3.29Å
456A77.6Confident75.6Confident58 Ų58113.9 Ų113.948%0.47959%0.591SS.*Hα-helixtrans-64.3-41.4176.600000112.1A452 D453 V459 K460A452-A456 WeakPolarHBondContact O-CB 3.49Å; A452-A456 PolarHBondContact O-N 2.78Å; D453-A456 PolarHBondContact O-N 2.96Å; A456-V459 PolarHBondContact O-N 3.43Å; A456-K460 WeakPolarHBondContact O-CB 3.43Å; A456-K460 PolarHBondContact O-N 3.12Å
457T73.6Confident74.9Confident83 Ų83111.8 Ų111.851%0.50959%0.592SS.*Hα-helixtrans-68.4-36.3175.949.50000112.6D453 I454 K460 T461D453-T457 WeakPolarHBondContact O-CG2 3.5Å; D453-T457 PolarHBondContact O-N 2.76Å; D453-T457 PolarHBondContact O-OG1 3.43Å; I454-T457 WeakPolarHBondContact CA-OG1 3.37Å; I454-T457 PolarHBondContact O-OG1 2.83Å; T457-K460 PolarHBondContact O-N 3.4Å; T457-T461 WeakPolarHBondContact O-CG2 3.24Å; T457-T461 PolarHBondContact O-N 2.93Å; T457-T461 PolarHBondContact O-OG1 3.22Å
458K73.4Confident74Confident123 Ų123112.5 Ų112.554%0.53560%0.597SS.*Hα-helixtrans-62.4-43.5170.5-77.1178.9178.8-175.90112.4I454 N455 K460 T461 H462I454-K458 HydrophobicContact CG2-CD 4.28Å; I454-K458 WeakPolarHBondContact O-CB 3.29Å; I454-K458 VanDerWaalsContact O-CG 3.31Å; I454-K458 WeakPolarHBondContact O-CG 3.38Å; I454-K458 PolarHBondContact O-N 3.01Å; N455-K458 PolarHBondContact O-N 2.9Å; K458-K460 VanDerWaalsContact C-N 3.34Å; K458-K460 PolarHBondContact O-N 3.05Å; K458-T461 WeakPolarHBondContact CA-OG1 3.25Å; K458-T461 PolarHBondContact O-N 3.25Å; K458-T461 PolarHBondContact O-OG1 2.91Å; K458-H462 PolarHBondContact O-CD2 3.41Å; K458-H462 PolarHBondContact O-N 3.04Å; K458-H462 VanDerWaalsContact O-N 3.14Å
459V69.9Low73.2Confident105 Ų105112.2 Ų112.264%0.63660%0.599SS**Hα-helixtrans-65.5-38.7176.9174.20000111.2N455 A456 H462 S463N455-V459 VanDerWaalsContact O-CG2 3.32Å; N455-V459 WeakPolarHBondContact O-CG2 3.46Å; N455-V459 PolarHBondContact O-N 3.29Å; A456-V459 PolarHBondContact O-N 3.43Å; V459-H462 PolarHBondContact O-N 2.71Å; V459-S463 PolarHBondContact O-N 2.89Å; V459-S463 VanDerWaalsContact O-N 3.14Å
460K65.7Low72.1Confident162 Ų162110.2 Ų110.270%0.70460%0.598SS**Hα-helixtrans-68.5-35.6178.9-137.2166.2-175.6176.80113.1A456 T457 K458 S463A456-K460 WeakPolarHBondContact O-CB 3.43Å; A456-K460 PolarHBondContact O-N 3.12Å; T457-K460 PolarHBondContact O-N 3.4Å; K458-K460 VanDerWaalsContact C-N 3.34Å; K458-K460 PolarHBondContact O-N 3.05Å; K460-S463 PolarHBondContact O-N 2.95Å
461T61.3Low70.8Confident95 Ų95112.3 Ų112.358%0.58361%0.605SS**Hα-helixtrans-74.3-27.917644.40000113.2T457 K458T457-T461 WeakPolarHBondContact O-CG2 3.24Å; T457-T461 PolarHBondContact O-N 2.93Å; T457-T461 PolarHBondContact O-OG1 3.22Å; K458-T461 WeakPolarHBondContact CA-OG1 3.25Å; K458-T461 PolarHBondContact O-N 3.25Å; K458-T461 PolarHBondContact O-OG1 2.91Å
462H58.3Low69.5Low154 Ų154110.4 Ų110.471%0.71361%0.606SS**Hα-helixtrans-78.4-20.5171.6-81.5-69000114.1K458 V459K458-H462 PolarHBondContact O-CD2 3.41Å; K458-H462 PolarHBondContact O-N 3.04Å; K458-H462 VanDerWaalsContact O-N 3.14Å; V459-H462 PolarHBondContact O-N 2.71Å
463S56.8Low68.2Low99 Ų99114.7 Ų114.769%0.69262%0.617SS**THydrogen-bonded Turntrans-86-9.3177.4-177.80000114.3V459 K460V459-S463 PolarHBondContact O-N 2.89Å; V459-S463 VanDerWaalsContact O-N 3.14Å; K460-S463 PolarHBondContact O-N 2.95Å
464S55.2Low66.9Low105 Ų105116.8 Ų116.873%0.73463%0.629SS**THydrogen-bonded Turntrans-109.326.4-179.7-66.60000113.3
465K46.4Very low65.3Low255 Ų255120 Ų120100%1.10965%0.648SS**  trans-120.20171-96.7-178.6175177.80111.2

Retrieved 465 of 465 residues in 463.3 ms (Link to these results)