A0A087XDA3_POEFO Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XDA3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 176 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
1Y63Low76.6Confident231 Ų231105 Ų10591%0.90651%0.505SS*.  0-70.20-140.3-97.2000112.1F3 S4 L5Y1-F3 VanDerWaalsContact C-N 3.35Å; Y1-F3 PolarHBondContact O-N 3.44Å; Y1-S4 PolarHBondContact O-N 3.33Å; Y1-L5 WeakPolarHBondContact O-CB 3.5Å; Y1-L5 PolarHBondContact O-N 3.37Å
2I72.5Confident77.4Confident87 Ų87100.3 Ų100.345%0.44649%0.492SS..Hα-helixtrans-57.9-42.2-179.6-69.6160.1000113L5 F6 R135I2-L5 WeakPolarHBondContact O-CB 3.38Å; I2-L5 PolarHBondContact O-N 3.13Å; I2-F6 HydrophobicContact CG2-CD2 3.99Å; I2-F6 HydrophobicContact CG2-CE2 4.19Å; I2-F6 WeakPolarHBondContact O-CD2 3.43Å; I2-F6 PolarHBondContact O-N 3.3Å; I2-R135 VanDerWaalsContact CD1-NH2 3.33Å
3F66.5Low78Confident61 Ų6196.8 Ų96.827%0.26849%0.488SS..Hα-helixtrans-66-46176.1176.9-120.2000113Y1 L5 F6 L7 I124 L125 S128Y1-F3 VanDerWaalsContact C-N 3.35Å; Y1-F3 PolarHBondContact O-N 3.44Å; F3-L5 PolarHBondContact O-N 3.23Å; F3-F6 PolarHBondContact O-N 3.44Å; F3-L7 HydrophobicContact CD1-CD1 4.07Å; F3-L7 HydrophobicContact CD2-CD1 4.49Å; F3-L7 HydrophobicContact CD2-CG 4.25Å; F3-L7 HydrophobicContact CE1-CD1 3.45Å; F3-L7 VanDerWaalsContact CE1-CD1 3.45Å; F3-L7 HydrophobicContact CE1-CG 4.21Å; F3-L7 HydrophobicContact CE2-CD1 3.94Å; F3-L7 HydrophobicContact CE2-CD2 4.06Å; F3-L7 HydrophobicContact CE2-CG 3.81Å; F3-L7 HydrophobicContact CZ-CD1 3.41Å; F3-L7 VanDerWaalsContact CZ-CD1 3.41Å; F3-L7 HydrophobicContact CZ-CD2 4.13Å; F3-L7 HydrophobicContact CZ-CG 3.83Å; F3-L7 PolarHBondContact O-N 3.24Å; F3-I124 HydrophobicContact CE2-CG2 4.23Å; F3-L125 HydrophobicContact CZ-CD2 4.38Å; F3-S128 WeakPolarHBondContact CD1-OG 3.27Å; F3-S128 WeakPolarHBondContact CD2-OG 3.44Å; F3-S128 WeakPolarHBondContact CE2-OG 3.33Å; F3-S128 WeakPolarHBondContact CG-OG 3.12Å; F3-S128 VanDerWaalsContact CZ-OG 3.28Å; F3-S128 WeakPolarHBondContact CZ-OG 3.26Å
4S74.2Confident78.4Confident76 Ų7697.5 Ų97.553%0.53149%0.493SS..Hα-helixtrans-59.2-35.1173.1-56.80000111.8Y1 F8Y1-S4 PolarHBondContact O-N 3.33Å; S4-F8 VanDerWaalsContact O-CB 3.23Å; S4-F8 WeakPolarHBondContact O-CB 3.41Å; S4-F8 PolarHBondContact O-N 3.32Å
5L77.5Confident78.6Confident89 Ų8994.3 Ų94.347%0.46649%0.488SS..Hα-helixtrans-65.7-47.2175.8-16296.4000110.9Y1 I2 F3 F8 I9Y1-L5 WeakPolarHBondContact O-CB 3.5Å; Y1-L5 PolarHBondContact O-N 3.37Å; I2-L5 WeakPolarHBondContact O-CB 3.38Å; I2-L5 PolarHBondContact O-N 3.13Å; F3-L5 PolarHBondContact O-N 3.23Å; L5-F8 PolarHBondContact O-N 2.87Å; L5-I9 HydrophobicContact CD2-CD1 4.02Å; L5-I9 HydrophobicContact CG-CD1 4.06Å; L5-I9 WeakPolarHBondContact O-CB 3.37Å; L5-I9 WeakPolarHBondContact O-CG1 3.35Å; L5-I9 PolarHBondContact O-N 3.24Å
6F78.9Confident78.8Confident130 Ų13094.9 Ų94.957%0.5749%0.492SS*.Hα-helixtrans-62.8-42.4176.6-96.4-76.9000112.7I2 F3 I9 A10I2-F6 HydrophobicContact CG2-CD2 3.99Å; I2-F6 HydrophobicContact CG2-CE2 4.19Å; I2-F6 WeakPolarHBondContact O-CD2 3.43Å; I2-F6 PolarHBondContact O-N 3.3Å; F3-F6 PolarHBondContact O-N 3.44Å; F6-I9 PolarHBondContact O-N 3.07Å; F6-A10 WeakPolarHBondContact O-CB 3.43Å; F6-A10 PolarHBondContact O-N 3.02Å
7L78.1Confident79Confident45 Ų4599.6 Ų99.624%0.23650%0.502CS..Hα-helixtrans-63.3-43.2174-72.1-178.1000111.2F3 I9 A10 F11 I124F3-L7 HydrophobicContact CD1-CD1 4.07Å; F3-L7 HydrophobicContact CD2-CD1 4.49Å; F3-L7 HydrophobicContact CD2-CG 4.25Å; F3-L7 HydrophobicContact CE1-CD1 3.45Å; F3-L7 VanDerWaalsContact CE1-CD1 3.45Å; F3-L7 HydrophobicContact CE1-CG 4.21Å; F3-L7 HydrophobicContact CE2-CD1 3.94Å; F3-L7 HydrophobicContact CE2-CD2 4.06Å; F3-L7 HydrophobicContact CE2-CG 3.81Å; F3-L7 HydrophobicContact CZ-CD1 3.41Å; F3-L7 VanDerWaalsContact CZ-CD1 3.41Å; F3-L7 HydrophobicContact CZ-CD2 4.13Å; F3-L7 HydrophobicContact CZ-CG 3.83Å; F3-L7 PolarHBondContact O-N 3.24Å; L7-I9 PolarHBondContact O-N 3.45Å; L7-A10 PolarHBondContact O-N 3.32Å; L7-F11 WeakPolarHBondContact O-CB 3.33Å; L7-F11 VanDerWaalsContact O-CD2 3.25Å; L7-F11 WeakPolarHBondContact O-CD2 3.29Å; L7-F11 PolarHBondContact O-N 2.84Å; L7-I124 HydrophobicContact CD2-CG2 4.4Å
8F80.7Confident79Confident161 Ų161101.9 Ų101.971%0.70651%0.508SS*.Hα-helixtrans-63.6-41178.4-159.4-91.4000111.9S4 L5 S12S4-F8 VanDerWaalsContact O-CB 3.23Å; S4-F8 WeakPolarHBondContact O-CB 3.41Å; S4-F8 PolarHBondContact O-N 3.32Å; L5-F8 PolarHBondContact O-N 2.87Å; F8-S12 WeakPolarHBondContact O-CB 3.34Å; F8-S12 PolarHBondContact O-N 2.87Å; F8-S12 PolarHBondContact O-OG 3.05Å
9I84.4Confident78.8Confident92 Ų92106.5 Ų106.547%0.47252%0.518SS..Hα-helixtrans-64.2-43.9174.1-67.5164.6000110.6L5 F6 L7 S12 A13L5-I9 HydrophobicContact CD2-CD1 4.02Å; L5-I9 HydrophobicContact CG-CD1 4.06Å; L5-I9 WeakPolarHBondContact O-CB 3.37Å; L5-I9 WeakPolarHBondContact O-CG1 3.35Å; L5-I9 PolarHBondContact O-N 3.24Å; F6-I9 PolarHBondContact O-N 3.07Å; L7-I9 PolarHBondContact O-N 3.45Å; I9-S12 VanDerWaalsContact CA-OG 3.31Å; I9-S12 WeakPolarHBondContact CA-OG 3.12Å; I9-S12 PolarHBondContact O-N 3.39Å; I9-S12 PolarHBondContact O-OG 3.02Å; I9-A13 VanDerWaalsContact O-CB 3.27Å; I9-A13 WeakPolarHBondContact O-CB 3.25Å; I9-A13 PolarHBondContact O-N 2.82Å
10A83.3Confident78.3Confident40 Ų40105.4 Ų105.433%0.33152%0.521SS..Hα-helixtrans-65.1-44.1177.700000112.1F6 L7 A13 L14F6-A10 WeakPolarHBondContact O-CB 3.43Å; F6-A10 PolarHBondContact O-N 3.02Å; L7-A10 PolarHBondContact O-N 3.32Å; A10-A13 PolarHBondContact O-N 2.87Å; A10-L14 WeakPolarHBondContact O-CB 3.27Å; A10-L14 PolarHBondContact O-N 3.44Å
11F83.5Confident77.6Confident143 Ų143103.5 Ų103.563%0.62751%0.513SS*.Hα-helixtrans-64.7-41.8176.9-92.1-76.1000112.2L7 L14 A15L7-F11 WeakPolarHBondContact O-CB 3.33Å; L7-F11 VanDerWaalsContact O-CD2 3.25Å; L7-F11 WeakPolarHBondContact O-CD2 3.29Å; L7-F11 PolarHBondContact O-N 2.84Å; F11-L14 PolarHBondContact O-N 3.13Å; F11-A15 WeakPolarHBondContact O-CB 3.34Å; F11-A15 PolarHBondContact O-N 3.48Å
12S85.8Confident77.3Confident49 Ų4995.4 Ų95.434%0.34349%0.494SS..Hα-helixtrans-67.5-40.6176.247.20000111.8F8 I9 L14 A15 L16F8-S12 WeakPolarHBondContact O-CB 3.34Å; F8-S12 PolarHBondContact O-N 2.87Å; F8-S12 PolarHBondContact O-OG 3.05Å; I9-S12 VanDerWaalsContact CA-OG 3.31Å; I9-S12 WeakPolarHBondContact CA-OG 3.12Å; I9-S12 PolarHBondContact O-N 3.39Å; I9-S12 PolarHBondContact O-OG 3.02Å; S12-L14 PolarHBondContact O-N 3.13Å; S12-A15 PolarHBondContact O-N 3.45Å; S12-L16 WeakPolarHBondContact O-CB 3.32Å; S12-L16 VanDerWaalsContact O-CG 3.27Å; S12-L16 WeakPolarHBondContact O-CG 3.2Å; S12-L16 PolarHBondContact O-N 3.11Å
13A86Confident76.1Confident54 Ų5498.6 Ų98.645%0.44651%0.506SS..Hα-helixtrans-61.7-42.3172.200000112.2I9 A10 A15 L16 W17I9-A13 VanDerWaalsContact O-CB 3.27Å; I9-A13 WeakPolarHBondContact O-CB 3.25Å; I9-A13 PolarHBondContact O-N 2.82Å; A10-A13 PolarHBondContact O-N 2.87Å; A13-A15 VanDerWaalsContact C-N 3.34Å; A13-A15 PolarHBondContact O-N 3.45Å; A13-L16 PolarHBondContact O-N 3.25Å; A13-W17 VanDerWaalsContact O-CB 3.26Å; A13-W17 WeakPolarHBondContact O-CB 3.43Å; A13-W17 PolarHBondContact O-N 2.94Å
14L83.7Confident75.3Confident107 Ų107105.8 Ų105.856%0.5653%0.532SS*.Hα-helixtrans-65-38.3176.2-143.190.3000111.8A10 F11 S12 K18A10-L14 WeakPolarHBondContact O-CB 3.27Å; A10-L14 PolarHBondContact O-N 3.44Å; F11-L14 PolarHBondContact O-N 3.13Å; S12-L14 PolarHBondContact O-N 3.13Å; L14-K18 WeakPolarHBondContact O-CB 3.35Å; L14-K18 VanDerWaalsContact O-CG 3.27Å; L14-K18 WeakPolarHBondContact O-CG 3.47Å; L14-K18 PolarHBondContact O-N 3.45Å
15A81.2Confident73.9Confident50 Ų50107.7 Ų107.741%0.41354%0.536SS..Hα-helixtrans-68.5-41.7177.100000112F11 S12 A13 K18 R19F11-A15 WeakPolarHBondContact O-CB 3.34Å; F11-A15 PolarHBondContact O-N 3.48Å; S12-A15 PolarHBondContact O-N 3.45Å; A13-A15 VanDerWaalsContact C-N 3.34Å; A13-A15 PolarHBondContact O-N 3.45Å; A15-K18 PolarHBondContact O-N 3.06Å; A15-R19 WeakPolarHBondContact O-CG 3.42Å; A15-R19 PolarHBondContact O-N 3.26Å
16L81.7Confident72.6Confident104 Ų104107.2 Ų107.255%0.54555%0.545SS..Hα-helixtrans-65.2-43.6173.9-70.4172.4000111S12 A13 K18 R19 C20S12-L16 WeakPolarHBondContact O-CB 3.32Å; S12-L16 VanDerWaalsContact O-CG 3.27Å; S12-L16 WeakPolarHBondContact O-CG 3.2Å; S12-L16 PolarHBondContact O-N 3.11Å; A13-L16 PolarHBondContact O-N 3.25Å; L16-K18 VanDerWaalsContact C-N 3.33Å; L16-K18 PolarHBondContact O-N 3.44Å; L16-R19 WeakPolarHBondContact O-CB 3.46Å; L16-R19 PolarHBondContact O-N 3.12Å; L16-R19 VanDerWaalsContact O-N 3.1Å; L16-C20 PolarHBondContact O-N 3.01Å; L16-C20 PolarHBondContact O-SG 2.94Å; L16-C20 VanDerWaalsContact O-SG 3.34Å
17W82.1Confident71.2Confident175 Ų175106 Ų10666%0.66355%0.548SS*.Hα-helixtrans-56.2-47.3172.7-178.6-82.5000111.3A13 R19 C20 L21A13-W17 VanDerWaalsContact O-CB 3.26Å; A13-W17 WeakPolarHBondContact O-CB 3.43Å; A13-W17 PolarHBondContact O-N 2.94Å; W17-R19 VanDerWaalsContact C-N 3.3Å; W17-R19 PolarHBondContact O-N 3.2Å; W17-C20 PolarHBondContact O-N 2.78Å; W17-L21 HydrophobicContact CZ2-CD1 4.42Å; W17-L21 WeakPolarHBondContact O-CB 3.27Å; W17-L21 PolarHBondContact O-N 2.79Å
18K78.4Confident69.7Low141 Ų141112.2 Ų112.261%0.61358%0.582SS**Hα-helixtrans-60.9-35.2175.9-76.6-71.5-172.8-172.80113.1L14 A15 L16 A22L14-K18 WeakPolarHBondContact O-CB 3.35Å; L14-K18 VanDerWaalsContact O-CG 3.27Å; L14-K18 WeakPolarHBondContact O-CG 3.47Å; L14-K18 PolarHBondContact O-N 3.45Å; A15-K18 PolarHBondContact O-N 3.06Å; L16-K18 VanDerWaalsContact C-N 3.33Å; L16-K18 PolarHBondContact O-N 3.44Å; K18-A22 PolarHBondContact O-N 3.38Å; K18-A22 VanDerWaalsContact O-N 3.08Å
19R75.2Confident68.3Low188 Ų188108 Ų10871%0.70958%0.584SS**Hα-helixtrans-67.4-46.2174.4-74-177.7-178-166.30.3111.6A15 L16 W17 L21 A22 E23A15-R19 WeakPolarHBondContact O-CG 3.42Å; A15-R19 PolarHBondContact O-N 3.26Å; L16-R19 WeakPolarHBondContact O-CB 3.46Å; L16-R19 PolarHBondContact O-N 3.12Å; L16-R19 VanDerWaalsContact O-N 3.1Å; W17-R19 VanDerWaalsContact C-N 3.3Å; W17-R19 PolarHBondContact O-N 3.2Å; R19-L21 VanDerWaalsContact C-N 3.29Å; R19-L21 PolarHBondContact O-N 2.72Å; R19-A22 WeakPolarHBondContact O-CB 3.27Å; R19-A22 PolarHBondContact O-N 2.75Å; R19-E23 PolarHBondContact O-N 2.8Å
20C68.8Low66.3Low84 Ų84109 Ų10957%0.56860%0.6SS**Hα-helixtrans-64.6-34.3176.4-61.90000112.3L16 W17 E23 W24L16-C20 PolarHBondContact O-N 3.01Å; L16-C20 PolarHBondContact O-SG 2.94Å; L16-C20 VanDerWaalsContact O-SG 3.34Å; W17-C20 PolarHBondContact O-N 2.78Å; C20-E23 WeakPolarHBondContact O-CB 3.11Å; C20-E23 PolarHBondContact O-N 3.48Å; C20-W24 PolarHBondContact O-N 2.91Å; C20-W24 VanDerWaalsContact O-N 3.14Å
21L64.6Low64.6Low67 Ų67110.6 Ų110.635%0.35161%0.608SS.*Hα-helixtrans-72.8-29178.1-141.8139.5000112.4W17 R19 E23 N25W17-L21 HydrophobicContact CZ2-CD1 4.42Å; W17-L21 WeakPolarHBondContact O-CB 3.27Å; W17-L21 PolarHBondContact O-N 2.79Å; R19-L21 VanDerWaalsContact C-N 3.29Å; R19-L21 PolarHBondContact O-N 2.72Å; L21-E23 VanDerWaalsContact C-N 3.35Å; L21-N25 WeakPolarHBondContact O-CB 3.39Å; L21-N25 PolarHBondContact O-N 2.86Å; L21-N25 PolarHBondContact O-ND2 3.36Å
22A56.3Low62.5Low61 Ų61111.9 Ų111.950%0.50462%0.621SS.*Hα-helixtrans-68.9-34.6171.700000112K18 R19 A26K18-A22 PolarHBondContact O-N 3.38Å; K18-A22 VanDerWaalsContact O-N 3.08Å; R19-A22 WeakPolarHBondContact O-CB 3.27Å; R19-A22 PolarHBondContact O-N 2.75Å; A22-A26 PolarHBondContact O-N 3.2Å
23E46.8Very low60.6Low153 Ų153117.5 Ų117.572%0.71564%0.642SS**Hα-helixtrans-69.5-37.3176-161.1168.3146.700111.7R19 C20 L21 A26 T27R19-E23 PolarHBondContact O-N 2.8Å; C20-E23 WeakPolarHBondContact O-CB 3.11Å; C20-E23 PolarHBondContact O-N 3.48Å; L21-E23 VanDerWaalsContact C-N 3.35Å; E23-A26 PolarHBondContact O-N 2.92Å; E23-T27 PolarHBondContact O-OG1 3.26Å
24W49.9Very low58.6Low212 Ų212120.9 Ų120.980%0.80366%0.658SS**Hα-helixtrans-76.3-36.1176.7-152.870.9000113.2C20 A26 T27C20-W24 PolarHBondContact O-N 2.91Å; C20-W24 VanDerWaalsContact O-N 3.14Å; W24-A26 PolarHBondContact O-N 3.46Å; W24-T27 PolarHBondContact O-N 3.48Å
25N46.2Very low56.5Low117 Ų117120.4 Ų120.463%0.62667%0.669SS**THydrogen-bonded Turntrans-68.5-11.8174.2-80.7-16.4000113.9L21L21-N25 WeakPolarHBondContact O-CB 3.39Å; L21-N25 PolarHBondContact O-N 2.86Å; L21-N25 PolarHBondContact O-ND2 3.36Å
26A48.6Very low54.5Low78 Ų78122.5 Ų122.565%0.64568%0.68SS**THydrogen-bonded Turntrans-89.71.5178.600000113.9A22 E23 W24A22-A26 PolarHBondContact O-N 3.2Å; E23-A26 PolarHBondContact O-N 2.92Å; W24-A26 PolarHBondContact O-N 3.46Å
27T50.6Low52.5Low105 Ų105123.6 Ų123.664%0.64469%0.691SS**  trans-11626.6-172.4-420000114.9E23 W24 G29E23-T27 PolarHBondContact O-OG1 3.26Å; W24-T27 PolarHBondContact O-N 3.48Å; T27-G29 VanDerWaalsContact C-N 3.33Å
28D47Very low50.5Low175 Ų175120.3 Ų120.394%0.93669%0.694SS**  trans-99.838.5164.8-94.5-12000112.1
29G50.9Low48.8Very low73 Ų73121.1 Ų121.175%0.75370%0.7SS**  trans-117.944.8174.200000112.1T27 S31T27-G29 VanDerWaalsContact C-N 3.33Å; G29-S31 PolarHBondContact O-N 2.96Å
30S41.4Very low47.1Very low114 Ų114118.5 Ų118.580%0.79770%0.7SS**  trans-89.6106.2174-169.40000111.4
31S48Very low46.2Very low72 Ų72122 Ų12250%0.50371%0.713SS.*  trans58.8101.8133.9-156.30000117.8G29G29-S31 PolarHBondContact O-N 2.96Å
32N38.6Very low44.9Very low171 Ų171124.5 Ų124.591%0.91474%0.735SS**  -134.7113.8118.1-83.7-38.1000108.5
33Q47.6Very low44Very low166 Ų166128 Ų12878%0.77675%0.75SS**  trans-62.6158.3175.7-78.6166.2-7.500111.8
34T42.4Very low43.6Very low126 Ų126125.2 Ų125.277%0.77375%0.753SS**  trans90.375.2158.1-15.70000116.2
35A39.9Very low42.8Very low96 Ų96124.3 Ų124.379%0.79376%0.758SS**  trans-10885.7144.100000107.6V37A35-V37 PolarHBondContact O-N 3.33Å
36S40.4Very low42.5Very low94 Ų94126.7 Ų126.766%0.65776%0.762SS**  trans-66.7106.9157.953.90000106.7C38S36-C38 PolarHBondContact O-N 3.24Å
37V40Very low41.7Very low127 Ų127131.2 Ų131.277%0.7778%0.776SS**  trans-65.8103.7168.6172.90000106.9A35 Q39A35-V37 PolarHBondContact O-N 3.33Å; V37-Q39 PolarHBondContact O-N 3.03Å
38C39.3Very low41.1Very low106 Ų106131.2 Ų131.272%0.71678%0.776SS**  trans-74.8112.5160.4-760000107.4S36S36-C38 PolarHBondContact O-N 3.24Å
39Q42.4Very low40.5Very low158 Ų158132 Ų13274%0.73877%0.774SS**  trans-80.6116.1166.9-166.4155.6-25.200107.2V37V37-Q39 PolarHBondContact O-N 3.03Å
40D39.6Very low39.8Very low134 Ų134136 Ų13672%0.71777%0.773SS**SBendtrans53.9113.6157.6-38.5-28.1000118.4
41N49.6Very low39.2Very low158 Ų158136 Ų13685%0.84577%0.773SS**  trans64.2100.3171.2-74.6-12000118.5
42C38.4Very low38.5Very low119 Ų119139 Ų13980%0.80478%0.783SS**  trans-131.6108.6156.5-70.90000109.7
43T35.7Very low38.5Very low135 Ų135134 Ų13483%0.82877%0.772SS**  trans-94.7118.8172.1-54.40000109.1
44A40.1Very low38Very low93 Ų93131.7 Ų131.777%0.76976%0.761SS**  trans44.1123153.900000120.8
45E32.3Very low37.8Very low194 Ų194135.8 Ų135.891%0.90777%0.769SS**  -151.5153.6114.8-157.2162152.100111.5
46K39.6Very low38Very low166 Ų166134.7 Ų134.772%0.72276%0.755SS**  trans-67.8139.3-169-65.6174.4170.9173.10113.5
47D32.2Very low38.2Very low173 Ų173139.3 Ų139.393%0.92577%0.766SS**  trans-114.4109.8136.4-77.1-40.6000108.3
48T37.7Very low38.2Very low106 Ų106134.4 Ų134.465%0.6574%0.737SS**  trans-90.197.6172.1-51.30000107.2
49E34.5Very low38.7Very low191 Ų191133.3 Ų133.389%0.89373%0.729SS**  trans-119.276.8151.8-78.3-158124.500108.8S51E49-S51 PolarHBondContact O-N 3.47Å
50Q36.4Very low38.9Very low157 Ų157132.7 Ų132.773%0.73473%0.726SS**  trans14.198.2132.6-169.7165.1-26.600116.6
51S29.3Very low39.2Very low114 Ų114135.1 Ų135.180%0.79773%0.733SS**  trans-135.8111.9136.9-168.50000109.5E49E49-S51 PolarHBondContact O-N 3.47Å
52N32.1Very low39Very low134 Ų134131 Ų13172%0.71771%0.711SS**  trans-67.7128.1-175.6-72.4-64.5000111
53G38.4Very low39.5Very low67 Ų67130.4 Ų130.469%0.69170%0.699SS**SBendtrans59.195.6142.800000118.7
54H37.8Very low40.2Very low117 Ų117132.5 Ų132.554%0.54269%0.693SS.*  trans-173.634.4131.2-128.2-59.7000114.9S56 K75H54-S56 PolarHBondContact O-N 3.3Å; H54-K75 HydrophobicContact CB-CD 4.2Å; H54-K75 PolarHBondContact CE1-NZ 2.88Å; H54-K75 PolarHBondContact ND1-NZ 2.87Å; H54-K75 PolarHBondContact NE2-NZ 3.37Å
55F38.2Very low40.6Very low213 Ų213131.5 Ų131.593%0.93467%0.67SS**  trans-75.896.5177.5-71.2-87.2000110.4
56S43.8Very low41.3Very low72 Ų72123.1 Ų123.150%0.50363%0.633SS.*  trans-108138.4166.749.70000109.8H54H54-S56 PolarHBondContact O-N 3.3Å
57E45Very low42Very low191 Ų191120.9 Ų120.989%0.89363%0.627SS**PPolyproline II helixtrans-46.8139.3171.3-151.4159.3171.300111.3
58C40.6Very low42.8Very low24 Ų24117.4 Ų117.416%0.16261%0.605CS.*PPolyproline II helixtrans-63.9133.8-179.4-73.70000109.7C71C58-C71 HydrophobicContact CB-CB 3.95Å; C58-C71 WeakPolarHBondContact CB-SG 3.16Å; C58-C71 WeakPolarHBondContact SG-CB 3.35Å; C58-C71 CovalentContact SG-SG 2.06Å; C58-C71 PolarHBondContact SG-SG 3.28Å
59P48.1Very low43.4Very low83 Ų83114 Ų11454%0.53959%0.592SS.*PPolyproline II helixtrans-61.7138.6-179.723.4-31.7000111E61 L62P59-E61 PolarHBondContact O-N 2.89Å; P59-L62 PolarHBondContact O-N 3.39Å
60E47.7Very low44.2Very low145 Ų145112.8 Ų112.868%0.67859%0.586SS**Hα-helixtrans-56.6-27.4-170.7-151.6175.3-179.700113.2L62 L63 Y64E60-L62 VanDerWaalsContact C-N 3.28Å; E60-L62 PolarHBondContact O-N 2.91Å; E60-L63 PolarHBondContact O-N 3.43Å; E60-Y64 HydrophobicContact CG-CE2 4.38Å; E60-Y64 WeakPolarHBondContact O-CD2 3.35Å; E60-Y64 VanDerWaalsContact O-CE2 3.31Å; E60-Y64 WeakPolarHBondContact O-CE2 2.99Å
61E44.7Very low44.8Very low185 Ų185108.3 Ų108.386%0.86457%0.572SS**Hα-helixtrans-68.7-21.1177-61.8-177.7179.400114P59P59-E61 PolarHBondContact O-N 2.89Å
62L46.9Very low45.6Very low72 Ų72113 Ų11338%0.37757%0.571SS.*Hα-helixtrans-100.8-10.9-179.4-143.573.1000112.8P59 E60 Y64 Y65P59-L62 PolarHBondContact O-N 3.39Å; E60-L62 VanDerWaalsContact C-N 3.28Å; E60-L62 PolarHBondContact O-N 2.91Å; L62-Y64 VanDerWaalsContact C-N 3.27Å; L62-Y64 PolarHBondContact O-N 3.18Å; L62-Y65 WeakPolarHBondContact O-CB 2.87Å; L62-Y65 PolarHBondContact O-N 3.47Å
63L49Very low46Very low107 Ų107113.5 Ų113.556%0.5656%0.564SS**Hα-helixtrans-70.2-28178.9-142.3130.4000111.6E60 Y65E60-L63 PolarHBondContact O-N 3.43Å; L63-Y65 VanDerWaalsContact C-N 3.31Å
64Y50.6Low46.4Very low178 Ų178117 Ų11770%0.69857%0.566SS**THydrogen-bonded Turntrans-84.5-1174.6-58.1-78.9000113.8E60 L62E60-Y64 HydrophobicContact CG-CE2 4.38Å; E60-Y64 WeakPolarHBondContact O-CD2 3.35Å; E60-Y64 VanDerWaalsContact O-CE2 3.31Å; E60-Y64 WeakPolarHBondContact O-CE2 2.99Å; L62-Y64 VanDerWaalsContact C-N 3.27Å; L62-Y64 PolarHBondContact O-N 3.18Å
65Y48Very low46.6Very low72 Ų72116.9 Ų116.928%0.28256%0.564SS.*THydrogen-bonded Turntrans-89.9-37.9-177.5-167.8-96.5000113.3L62 L63 R94L62-Y65 WeakPolarHBondContact O-CB 2.87Å; L62-Y65 PolarHBondContact O-N 3.47Å; L63-Y65 VanDerWaalsContact C-N 3.31Å; Y65-R94 HydrophobicContact CD1-CG 3.96Å; Y65-R94 HydrophobicContact CE1-CB 4.48Å; Y65-R94 HydrophobicContact CE1-CG 3.34Å; Y65-R94 HydrophobicContact CE2-CG 4.21Å; Y65-R94 VanDerWaalsContact CZ-CG 3.48Å; Y65-R94 PolarHBondContact OH-NE 3.43Å; Y65-R94 PolarHBondContact OH-NH2 3.01Å
66C47Very low46.8Very low19 Ų19115.9 Ų115.913%0.12856%0.562CS.*  trans-105.596.3177.3-75.10000107.7H68 C82C66-H68 VanDerWaalsContact C-N 3.31Å; C66-H68 PolarHBondContact O-N 3.24Å; C66-C82 WeakPolarHBondContact CB-SG 3.41Å; C66-C82 WeakPolarHBondContact SG-CB 3.28Å; C66-C82 CovalentContact SG-SG 2.12Å; C66-C82 PolarHBondContact SG-SG 2.78Å
67I53.8Low46.7Very low119 Ų119119.8 Ų119.861%0.6157%0.573SS**THydrogen-bonded Turntrans-65.7-30.8-170.1-56.6171.7000112.4
68H48.8Very low46.4Very low99 Ų99121.5 Ų121.546%0.45858%0.577SS.*THydrogen-bonded Turntrans-13757.6-174.9-66.1-53.3000113C66 Y90C66-H68 VanDerWaalsContact C-N 3.31Å; C66-H68 PolarHBondContact O-N 3.24Å; H68-Y90 AromaticContact CD2-CE1 3.99Å
69G51.2Low46.3Very low36 Ų36123.1 Ų123.137%0.37159%0.592SS.*SBendtrans-162160.5174.700000114.9
70E51.5Low45.9Very low165 Ų165124.7 Ų124.777%0.77160%0.6SS**  trans-94.8103176.7-69-172.6165.800114.9L84E70-L84 VanDerWaalsContact N-CD2 3.28Å; E70-L84 WeakPolarHBondContact O-CD1 3.07Å; E70-L84 WeakPolarHBondContact O-CD2 3.39Å; E70-L84 WeakPolarHBondContact O-CG 3.21Å
71C47.5Very low45.7Very low63 Ų63120.9 Ų120.943%0.42659%0.59SS.*  trans-57.7131.5-175.3-175.50000115.3C58C58-C71 HydrophobicContact CB-CB 3.95Å; C58-C71 WeakPolarHBondContact CB-SG 3.16Å; C58-C71 WeakPolarHBondContact SG-CB 3.35Å; C58-C71 CovalentContact SG-SG 2.06Å; C58-C71 PolarHBondContact SG-SG 3.28Å
72R46.2Very low45.6Very low211 Ų211114.1 Ų114.180%0.79656%0.563SS**  trans-131.5125164.7-75.2-171.1179.1178.20.3110.5L84R72-L84 HydrophobicContact CB-CD1 4.35Å
73Y41.7Very low45.5Very low145 Ų145115.8 Ų115.857%0.56958%0.58SS**  trans-105.8124.3-176.4-175.8-100000111.2K75Y73-K75 HydrophobicContact CE1-CB 4.14Å; Y73-K75 HydrophobicContact CE1-CG 3.97Å
74I46.1Very low45.4Very low141 Ų141112.3 Ų112.372%0.72356%0.562SS**  trans-113.9119.3175.9-58.9174.3000108.5E76I74-E76 VanDerWaalsContact C-N 3.34Å; I74-E76 PolarHBondContact O-N 3.31Å
75K41.7Very low45.5Very low115 Ų115115.2 Ų115.250%0.557%0.571SS.*THydrogen-bonded Turntrans-79.7-4.3-162.3-155.6168.8-175.7-1770115.5H54 Y73H54-K75 HydrophobicContact CB-CD 4.2Å; H54-K75 PolarHBondContact CE1-NZ 2.88Å; H54-K75 PolarHBondContact ND1-NZ 2.87Å; H54-K75 PolarHBondContact NE2-NZ 3.37Å; Y73-K75 HydrophobicContact CE1-CB 4.14Å; Y73-K75 HydrophobicContact CE1-CG 3.97Å
76E43.3Very low45.7Very low191 Ų191113.1 Ų113.189%0.89357%0.567SS**THydrogen-bonded Turntrans-94.6-9.1-172.4-67.6-161.6161.100115.4I74I74-E76 VanDerWaalsContact C-N 3.34Å; I74-E76 PolarHBondContact O-N 3.31Å
77Q40.6Very low46Very low155 Ų155118.9 Ų118.972%0.72459%0.592SS**  trans-124107.4176.6-150.7158.377.900107.8A79Q77-A79 HydrophobicContact CG-CB 4.41Å; Q77-A79 PolarHBondContact O-N 2.93Å
78K40.5Very low45.9Very low226 Ų226118.7 Ų118.798%0.98360%0.596SS**  trans-62.342.1173.2-101.5178176.5175.20112.5
79A38.6Very low45.9Very low58 Ų58118 Ų11848%0.47960%0.596SS.*  trans-122.3104.617600000107.5Q77 S81Q77-A79 HydrophobicContact CG-CB 4.41Å; Q77-A79 PolarHBondContact O-N 2.93Å; A79-S81 PolarHBondContact O-N 2.96Å
80T39.5Very low46Very low116 Ų116119.7 Ų119.771%0.71259%0.591SS**  trans-69.472.2170.1-28.70000108.7H93T80-H93 PolarHBondContact O-CE1 3.36Å
81S43.4Very low46.2Very low66 Ų66117.4 Ų117.446%0.46258%0.58SS.*  trans-97.4120.7165.548.30000106.8A79 S83A79-S81 PolarHBondContact O-N 2.96Å; S81-S83 PolarHBondContact O-N 3.48Å
82C42.8Very low46.5Very low43 Ų43116.1 Ų116.129%0.29158%0.578SS.*  trans-65.976.7161.3-143.70000104.4C66 L84 H93C66-C82 WeakPolarHBondContact CB-SG 3.41Å; C66-C82 WeakPolarHBondContact SG-CB 3.28Å; C66-C82 CovalentContact SG-SG 2.12Å; C66-C82 PolarHBondContact SG-SG 2.78Å; C82-L84 PolarHBondContact O-N 3.28Å; C82-L84 VanDerWaalsContact O-N 3.16Å; C82-H93 VanDerWaalsContact CB-O 3.28Å; C82-H93 WeakPolarHBondContact CB-O 3.22Å
83S44.1Very low46.8Very low106 Ų106111.2 Ų111.274%0.74156%0.564SS**  trans-86.439178.774.30000109.6S81S81-S83 PolarHBondContact O-N 3.48Å
84L47.3Very low47.1Very low34 Ų34110 Ų11018%0.17856%0.558CS.*  trans-104.3133.3-169.2-167.881.6000109.1E70 R72 C82 C86E70-L84 VanDerWaalsContact N-CD2 3.28Å; E70-L84 WeakPolarHBondContact O-CD1 3.07Å; E70-L84 WeakPolarHBondContact O-CD2 3.39Å; E70-L84 WeakPolarHBondContact O-CG 3.21Å; R72-L84 HydrophobicContact CB-CD1 4.35Å; C82-L84 PolarHBondContact O-N 3.28Å; C82-L84 VanDerWaalsContact O-N 3.16Å; L84-C86 PolarHBondContact O-N 3.38Å
85R52Low47.5Very low239 Ų239103.4 Ų103.490%0.90253%0.525SS*.  trans-52.297.4173.2-161.9172.8-167.6-170.22.5109.3
86C51.2Low47.9Very low28 Ų28103.7 Ų103.719%0.18953%0.528CS..PPolyproline II helixtrans-59.6153.8172.6-56.40000109.4L84 Y90 C95L84-C86 PolarHBondContact O-N 3.38Å; C86-Y90 WeakPolarHBondContact CB-O 3.34Å; C86-C95 HydrophobicContact CB-CB 3.95Å; C86-C95 WeakPolarHBondContact CB-SG 3.25Å; C86-C95 WeakPolarHBondContact SG-CB 3.44Å; C86-C95 CovalentContact SG-SG 2.05Å; C86-C95 PolarHBondContact SG-SG 3.31Å
87H53.7Low48.5Very low141 Ų141102.1 Ų102.165%0.65352%0.515SS*.SBendtrans-55.2150.8171.7-143.5-93.2000110.4N89 Y90H87-N89 PolarHBondContact O-N 2.94Å; H87-N89 VanDerWaalsContact O-N 3.15Å; H87-Y90 HydrophobicContact CB-CD2 4.33Å; H87-Y90 PolarHBondContact O-N 3.23Å; H87-Y90 VanDerWaalsContact O-N 3.07Å
88V52.5Low49.2Very low114 Ų11497.7 Ų97.769%0.69150%0.498SS*.THydrogen-bonded Turntrans-49.8123.7-174178.50000110.7
89N49.3Very low49.8Very low86 Ų8688.9 Ų88.946%0.4646%0.464SS..THydrogen-bonded Turntrans79.523.8-176.9-46.5-54.2000117.8H87 V98 T99H87-N89 PolarHBondContact O-N 2.94Å; H87-N89 VanDerWaalsContact O-N 3.15Å; N89-V98 WeakPolarHBondContact O-CA 3.42Å; N89-T99 VanDerWaalsContact C-OG1 3.23Å; N89-T99 WeakPolarHBondContact CA-OG1 3.32Å; N89-T99 PolarHBondContact O-N 2.81Å; N89-T99 PolarHBondContact O-OG1 3.48Å
90Y52.4Low50.5Low71 Ų7190.8 Ų90.828%0.27847%0.465SS..EExtended strand (participates in β ladder)trans-120.4139.3171.2-71-102.5000110.9H68 C86 H87 Y97 V98H68-Y90 AromaticContact CD2-CE1 3.99Å; C86-Y90 WeakPolarHBondContact CB-O 3.34Å; H87-Y90 HydrophobicContact CB-CD2 4.33Å; H87-Y90 PolarHBondContact O-N 3.23Å; H87-Y90 VanDerWaalsContact O-N 3.07Å; Y90-Y97 CarbonylContact C-O 3.56Å; Y90-Y97 WeakPolarHBondContact CA-O 3.4Å; Y90-V98 HydrophobicContact CD1-CG2 3.72Å; Y90-V98 HydrophobicContact CE1-CB 4.43Å; Y90-V98 HydrophobicContact CE1-CG2 3.16Å; Y90-V98 HydrophobicContact CE2-CG2 4.13Å; Y90-V98 HydrophobicContact CG-CG2 4.41Å
91H55.2Low51.1Low116 Ų11691.3 Ų91.354%0.53746%0.464SS..EExtended strand (participates in β ladder)trans-142.2162.1179.2-71.8-76.4000112.4Y97 T99H91-Y97 PolarHBondContact N-O 3.2Å; H91-Y97 WeakPolarHBondContact O-CB 3.49Å; H91-Y97 PolarHBondContact O-N 2.91Å; H91-T99 PolarHBondContact CD2-OG1 2.95Å
92G54.1Low51.4Low37 Ų3793.9 Ų93.938%0.38147%0.472SS..SBendtrans119.5164.6177.100000113.5R94 C95G92-R94 PolarHBondContact O-N 2.89Å; G92-C95 PolarHBondContact O-N 2.96Å
93H52.1Low51.6Low107 Ų10795.8 Ų95.850%0.49548%0.476SS..THydrogen-bonded Turntrans-62.2-14.6179.6-172.479.4000113.7T80 C82T80-H93 PolarHBondContact O-CE1 3.36Å; C82-H93 VanDerWaalsContact CB-O 3.28Å; C82-H93 WeakPolarHBondContact CB-O 3.22Å
94R48.7Very low51.9Low119 Ų11993.9 Ų93.945%0.44946%0.457SS..THydrogen-bonded Turntrans-122.25176.2-73.8177.7178.1-162-3.7113.9Y65 G92 E96Y65-R94 HydrophobicContact CD1-CG 3.96Å; Y65-R94 HydrophobicContact CE1-CB 4.48Å; Y65-R94 HydrophobicContact CE1-CG 3.34Å; Y65-R94 HydrophobicContact CE2-CG 4.21Å; Y65-R94 VanDerWaalsContact CZ-CG 3.48Å; Y65-R94 PolarHBondContact OH-NE 3.43Å; Y65-R94 PolarHBondContact OH-NH2 3.01Å; G92-R94 PolarHBondContact O-N 2.89Å; R94-E96 HydrophobicContact CB-CB 4.31Å; R94-E96 PolarHBondContact O-N 3.19Å; R94-E96 VanDerWaalsContact O-N 3.15Å
95C53.6Low52.2Low4 Ų493.5 Ų93.53%0.02746%0.462CS..SBendtrans48.632.1-167-550000113.9C86 G92C86-C95 HydrophobicContact CB-CB 3.95Å; C86-C95 WeakPolarHBondContact CB-SG 3.25Å; C86-C95 WeakPolarHBondContact SG-CB 3.44Å; C86-C95 CovalentContact SG-SG 2.05Å; C86-C95 PolarHBondContact SG-SG 3.31Å; G92-C95 PolarHBondContact O-N 2.96Å
96E51.9Low52.4Low120 Ų12089.8 Ų89.856%0.56145%0.447SS*.  trans-78.7-23.4-177-173.2174.9171.800112.6R94R94-E96 HydrophobicContact CB-CB 4.31Å; R94-E96 PolarHBondContact O-N 3.19Å; R94-E96 VanDerWaalsContact O-N 3.15Å
97Y54.4Low52.8Low158 Ų15895.4 Ų95.462%0.6247%0.465SS*.EExtended strand (participates in β ladder)trans-96.9111.3-175.9-54-78.8000110.3Y90 H91 T99Y90-Y97 CarbonylContact C-O 3.56Å; Y90-Y97 WeakPolarHBondContact CA-O 3.4Å; H91-Y97 PolarHBondContact N-O 3.2Å; H91-Y97 WeakPolarHBondContact O-CB 3.49Å; H91-Y97 PolarHBondContact O-N 2.91Å; Y97-T99 PolarHBondContact O-N 3.49Å
98V55Low53.3Low62 Ų6293.8 Ų93.838%0.37646%0.457SS..EExtended strand (participates in β ladder)trans-61.7131.7156.5165.80000107.4N89 Y90 L100N89-V98 WeakPolarHBondContact O-CA 3.42Å; Y90-V98 HydrophobicContact CD1-CG2 3.72Å; Y90-V98 HydrophobicContact CE1-CB 4.43Å; Y90-V98 HydrophobicContact CE1-CG2 3.16Å; Y90-V98 HydrophobicContact CE2-CG2 4.13Å; Y90-V98 HydrophobicContact CG-CG2 4.41Å; V98-L100 HydrophobicContact CB-CG 4.48Å; V98-L100 HydrophobicContact CG1-CD2 4.34Å; V98-L100 HydrophobicContact CG1-CG 3.91Å; V98-L100 PolarHBondContact O-N 3.31Å
99T54.1Low54.2Low42 Ų4295.2 Ų95.226%0.25846%0.456SS..  trans-68.673.2167.56.60000109.4N89 H91 Y97 D101 L102N89-T99 VanDerWaalsContact C-OG1 3.23Å; N89-T99 WeakPolarHBondContact CA-OG1 3.32Å; N89-T99 PolarHBondContact O-N 2.81Å; N89-T99 PolarHBondContact O-OG1 3.48Å; H91-T99 PolarHBondContact CD2-OG1 2.95Å; Y97-T99 PolarHBondContact O-N 3.49Å; T99-D101 PolarHBondContact O-N 2.98Å; T99-L102 PolarHBondContact O-N 3.01Å
100L53.6Low55.4Low97 Ų9795.8 Ų95.851%0.50846%0.458SS..THydrogen-bonded Turntrans-63.4-24.6167.3-79.8166.1000109.8V98 L102 Q103 I104V98-L100 HydrophobicContact CB-CG 4.48Å; V98-L100 HydrophobicContact CG1-CD2 4.34Å; V98-L100 HydrophobicContact CG1-CG 3.91Å; V98-L100 PolarHBondContact O-N 3.31Å; L100-L102 VanDerWaalsContact C-N 3.27Å; L100-L102 PolarHBondContact O-N 3.33Å; L100-Q103 CarbonylContact O-C 3.44Å; L100-Q103 WeakPolarHBondContact O-CA 3.43Å; L100-Q103 PolarHBondContact O-N 3.26Å; L100-I104 WeakPolarHBondContact O-CB 3.45Å; L100-I104 PolarHBondContact O-N 2.89Å
101D51.9Low56.8Low127 Ų12797.8 Ų97.868%0.67947%0.473SS*.Hα-helixtrans-53.7-36.7175.6-93.4-77.1000114.2T99 Q103 G105T99-D101 PolarHBondContact O-N 2.98Å; D101-Q103 VanDerWaalsContact C-N 3.26Å; D101-Q103 PolarHBondContact O-N 3.26Å; D101-G105 PolarHBondContact O-N 3.4Å
102L48.9Very low58.2Low120 Ų12097 Ų9763%0.62847%0.471SS*.Hα-helixtrans-70.9-27.5177.6-143.282.2000111.8T99 L100T99-L102 PolarHBondContact O-N 3.01Å; L100-L102 VanDerWaalsContact C-N 3.27Å; L100-L102 PolarHBondContact O-N 3.33Å
103Q47.9Very low59.5Low83 Ų8397 Ų9739%0.38847%0.472SS..Hα-helixtrans-92.2-29.9178-148.1174.726.900112.1L100 D101 R106 R107L100-Q103 CarbonylContact O-C 3.44Å; L100-Q103 WeakPolarHBondContact O-CA 3.43Å; L100-Q103 PolarHBondContact O-N 3.26Å; D101-Q103 VanDerWaalsContact C-N 3.26Å; D101-Q103 PolarHBondContact O-N 3.26Å; Q103-R106 PolarHBondContact O-N 3.42Å; Q103-R107 WeakPolarHBondContact O-CB 3.43Å; Q103-R107 WeakPolarHBondContact O-CG 3.33Å; Q103-R107 PolarHBondContact O-N 2.94Å
104I51.1Low60.9Low67 Ų6795.6 Ų95.634%0.34447%0.473SS..Hα-helixtrans-70.2-46.4173.1-117.172.4000109L100 R106 R107 E108L100-I104 WeakPolarHBondContact O-CB 3.45Å; L100-I104 PolarHBondContact O-N 2.89Å; I104-R106 PolarHBondContact O-N 3.33Å; I104-R107 PolarHBondContact O-N 3.43Å; I104-E108 WeakPolarHBondContact O-CB 3.47Å; I104-E108 VanDerWaalsContact O-CG 3.24Å; I104-E108 WeakPolarHBondContact O-CG 3.35Å; I104-E108 PolarHBondContact O-N 3.49Å
105G53Low62.8Low26 Ų2692.7 Ų92.727%0.26848%0.475SS..Hα-helixtrans-58.2-37.9173.900000111.9D101 Q109D101-G105 PolarHBondContact O-N 3.4Å; G105-Q109 VanDerWaalsContact O-CB 3.25Å; G105-Q109 WeakPolarHBondContact O-CB 3.25Å; G105-Q109 WeakPolarHBondContact O-CG 3.4Å; G105-Q109 PolarHBondContact O-N 3.26Å; G105-Q109 PolarHBondContact O-NE2 3.03Å
106R55.9Low64.5Low161 Ų16197 Ų9761%0.60850%0.496SS*.Hα-helixtrans-75.1-42.2176.1-146.8-157.3-57.5170.3-2.1113Q103 I104 I110Q103-R106 PolarHBondContact O-N 3.42Å; I104-R106 PolarHBondContact O-N 3.33Å; R106-I110 HydrophobicContact CG-CD1 4.48Å; R106-I110 VanDerWaalsContact O-CD1 3.28Å; R106-I110 WeakPolarHBondContact O-CD1 3.35Å; R106-I110 WeakPolarHBondContact O-CG1 3.37Å; R106-I110 PolarHBondContact O-N 3.47Å
107R60.4Low65.9Low146 Ų14693.9 Ų93.955%0.55149%0.491SS*.Hα-helixtrans-72.6-40.5-178.7-76.1-178.2-172.2-155.48.2112Q103 I104 I110 I111Q103-R107 WeakPolarHBondContact O-CB 3.43Å; Q103-R107 WeakPolarHBondContact O-CG 3.33Å; Q103-R107 PolarHBondContact O-N 2.94Å; I104-R107 PolarHBondContact O-N 3.43Å; R107-I110 PolarHBondContact O-N 2.88Å; R107-I111 VanDerWaalsContact O-CG1 3.24Å; R107-I111 WeakPolarHBondContact O-CG1 3.23Å; R107-I111 PolarHBondContact O-N 2.89Å
108E63.2Low67.4Low107 Ų10790.4 Ų90.450%0.549%0.486SS..Hα-helixtrans-64.3-44.2174.7-69.8-174.4172.400110.9I104 I110 I111 I112I104-E108 WeakPolarHBondContact O-CB 3.47Å; I104-E108 VanDerWaalsContact O-CG 3.24Å; I104-E108 WeakPolarHBondContact O-CG 3.35Å; I104-E108 PolarHBondContact O-N 3.49Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 2.95Å; E108-I111 PolarHBondContact O-N 3.28Å; E108-I112 WeakPolarHBondContact O-CB 3.25Å; E108-I112 WeakPolarHBondContact O-CD1 3.47Å; E108-I112 WeakPolarHBondContact O-CG1 3.33Å; E108-I112 PolarHBondContact O-N 2.82Å
109Q70.9Confident69.1Low143 Ų14392.9 Ų92.967%0.66850%0.497SS*.Hα-helixtrans-61.1-38.4173.9-75.4179.740.500112.7G105 G113G105-Q109 VanDerWaalsContact O-CB 3.25Å; G105-Q109 WeakPolarHBondContact O-CB 3.25Å; G105-Q109 WeakPolarHBondContact O-CG 3.4Å; G105-Q109 PolarHBondContact O-N 3.26Å; G105-Q109 PolarHBondContact O-NE2 3.03Å; Q109-G113 PolarHBondContact O-N 3.38Å
110I76.1Confident70.6Confident98 Ų9895.8 Ų95.850%0.50351%0.51SS..Hα-helixtrans-64.6-45.8174.5-69.5161.9000110.8R106 R107 E108 G113 C114R106-I110 HydrophobicContact CG-CD1 4.48Å; R106-I110 VanDerWaalsContact O-CD1 3.28Å; R106-I110 WeakPolarHBondContact O-CD1 3.35Å; R106-I110 WeakPolarHBondContact O-CG1 3.37Å; R106-I110 PolarHBondContact O-N 3.47Å; R107-I110 PolarHBondContact O-N 2.88Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 2.95Å; I110-G113 PolarHBondContact O-N 3.2Å; I110-C114 WeakPolarHBondContact O-CB 3.22Å; I110-C114 PolarHBondContact O-N 2.86Å; I110-C114 PolarHBondContact O-SG 3.25Å; I110-C114 VanDerWaalsContact O-SG 3.35Å
111I81.5Confident72Confident113 Ų11395.6 Ų95.658%0.57951%0.51SS*.Hα-helixtrans-63.1-45.2180-68.5163.6000110.7R107 E108 C114 A115R107-I111 VanDerWaalsContact O-CG1 3.24Å; R107-I111 WeakPolarHBondContact O-CG1 3.23Å; R107-I111 PolarHBondContact O-N 2.89Å; E108-I111 PolarHBondContact O-N 3.28Å; I111-C114 PolarHBondContact O-N 2.9Å; I111-A115 WeakPolarHBondContact O-CB 3.47Å; I111-A115 PolarHBondContact O-N 2.87Å
112I83.1Confident73.6Confident99 Ų9994.1 Ų94.151%0.50850%0.501SS..Hα-helixtrans-62-46.6177.3-66163000110.2E108 C114 A115 I116E108-I112 WeakPolarHBondContact O-CB 3.25Å; E108-I112 WeakPolarHBondContact O-CD1 3.47Å; E108-I112 WeakPolarHBondContact O-CG1 3.33Å; E108-I112 PolarHBondContact O-N 2.82Å; I112-C114 PolarHBondContact O-N 3.28Å; I112-A115 PolarHBondContact O-N 3.36Å; I112-I116 HydrophobicContact CG2-CD1 3.85Å; I112-I116 VanDerWaalsContact O-CG1 3.32Å; I112-I116 WeakPolarHBondContact O-CG1 3.19Å; I112-I116 PolarHBondContact O-N 2.87Å
113G81.7Confident75.4Confident39 Ų3993.6 Ų93.640%0.40250%0.497SS..Hα-helixtrans-60.1-43.7176.600000112.9Q109 I110 I116 A117Q109-G113 PolarHBondContact O-N 3.38Å; I110-G113 PolarHBondContact O-N 3.2Å; G113-I116 PolarHBondContact O-N 2.92Å; G113-A117 WeakPolarHBondContact O-CB 3.43Å; G113-A117 PolarHBondContact O-N 3.01Å
114C82.9Confident77.1Confident76 Ų7692.6 Ų92.651%0.51449%0.493SS..Hα-helixtrans-62.8-43.7174.9-76.80000112.1I110 I111 I112 I116 A117 V118I110-C114 WeakPolarHBondContact O-CB 3.22Å; I110-C114 PolarHBondContact O-N 2.86Å; I110-C114 PolarHBondContact O-SG 3.25Å; I110-C114 VanDerWaalsContact O-SG 3.35Å; I111-C114 PolarHBondContact O-N 2.9Å; I112-C114 PolarHBondContact O-N 3.28Å; C114-I116 PolarHBondContact O-N 3.46Å; C114-A117 PolarHBondContact O-N 3.35Å; C114-V118 WeakPolarHBondContact O-CG2 3.18Å; C114-V118 PolarHBondContact O-N 3.35Å
115A88.6Confident78.7Confident59 Ų5992.9 Ų92.949%0.48850%0.495SS..Hα-helixtrans-61.2-45.1178.600000111.7I111 I112 V118 L119I111-A115 WeakPolarHBondContact O-CB 3.47Å; I111-A115 PolarHBondContact O-N 2.87Å; I112-A115 PolarHBondContact O-N 3.36Å; A115-V118 PolarHBondContact O-N 3.03Å; A115-L119 WeakPolarHBondContact O-CB 3.21Å; A115-L119 PolarHBondContact O-N 3.28Å
116I88.4Confident80.3Confident93 Ų9395.6 Ų95.648%0.47751%0.507SS..Hα-helixtrans-62.5-45.5177-65.3165000110.7I112 G113 C114 V118 L119 L120I112-I116 HydrophobicContact CG2-CD1 3.85Å; I112-I116 VanDerWaalsContact O-CG1 3.32Å; I112-I116 WeakPolarHBondContact O-CG1 3.19Å; I112-I116 PolarHBondContact O-N 2.87Å; G113-I116 PolarHBondContact O-N 2.92Å; C114-I116 PolarHBondContact O-N 3.46Å; I116-V118 VanDerWaalsContact C-N 3.35Å; I116-V118 PolarHBondContact O-N 3.48Å; I116-L119 PolarHBondContact O-N 3.39Å; I116-L120 HydrophobicContact CG2-CD1 3.94Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CG 3.43Å; I116-L120 PolarHBondContact O-N 2.88Å
117A82.3Confident81.7Confident55 Ų5592.2 Ų92.246%0.45550%0.499SS..Hα-helixtrans-60-43.3179.100000112.4G113 C114 L121G113-A117 WeakPolarHBondContact O-CB 3.43Å; G113-A117 PolarHBondContact O-N 3.01Å; C114-A117 PolarHBondContact O-N 3.35Å; A117-L121 WeakPolarHBondContact O-CB 3.32Å; A117-L121 PolarHBondContact O-N 3Å
118V85.4Confident82.7Confident85 Ų8585.8 Ų85.852%0.51548%0.477SS..Hα-helixtrans-65.1-43.6176.7172.40000111.1C114 A115 I116 L120 L121 L122C114-V118 WeakPolarHBondContact O-CG2 3.18Å; C114-V118 PolarHBondContact O-N 3.35Å; A115-V118 PolarHBondContact O-N 3.03Å; I116-V118 VanDerWaalsContact C-N 3.35Å; I116-V118 PolarHBondContact O-N 3.48Å; V118-L120 PolarHBondContact O-N 2.9Å; V118-L121 PolarHBondContact O-N 3.49Å; V118-L122 HydrophobicContact CG1-CD1 4Å; V118-L122 HydrophobicContact CG1-CG 4.44Å; V118-L122 WeakPolarHBondContact O-CG 3.41Å; V118-L122 PolarHBondContact O-N 2.91Å
119L89.4Confident83.7Confident114 Ų11485.9 Ų85.960%0.59748%0.48SS*.Hα-helixtrans-60.9-45.7178.6-165.677.8000111.5A115 I116 L121 L122 M123A115-L119 WeakPolarHBondContact O-CB 3.21Å; A115-L119 PolarHBondContact O-N 3.28Å; I116-L119 PolarHBondContact O-N 3.39Å; L119-L121 PolarHBondContact O-N 3.5Å; L119-L122 PolarHBondContact O-N 2.88Å; L119-M123 VanDerWaalsContact O-CG 3.32Å; L119-M123 WeakPolarHBondContact O-CG 3.24Å; L119-M123 PolarHBondContact O-N 3.42Å
120L85.8Confident84.4Confident103 Ų10382.4 Ų82.454%0.53947%0.471SS..Hα-helixtrans-62.8-41.8177.1-69.4175.4000111.8I116 V118 M123 I124I116-L120 HydrophobicContact CG2-CD1 3.94Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CG 3.43Å; I116-L120 PolarHBondContact O-N 2.88Å; V118-L120 PolarHBondContact O-N 2.9Å; L120-M123 PolarHBondContact O-N 3.24Å; L120-I124 WeakPolarHBondContact O-CD1 3.34Å; L120-I124 VanDerWaalsContact O-CG1 3.25Å; L120-I124 WeakPolarHBondContact O-CG1 3.27Å; L120-I124 PolarHBondContact O-N 2.67Å
121L82.6Confident84.7Confident94 Ų9481.7 Ų81.749%0.49247%0.467SS..Hα-helixtrans-62-44.6176.4-171.471.3000111.6A117 V118 L119 I124 L125A117-L121 WeakPolarHBondContact O-CB 3.32Å; A117-L121 PolarHBondContact O-N 3Å; V118-L121 PolarHBondContact O-N 3.49Å; L119-L121 PolarHBondContact O-N 3.5Å; L121-I124 PolarHBondContact O-N 2.65Å; L121-L125 HydrophobicContact CG-CD1 4.31Å; L121-L125 WeakPolarHBondContact O-CG 3.44Å; L121-L125 PolarHBondContact O-N 3.48Å
122L86.4Confident84.7Confident95 Ų9579.1 Ų79.150%0.49746%0.458SS..Hα-helixtrans-61.3-45.5176.4-75.8170.5000111.7V118 L119 I124 L125 V126V118-L122 HydrophobicContact CG1-CD1 4Å; V118-L122 HydrophobicContact CG1-CG 4.44Å; V118-L122 WeakPolarHBondContact O-CG 3.41Å; V118-L122 PolarHBondContact O-N 2.91Å; L119-L122 PolarHBondContact O-N 2.88Å; L122-I124 VanDerWaalsContact C-N 3.34Å; L122-I124 PolarHBondContact O-N 3.19Å; L122-L125 PolarHBondContact O-N 2.76Å; L122-V126 WeakPolarHBondContact O-CG2 3.24Å; L122-V126 PolarHBondContact O-N 3.24Å
123M87.7Confident84.6Confident109 Ų10977.1 Ų77.154%0.53745%0.453SS..Hα-helixtrans-59.2-45.1176.9-73.1-62.9-67.300111.8L119 L120 L125 V126 I127L119-M123 VanDerWaalsContact O-CG 3.32Å; L119-M123 WeakPolarHBondContact O-CG 3.24Å; L119-M123 PolarHBondContact O-N 3.42Å; L120-M123 PolarHBondContact O-N 3.24Å; M123-L125 PolarHBondContact O-N 3.22Å; M123-V126 PolarHBondContact O-N 3.34Å; M123-I127 WeakPolarHBondContact O-CB 3.33Å; M123-I127 WeakPolarHBondContact O-CD1 3.25Å; M123-I127 WeakPolarHBondContact O-CG1 3.04Å; M123-I127 PolarHBondContact O-N 2.93Å
124I83.4Confident84.6Confident62 Ų6279.7 Ų79.732%0.31845%0.454SS..Hα-helixtrans-63.5-41.5177.6-67.6164.7000111.2F3 L7 L120 L121 L122 S128F3-I124 HydrophobicContact CE2-CG2 4.23Å; L7-I124 HydrophobicContact CD2-CG2 4.4Å; L120-I124 WeakPolarHBondContact O-CD1 3.34Å; L120-I124 VanDerWaalsContact O-CG1 3.25Å; L120-I124 WeakPolarHBondContact O-CG1 3.27Å; L120-I124 PolarHBondContact O-N 2.67Å; L121-I124 PolarHBondContact O-N 2.65Å; L122-I124 VanDerWaalsContact C-N 3.34Å; L122-I124 PolarHBondContact O-N 3.19Å; I124-S128 WeakPolarHBondContact O-CB 3.31Å; I124-S128 PolarHBondContact O-N 2.79Å
125L83.6Confident84.5Confident73 Ų7382.8 Ų82.838%0.38246%0.455SS..Hα-helixtrans-61.7-47.1176.7-77.4167.4000111.6F3 L121 L122 M123 S128 I129F3-L125 HydrophobicContact CZ-CD2 4.38Å; L121-L125 HydrophobicContact CG-CD1 4.31Å; L121-L125 WeakPolarHBondContact O-CG 3.44Å; L121-L125 PolarHBondContact O-N 3.48Å; L122-L125 PolarHBondContact O-N 2.76Å; M123-L125 PolarHBondContact O-N 3.22Å; L125-S128 WeakPolarHBondContact O-CB 3.39Å; L125-S128 PolarHBondContact O-N 3.48Å; L125-I129 VanDerWaalsContact O-CG1 3.27Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 3.05Å
126V87.6Confident84Confident84 Ų8487.6 Ų87.651%0.50946%0.461SS..Hα-helixtrans-62.1-49.7178.5173.30000110.6L122 M123 S128 I129 C130L122-V126 WeakPolarHBondContact O-CG2 3.24Å; L122-V126 PolarHBondContact O-N 3.24Å; M123-V126 PolarHBondContact O-N 3.34Å; V126-S128 VanDerWaalsContact C-N 3.25Å; V126-S128 PolarHBondContact O-N 3.41Å; V126-I129 PolarHBondContact O-N 3.26Å; V126-C130 WeakPolarHBondContact O-CB 3.45Å; V126-C130 PolarHBondContact O-N 2.84Å; V126-C130 PolarHBondContact O-SG 3.01Å; V126-C130 VanDerWaalsContact O-SG 3.33Å
127I85.3Confident83.5Confident89 Ų8987 Ų8746%0.45646%0.464SS..Hα-helixtrans-58.2-42178.1-68.2166000110.5M123 C130 I131M123-I127 WeakPolarHBondContact O-CB 3.33Å; M123-I127 WeakPolarHBondContact O-CD1 3.25Å; M123-I127 WeakPolarHBondContact O-CG1 3.04Å; M123-I127 PolarHBondContact O-N 2.93Å; I127-C130 PolarHBondContact O-N 3.41Å; I127-I131 HydrophobicContact CG2-CD1 3.62Å; I127-I131 HydrophobicContact CG2-CG1 4.34Å; I127-I131 WeakPolarHBondContact O-CB 3.19Å; I127-I131 VanDerWaalsContact O-CG1 3.25Å; I127-I131 WeakPolarHBondContact O-CG1 3.43Å; I127-I131 PolarHBondContact O-N 3.22Å
128S81.1Confident83.4Confident11 Ų1192.4 Ų92.48%0.07747%0.472CS..Hα-helixtrans-61.3-48.7176.2177.10000112.7F3 I124 L125 V126 C130 I131 C132F3-S128 WeakPolarHBondContact CD1-OG 3.27Å; F3-S128 WeakPolarHBondContact CD2-OG 3.44Å; F3-S128 WeakPolarHBondContact CE2-OG 3.33Å; F3-S128 WeakPolarHBondContact CG-OG 3.12Å; F3-S128 VanDerWaalsContact CZ-OG 3.28Å; F3-S128 WeakPolarHBondContact CZ-OG 3.26Å; I124-S128 WeakPolarHBondContact O-CB 3.31Å; I124-S128 PolarHBondContact O-N 2.79Å; L125-S128 WeakPolarHBondContact O-CB 3.39Å; L125-S128 PolarHBondContact O-N 3.48Å; V126-S128 VanDerWaalsContact C-N 3.25Å; V126-S128 PolarHBondContact O-N 3.41Å; S128-C130 VanDerWaalsContact C-N 3.3Å; S128-C130 PolarHBondContact O-N 2.88Å; S128-I131 PolarHBondContact O-N 3.36Å; S128-C132 WeakPolarHBondContact O-CB 3.28Å; S128-C132 PolarHBondContact O-N 2.9Å; S128-C132 PolarHBondContact O-SG 2.87Å
129I84.3Confident82.9Confident110 Ų11093.9 Ų93.956%0.56448%0.477SS*.Hα-helixtrans-61.6-42.9178.7-67.5163.7000109.7L125 V126 C132 S133L125-I129 VanDerWaalsContact O-CG1 3.27Å; L125-I129 WeakPolarHBondContact O-CG1 3.46Å; L125-I129 PolarHBondContact O-N 3.05Å; V126-I129 PolarHBondContact O-N 3.26Å; I129-C132 PolarHBondContact O-N 3.37Å; I129-S133 WeakPolarHBondContact O-CB 3.39Å; I129-S133 PolarHBondContact O-N 2.85Å; I129-S133 PolarHBondContact O-OG 2.83Å
130C84.4Confident81.9Confident70 Ų7096.1 Ų96.147%0.47348%0.477SS..Hα-helixtrans-61.5-46.3175.9-70.90000112.3V126 I127 S128 S133 H134V126-C130 WeakPolarHBondContact O-CB 3.45Å; V126-C130 PolarHBondContact O-N 2.84Å; V126-C130 PolarHBondContact O-SG 3.01Å; V126-C130 VanDerWaalsContact O-SG 3.33Å; I127-C130 PolarHBondContact O-N 3.41Å; S128-C130 VanDerWaalsContact C-N 3.3Å; S128-C130 PolarHBondContact O-N 2.88Å; C130-S133 WeakPolarHBondContact CA-OG 3.27Å; C130-S133 PolarHBondContact O-OG 2.98Å; C130-H134 WeakPolarHBondContact O-CB 3.49Å; C130-H134 PolarHBondContact O-N 3.47Å
131I83.4Confident81.4Confident83 Ų8392.8 Ų92.843%0.42647%0.468SS..Hα-helixtrans-68.1-43.2178.7-66.7168.3000111I127 S128 H134 R135I127-I131 HydrophobicContact CG2-CD1 3.62Å; I127-I131 HydrophobicContact CG2-CG1 4.34Å; I127-I131 WeakPolarHBondContact O-CB 3.19Å; I127-I131 VanDerWaalsContact O-CG1 3.25Å; I127-I131 WeakPolarHBondContact O-CG1 3.43Å; I127-I131 PolarHBondContact O-N 3.22Å; S128-I131 PolarHBondContact O-N 3.36Å; I131-H134 PolarHBondContact O-N 3.49Å; I131-R135 HydrophobicContact CG2-CG 4.43Å; I131-R135 WeakPolarHBondContact O-CB 3.43Å; I131-R135 WeakPolarHBondContact O-CG 3.31Å; I131-R135 PolarHBondContact O-N 3.15Å
132C80.9Confident80.8Confident59 Ų5997.8 Ų97.840%0.39948%0.48SS..Hα-helixtrans-63.9-47.4179.3-75.30000111.2S128 I129 R135 R136S128-C132 WeakPolarHBondContact O-CB 3.28Å; S128-C132 PolarHBondContact O-N 2.9Å; S128-C132 PolarHBondContact O-SG 2.87Å; I129-C132 PolarHBondContact O-N 3.37Å; C132-R135 PolarHBondContact O-N 3.37Å; C132-R136 VanDerWaalsContact O-CB 3.27Å; C132-R136 WeakPolarHBondContact O-CB 3.15Å; C132-R136 WeakPolarHBondContact O-CG 3.42Å; C132-R136 PolarHBondContact O-N 3.4Å
133S81.3Confident80Confident56 Ų56101.9 Ų101.939%0.39249%0.489SS..Hα-helixtrans-62.2-47.7175.557.50000110.8I129 C130 R135 R136 C137I129-S133 WeakPolarHBondContact O-CB 3.39Å; I129-S133 PolarHBondContact O-N 2.85Å; I129-S133 PolarHBondContact O-OG 2.83Å; C130-S133 WeakPolarHBondContact CA-OG 3.27Å; C130-S133 PolarHBondContact O-OG 2.98Å; S133-R135 PolarHBondContact O-N 3.5Å; S133-R136 PolarHBondContact O-N 2.92Å; S133-C137 VanDerWaalsContact O-CB 3.29Å; S133-C137 WeakPolarHBondContact O-CB 3.33Å; S133-C137 PolarHBondContact O-N 2.72Å; S133-C137 PolarHBondContact O-SG 3.34Å
134H81Confident79.1Confident93 Ų93105.2 Ų105.243%0.43150%0.495SS..Hα-helixtrans-61.1-43.2178.5-177.7-123000112.6C130 I131 C137 R138C130-H134 WeakPolarHBondContact O-CB 3.49Å; C130-H134 PolarHBondContact O-N 3.47Å; I131-H134 PolarHBondContact O-N 3.49Å; H134-C137 PolarHBondContact O-N 3.14Å; H134-R138 PolarHBondContact CE1-NE 2.99Å; H134-R138 PolarHBondContact CE1-NH2 3.25Å; H134-R138 VanDerWaalsContact NE2-CZ 3.25Å; H134-R138 PolarHBondContact NE2-NH1 3.08Å; H134-R138 WeakPolarHBondContact O-CG 3.28Å; H134-R138 PolarHBondContact O-N 3.1Å
135R81.1Confident78.5Confident141 Ų141111 Ų11153%0.53251%0.513SS..Hα-helixtrans-64.8-44.1174.3-76.1-172.7178.7-152.41.1112.1I2 I131 C132 S133 R138 L139I2-R135 VanDerWaalsContact CD1-NH2 3.33Å; I131-R135 HydrophobicContact CG2-CG 4.43Å; I131-R135 WeakPolarHBondContact O-CB 3.43Å; I131-R135 WeakPolarHBondContact O-CG 3.31Å; I131-R135 PolarHBondContact O-N 3.15Å; C132-R135 PolarHBondContact O-N 3.37Å; S133-R135 PolarHBondContact O-N 3.5Å; R135-R138 PolarHBondContact O-N 3.36Å; R135-L139 WeakPolarHBondContact O-CB 3.45Å; R135-L139 WeakPolarHBondContact O-CD1 3.33Å; R135-L139 VanDerWaalsContact O-CG 3.27Å; R135-L139 WeakPolarHBondContact O-CG 3.5Å; R135-L139 PolarHBondContact O-N 3.41Å
136R78.5Confident77.8Confident161 Ų161114.6 Ų114.661%0.60853%0.528SS*.Hα-helixtrans-61.3-45.3176.2-74.4-86-163.4170.24.5110.9C132 S133 L139 W140C132-R136 VanDerWaalsContact O-CB 3.27Å; C132-R136 WeakPolarHBondContact O-CB 3.15Å; C132-R136 WeakPolarHBondContact O-CG 3.42Å; C132-R136 PolarHBondContact O-N 3.4Å; S133-R136 PolarHBondContact O-N 2.92Å; R136-L139 PolarHBondContact O-N 3.33Å; R136-W140 WeakPolarHBondContact O-CB 3.45Å; R136-W140 PolarHBondContact O-N 3.26Å
137C78.4Confident76.9Confident80 Ų80115 Ų11554%0.54153%0.531SS..Hα-helixtrans-63.3-41176.6-70.50000112S133 H134 G141S133-C137 VanDerWaalsContact O-CB 3.29Å; S133-C137 WeakPolarHBondContact O-CB 3.33Å; S133-C137 PolarHBondContact O-N 2.72Å; S133-C137 PolarHBondContact O-SG 3.34Å; H134-C137 PolarHBondContact O-N 3.14Å; C137-G141 PolarHBondContact O-N 2.95Å
138R78.8Confident76.3Confident168 Ų168115.1 Ų115.163%0.63453%0.53SS*.Hα-helixtrans-63.5-42.9173.4-70.2-142.7-142.5-96.519.4112.2H134 R135 R142H134-R138 PolarHBondContact CE1-NE 2.99Å; H134-R138 PolarHBondContact CE1-NH2 3.25Å; H134-R138 VanDerWaalsContact NE2-CZ 3.25Å; H134-R138 PolarHBondContact NE2-NH1 3.08Å; H134-R138 WeakPolarHBondContact O-CG 3.28Å; H134-R138 PolarHBondContact O-N 3.1Å; R135-R138 PolarHBondContact O-N 3.36Å; R138-R142 PolarHBondContact O-N 2.88Å
139L74.9Confident75.8Confident116 Ų116121.1 Ų121.161%0.60756%0.556SS**Hα-helixtrans-68.2-43179.3-72.7164.3000111.8R135 R136 R142 R143R135-L139 WeakPolarHBondContact O-CB 3.45Å; R135-L139 WeakPolarHBondContact O-CD1 3.33Å; R135-L139 VanDerWaalsContact O-CG 3.27Å; R135-L139 WeakPolarHBondContact O-CG 3.5Å; R135-L139 PolarHBondContact O-N 3.41Å; R136-L139 PolarHBondContact O-N 3.33Å; L139-R142 PolarHBondContact O-N 3.06Å; L139-R143 PolarHBondContact O-N 3.05Å
140W69.6Low75.3Confident162 Ų162122 Ų12261%0.61456%0.561SS**Hα-helixtrans-68.5-38.8174.9-81.4-21.4000112.6R136 R142 R143 R144R136-W140 WeakPolarHBondContact O-CB 3.45Å; R136-W140 PolarHBondContact O-N 3.26Å; W140-R142 VanDerWaalsContact C-N 3.33Å; W140-R142 PolarHBondContact O-N 3.05Å; W140-R143 PolarHBondContact O-N 3.45Å; W140-R144 WeakPolarHBondContact O-CB 3.15Å; W140-R144 PolarHBondContact O-N 3.4Å
141G74.4Confident74.5Confident32 Ų32128 Ų12833%0.3357%0.574SS.*Hα-helixtrans-59.9-42.1173.300000112.2C137 R145C137-G141 PolarHBondContact O-N 2.95Å; G141-R145 WeakPolarHBondContact O-CG 3.46Å; G141-R145 PolarHBondContact O-N 3.48Å; G141-R145 VanDerWaalsContact O-N 3.11Å
142R69.7Low73.9Confident199 Ų199129.2 Ų129.275%0.75158%0.581SS**Hα-helixtrans-64.7-45.6173-82.1-166.4-175.5-163.32.2112.7R138 L139 W140 R145 Q146R138-R142 PolarHBondContact O-N 2.88Å; L139-R142 PolarHBondContact O-N 3.06Å; W140-R142 VanDerWaalsContact C-N 3.33Å; W140-R142 PolarHBondContact O-N 3.05Å; R142-R145 PolarHBondContact O-N 3.21Å; R142-Q146 PolarHBondContact O-N 2.12Å; R142-Q146 VanDerWaalsContact O-N 3.13Å
143R69.6Low73.2Confident181 Ų181128 Ų12868%0.68358%0.58SS**Hα-helixtrans-61.3-44.9177.3-86.8-172.2-174.9-173.81.1112L139 W140 R145 Q146 T147L139-R143 PolarHBondContact O-N 3.05Å; W140-R143 PolarHBondContact O-N 3.45Å; R143-R145 VanDerWaalsContact C-N 3.35Å; R143-R145 PolarHBondContact O-N 2.94Å; R143-Q146 PolarHBondContact O-N 2.05Å; R143-Q146 VanDerWaalsContact O-N 3.13Å; R143-T147 PolarHBondContact O-N 3.07Å; R143-T147 PolarHBondContact O-OG1 3.37Å; R143-T147 VanDerWaalsContact O-OG1 3.12Å
144R70.6Confident72.2Confident179 Ų179129.3 Ų129.368%0.67559%0.585SS**Hα-helixtrans-62.7-42.1-179.2-161.7179.1-176.1173.78111.4W140 Q146 T147 E148W140-R144 WeakPolarHBondContact O-CB 3.15Å; W140-R144 PolarHBondContact O-N 3.4Å; R144-Q146 VanDerWaalsContact C-N 3.35Å; R144-Q146 PolarHBondContact O-N 3.49Å; R144-T147 PolarHBondContact O-N 3.34Å; R144-E148 IonicContact NE-OE1 3.45Å; R144-E148 PolarHBondContact NE-OE1 2.06Å; R144-E148 WeakPolarHBondContact O-CB 3.35Å; R144-E148 WeakPolarHBondContact O-CG 3.33Å; R144-E148 PolarHBondContact O-N 3.22Å
145R70.3Confident71.1Confident183 Ų183127.9 Ų127.969%0.69160%0.596SS**Hα-helixtrans-58.4-44.3172.2-72.2177.5-171-167.51.1111.8G141 R142 R143 T147 E148 E149G141-R145 WeakPolarHBondContact O-CG 3.46Å; G141-R145 PolarHBondContact O-N 3.48Å; G141-R145 VanDerWaalsContact O-N 3.11Å; R142-R145 PolarHBondContact O-N 3.21Å; R143-R145 VanDerWaalsContact C-N 3.35Å; R143-R145 PolarHBondContact O-N 2.94Å; R145-T147 PolarHBondContact O-N 3.37Å; R145-E148 PolarHBondContact O-N 3.49Å; R145-E149 WeakPolarHBondContact O-CB 3.15Å; R145-E149 VanDerWaalsContact O-CG 3.25Å; R145-E149 WeakPolarHBondContact O-CG 3.07Å; R145-E149 PolarHBondContact O-N 2.83Å
146Q68.6Low70Confident150 Ų150130.3 Ų130.370%0.70161%0.61SS**Hα-helixtrans-65.6-37.8177-73.4-164.1-21.600113.5R142 R143 R144 L150R142-Q146 PolarHBondContact O-N 2.12Å; R142-Q146 VanDerWaalsContact O-N 3.13Å; R143-Q146 PolarHBondContact O-N 2.05Å; R143-Q146 VanDerWaalsContact O-N 3.13Å; R144-Q146 VanDerWaalsContact C-N 3.35Å; R144-Q146 PolarHBondContact O-N 3.49Å; Q146-L150 WeakPolarHBondContact O-CB 2.87Å; Q146-L150 PolarHBondContact O-N 3.45Å
147T68.2Low68.9Low93 Ų93133.3 Ų133.357%0.57162%0.621SS**Hα-helixtrans-67.9-37.1175.2-520000111.8R143 R144 R145 R151R143-T147 PolarHBondContact O-N 3.07Å; R143-T147 PolarHBondContact O-OG1 3.37Å; R143-T147 VanDerWaalsContact O-OG1 3.12Å; R144-T147 PolarHBondContact O-N 3.34Å; R145-T147 PolarHBondContact O-N 3.37Å; T147-R151 WeakPolarHBondContact O-CB 2.88Å; T147-R151 PolarHBondContact O-N 3.15Å
148E73.8Confident67.6Low91 Ų91134.3 Ų134.343%0.42563%0.625SS.*Hα-helixtrans-70.3-40.7176-74.1177.3-177.600112.2R144 R145 R151 N152R144-E148 IonicContact NE-OE1 3.45Å; R144-E148 PolarHBondContact NE-OE1 2.06Å; R144-E148 WeakPolarHBondContact O-CB 3.35Å; R144-E148 WeakPolarHBondContact O-CG 3.33Å; R144-E148 PolarHBondContact O-N 3.22Å; R145-E148 PolarHBondContact O-N 3.49Å; E148-R151 PolarHBondContact O-N 3.33Å; E148-N152 WeakPolarHBondContact O-CB 3.17Å; E148-N152 PolarHBondContact O-N 3.16Å
149E70.6Confident66.5Low137 Ų137134.7 Ų134.764%0.6464%0.636SS**Hα-helixtrans-63.7-41.4173.6-71.3-63.4139.400112.1R145 G153R145-E149 WeakPolarHBondContact O-CB 3.15Å; R145-E149 VanDerWaalsContact O-CG 3.25Å; R145-E149 WeakPolarHBondContact O-CG 3.07Å; R145-E149 PolarHBondContact O-N 2.83Å; E149-G153 PolarHBondContact O-N 2.83Å
150L73.4Confident65.5Low127 Ų127134.3 Ų134.367%0.66564%0.64SS**Hα-helixtrans-63.5-42.5174.9-172.669000111.2Q146 G153 T154Q146-L150 WeakPolarHBondContact O-CB 2.87Å; Q146-L150 PolarHBondContact O-N 3.45Å; L150-G153 PolarHBondContact O-N 2.7Å; L150-T154 PolarHBondContact O-N 3.17Å; L150-T154 PolarHBondContact O-OG1 2.7Å; L150-T154 VanDerWaalsContact O-OG1 3.07Å
151R68.1Low64.4Low196 Ų196134.5 Ų134.574%0.7465%0.653SS**Hα-helixtrans-70.3-38.9179.7-164.8162.482.8136.52112.7T147 E148 G155T147-R151 WeakPolarHBondContact O-CB 2.88Å; T147-R151 PolarHBondContact O-N 3.15Å; E148-R151 PolarHBondContact O-N 3.33Å; R151-G155 PolarHBondContact O-N 3.31Å
152N71.1Confident63.2Low109 Ų109138.1 Ų138.158%0.58367%0.673SS**Hα-helixtrans-68.7-34.2173.3-84.35.7000112.1E148 K156E148-N152 WeakPolarHBondContact O-CB 3.17Å; E148-N152 PolarHBondContact O-N 3.16Å; N152-K156 WeakPolarHBondContact O-CG 3.09Å; N152-K156 PolarHBondContact O-N 3.45Å
153G65.8Low62.4Low35 Ų35133.7 Ų133.736%0.36167%0.673SS.*Hα-helixtrans-69-41.1176.200000113.4E149 L150 K156E149-G153 PolarHBondContact O-N 2.83Å; L150-G153 PolarHBondContact O-N 2.7Å; G153-K156 PolarHBondContact O-N 3.29Å
154T59.2Low61.2Low83 Ų83131.3 Ų131.351%0.50968%0.681SS.*Hα-helixtrans-67.5-38.7176.5-57.30000112L150 K156 R157 V158L150-T154 PolarHBondContact O-N 3.17Å; L150-T154 PolarHBondContact O-OG1 2.7Å; L150-T154 VanDerWaalsContact O-OG1 3.07Å; T154-K156 PolarHBondContact O-N 2.91Å; T154-R157 PolarHBondContact O-N 2.86Å; T154-V158 HydrophobicContact CG2-CG2 4.48Å
155G58.8Low59.5Low63 Ų63128.6 Ų128.665%0.64969%0.69SS**Hα-helixtrans-64.2-21.7175.500000114.4R151R151-G155 PolarHBondContact O-N 3.31Å
156K57.3Low58.4Low191 Ų191128 Ų12883%0.8370%0.695SS**THydrogen-bonded Turntrans-89.9-10.9177.2-70.5-162.3-179.8-165.80114.8N152 G153 T154N152-K156 WeakPolarHBondContact O-CG 3.09Å; N152-K156 PolarHBondContact O-N 3.45Å; G153-K156 PolarHBondContact O-N 3.29Å; T154-K156 PolarHBondContact O-N 2.91Å
157R55.5Low56.9Low225 Ų225126.1 Ų126.185%0.84970%0.697SS**THydrogen-bonded Turntrans-109.4-5.3-177.2-64.4-152.3-158.7-144.88.5115.3T154 M159T154-R157 PolarHBondContact O-N 2.86Å; R157-M159 PolarHBondContact O-N 2.99Å
158V51.8Low55.5Low101 Ų101126.8 Ų126.861%0.61270%0.702SS**  trans-99.483.8178.6-174.70000109.1T154T154-V158 HydrophobicContact CG2-CG2 4.48Å
159M55.2Low54.1Low175 Ų175130.8 Ų130.886%0.86272%0.721SS**  trans-124107.5152.9-138.466.3141.500105.3R157 D161R157-M159 PolarHBondContact O-N 2.99Å; M159-D161 PolarHBondContact O-N 3.07Å
160P53.5Low52.7Low109 Ų109132 Ų13271%0.70873%0.73SS**  trans-72.2116.3170.28.54000107.5S162P160-S162 PolarHBondContact O-N 3.37Å; P160-S162 VanDerWaalsContact O-N 3.13Å
161D48Very low51.3Low165 Ų165131.5 Ų131.588%0.88273%0.733SS**  trans-67.5105.8167.7-132.2-13.2000107.5M159 S163M159-D161 PolarHBondContact O-N 3.07Å; D161-S163 PolarHBondContact O-N 3.35Å
162S49.3Very low50.8Low108 Ų108127.3 Ų127.376%0.75573%0.731SS**  trans-87.890.3171.759.90000108.9P160P160-S162 PolarHBondContact O-N 3.37Å; P160-S162 VanDerWaalsContact O-N 3.13Å
163S50.9Low49.6Very low106 Ų106129.2 Ų129.274%0.74174%0.74SS**  trans-158.6117.1154.1-76.60000108.6D161D161-S163 PolarHBondContact O-N 3.35Å
164P45.2Very low48.7Very low132 Ų132135 Ų13586%0.85776%0.763SS**  -145.9124.1112.733.5-16.4000112.2
165S35.6Very low47.9Very low122 Ų122136.7 Ų136.785%0.85378%0.778SS**  trans-116.391.2156.450.70000107.9
166H45.7Very low47.1Very low171 Ų171144.2 Ų144.279%0.79281%0.81SS**  trans-98.2119.4160.1-159.6-75.6000107.2
167S37.3Very low46.6Very low109 Ų109141.9 Ų141.976%0.76281%0.809SS**  trans-149.787.5164.7-40.50000105
168T40.1Very low46.1Very low108 Ų108137.5 Ų137.566%0.66381%0.807SS**  60.697.3105.3-49.10000111.8L170T168-L170 HydrophobicContact CG2-CD1 4.36Å
169E44.7Very low45.8Very low175 Ų175139.5 Ų139.582%0.81882%0.818SS**  trans-42.8127.5159-175.8-173.4134.100112.4
170L40.8Very low45.2Very low161 Ų161137.4 Ų137.484%0.84382%0.815SS**  trans-156.898.3151.8-98.3123.1000108.8T168T168-L170 HydrophobicContact CG2-CD1 4.36Å
171T44.5Very low44.7Very low118 Ų118139.2 Ų139.272%0.72482%0.822SS**  trans-74.8154.2145.844.50000108.4
172P57.1Low44.5Very low107 Ų107137.5 Ų137.570%0.69582%0.818SS**  cis-140.5-178.337.632.1-8.5000114.3
173I45Very low44.2Very low149 Ų149139.6 Ų139.676%0.76482%0.822SS**  trans153.2111.9134.7-67.4149.5000110.1
174N48Very low43.6Very low158 Ų158142.2 Ų142.285%0.84583%0.829SS**  trans30.6128.4147.2-59.7-6.4000122.1
175S41.5Very low43.5Very low118 Ų118143 Ų14383%0.82583%0.826SS**  trans-141.7129.5146.560.40000110.8
176V41.9Very low44.2Very low220 Ų220144.9 Ų144.9100%1.33382%0.824SS**  trans-19.30166.8-178.70000116.8

Retrieved 176 of 176 residues in 69.5 ms (Link to these results)