A0A060Y5X3_ONCMY Loading...

Immediate early response 5 like

AlphaFold DB , UniProt , Accession A0A060Y5X3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene IER5L, Length 306 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
1M48.6Very low70.4Confident237 Ų237117.1 Ų117.1100%1.16765%0.653SS**  095.70-157.3177.8-82.400105N3M1-N3 PolarHBondContact O-N 3.39Å
2I59.6Low72.2Confident161 Ų161119.1 Ų119.183%0.82665%0.653SS**  trans-73.9123.2-174-64.3166.6000106.7T4I2-T4 PolarHBondContact O-N 2.77Å
3N59.6Low73.9Confident102 Ų102114.5 Ų114.555%0.54564%0.635SS.*  trans-58.5107.6-172.8-70.7-33.7000110.5M1 M5 E6 C7M1-N3 PolarHBondContact O-N 3.39Å; N3-M5 PolarHBondContact O-N 3.09Å; N3-M5 VanDerWaalsContact O-N 3.16Å; N3-E6 HydrophobicContact CB-CB 4.38Å; N3-E6 HydrophobicContact CB-CG 4.46Å; N3-E6 WeakPolarHBondContact CB-OE2 3.06Å; N3-E6 PolarHBondContact ND2-OE2 3.14Å; N3-E6 VanDerWaalsContact ND2-OE2 3.09Å; N3-E6 PolarHBondContact O-N 3.23Å; N3-E6 VanDerWaalsContact O-N 3.14Å; N3-C7 PolarHBondContact O-N 3.16Å
4T65.5Low75.4Confident121 Ų121114.6 Ų114.674%0.74263%0.633SS**Hα-helixtrans-59.5-26.6-179.449.10000112.7I2 A8I2-T4 PolarHBondContact O-N 2.77Å; T4-A8 PolarHBondContact O-N 3.44Å
5M69.1Low76.7Confident159 Ų159113.7 Ų113.778%0.78363%0.625SS**Hα-helixtrans-69.9-40.3174.9-93-172.2145.400113.7N3 A8 V9N3-M5 PolarHBondContact O-N 3.09Å; N3-M5 VanDerWaalsContact O-N 3.16Å; M5-A8 PolarHBondContact O-N 3.09Å; M5-V9 WeakPolarHBondContact O-CG2 3.35Å; M5-V9 PolarHBondContact O-N 2.88Å; M5-V9 VanDerWaalsContact O-N 3.09Å
6E67.8Low77.9Confident122 Ų122110.3 Ų110.357%0.5761%0.612SS**Hα-helixtrans-66.9-40.6178.2-82.3174134.300111.1N3 A8 V9 D10N3-E6 HydrophobicContact CB-CB 4.38Å; N3-E6 HydrophobicContact CB-CG 4.46Å; N3-E6 WeakPolarHBondContact CB-OE2 3.06Å; N3-E6 PolarHBondContact ND2-OE2 3.14Å; N3-E6 VanDerWaalsContact ND2-OE2 3.09Å; N3-E6 PolarHBondContact O-N 3.23Å; N3-E6 VanDerWaalsContact O-N 3.14Å; E6-A8 VanDerWaalsContact C-N 3.3Å; E6-A8 PolarHBondContact O-N 3.3Å; E6-V9 PolarHBondContact O-N 2.89Å; E6-D10 WeakPolarHBondContact O-CB 3.18Å; E6-D10 PolarHBondContact O-N 3.37Å
7C70.8Confident78.9Confident84 Ų84108.9 Ų108.957%0.56860%0.602SS**Hα-helixtrans-62.2-37174.9-173.40000112.4N3 A11N3-C7 PolarHBondContact O-N 3.16Å; C7-A11 VanDerWaalsContact O-CB 3.26Å; C7-A11 WeakPolarHBondContact O-CB 3.43Å; C7-A11 PolarHBondContact O-N 3.42Å
8A73.9Confident79.8Confident53 Ų53105.8 Ų105.844%0.43859%0.59SS.*Hα-helixtrans-68.6-38.7176.600000112.4T4 M5 E6 Q12T4-A8 PolarHBondContact O-N 3.44Å; M5-A8 PolarHBondContact O-N 3.09Å; E6-A8 VanDerWaalsContact C-N 3.3Å; E6-A8 PolarHBondContact O-N 3.3Å; A8-Q12 WeakPolarHBondContact O-CG 3.43Å; A8-Q12 PolarHBondContact O-N 3.01Å
9V80.5Confident80.5Confident94 Ų94105.9 Ų105.957%0.5759%0.588SS**Hα-helixtrans-69.9-41177.51760000110.9M5 E6 Q12 S13M5-V9 WeakPolarHBondContact O-CG2 3.35Å; M5-V9 PolarHBondContact O-N 2.88Å; M5-V9 VanDerWaalsContact O-N 3.09Å; E6-V9 PolarHBondContact O-N 2.89Å; V9-Q12 PolarHBondContact O-N 3.31Å; V9-S13 WeakPolarHBondContact O-CB 3.39Å; V9-S13 PolarHBondContact O-N 2.91Å
10D87.9Confident81.1Confident107 Ų107108.7 Ų108.757%0.57259%0.589SS**Hα-helixtrans-64-43.1174.4-80-16.1000111.7E6 Q12 S13 L14E6-D10 WeakPolarHBondContact O-CB 3.18Å; E6-D10 PolarHBondContact O-N 3.37Å; D10-Q12 VanDerWaalsContact C-N 3.34Å; D10-Q12 PolarHBondContact O-N 2.74Å; D10-S13 WeakPolarHBondContact O-CB 3.35Å; D10-S13 PolarHBondContact O-N 3.44Å; D10-L14 WeakPolarHBondContact O-CB 3.33Å; D10-L14 PolarHBondContact O-N 3.44Å
11A91.3Very high81.6Confident48 Ų48110.7 Ų110.740%0.39759%0.593SS.*Hα-helixtrans-60.2-43.7174.700000111.7C7 S13 L14 I15C7-A11 VanDerWaalsContact O-CB 3.26Å; C7-A11 WeakPolarHBondContact O-CB 3.43Å; C7-A11 PolarHBondContact O-N 3.42Å; A11-S13 PolarHBondContact O-N 2.88Å; A11-L14 PolarHBondContact O-N 3.23Å; A11-I15 WeakPolarHBondContact O-CB 3.46Å; A11-I15 WeakPolarHBondContact O-CD1 3.49Å; A11-I15 WeakPolarHBondContact O-CG1 3.43Å; A11-I15 PolarHBondContact O-N 3.27Å
12Q92.3Very high83.4Confident141 Ų141104 Ų10466%0.65956%0.56SS**Hα-helixtrans-63.8-39.7175.3-76.8-170.5600112.7A8 V9 D10 I15 S16A8-Q12 WeakPolarHBondContact O-CG 3.43Å; A8-Q12 PolarHBondContact O-N 3.01Å; V9-Q12 PolarHBondContact O-N 3.31Å; D10-Q12 VanDerWaalsContact C-N 3.34Å; D10-Q12 PolarHBondContact O-N 2.74Å; Q12-I15 PolarHBondContact O-N 3.43Å; Q12-S16 WeakPolarHBondContact O-CB 3.47Å; Q12-S16 PolarHBondContact O-N 3.22Å
13S93.8Very high84.6Confident60 Ų60102.3 Ų102.342%0.4255%0.549SS..Hα-helixtrans-61.5-46.2175.1-175.50000111.2V9 D10 A11 I15 S16 I17V9-S13 WeakPolarHBondContact O-CB 3.39Å; V9-S13 PolarHBondContact O-N 2.91Å; D10-S13 WeakPolarHBondContact O-CB 3.35Å; D10-S13 PolarHBondContact O-N 3.44Å; A11-S13 PolarHBondContact O-N 2.88Å; S13-I15 PolarHBondContact O-N 3.05Å; S13-S16 WeakPolarHBondContact O-CB 3.34Å; S13-S16 PolarHBondContact O-N 3.49Å; S13-I17 WeakPolarHBondContact O-CB 3.49Å; S13-I17 VanDerWaalsContact O-CG1 3.23Å; S13-I17 WeakPolarHBondContact O-CG1 3.2Å; S13-I17 PolarHBondContact O-N 2.92Å
14L94.5Very high85.7Confident115 Ų115101.2 Ų101.260%0.60254%0.543SS*.Hα-helixtrans-64.2-40.2178.9-129.4144.4000112.1D10 A11 S18D10-L14 WeakPolarHBondContact O-CB 3.33Å; D10-L14 PolarHBondContact O-N 3.44Å; A11-L14 PolarHBondContact O-N 3.23Å; L14-S18 VanDerWaalsContact O-CB 3.27Å; L14-S18 WeakPolarHBondContact O-CB 3.23Å; L14-S18 PolarHBondContact O-N 2.88Å; L14-S18 PolarHBondContact O-OG 3.01Å
15I95.3Very high86.4Confident101 Ų10198.5 Ų98.552%0.51853%0.529SS..Hα-helixtrans-62-48.1172.8-69163.1000110.3A11 Q12 S13 I17 S18 L19A11-I15 WeakPolarHBondContact O-CB 3.46Å; A11-I15 WeakPolarHBondContact O-CD1 3.49Å; A11-I15 WeakPolarHBondContact O-CG1 3.43Å; A11-I15 PolarHBondContact O-N 3.27Å; Q12-I15 PolarHBondContact O-N 3.43Å; S13-I15 PolarHBondContact O-N 3.05Å; I15-I17 PolarHBondContact O-N 3.35Å; I15-S18 PolarHBondContact O-N 3.5Å; I15-L19 HydrophobicContact CG2-CD1 3.9Å; I15-L19 HydrophobicContact CG2-CG 4.37Å; I15-L19 WeakPolarHBondContact O-CB 3.38Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3.45Å; I15-L19 PolarHBondContact O-N 3.01Å
16S95.8Very high86.8Confident59 Ų59100.2 Ų100.241%0.41353%0.526SS..Hα-helixtrans-60.8-44.2179.5-176.40000112.3Q12 S13 L19 R20Q12-S16 WeakPolarHBondContact O-CB 3.47Å; Q12-S16 PolarHBondContact O-N 3.22Å; S13-S16 WeakPolarHBondContact O-CB 3.34Å; S13-S16 PolarHBondContact O-N 3.49Å; S16-L19 PolarHBondContact O-N 3.01Å; S16-R20 WeakPolarHBondContact O-CB 3.31Å; S16-R20 PolarHBondContact O-N 3.21Å
17I94.5Very high86.9Confident87 Ų8798.6 Ų98.645%0.44653%0.525SS..Hα-helixtrans-63.6-44.2175.5-67.1164000110.4S13 I15 R20 K21S13-I17 WeakPolarHBondContact O-CB 3.49Å; S13-I17 VanDerWaalsContact O-CG1 3.23Å; S13-I17 WeakPolarHBondContact O-CG1 3.2Å; S13-I17 PolarHBondContact O-N 2.92Å; I15-I17 PolarHBondContact O-N 3.35Å; I17-R20 PolarHBondContact O-N 3.22Å; I17-K21 HydrophobicContact CG2-CD 4.08Å; I17-K21 HydrophobicContact CG2-CG 4.44Å; I17-K21 WeakPolarHBondContact O-CG 3.41Å; I17-K21 PolarHBondContact O-N 2.95Å
18S95.4Very high86.9Confident54 Ų54102.3 Ų102.338%0.37853%0.534SS..Hα-helixtrans-62.3-44.8179.2-60.50000111.9L14 I15 R20 K21 I22L14-S18 VanDerWaalsContact O-CB 3.27Å; L14-S18 WeakPolarHBondContact O-CB 3.23Å; L14-S18 PolarHBondContact O-N 2.88Å; L14-S18 PolarHBondContact O-OG 3.01Å; I15-S18 PolarHBondContact O-N 3.5Å; S18-R20 PolarHBondContact O-N 3.46Å; S18-K21 PolarHBondContact O-N 3.46Å; S18-I22 VanDerWaalsContact O-CG1 3.3Å; S18-I22 WeakPolarHBondContact O-CG1 3.26Å; S18-I22 PolarHBondContact O-N 3.5Å
19L93.9Very high86.4Confident108 Ų108110 Ų11057%0.56555%0.552SS**Hα-helixtrans-62.2-41.8175.8-71.5172.4000111.9I15 S16 I22 H23I15-L19 HydrophobicContact CG2-CD1 3.9Å; I15-L19 HydrophobicContact CG2-CG 4.37Å; I15-L19 WeakPolarHBondContact O-CB 3.38Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3.45Å; I15-L19 PolarHBondContact O-N 3.01Å; S16-L19 PolarHBondContact O-N 3.01Å; L19-I22 PolarHBondContact O-N 3.21Å; L19-H23 WeakPolarHBondContact O-CB 3.45Å; L19-H23 PolarHBondContact O-N 2.88Å
20R92.1Very high85.6Confident160 Ų160108.1 Ų108.160%0.60455%0.551SS**Hα-helixtrans-64.4-41.1175.5-169.7178.8-59.9167.24.5111.9S16 I17 S18 H23 N24S16-R20 WeakPolarHBondContact O-CB 3.31Å; S16-R20 PolarHBondContact O-N 3.21Å; I17-R20 PolarHBondContact O-N 3.22Å; S18-R20 PolarHBondContact O-N 3.46Å; R20-H23 PolarHBondContact O-N 3.44Å; R20-N24 WeakPolarHBondContact O-CB 3.5Å; R20-N24 PolarHBondContact O-N 2.76Å
21K91.4Very high84.6Confident152 Ų152106 Ų10666%0.66156%0.555SS**Hα-helixtrans-65-39.2175.8-72.7179.784.4176.20111.8I17 S18 S25I17-K21 HydrophobicContact CG2-CD 4.08Å; I17-K21 HydrophobicContact CG2-CG 4.44Å; I17-K21 WeakPolarHBondContact O-CG 3.41Å; I17-K21 PolarHBondContact O-N 2.95Å; S18-K21 PolarHBondContact O-N 3.46Å; K21-S25 WeakPolarHBondContact O-CB 3.35Å; K21-S25 PolarHBondContact O-N 3.37Å
22I85.8Confident83.3Confident96 Ų96109.6 Ų109.649%0.49257%0.566SS.*Hα-helixtrans-64-46.7174-69163.4000110.6S18 L19 S25 R26S18-I22 VanDerWaalsContact O-CG1 3.3Å; S18-I22 WeakPolarHBondContact O-CG1 3.26Å; S18-I22 PolarHBondContact O-N 3.5Å; L19-I22 PolarHBondContact O-N 3.21Å; I22-S25 PolarHBondContact O-N 3.44Å; I22-R26 WeakPolarHBondContact O-CB 3.48Å; I22-R26 VanDerWaalsContact O-CG 3.3Å; I22-R26 WeakPolarHBondContact O-CG 3.42Å; I22-R26 PolarHBondContact O-N 3.36Å
23H85.4Confident82.1Confident125 Ų125109.7 Ų109.758%0.57956%0.564SS**Hα-helixtrans-65.5-43.7179.7-17517.8000112.2L19 R20 R26 T27L19-H23 WeakPolarHBondContact O-CB 3.45Å; L19-H23 PolarHBondContact O-N 2.88Å; R20-H23 PolarHBondContact O-N 3.44Å; H23-R26 PolarHBondContact O-N 2.93Å; H23-T27 PolarHBondContact ND1-OG1 2.91Å; H23-T27 WeakPolarHBondContact O-CB 3.27Å; H23-T27 PolarHBondContact O-N 3.42Å; H23-T27 PolarHBondContact O-OG1 3.29Å
24N82.3Confident80.8Confident79 Ų79113.6 Ų113.642%0.42258%0.58SS.*Hα-helixtrans-64.4-40.2174.3-91-15.6000111.9R20 R26 T27 Q28R20-N24 WeakPolarHBondContact O-CB 3.5Å; R20-N24 PolarHBondContact O-N 2.76Å; N24-R26 VanDerWaalsContact C-N 3.34Å; N24-R26 PolarHBondContact O-N 2.86Å; N24-T27 PolarHBondContact O-N 3.26Å; N24-Q28 VanDerWaalsContact O-CB 3.3Å; N24-Q28 WeakPolarHBondContact O-CB 3.28Å; N24-Q28 WeakPolarHBondContact O-CG 3.44Å; N24-Q28 PolarHBondContact O-N 2.89Å
25S81.8Confident79.6Confident64 Ų64114.1 Ų114.145%0.44858%0.579SS.*Hα-helixtrans-58.8-46.4173.3177.10000111K21 I22 T27 R29K21-S25 WeakPolarHBondContact O-CB 3.35Å; K21-S25 PolarHBondContact O-N 3.37Å; I22-S25 PolarHBondContact O-N 3.44Å; S25-T27 VanDerWaalsContact C-N 3.26Å; S25-T27 PolarHBondContact O-N 3.47Å; S25-R29 WeakPolarHBondContact O-CB 3.37Å; S25-R29 PolarHBondContact O-N 2.86Å
26R76.2Confident78.7Confident195 Ų195115.8 Ų115.874%0.73658%0.582SS**Hα-helixtrans-62.6-33.5177-73.1176.6129.5-169.8-3.8113.2I22 H23 N24I22-R26 WeakPolarHBondContact O-CB 3.48Å; I22-R26 VanDerWaalsContact O-CG 3.3Å; I22-R26 WeakPolarHBondContact O-CG 3.42Å; I22-R26 PolarHBondContact O-N 3.36Å; H23-R26 PolarHBondContact O-N 2.93Å; N24-R26 VanDerWaalsContact C-N 3.34Å; N24-R26 PolarHBondContact O-N 2.86Å
27T70.9Confident77.7Confident88 Ų88117 Ų11754%0.5459%0.585SS.*Hα-helixtrans-82.8-42.8-177.6-50.40000112H23 N24 S25H23-T27 PolarHBondContact ND1-OG1 2.91Å; H23-T27 WeakPolarHBondContact O-CB 3.27Å; H23-T27 PolarHBondContact O-N 3.42Å; H23-T27 PolarHBondContact O-OG1 3.29Å; N24-T27 PolarHBondContact O-N 3.26Å; S25-T27 VanDerWaalsContact C-N 3.26Å; S25-T27 PolarHBondContact O-N 3.47Å
28Q70.4Confident77.2Confident162 Ų162118.9 Ų118.976%0.75760%0.595SS**Hα-helixtrans-80.9-28.2-179-70.7-172.25.600113.6N24 G30N24-Q28 VanDerWaalsContact O-CB 3.3Å; N24-Q28 WeakPolarHBondContact O-CB 3.28Å; N24-Q28 WeakPolarHBondContact O-CG 3.44Å; N24-Q28 PolarHBondContact O-N 2.89Å; Q28-G30 PolarHBondContact O-N 2.69Å; Q28-G30 VanDerWaalsContact O-N 3.12Å
29R63.7Low76.8Confident216 Ų216120.9 Ų120.982%0.81560%0.601SS**THydrogen-bonded Turntrans-75.67.5174.1-145.1177.1-153.7-149.24.3112.6S25 G31S25-R29 WeakPolarHBondContact O-CB 3.37Å; S25-R29 PolarHBondContact O-N 2.86Å; R29-G31 VanDerWaalsContact C-N 3.31Å; R29-G31 PolarHBondContact O-N 3.15Å; R29-G31 VanDerWaalsContact O-N 3.15Å
30G62.3Low76.6Confident53 Ų53119.8 Ų119.855%0.54660%0.598SS.*THydrogen-bonded Turntrans44.957.716700000111Q28 I32Q28-G30 PolarHBondContact O-N 2.69Å; Q28-G30 VanDerWaalsContact O-N 3.12Å; G30-I32 PolarHBondContact O-N 3.47Å
31G68.7Low76.4Confident64 Ų64115.8 Ų115.866%0.6659%0.594SS**  trans-49.3121.317100000107.2R29 K33R29-G31 VanDerWaalsContact C-N 3.31Å; R29-G31 PolarHBondContact O-N 3.15Å; R29-G31 VanDerWaalsContact O-N 3.15Å; G31-K33 PolarHBondContact O-N 2.76Å; G31-K33 VanDerWaalsContact O-N 3.11Å
32I62.9Low76.5Confident123 Ų123115.6 Ų115.663%0.63159%0.591SS**  trans-43.7124.9-177.6-70.8171.2000107.5G30 L34 N37G30-I32 PolarHBondContact O-N 3.47Å; I32-L34 VanDerWaalsContact C-N 3.28Å; I32-L34 PolarHBondContact O-N 3.2Å; I32-N37 WeakPolarHBondContact CG2-ND2 3.3Å
33K67.1Low77Confident142 Ų142115 Ų11562%0.61759%0.591SS**  trans-55.895.7-177.8-173173.8-178.5168.90107.9G31 H35 K36G31-K33 PolarHBondContact O-N 2.76Å; G31-K33 VanDerWaalsContact O-N 3.11Å; K33-H35 HydrophobicContact CG-CB 4.2Å; K33-H35 PolarHBondContact O-N 2.92Å; K33-K36 HydrophobicContact CD-CG 4.45Å; K33-K36 PolarHBondContact O-N 2.91Å
34L66Low77.5Confident142 Ų142114 Ų11474%0.74359%0.59SS**Hα-helixtrans-50.6-35.7-172.5-86.9154.8000110.4I32 K36 N37 L38I32-L34 VanDerWaalsContact C-N 3.28Å; I32-L34 PolarHBondContact O-N 3.2Å; L34-K36 VanDerWaalsContact C-N 3.34Å; L34-K36 PolarHBondContact O-N 3.17Å; L34-N37 PolarHBondContact O-N 3.5Å; L34-L38 WeakPolarHBondContact O-CB 3.38Å; L34-L38 PolarHBondContact O-N 3.38Å
35H69.6Low78Confident126 Ų126119.6 Ų119.658%0.58361%0.605SS**Hα-helixtrans-52.3-44.7176.3-170.3-82.3000114.1K33 L39K33-H35 HydrophobicContact CG-CB 4.2Å; K33-H35 PolarHBondContact O-N 2.92Å; H35-L39 WeakPolarHBondContact O-CB 3.32Å; H35-L39 PolarHBondContact O-N 3.29Å
36K77.1Confident78.7Confident136 Ų136119.8 Ų119.859%0.59160%0.601SS**Hα-helixtrans-73.4-38.7-178.1-68.9-173.2176.3-174.80111.7K33 L34 L39 V40K33-K36 HydrophobicContact CD-CG 4.45Å; K33-K36 PolarHBondContact O-N 2.91Å; L34-K36 VanDerWaalsContact C-N 3.34Å; L34-K36 PolarHBondContact O-N 3.17Å; K36-L39 PolarHBondContact O-N 2.97Å; K36-V40 VanDerWaalsContact O-CG2 3.27Å; K36-V40 WeakPolarHBondContact O-CG2 3.14Å; K36-V40 PolarHBondContact O-N 2.91Å
37N75.3Confident79.6Confident86 Ų86113.3 Ų113.346%0.4659%0.589SS.*Hα-helixtrans-73.6-39.1179.2-76.6-96000111.3I32 L34 L39 V40 S41I32-N37 WeakPolarHBondContact CG2-ND2 3.3Å; L34-N37 PolarHBondContact O-N 3.5Å; N37-L39 VanDerWaalsContact C-N 3.33Å; N37-L39 PolarHBondContact O-N 2.92Å; N37-V40 PolarHBondContact O-N 3.35Å; N37-S41 WeakPolarHBondContact O-CB 3.34Å; N37-S41 PolarHBondContact O-N 3.42Å; N37-S41 PolarHBondContact O-OG 2.96Å; N37-S41 VanDerWaalsContact O-OG 3.04Å
38L82.4Confident80.8Confident126 Ų126116 Ų11666%0.6659%0.589SS**Hα-helixtrans-64.1-39173.9-170.966.8000111.4L34 Y42L34-L38 WeakPolarHBondContact O-CB 3.38Å; L34-L38 PolarHBondContact O-N 3.38Å; L38-Y42 WeakPolarHBondContact O-CB 3.49Å; L38-Y42 PolarHBondContact O-N 2.92Å
39L86.9Confident81.9Confident96 Ų96112.8 Ų112.850%0.50357%0.574SS.*Hα-helixtrans-65.2-45.5175.2-169.871.5000111.4H35 K36 N37 Y42 V43H35-L39 WeakPolarHBondContact O-CB 3.32Å; H35-L39 PolarHBondContact O-N 3.29Å; K36-L39 PolarHBondContact O-N 2.97Å; N37-L39 VanDerWaalsContact C-N 3.33Å; N37-L39 PolarHBondContact O-N 2.92Å; L39-Y42 PolarHBondContact O-N 3.12Å; L39-V43 WeakPolarHBondContact O-CB 3.06Å; L39-V43 VanDerWaalsContact O-CG2 3.29Å; L39-V43 WeakPolarHBondContact O-CG2 3.06Å; L39-V43 PolarHBondContact O-N 3.09Å
40V89.9Confident83.3Confident85 Ų85106.7 Ų106.752%0.51556%0.561SS.*Hα-helixtrans-61.8-46.5175.9171.60000110.8K36 N37 Y42 V43 L44K36-V40 VanDerWaalsContact O-CG2 3.27Å; K36-V40 WeakPolarHBondContact O-CG2 3.14Å; K36-V40 PolarHBondContact O-N 2.91Å; N37-V40 PolarHBondContact O-N 3.35Å; V40-Y42 VanDerWaalsContact C-N 3.32Å; V40-Y42 PolarHBondContact O-N 2.89Å; V40-V43 PolarHBondContact O-N 3.37Å; V40-L44 HydrophobicContact CG1-CD1 3.86Å; V40-L44 HydrophobicContact CG1-CG 4.37Å; V40-L44 WeakPolarHBondContact O-CB 3.49Å; V40-L44 WeakPolarHBondContact O-CG 3.12Å; V40-L44 PolarHBondContact O-N 3.48Å
41S88.9Confident84.8Confident75 Ų75110.4 Ų110.452%0.52456%0.559SS.*Hα-helixtrans-60.7-40.1175.5-64.40000112.3N37 R45N37-S41 WeakPolarHBondContact O-CB 3.34Å; N37-S41 PolarHBondContact O-N 3.42Å; N37-S41 PolarHBondContact O-OG 2.96Å; N37-S41 VanDerWaalsContact O-OG 3.04Å; S41-R45 WeakPolarHBondContact O-CB 3.5Å; S41-R45 PolarHBondContact O-N 3.35Å
42Y93.8Very high85.9Confident148 Ų148109.4 Ų109.458%0.5854%0.538SS*.Hα-helixtrans-65.2-45.4176.6178.7-95.3000112.1L38 L39 V40 R45 N46L38-Y42 WeakPolarHBondContact O-CB 3.49Å; L38-Y42 PolarHBondContact O-N 2.92Å; L39-Y42 PolarHBondContact O-N 3.12Å; V40-Y42 VanDerWaalsContact C-N 3.32Å; V40-Y42 PolarHBondContact O-N 2.89Å; Y42-R45 PolarHBondContact O-N 3.32Å; Y42-N46 WeakPolarHBondContact CE1-ND2 3.3Å; Y42-N46 WeakPolarHBondContact O-CB 3.3Å; Y42-N46 PolarHBondContact O-N 2.82Å; Y42-N46 PolarHBondContact OH-ND2 2.95Å
43V96.3Very high87.1Confident84 Ų84107.9 Ų107.951%0.50953%0.531SS..Hα-helixtrans-64.1-46.5178.4170.50000110.8L39 V40 R45 N46 A47L39-V43 WeakPolarHBondContact O-CB 3.06Å; L39-V43 VanDerWaalsContact O-CG2 3.29Å; L39-V43 WeakPolarHBondContact O-CG2 3.06Å; L39-V43 PolarHBondContact O-N 3.09Å; V40-V43 PolarHBondContact O-N 3.37Å; V43-R45 PolarHBondContact O-N 2.79Å; V43-N46 PolarHBondContact O-N 3.25Å; V43-A47 WeakPolarHBondContact O-CB 3.16Å; V43-A47 PolarHBondContact O-N 3.39Å
44L95.5Very high88.1Confident104 Ų104107.3 Ų107.355%0.54553%0.531SS..Hα-helixtrans-64-39.9177.6-70.7174.7000112.1V40 A47 R48V40-L44 HydrophobicContact CG1-CD1 3.86Å; V40-L44 HydrophobicContact CG1-CG 4.37Å; V40-L44 WeakPolarHBondContact O-CB 3.49Å; V40-L44 WeakPolarHBondContact O-CG 3.12Å; V40-L44 PolarHBondContact O-N 3.48Å; L44-A47 PolarHBondContact O-N 2.85Å; L44-R48 WeakPolarHBondContact O-CB 3.38Å; L44-R48 PolarHBondContact O-N 2.99Å
45R93.2Very high89.1Confident197 Ų197105.5 Ų105.574%0.74352%0.517SS*.Hα-helixtrans-63-43.2174.9-177.2177.8177-178.5-0.5111.6S41 Y42 V43 Q49S41-R45 WeakPolarHBondContact O-CB 3.5Å; S41-R45 PolarHBondContact O-N 3.35Å; Y42-R45 PolarHBondContact O-N 3.32Å; V43-R45 PolarHBondContact O-N 2.79Å; R45-Q49 PolarHBondContact O-N 3.17Å
46N95.2Very high89.7Confident68 Ų68106.2 Ų106.236%0.36452%0.515SS..Hα-helixtrans-63.5-48.3175.7-104.9-65.9000112Y42 V43 R48 Q49 V50Y42-N46 WeakPolarHBondContact CE1-ND2 3.3Å; Y42-N46 WeakPolarHBondContact O-CB 3.3Å; Y42-N46 PolarHBondContact O-N 2.82Å; Y42-N46 PolarHBondContact OH-ND2 2.95Å; V43-N46 PolarHBondContact O-N 3.25Å; N46-R48 VanDerWaalsContact C-N 3.3Å; N46-R48 PolarHBondContact O-N 3.37Å; N46-Q49 WeakPolarHBondContact O-CB 3.33Å; N46-Q49 PolarHBondContact O-N 3.03Å; N46-V50 WeakPolarHBondContact O-CG2 3.48Å; N46-V50 PolarHBondContact O-N 3.18Å
47A95.8Very high90Very high58 Ų58102 Ų10248%0.47951%0.506SS..Hα-helixtrans-58.3-43.3178.300000111.6V43 L44 Q49 V50 Y51V43-A47 WeakPolarHBondContact O-CB 3.16Å; V43-A47 PolarHBondContact O-N 3.39Å; L44-A47 PolarHBondContact O-N 2.85Å; A47-Q49 VanDerWaalsContact C-N 3.33Å; A47-Q49 PolarHBondContact O-N 2.66Å; A47-V50 PolarHBondContact O-N 3.28Å; A47-Y51 WeakPolarHBondContact O-CB 3.28Å; A47-Y51 PolarHBondContact O-N 2.9Å
48R94.9Very high90.5Very high145 Ų145101.8 Ų101.855%0.54750%0.502SS..Hα-helixtrans-60.9-42.2174.1-174.8-176-178.8-76.70.4111.8L44 N46 M52L44-R48 WeakPolarHBondContact O-CB 3.38Å; L44-R48 PolarHBondContact O-N 2.99Å; N46-R48 VanDerWaalsContact C-N 3.3Å; N46-R48 PolarHBondContact O-N 3.37Å; R48-M52 HydrophobicContact CG-CG 4.2Å; R48-M52 WeakPolarHBondContact O-CB 3.48Å; R48-M52 WeakPolarHBondContact O-CG 2.9Å; R48-M52 PolarHBondContact O-N 3.15Å
49Q93.8Very high90.2Very high94 Ų9499.9 Ų99.944%0.43949%0.492SS..Hα-helixtrans-62.8-46.3179.9-170.26737.100111.1R45 N46 A47 M52 N53R45-Q49 PolarHBondContact O-N 3.17Å; N46-Q49 WeakPolarHBondContact O-CB 3.33Å; N46-Q49 PolarHBondContact O-N 3.03Å; A47-Q49 VanDerWaalsContact C-N 3.33Å; A47-Q49 PolarHBondContact O-N 2.66Å; Q49-M52 PolarHBondContact O-N 3.12Å; Q49-N53 PolarHBondContact NE2-OD1 2.84Å; Q49-N53 WeakPolarHBondContact O-CB 3.1Å; Q49-N53 PolarHBondContact O-N 2.68Å; Q49-N53 PolarHBondContact O-OD1 2.8Å
50V93.7Very high89.8Confident88 Ų88103 Ų10353%0.53350%0.498SS..Hα-helixtrans-61.9-50.1177.6175.30000110.5N46 A47 M52 N53 E54N46-V50 WeakPolarHBondContact O-CG2 3.48Å; N46-V50 PolarHBondContact O-N 3.18Å; A47-V50 PolarHBondContact O-N 3.28Å; V50-M52 VanDerWaalsContact C-N 3.35Å; V50-M52 PolarHBondContact O-N 2.85Å; V50-N53 PolarHBondContact O-N 3.11Å; V50-E54 WeakPolarHBondContact O-CB 3.27Å; V50-E54 PolarHBondContact O-N 3.01Å
51Y94Very high89.4Confident131 Ų131106.6 Ų106.651%0.51450%0.502SS..Hα-helixtrans-59.2-43.5179.3174.4-100000112.7A47 K55A47-Y51 WeakPolarHBondContact O-CB 3.28Å; A47-Y51 PolarHBondContact O-N 2.9Å; Y51-K55 HydrophobicContact CE1-CD 4.27Å; Y51-K55 VanDerWaalsContact O-CB 3.27Å; Y51-K55 WeakPolarHBondContact O-CB 3.22Å; Y51-K55 PolarHBondContact O-N 3.49Å
52M91.4Very high88.8Confident44 Ų44108.6 Ų108.622%0.21751%0.505CS..Hα-helixtrans-67-45.6178.7-70.6-66.617100110.9R48 Q49 V50 E54 K55 Y56R48-M52 HydrophobicContact CG-CG 4.2Å; R48-M52 WeakPolarHBondContact O-CB 3.48Å; R48-M52 WeakPolarHBondContact O-CG 2.9Å; R48-M52 PolarHBondContact O-N 3.15Å; Q49-M52 PolarHBondContact O-N 3.12Å; V50-M52 VanDerWaalsContact C-N 3.35Å; V50-M52 PolarHBondContact O-N 2.85Å; M52-E54 VanDerWaalsContact C-N 3.31Å; M52-E54 PolarHBondContact O-N 3.33Å; M52-K55 PolarHBondContact O-N 2.76Å; M52-Y56 HydrophobicContact CB-CD2 4.34Å; M52-Y56 HydrophobicContact CB-CE2 4.28Å; M52-Y56 WeakPolarHBondContact O-CB 3.45Å; M52-Y56 WeakPolarHBondContact O-CD2 3.21Å; M52-Y56 PolarHBondContact O-N 3.07Å
53N88.1Confident87.7Confident90 Ų90106.7 Ų106.748%0.48150%0.501SS..Hα-helixtrans-58.7-43.5177.5-71.31.5000111.6Q49 V50 Y56 A57Q49-N53 PolarHBondContact NE2-OD1 2.84Å; Q49-N53 WeakPolarHBondContact O-CB 3.1Å; Q49-N53 PolarHBondContact O-N 2.68Å; Q49-N53 PolarHBondContact O-OD1 2.8Å; V50-N53 PolarHBondContact O-N 3.11Å; N53-Y56 PolarHBondContact O-N 3.48Å; N53-A57 WeakPolarHBondContact O-CB 3.44Å; N53-A57 PolarHBondContact O-N 2.98Å
54E89.2Confident86.3Confident131 Ų131109 Ų10961%0.61251%0.506SS*.Hα-helixtrans-65-44.4176.5-174172.3-162.300111.7V50 M52 Y56 A57 E58V50-E54 WeakPolarHBondContact O-CB 3.27Å; V50-E54 PolarHBondContact O-N 3.01Å; M52-E54 VanDerWaalsContact C-N 3.31Å; M52-E54 PolarHBondContact O-N 3.33Å; E54-Y56 PolarHBondContact O-N 3.03Å; E54-A57 PolarHBondContact O-N 2.99Å; E54-E58 WeakPolarHBondContact O-CB 2.96Å; E54-E58 PolarHBondContact O-N 3.48Å
55K85.7Confident85Confident104 Ų104112 Ų11245%0.45251%0.512SS..Hα-helixtrans-63.3-39.6176-172.8180178.5-178.20112.5Y51 M52 E58 I59Y51-K55 HydrophobicContact CE1-CD 4.27Å; Y51-K55 VanDerWaalsContact O-CB 3.27Å; Y51-K55 WeakPolarHBondContact O-CB 3.22Å; Y51-K55 PolarHBondContact O-N 3.49Å; M52-K55 PolarHBondContact O-N 2.76Å; K55-E58 PolarHBondContact O-N 2.84Å; K55-I59 HydrophobicContact CG-CD1 4.21Å; K55-I59 WeakPolarHBondContact O-CD1 3.29Å; K55-I59 VanDerWaalsContact O-CG1 3.26Å; K55-I59 WeakPolarHBondContact O-CG1 3.2Å; K55-I59 PolarHBondContact O-N 3.31Å
56Y82.5Confident83.9Confident140 Ų140109.2 Ų109.255%0.54951%0.507SS..Hα-helixtrans-65.7-45.3174.2-79.9-67.7000110.8M52 N53 E54 E58 I59 Y60M52-Y56 HydrophobicContact CB-CD2 4.34Å; M52-Y56 HydrophobicContact CB-CE2 4.28Å; M52-Y56 WeakPolarHBondContact O-CB 3.45Å; M52-Y56 WeakPolarHBondContact O-CD2 3.21Å; M52-Y56 PolarHBondContact O-N 3.07Å; N53-Y56 PolarHBondContact O-N 3.48Å; E54-Y56 PolarHBondContact O-N 3.03Å; Y56-E58 VanDerWaalsContact C-N 3.28Å; Y56-E58 PolarHBondContact O-N 3.25Å; Y56-I59 PolarHBondContact O-N 2.91Å; Y56-Y60 WeakPolarHBondContact O-CD2 3.19Å; Y56-Y60 PolarHBondContact O-N 3.24Å
57A84.3Confident82.7Confident48 Ų48111.8 Ų111.840%0.39752%0.517SS..Hα-helixtrans-59.6-39175.600000112.1N53 E54 Y60 R61N53-A57 WeakPolarHBondContact O-CB 3.44Å; N53-A57 PolarHBondContact O-N 2.98Å; E54-A57 PolarHBondContact O-N 2.99Å; A57-Y60 PolarHBondContact O-N 3.04Å; A57-R61 WeakPolarHBondContact O-CG 3.38Å; A57-R61 PolarHBondContact O-N 2.88Å
58E84.8Confident81.6Confident82 Ų82113 Ų11338%0.38352%0.518SS..Hα-helixtrans-62.5-48.6174.9-170.959.6-154.600111.9E54 K55 Y56 Y60 R61 M62E54-E58 WeakPolarHBondContact O-CB 2.96Å; E54-E58 PolarHBondContact O-N 3.48Å; K55-E58 PolarHBondContact O-N 2.84Å; Y56-E58 VanDerWaalsContact C-N 3.28Å; Y56-E58 PolarHBondContact O-N 3.25Å; E58-Y60 VanDerWaalsContact C-N 3.29Å; E58-Y60 PolarHBondContact O-N 2.74Å; E58-R61 PolarHBondContact O-N 3.28Å; E58-R61 IonicContact OE2-CZ 3.84Å; E58-R61 IonicContact OE2-NE 3.57Å; E58-R61 IonicContact OE2-NH2 3.5Å; E58-R61 PolarHBondContact OE2-NH2 3.47Å; E58-M62 WeakPolarHBondContact O-CB 3.5Å; E58-M62 WeakPolarHBondContact O-CG 3.45Å; E58-M62 PolarHBondContact O-N 2.76Å
59I77.3Confident80.5Confident86 Ų86109.8 Ų109.844%0.44151%0.51SS..Hα-helixtrans-58.9-42.7176.6-68164000110.6K55 Y56 M62 Q63K55-I59 HydrophobicContact CG-CD1 4.21Å; K55-I59 WeakPolarHBondContact O-CD1 3.29Å; K55-I59 VanDerWaalsContact O-CG1 3.26Å; K55-I59 WeakPolarHBondContact O-CG1 3.2Å; K55-I59 PolarHBondContact O-N 3.31Å; Y56-I59 PolarHBondContact O-N 2.91Å; I59-M62 PolarHBondContact O-N 3.31Å; I59-Q63 WeakPolarHBondContact O-CB 3.44Å; I59-Q63 PolarHBondContact O-N 2.89Å
60Y76.8Confident79.6Confident160 Ų160108.4 Ų108.463%0.62751%0.508SS*.Hα-helixtrans-63-42.3176.5-84.7-68.2000112.6Y56 A57 E58 Q64Y56-Y60 WeakPolarHBondContact O-CD2 3.19Å; Y56-Y60 PolarHBondContact O-N 3.24Å; A57-Y60 PolarHBondContact O-N 3.04Å; E58-Y60 VanDerWaalsContact C-N 3.29Å; E58-Y60 PolarHBondContact O-N 2.74Å; Y60-Q64 WeakPolarHBondContact O-CB 3.4Å; Y60-Q64 PolarHBondContact O-N 2.93Å; Y60-Q64 VanDerWaalsContact O-N 3.08Å
61R83.1Confident78.7Confident161 Ų161107.8 Ų107.861%0.60850%0.504SS*.Hα-helixtrans-66.4-41.8176.5-71.8-168.1-59.6-174.30.4112.2A57 E58 Q64 Y65A57-R61 WeakPolarHBondContact O-CG 3.38Å; A57-R61 PolarHBondContact O-N 2.88Å; E58-R61 PolarHBondContact O-N 3.28Å; E58-R61 IonicContact OE2-CZ 3.84Å; E58-R61 IonicContact OE2-NE 3.57Å; E58-R61 IonicContact OE2-NH2 3.5Å; E58-R61 PolarHBondContact OE2-NH2 3.47Å; R61-Q64 PolarHBondContact O-N 3.42Å; R61-Y65 PolarHBondContact O-N 2.83Å
62M74.8Confident77.5Confident118 Ų118104.7 Ų104.758%0.58150%0.501SS*.Hα-helixtrans-63.6-43.6177.1-72.8-142.472.500111.6E58 I59 Q64 Y65 E66E58-M62 WeakPolarHBondContact O-CB 3.5Å; E58-M62 WeakPolarHBondContact O-CG 3.45Å; E58-M62 PolarHBondContact O-N 2.76Å; I59-M62 PolarHBondContact O-N 3.31Å; M62-Q64 VanDerWaalsContact C-N 3.32Å; M62-Q64 PolarHBondContact O-N 3.29Å; M62-Y65 PolarHBondContact O-N 3.41Å; M62-E66 WeakPolarHBondContact O-CB 3.35Å; M62-E66 PolarHBondContact O-N 2.94Å
63Q70.9Confident76.5Confident107 Ų107107.2 Ų107.250%0.552%0.516SS..Hα-helixtrans-62.9-39.9178-167.4165.229.500111.9I59 E66 E67I59-Q63 WeakPolarHBondContact O-CB 3.44Å; I59-Q63 PolarHBondContact O-N 2.89Å; Q63-E66 PolarHBondContact O-N 3.28Å; Q63-E67 PolarHBondContact O-N 3.03Å
64Q67.5Low75.6Confident133 Ų133108.8 Ų108.862%0.62152%0.52SS*.Hα-helixtrans-67.5-35.7175.8-157.61782.900112.2Y60 R61 M62 V68Y60-Q64 WeakPolarHBondContact O-CB 3.4Å; Y60-Q64 PolarHBondContact O-N 2.93Å; Y60-Q64 VanDerWaalsContact O-N 3.08Å; R61-Q64 PolarHBondContact O-N 3.42Å; M62-Q64 VanDerWaalsContact C-N 3.32Å; M62-Q64 PolarHBondContact O-N 3.29Å; Q64-V68 WeakPolarHBondContact O-CB 3.49Å; Q64-V68 WeakPolarHBondContact O-CG2 3.38Å; Q64-V68 PolarHBondContact O-N 3.06Å; Q64-V68 VanDerWaalsContact O-N 3.08Å
65Y68.1Low74.6Confident167 Ų167107.8 Ų107.866%0.65552%0.518SS*.Hα-helixtrans-70.3-37175.4-156-89.8000111.8R61 M62 V68 M69R61-Y65 PolarHBondContact O-N 2.83Å; M62-Y65 PolarHBondContact O-N 3.41Å; Y65-V68 PolarHBondContact O-N 2.88Å; Y65-M69 HydrophobicContact CD1-CG 3.81Å; Y65-M69 HydrophobicContact CE1-CG 3.73Å; Y65-M69 HydrophobicContact CE1-SD 4.21Å; Y65-M69 WeakPolarHBondContact O-CB 3.43Å; Y65-M69 VanDerWaalsContact O-CG 3.28Å; Y65-M69 WeakPolarHBondContact O-CG 3.24Å; Y65-M69 PolarHBondContact O-N 3.49Å
66E70.9Confident73.4Confident138 Ų138109.3 Ų109.365%0.64553%0.527SS*.Hα-helixtrans-66.9-44.8176.4-167.1150.5-150.200111.4M62 Q63 V68 M69 T70M62-E66 WeakPolarHBondContact O-CB 3.35Å; M62-E66 PolarHBondContact O-N 2.94Å; Q63-E66 PolarHBondContact O-N 3.28Å; E66-V68 PolarHBondContact O-N 3.08Å; E66-M69 PolarHBondContact O-N 2.88Å; E66-T70 WeakPolarHBondContact O-CG2 3.46Å; E66-T70 PolarHBondContact O-N 3.49Å; E66-T70 PolarHBondContact O-OG1 3.49Å; E66-T70 VanDerWaalsContact O-OG1 3.14Å
67E69.7Low72.3Confident123 Ų123110.8 Ų110.858%0.57554%0.538SS*.Hα-helixtrans-59.5-42.3172-83-178.9174.900112.7Q63 T70 V71Q63-E67 PolarHBondContact O-N 3.03Å; E67-T70 WeakPolarHBondContact CA-OG1 3.08Å; E67-T70 PolarHBondContact O-N 3.41Å; E67-T70 PolarHBondContact O-OG1 2.85Å; E67-V71 VanDerWaalsContact O-CG2 3.29Å; E67-V71 WeakPolarHBondContact O-CG2 3.41Å; E67-V71 PolarHBondContact O-N 3.19Å; E67-V71 VanDerWaalsContact O-N 3.11Å
68V72.8Confident71Confident82 Ų82115.2 Ų115.250%0.49756%0.555SS.*Hα-helixtrans-67.2-39.5178.1170.10000111.1Q64 Y65 E66 V71 C72Q64-V68 WeakPolarHBondContact O-CB 3.49Å; Q64-V68 WeakPolarHBondContact O-CG2 3.38Å; Q64-V68 PolarHBondContact O-N 3.06Å; Q64-V68 VanDerWaalsContact O-N 3.08Å; Y65-V68 PolarHBondContact O-N 2.88Å; E66-V68 PolarHBondContact O-N 3.08Å; V68-V71 PolarHBondContact O-N 3.17Å; V68-C72 PolarHBondContact O-N 3.08Å; V68-C72 PolarHBondContact O-SG 3.05Å
69M72.1Confident69.5Low78 Ų78116.6 Ų116.638%0.38457%0.565SS.*Hα-helixtrans-68.4-37.8177.2-78.8-57.7-49.400112.6Y65 E66 C72 N73Y65-M69 HydrophobicContact CD1-CG 3.81Å; Y65-M69 HydrophobicContact CE1-CG 3.73Å; Y65-M69 HydrophobicContact CE1-SD 4.21Å; Y65-M69 WeakPolarHBondContact O-CB 3.43Å; Y65-M69 VanDerWaalsContact O-CG 3.28Å; Y65-M69 WeakPolarHBondContact O-CG 3.24Å; Y65-M69 PolarHBondContact O-N 3.49Å; E66-M69 PolarHBondContact O-N 2.88Å; M69-C72 PolarHBondContact O-N 2.95Å; M69-N73 WeakPolarHBondContact O-CB 3.46Å; M69-N73 VanDerWaalsContact O-CG 3.28Å; M69-N73 PolarHBondContact O-N 3.36Å; M69-N73 PolarHBondContact O-ND2 3.46Å
70T74.6Confident68.5Low65 Ų65117.9 Ų117.940%0.39958%0.579SS.*Hα-helixtrans-64-43.3174.448.40000111.3E66 E67 C72 N73 E74E66-T70 WeakPolarHBondContact O-CG2 3.46Å; E66-T70 PolarHBondContact O-N 3.49Å; E66-T70 PolarHBondContact O-OG1 3.49Å; E66-T70 VanDerWaalsContact O-OG1 3.14Å; E67-T70 WeakPolarHBondContact CA-OG1 3.08Å; E67-T70 PolarHBondContact O-N 3.41Å; E67-T70 PolarHBondContact O-OG1 2.85Å; T70-C72 PolarHBondContact O-N 3.4Å; T70-N73 PolarHBondContact O-N 2.95Å; T70-E74 WeakPolarHBondContact O-CG 3.41Å; T70-E74 PolarHBondContact O-N 3.15Å
71V74.2Confident67.3Low75 Ų75117.5 Ų117.546%0.45559%0.587SS.*Hα-helixtrans-63.6-40.9177.3172.40000111.6E67 V68 E74 I75E67-V71 VanDerWaalsContact O-CG2 3.29Å; E67-V71 WeakPolarHBondContact O-CG2 3.41Å; E67-V71 PolarHBondContact O-N 3.19Å; E67-V71 VanDerWaalsContact O-N 3.11Å; V68-V71 PolarHBondContact O-N 3.17Å; V71-E74 PolarHBondContact O-N 2.98Å; V71-I75 HydrophobicContact CG1-CD1 3.83Å; V71-I75 WeakPolarHBondContact O-CD1 3.35Å; V71-I75 WeakPolarHBondContact O-CG1 3.39Å; V71-I75 PolarHBondContact O-N 3.46Å
72C68.4Low65.5Low66 Ų66117.5 Ų117.545%0.44660%0.599SS.*Hα-helixtrans-66.1-37.8177.1-670000112.5V68 M69 T70 I75 Q76V68-C72 PolarHBondContact O-N 3.08Å; V68-C72 PolarHBondContact O-SG 3.05Å; M69-C72 PolarHBondContact O-N 2.95Å; T70-C72 PolarHBondContact O-N 3.4Å; C72-I75 PolarHBondContact O-N 3.45Å; C72-Q76 PolarHBondContact O-N 2.97Å; C72-Q76 VanDerWaalsContact O-N 3.14Å
73N70.3Confident64.1Low98 Ų98119.4 Ų119.452%0.52461%0.611SS.*Hα-helixtrans-67.7-42.5176.4-73.7-28.1000111.8M69 T70 I75 Q76 E77M69-N73 WeakPolarHBondContact O-CB 3.46Å; M69-N73 VanDerWaalsContact O-CG 3.28Å; M69-N73 PolarHBondContact O-N 3.36Å; M69-N73 PolarHBondContact O-ND2 3.46Å; T70-N73 PolarHBondContact O-N 2.95Å; N73-I75 VanDerWaalsContact C-N 3.31Å; N73-I75 PolarHBondContact O-N 3.41Å; N73-Q76 PolarHBondContact O-N 3.45Å; N73-E77 PolarHBondContact O-N 3.47Å
74E70.8Confident62.9Low122 Ų122118.6 Ų118.657%0.5762%0.622SS**Hα-helixtrans-61.6-38.3175.4-73.9175.5-16500112T70 V71 E77 L78T70-E74 WeakPolarHBondContact O-CG 3.41Å; T70-E74 PolarHBondContact O-N 3.15Å; V71-E74 PolarHBondContact O-N 2.98Å; E74-E77 PolarHBondContact O-N 3.01Å; E74-L78 WeakPolarHBondContact O-CG 3.38Å; E74-L78 PolarHBondContact O-N 3.38Å
75I67.6Low61.7Low111 Ų111120 Ų12057%0.56963%0.628SS**Hα-helixtrans-67.2-36.3175.9-67164000111.7V71 C72 N73 L78V71-I75 HydrophobicContact CG1-CD1 3.83Å; V71-I75 WeakPolarHBondContact O-CD1 3.35Å; V71-I75 WeakPolarHBondContact O-CG1 3.39Å; V71-I75 PolarHBondContact O-N 3.46Å; C72-I75 PolarHBondContact O-N 3.45Å; N73-I75 VanDerWaalsContact C-N 3.31Å; N73-I75 PolarHBondContact O-N 3.41Å; I75-L78 PolarHBondContact O-N 3.38Å
76Q59.3Low60.4Low136 Ų136119.6 Ų119.664%0.63664%0.638SS**Hα-helixtrans-70.8-33.1178.5-173.863.844.100112.4C72 N73 L78 N79C72-Q76 PolarHBondContact O-N 2.97Å; C72-Q76 VanDerWaalsContact O-N 3.14Å; N73-Q76 PolarHBondContact O-N 3.45Å; Q76-L78 VanDerWaalsContact C-N 3.3Å; Q76-N79 PolarHBondContact O-N 3.17Å
77E59.4Low58.7Low170 Ų170117.9 Ų117.979%0.79464%0.64SS**Hα-helixtrans-73.3-22.9178.7-155.8169.4-158.600112.5N73 E74 N79N73-E77 PolarHBondContact O-N 3.47Å; E74-E77 PolarHBondContact O-N 3.01Å; E77-N79 VanDerWaalsContact C-N 3.3Å; E77-N79 PolarHBondContact O-N 2.87Å
78L57.3Low57.2Low141 Ų141119.6 Ų119.674%0.73865%0.648SS**THydrogen-bonded Turntrans-87.114.1175.7-66.8175.8000114.4E74 I75 Q76 P80E74-L78 WeakPolarHBondContact O-CG 3.38Å; E74-L78 PolarHBondContact O-N 3.38Å; I75-L78 PolarHBondContact O-N 3.38Å; Q76-L78 VanDerWaalsContact C-N 3.3Å; L78-P80 WeakPolarHBondContact O-CD 3.2Å
79N53.1Low55.6Low111 Ų111124.9 Ų124.959%0.59467%0.667SS**  trans-100.690.8174.7-129-17.5000109.8Q76 E77 L81Q76-N79 PolarHBondContact O-N 3.17Å; E77-N79 VanDerWaalsContact C-N 3.3Å; E77-N79 PolarHBondContact O-N 2.87Å; N79-L81 PolarHBondContact O-N 3.38Å; N79-L81 VanDerWaalsContact O-N 3.1Å
80P57Low53.9Low114 Ų114129.6 Ų129.674%0.7469%0.688SS**  trans-78.494.8-178.831-34.7000110.2L78L78-P80 WeakPolarHBondContact O-CD 3.2Å
81L51.7Low52.1Low152 Ų152132.4 Ų132.480%0.79671%0.711SS**  trans-136.987.9162.8-79.6175.9000109.6N79N79-L81 PolarHBondContact O-N 3.38Å; N79-L81 VanDerWaalsContact O-N 3.1Å
82D44.5Very low50.1Low161 Ų161132.4 Ų132.486%0.86173%0.725SS**  trans-16375.5138.6-98.9-19.6000108.9A84D82-A84 VanDerWaalsContact C-N 3.29Å; D82-A84 PolarHBondContact O-N 3.47Å
83L45.9Very low48.4Very low158 Ų158136.5 Ų136.583%0.82774%0.743SS**  trans-86.381.7147.6-83.4168.5000106.4E85L83-E85 HydrophobicContact CD2-CG 4.5Å; L83-E85 PolarHBondContact O-N 3.27Å; L83-E85 VanDerWaalsContact O-N 3.14Å
84A45.1Very low46.6Very low89 Ų89136.4 Ų136.474%0.73675%0.749SS**  trans-75.783.8152.600000106.1D82 D86D82-A84 VanDerWaalsContact C-N 3.29Å; D82-A84 PolarHBondContact O-N 3.47Å; A84-D86 PolarHBondContact O-N 2.91Å; A84-D86 VanDerWaalsContact O-N 3.13Å
85E44Very low45Very low162 Ų162136.6 Ų136.676%0.75776%0.762SS**  trans-65.1108163.8-79.5-162143.700107.7L83 C87L83-E85 HydrophobicContact CD2-CG 4.5Å; L83-E85 PolarHBondContact O-N 3.27Å; L83-E85 VanDerWaalsContact O-N 3.14Å; E85-C87 PolarHBondContact O-N 2.9Å
86D40.1Very low43.4Very low160 Ų160135.1 Ų135.186%0.85677%0.774SS**  trans-49.5120.6151.9-77.1-41.8000108.8A84A84-D86 PolarHBondContact O-N 2.91Å; A84-D86 VanDerWaalsContact O-N 3.13Å
87C35Very low42.3Very low101 Ų101136.4 Ų136.468%0.68279%0.785SS**  trans-151.2118.6160.7-114.60000111.4E85E85-C87 PolarHBondContact O-N 2.9Å
88E38Very low41.2Very low159 Ų159135.8 Ų135.874%0.74379%0.788SS**  trans93.185.8149.2-46.4-48.6110.100120.6
89E39.3Very low40.1Very low194 Ų194132.2 Ų132.291%0.90779%0.785SS**  trans-94.298.7134-94.2-165.8159.400109.7
90Q36.3Very low39.2Very low177 Ų177133.7 Ų133.783%0.82780%0.798SS**  trans-161.8105.6142.2-148.9118.980.600112.9
91S36.7Very low38.1Very low124 Ų124133.7 Ų133.787%0.86780%0.801SS**  trans13.2118.4142-178.30000119
92G32.2Very low37.5Very low74 Ų74134.9 Ų134.976%0.76380%0.802SS**  trans-174.173.7165.600000115
93D32.3Very low38Very low152 Ų152132 Ų13281%0.81379%0.792SS**  trans48.8125.7138.6-144.126.8000122.9
94C33Very low37.5Very low96 Ų96129.2 Ų129.265%0.64979%0.792SS**  trans70.3114.7142.3-82.80000124.6
95C37.8Very low37.2Very low127 Ų127129.9 Ų129.986%0.85879%0.791SS**  74.6125.3129.5-590000120.8
96G34.8Very low36.9Very low79 Ų79129.5 Ų129.581%0.81479%0.794SS**  trans-92.8-170.4-170.400000117.1
97N35.8Very low36.5Very low163 Ų163126.2 Ų126.287%0.87278%0.782SS**  trans-171.2147.6139.3-144.442.5000111.4
98D36.3Very low36.4Very low157 Ų157126.7 Ų126.784%0.8479%0.785SS**  trans-47149.4160.7-96.8-53.6000114
99G32.7Very low36.2Very low67 Ų67122.7 Ų122.769%0.69178%0.78SS**  trans167.880.1165.500000116.8
100V35.8Very low35.9Very low141 Ų141120.8 Ų120.886%0.85578%0.775SS**  trans17.5117.5136.8-179.50000117.4
101S33.6Very low35.9Very low115 Ų115119.8 Ų119.880%0.80477%0.774SS**  165.1112.6116.939.30000113.7
102E37.7Very low36.8Very low176 Ų176119 Ų11982%0.82277%0.766SS**  trans-62.6-179.6152.7-92.7-93.1101.200111.2
103P56.2Low36.8Very low101 Ų101121.6 Ų121.666%0.65677%0.767SS**  cis-138.2169.6-2129.5-9.8000114.2
104A34.3Very low36.9Very low100 Ų100118.7 Ų118.783%0.82676%0.759SS**  trans173.5132.6136.800000107.3
105S40Very low36.9Very low102 Ų102121.9 Ų121.971%0.71376%0.764SS**  cis-162.813015.4166.10000105.8
106L38.1Very low36.7Very low155 Ų155122.1 Ų122.181%0.81276%0.756SS**  trans13.9138.7135-67.4158000116.4
107C31.2Very low36.4Very low90 Ų90124.3 Ų124.361%0.60875%0.754SS**  cis178.9147.9-2.6-158.80000103.4
108C32.1Very low36.1Very low111 Ų111120.9 Ų120.975%0.7575%0.747SS**  57.8140.8124.7-46.90000119.4
109A34.7Very low35.9Very low76 Ų76119.5 Ų119.563%0.62875%0.745SS**  cis176.5143.1-9.300000103.9
110L33.6Very low35.8Very low153 Ų153125 Ų12580%0.80175%0.752SS**  trans47.3111.6136.1-56.8167.1000119.3
111L35.9Very low35.6Very low157 Ų157123.9 Ų123.982%0.82275%0.751SS**  32.7169.2118.5-66.5167.1000120
112P55.4Low35.4Very low106 Ų106122.7 Ų122.769%0.68875%0.748SS**  cis-132.5-160.1-40.835.2-15.6000110.8
113V32.5Very low35Very low130 Ų130121.4 Ų121.479%0.78874%0.742SS**  trans135131.2145.9178.90000115.1
114S33.5Very low33.9Very low91 Ų91124.7 Ų124.764%0.63675%0.752SS**  trans-59.5150.617646.30000118.4
115H32.6Very low33.8Very low163 Ų163127.5 Ų127.576%0.75575%0.748SS**  176.6130.6117.7-117.6-114.8000114.9
116L33.4Very low33.5Very low132 Ų132126.9 Ų126.969%0.69175%0.749SS**  trans52.7137.7136.4-68.3-175.7000126.3
117T29.7Very low33.8Very low125 Ų125125.2 Ų125.277%0.76775%0.747SS**  trans91.3107.5134.5410000123.6
118A29.7Very low34Very low90 Ų90126.5 Ų126.574%0.74476%0.758SS**  90.2136.2114.500000123.4
119V30.3Very low33.9Very low129 Ų129125 Ų12578%0.78275%0.753SS**  trans102.3103.1148.6-165.30000120.6
120Q31.9Very low33.7Very low182 Ų182127.5 Ų127.585%0.8576%0.764SS**  trans42.8129.6132.8-60.8-173.516.600125.9
121S30.3Very low33.7Very low118 Ų118126 Ų12683%0.82577%0.767SS**  79.5121126.6-158.90000123.6
122A31.2Very low33.7Very low90 Ų90123.4 Ų123.474%0.74477%0.768SS**  171.6110.2128.100000110.3
123H28.6Very low33.2Very low148 Ų148123.9 Ų123.969%0.68577%0.771SS**  56.5107.599.1-170.3-61.5000116.3
124I32.9Very low33Very low170 Ų170126.1 Ų126.187%0.87278%0.778SS**  trans-151.5140140.6-66.2-159.3000110.8
125Q32.3Very low32.9Very low160 Ų160127.3 Ų127.375%0.74879%0.786SS**  trans-80.1167.2-174.6-74.1162.1-46.700116
126A33.7Very low32.8Very low89 Ų89128 Ų12874%0.73679%0.794SS**  trans-65.3172.7168.900000115.2
127P43.7Very low32.6Very low119 Ų119129.7 Ų129.777%0.77380%0.799SS**  -142.8147.3101.329.1-9.4000113.8
128S35.8Very low32.6Very low118 Ų118129.4 Ų129.483%0.82580%0.802SS**  53.9132.978.4-164.90000113.1
129A30.7Very low32.7Very low79 Ų79131.9 Ų131.965%0.65380%0.803SS**  cis-157.3165.811.700000107
130C29.5Very low32.7Very low128 Ų128133.2 Ų133.287%0.86581%0.805SS**  172147.587-85.40000110.1
131S34.8Very low32.5Very low123 Ų123130.3 Ų130.386%0.8680%0.8SS**  trans-96.5152.4174.3-38.40000111.1
132A34.7Very low32.3Very low102 Ų102129.8 Ų129.884%0.84380%0.795SS**  trans159.4160.3133.200000113.8
133P45.2Very low32.3Very low116 Ų116133.8 Ų133.875%0.75380%0.795SS**  trans-110.9168.4-147.940.8-30.9000114.5
134L28.8Very low32.4Very low177 Ų177134.7 Ų134.793%0.92780%0.8SS**  trans-143.1122.9162.2-82.5174.1000112.4
135S31.9Very low32.4Very low115 Ų115132.9 Ų132.980%0.80480%0.797SS**  trans-81.8142.5159.8-60.40000109.7
136L28.8Very low32.4Very low179 Ų179133.2 Ų133.294%0.93780%0.798SS**  trans-156.5135.2150.9-117.1164.9000110.5
137Q31Very low32.8Very low167 Ų167133.5 Ų133.578%0.7879%0.793SS**  trans-108.4135.8-175.2176.1178.547.300107.9
138S29.2Very low32.3Very low119 Ų119132.2 Ų132.283%0.83279%0.787SS**  trans-164.5127.2146.865.50000111.1
139D31.4Very low32.1Very low142 Ų142136 Ų13676%0.75979%0.789SS**  trans-63.3149.1-178.7-63.7-79.8000115.8
140D30.2Very low32.9Very low156 Ų156143.3 Ų143.383%0.83480%0.801SS**  -160.2107.4126.6-125.3-40.1000112.3
141V28.6Very low33.2Very low122 Ų122147.7 Ų147.774%0.73980%0.799SS**  trans24.2110139.6177.40000119
142C26.2Very low33.2Very low106 Ų106146.1 Ų146.172%0.71679%0.788SS**  163.1136.290.4-145.30000114
143K30.7Very low33.1Very low174 Ų174147.3 Ų147.376%0.75779%0.789SS**  trans9993.4155.8-56-147.7178.6-166.90120.1
144E31.1Very low32.9Very low168 Ų168147.5 Ų147.579%0.78579%0.791SS**  7096.1110.5-143.6168.1-166.800117.4
145T31.6Very low33.2Very low131 Ų131143.4 Ų143.480%0.80478%0.783SS**  158.9110.3111.9-670000109.9
146E32.3Very low33.6Very low168 Ų168146 Ų14679%0.78578%0.783SS**  trans-127.6169163.7-88.4-71.5150.200106.5
147P42.3Very low33.6Very low95 Ų95141.9 Ų141.962%0.61777%0.774SS**  cis-136168-5.320.74.6000115.5
148S33.3Very low33.8Very low92 Ų92144 Ų14464%0.64378%0.776SS**  trans6.5123.7147.467.90000120
149F32.3Very low34.3Very low198 Ų198144 Ų14487%0.86877%0.774SS**  trans-141.4108.4134.8-83.2-75.6000110.1R151F149-R151 PolarHBondContact O-N 2.95Å
150Y47.1Very low34.4Very low231 Ų231143.7 Ų143.791%0.90678%0.777SS**  trans-57.3100.9158.1-177.5-95.5000108.2
151R36.3Very low34.5Very low221 Ų221141.8 Ų141.883%0.83478%0.776SS**  trans-110.3105.4177.1-176175.2-85.3-122.51109.7F149 C153F149-R151 PolarHBondContact O-N 2.95Å; R151-C153 PolarHBondContact O-N 3.49Å
152S33.3Very low34.4Very low90 Ų90143 Ų14363%0.62978%0.778SS**  trans-49.4118.8164.51780000111.5C154S152-C154 PolarHBondContact O-N 2.92Å; S152-C154 VanDerWaalsContact O-N 3.15Å
153C32.8Very low34.8Very low127 Ų127149 Ų14986%0.85879%0.786SS**  trans-8576.5174.2-70.20000111.3R151R151-C153 PolarHBondContact O-N 3.49Å
154C41.7Very low34.9Very low119 Ų119147.5 Ų147.580%0.80479%0.786SS**  trans-132.581.9160.6-67.90000108.7S152S152-C154 PolarHBondContact O-N 2.92Å; S152-C154 VanDerWaalsContact O-N 3.15Å
155A35.8Very low34.9Very low91 Ų91148.4 Ų148.475%0.75279%0.788SS**  trans174.597.8159.900000106.8
156E39.9Very low34.8Very low171 Ų171146.5 Ų146.580%0.79978%0.78SS**  95.8113.893-164.9102.6-13800111.3
157A28Very low34.7Very low91 Ų91144 Ų14475%0.75278%0.776SS**  trans-173.7110.2144.200000108.7
158Y35.9Very low34.4Very low211 Ų211145.8 Ų145.883%0.82779%0.785SS**  trans-50.7137.9164.4-90.2-104.7000111.1
159P39.8Very low34.3Very low121 Ų121148.2 Ų148.279%0.78679%0.791SS**  trans-98.5117.2146.817.6-1000109.3S161P159-S161 PolarHBondContact O-N 3.29Å
160V33.7Very low35Very low134 Ų134146 Ų14681%0.81279%0.788SS**  trans-27.5117.6154.5168.80000111.2N162V160-N162 PolarHBondContact O-N 3.38Å
161S31.1Very low34.5Very low116 Ų116142.1 Ų142.181%0.81178%0.783SS**  trans-7394.9171.450.90000109.2P159P159-S161 PolarHBondContact O-N 3.29Å
162N28.4Very low35.1Very low148 Ų148140 Ų14079%0.79179%0.788SS**  trans-80116.9163.1-159.329.4000107.9V160V160-N162 PolarHBondContact O-N 3.38Å
163W34.1Very low35.8Very low231 Ų231143.9 Ų143.988%0.87580%0.795SS**  trans-56141.5170-96-56.3000110.5
164D33.3Very low36.9Very low143 Ų143142.7 Ų142.777%0.76579%0.787SS**  -164.3120.4129.3-92.7-30.6000114
165F29.3Very low37.7Very low187 Ų187140.2 Ų140.282%0.8277%0.766SS**  trans55.5115.7143.5-92-100.2000125.3
166S30.8Very low39.6Very low92 Ų92141.4 Ų141.464%0.64375%0.754SS**  69.8127.8127.9-160.90000118.1
167T29.3Very low41.5Very low114 Ų114136.9 Ų136.970%0.69974%0.738SS**  -174.6141.359.8-47.70000109.8
168V35.6Very low44.2Very low134 Ų134137 Ų13781%0.81273%0.729SS**  trans61.498.7156.7175.70000117.5
169N33Very low46.7Very low143 Ų143130.8 Ų130.877%0.76571%0.714SS**  -162.6142.1123-151.3-3.1000110.9N171N169-N171 PolarHBondContact O-N 3.38Å; N169-N171 VanDerWaalsContact O-N 3.17Å
170N46Very low49.2Very low151 Ų151129.4 Ų129.481%0.80770%0.699SS**  trans-54.2114.7176-67.8-59.7000111.1
171N37Very low51.8Low149 Ų149126.2 Ų126.280%0.79768%0.678SS**  trans-147109.9158.1-109.7-36000109.4N169 H173N169-N171 PolarHBondContact O-N 3.38Å; N169-N171 VanDerWaalsContact O-N 3.17Å; N171-H173 VanDerWaalsContact C-N 3.29Å; N171-H173 PolarHBondContact O-N 3.48Å
172L48.1Very low54.5Low178 Ų178127 Ų12793%0.93267%0.672SS**  trans-63.790173.4-15775.9000107.5C174L172-C174 PolarHBondContact O-N 3.33Å
173H48.9Very low57.3Low171 Ų171127.1 Ų127.179%0.79267%0.672SS**  trans-70.1104.5-176.7-141.1-71.5000108.4N171 N175N171-H173 VanDerWaalsContact C-N 3.29Å; N171-H173 PolarHBondContact O-N 3.48Å; H173-N175 PolarHBondContact O-N 2.77Å; H173-N175 VanDerWaalsContact O-N 3.08Å
174C56.2Low59.8Low101 Ų101120 Ų12068%0.68265%0.654SS**  trans-69.6104.6174.51780000108.9L172 K176L172-C174 PolarHBondContact O-N 3.33Å; C174-K176 VanDerWaalsContact C-N 3.27Å; C174-K176 PolarHBondContact O-N 3.38Å
175N58.2Low62.3Low67 Ų67120.3 Ų120.336%0.35865%0.651SS.*  trans-88.214.2177.959.5-43.7000113.2H173 E191 N192H173-N175 PolarHBondContact O-N 2.77Å; H173-N175 VanDerWaalsContact O-N 3.08Å; N175-E191 WeakPolarHBondContact ND2-CG 3.49Å; N175-E191 PolarHBondContact ND2-OE1 3.4Å; N175-E191 WeakPolarHBondContact O-CA 3.36Å; N175-E191 PolarHBondContact OD1-OE1 3.42Å; N175-N192 PolarHBondContact O-N 2.91Å
176K74.1Confident65.2Low116 Ų116115.1 Ų115.150%0.50463%0.634SS.*EExtended strand (participates in β ladder)trans-100.9121.4-178.8-69.3170.2179.2163.90111C174 E191C174-K176 VanDerWaalsContact C-N 3.27Å; C174-K176 PolarHBondContact O-N 3.38Å; K176-E191 VanDerWaalsContact CE-CD 3.48Å; K176-E191 WeakPolarHBondContact CE-OE2 3.37Å; K176-E191 HydrophobicContact CG-CB 4.17Å; K176-E191 HydrophobicContact CG-CG 3.96Å; K176-E191 IonicContact NZ-OE2 3.88Å
177T81.1Confident67.9Low76 Ų76114.9 Ų114.947%0.46663%0.629SS.*EExtended strand (participates in β ladder)trans-107.3121.3173.9-54.20000108.9V179 T189 V190T177-V179 HydrophobicContact CG2-CG2 4.46Å; T177-T189 CarbonylContact O-C 3.59Å; T177-V190 PolarHBondContact N-O 3.41Å; T177-V190 PolarHBondContact O-N 3.41Å
178T84.8Confident70.6Confident93 Ų93113.3 Ų113.357%0.57162%0.62SS**EExtended strand (participates in β ladder)trans-93124.5175.962.80000110.1T188 T189T178-T188 CarbonylContact C-O 3.59Å; T178-T188 WeakPolarHBondContact CA-O 3.27Å; T178-T189 HydrophobicContact CG2-CG2 3.42Å; T178-T189 VanDerWaalsContact CG2-CG2 3.42Å
179V88.1Confident72.9Confident82 Ų82111.4 Ų111.450%0.49761%0.608SS.*EExtended strand (participates in β ladder)trans-110.6129.7178-175.10000108.9T177 V187 T188 V190T177-V179 HydrophobicContact CG2-CG2 4.46Å; V179-V187 WeakPolarHBondContact O-CA 3.49Å; V179-T188 PolarHBondContact N-O 3.26Å; V179-T188 PolarHBondContact O-N 2.84Å; V179-V190 HydrophobicContact CG2-CG2 4.47Å
180L92.7Very high75.1Confident91 Ų91108 Ų10848%0.47659%0.592SS.*EExtended strand (participates in β ladder)trans-95.5122.217317668.6000108.8V187L180-V187 HydrophobicContact CB-CG2 4.48Å; L180-V187 HydrophobicContact CD1-CG2 3.67Å
181D88.5Confident76.7Confident68 Ų68105.8 Ų105.836%0.36458%0.577SS.*  trans-79.9122.1167.7179.60.7000109.2D183 T184 H185 V186D181-D183 VanDerWaalsContact C-N 3.33Å; D181-D183 PolarHBondContact OD1-N 3.33Å; D181-T184 WeakPolarHBondContact CB-OG1 3.45Å; D181-T184 WeakPolarHBondContact OD2-CB 3.33Å; D181-T184 VanDerWaalsContact OD2-CG2 3.28Å; D181-T184 WeakPolarHBondContact OD2-CG2 3.37Å; D181-T184 PolarHBondContact OD2-OG1 3.23Å; D181-H185 WeakPolarHBondContact O-CA 3.01Å; D181-H185 PolarHBondContact O-N 3.02Å; D181-V186 PolarHBondContact N-O 3.42Å
182L87Confident78Confident133 Ų133104.3 Ų104.370%0.69657%0.569SS**THydrogen-bonded Turntrans-73.7-25.1-176.8-87.973.4000112.6H185L182-H185 PolarHBondContact O-CE1 2.89Å; L182-H185 PolarHBondContact O-ND1 2.66Å
183D86.4Confident78.4Confident149 Ų14998.5 Ų98.580%0.79755%0.552SS**THydrogen-bonded Turntrans-83.8-39.7-176.8-66.2-30.2000110.4D181D181-D183 VanDerWaalsContact C-N 3.33Å; D181-D183 PolarHBondContact OD1-N 3.33Å
184T86.6Confident78.2Confident81 Ų81101.4 Ų101.450%0.49756%0.558SS.*THydrogen-bonded Turntrans-97.4-11.8-179.365.90000113.9D181 V186D181-T184 WeakPolarHBondContact CB-OG1 3.45Å; D181-T184 WeakPolarHBondContact OD2-CB 3.33Å; D181-T184 VanDerWaalsContact OD2-CG2 3.28Å; D181-T184 WeakPolarHBondContact OD2-CG2 3.37Å; D181-T184 PolarHBondContact OD2-OG1 3.23Å; T184-V186 PolarHBondContact O-N 3.24Å
185H85.9Confident77.7Confident151 Ų151104.5 Ų104.570%0.69957%0.567SS**  trans56.621.9-173.3-61.969.2000113.6D181 L182D181-H185 WeakPolarHBondContact O-CA 3.01Å; D181-H185 PolarHBondContact O-N 3.02Å; L182-H185 PolarHBondContact O-CE1 2.89Å; L182-H185 PolarHBondContact O-ND1 2.66Å
186V90.7Very high76.9Confident77 Ų77108.9 Ų108.947%0.46759%0.585SS.*  trans-92.7134.7179.5178.80000110D181 T184D181-V186 PolarHBondContact N-O 3.42Å; T184-V186 PolarHBondContact O-N 3.24Å
187V88.2Confident75.5Confident88 Ų88111.3 Ų111.353%0.53360%0.598SS.*EExtended strand (participates in β ladder)trans-95120173.2-179.30000109V179 L180V179-V187 WeakPolarHBondContact O-CA 3.49Å; L180-V187 HydrophobicContact CB-CG2 4.48Å; L180-V187 HydrophobicContact CD1-CG2 3.67Å
188T85.2Confident73.4Confident81 Ų81114.1 Ų114.150%0.49761%0.61SS.*EExtended strand (participates in β ladder)trans-113.4129.8176.4-490000109.6T178 V179T178-T188 CarbonylContact C-O 3.59Å; T178-T188 WeakPolarHBondContact CA-O 3.27Å; V179-T188 PolarHBondContact N-O 3.26Å; V179-T188 PolarHBondContact O-N 2.84Å
189T84.9Confident71.1Confident93 Ų93115.2 Ų115.257%0.57162%0.62SS**EExtended strand (participates in β ladder)trans-93.4116.8177.762.90000110T177 T178T177-T189 CarbonylContact O-C 3.59Å; T178-T189 HydrophobicContact CG2-CG2 3.42Å; T178-T189 VanDerWaalsContact CG2-CG2 3.42Å
190V77.8Confident68.9Low71 Ų71117.7 Ų117.743%0.4364%0.639SS.*EExtended strand (participates in β ladder)trans-100.3126.3175.6-176.10000108.8T177 V179T177-V190 PolarHBondContact N-O 3.41Å; T177-V190 PolarHBondContact O-N 3.41Å; V179-V190 HydrophobicContact CG2-CG2 4.47Å
191E79.7Confident66.1Low105 Ų105117.5 Ų117.549%0.49165%0.651SS.*EExtended strand (participates in β ladder)trans-100.3123.3178.1-169.5164.6175.100109.7N175 K176 G193N175-E191 WeakPolarHBondContact ND2-CG 3.49Å; N175-E191 PolarHBondContact ND2-OE1 3.4Å; N175-E191 WeakPolarHBondContact O-CA 3.36Å; N175-E191 PolarHBondContact OD1-OE1 3.42Å; K176-E191 VanDerWaalsContact CE-CD 3.48Å; K176-E191 WeakPolarHBondContact CE-OE2 3.37Å; K176-E191 HydrophobicContact CG-CB 4.17Å; K176-E191 HydrophobicContact CG-CG 3.96Å; K176-E191 IonicContact NZ-OE2 3.88Å; E191-G193 PolarHBondContact O-N 3.45Å; E191-G193 VanDerWaalsContact O-N 3.15Å
192N64.8Low63.5Low119 Ų119119.2 Ų119.264%0.63667%0.669SS**SBendtrans-78.3102.1-179.9-89.534.6000110N175N175-N192 PolarHBondContact O-N 2.91Å
193G57.5Low60.5Low55 Ų55122.3 Ų122.357%0.56768%0.677SS**SBendtrans173.592170.600000110E191E191-G193 PolarHBondContact O-N 3.45Å; E191-G193 VanDerWaalsContact O-N 3.15Å
194Y44.2Very low58.2Low233 Ų233123.2 Ų123.291%0.91468%0.676SS**  trans76.4115.9179.9-57.1-85.7000116.4H196Y194-H196 PolarHBondContact O-N 2.82Å
195L44.4Very low55.8Low166 Ų166127.1 Ų127.187%0.86969%0.689SS**  trans-53.4114.6158.4-104140.9000108.1Q197L195-Q197 PolarHBondContact O-N 3.45Å
196H41.4Very low53Low159 Ų159126.1 Ų126.174%0.73670%0.697SS**  trans-7282.1163.9-168.7-80.7000107.8Y194 D198Y194-H196 PolarHBondContact O-N 2.82Å; H196-D198 PolarHBondContact CE1-O 3.49Å; H196-D198 PolarHBondContact ND1-O 3.34Å; H196-D198 PolarHBondContact O-N 3.45Å; H196-D198 VanDerWaalsContact O-N 3.08Å
197Q44.7Very low50Low167 Ų167127 Ų12778%0.7871%0.705SS**  trans-79.277.9167.7-175.7153.125.100107.5L195L195-Q197 PolarHBondContact O-N 3.45Å
198D37.2Very low47.4Very low135 Ų135132.3 Ų132.372%0.72272%0.724SS**  trans-170.4145.7158.1-90.2-34.4000111.1H196H196-D198 PolarHBondContact CE1-O 3.49Å; H196-D198 PolarHBondContact ND1-O 3.34Å; H196-D198 PolarHBondContact O-N 3.45Å; H196-D198 VanDerWaalsContact O-N 3.08Å
199C38Very low44.6Very low115 Ų115132 Ų13278%0.77774%0.738SS**  trans95.665.9166.2-130.90000118
200C41.4Very low42Very low134 Ų134132.8 Ų132.891%0.90575%0.753SS**  trans-88.3132.5133.2-79.90000109.1
201A34.3Very low39.9Very low88 Ų88138.5 Ų138.573%0.72778%0.776SS**  trans74.8105.6167.300000118.5
202S32.8Very low37.7Very low104 Ų104138.4 Ų138.473%0.72779%0.787SS**  169153.7106.751.80000114.1
203F25.3Very low36.8Very low198 Ų198138.1 Ų138.187%0.86879%0.791SS**  trans8289.3161.3-79.3-82.2000122
204Q38Very low35.6Very low167 Ų167139.6 Ų139.678%0.7880%0.798SS**  -14.4132.6125.7-171.6160.4-13.600117.1
205Q34.8Very low35.6Very low164 Ų164138.3 Ų138.377%0.76680%0.797SS**  trans86.5106.9147.5-160.6164.41.700119.4
206C27.1Very low35.6Very low129 Ų129140 Ų14087%0.87280%0.798SS**  -170.5157.2121.4-1530000112.1
207C28.7Very low35.8Very low95 Ų95144.1 Ų144.164%0.64281%0.807SS**  trans-99.8175.4-154.5-52.30000114.5
208Q34Very low35.5Very low200 Ų200144.2 Ų144.294%0.93580%0.804SS**  trans77.4134.6156.8-37.8-161.137.100115.8
209G26.8Very low35.7Very low76 Ų76144 Ų14478%0.78481%0.808SS**  cis161.7140.75.400000107
210A30.3Very low35.7Very low108 Ų108144.4 Ų144.489%0.89380%0.802SS**  trans-173.4138.3152.500000110
211Q33.1Very low35.4Very low192 Ų192147.3 Ų147.390%0.89780%0.8SS**  trans-84.2161.8-166-61.3-177.9-0.700113.9
212S32.8Very low35.5Very low103 Ų103152.2 Ų152.272%0.7281%0.808SS**  trans-44.5-173.416667.60000116.9
213P45.8Very low35.5Very low112 Ų112156.6 Ų156.673%0.72781%0.81SS**  cis-150.8178.711.540-17.1000119.5
214A31.9Very low36.1Very low87 Ų87155 Ų15572%0.71980%0.799SS**  trans75.5143.7144.500000119.2
215K45.6Very low35.8Very low206 Ų206154.2 Ų154.290%0.89680%0.799SS**  cis-149.9146.530.2-74.1173.5177.9170.60112.6
216K43.7Very low35.9Very low201 Ų201149.4 Ų149.487%0.87478%0.783SS**  trans-68.2154.7170.2-59.1-177.8174.6-176.40112.6
217R45.5Very low36.2Very low246 Ų246150 Ų15093%0.92878%0.778SS**  -155.6117122.6-103.3-173.9-65.2149.70.3110.4
218K39.6Very low36.7Very low168 Ų168153.8 Ų153.873%0.7379%0.79SS**  trans-89.1140.4162.3-118.9-166.9168.6-131.30106.8D220K218-D220 IonicContact NZ-OD2 2.66Å; K218-D220 PolarHBondContact NZ-OD2 3.37Å
219V39.9Very low37Very low132 Ų132152.5 Ų152.580%0.878%0.784SS**  trans-139.3108.5156.4167.90000106.4
220D38.9Very low37.4Very low123 Ų123157.7 Ų157.766%0.65879%0.788SS**  trans-87.9140163.7-71.2-53.6000107K218K218-D220 IonicContact NZ-OD2 2.66Å; K218-D220 PolarHBondContact NZ-OD2 3.37Å
221F34.1Very low37.8Very low194 Ų194159.3 Ų159.385%0.85179%0.786SS**  trans-140.1109.6166.2-159-92.4000109.5
222E36.5Very low38.9Very low191 Ų191155.4 Ų155.489%0.89378%0.778SS**  trans-132.9123169.4-171.4176.6-152.700106.2
223Y32.7Very low38.7Very low196 Ų196157.5 Ų157.577%0.76978%0.781SS**  trans-152.9136.5156.8-167.9-106.2000110.6I225Y223-I225 HydrophobicContact CE1-CD1 4.3Å; Y223-I225 HydrophobicContact CE1-CG1 3.94Å
224Y37.7Very low38.1Very low164 Ų164160.9 Ų160.964%0.64378%0.784SS**  trans-104.4138.5-166.2172-88.7000109.7S226Y224-S226 WeakPolarHBondContact CE1-OG 3.12Å; Y224-S226 PolarHBondContact OH-OG 3.45Å
225I33.3Very low38.6Very low151 Ų151163.1 Ų163.177%0.77479%0.789SS**  trans-142.5135.6151.5-71.6-156.8000109.7Y223Y223-I225 HydrophobicContact CE1-CD1 4.3Å; Y223-I225 HydrophobicContact CE1-CG1 3.94Å
226S35.9Very low38.6Very low64 Ų64158.6 Ų158.645%0.44878%0.781SS.*  trans-76.1154.8-162.6-530000118.2Y224Y224-S226 WeakPolarHBondContact CE1-OG 3.12Å; Y224-S226 PolarHBondContact OH-OG 3.45Å
227D33.3Very low38.2Very low141 Ų141155.4 Ų155.475%0.75478%0.782SS**  trans48.1117132.7-57.1-22.6000121.9
228I38.8Very low38.1Very low174 Ų174153.4 Ų153.489%0.89278%0.78SS**  trans-144.7107.5134.9-110.2158.9000109.8
229E40.2Very low37.9Very low174 Ų174156.6 Ų156.681%0.81379%0.788SS**  trans0.9124.8141.6-160.4166.6-167.100119.8
230E34.9Very low37.8Very low184 Ų184154.7 Ų154.786%0.8679%0.786SS**  170.5102.7121-93.3-170.7163.500112.7
231V38.9Very low37.8Very low142 Ų142157 Ų15786%0.86179%0.79SS**  trans30.1146.7133.6175.10000122
232P56.3Low37.8Very low111 Ų111155.6 Ų155.672%0.72178%0.784SS**  trans-108.3170.3-145.241.4-31.3000115.1
233D30.2Very low37.8Very low147 Ų147154.1 Ų154.179%0.78678%0.777SS**  trans-160.5153.9155.1-12314.5000116.7
234F31.6Very low37.9Very low183 Ų183150.8 Ų150.880%0.80377%0.772SS**  trans-45.7147.5-163.6-60.3-92.5000120.6
235T42.2Very low38.2Very low133 Ų133148.9 Ų148.982%0.81678%0.782SS**  trans-94.2147.5147.155.10000107.8
236P46.7Very low38Very low112 Ų112147.4 Ų147.473%0.72779%0.785SS**  -156.6156.270.938.5-17.4000116.7
237C34.9Very low38.1Very low133 Ų133155.2 Ų155.290%0.89981%0.806SS**  176.2146.1127.1-97.40000115.7
238K43Very low38Very low205 Ų205153.3 Ų153.389%0.89181%0.81SS**  trans-70.4148.5172.6-59.8169177.3172.90111.4
239R35.7Very low38Very low234 Ų234152.6 Ų152.688%0.88381%0.808SS**  trans-140.9109.5141.6-172173.7-71.2142.8-1.6109.7
240A37.8Very low37.7Very low92 Ų92148.9 Ų148.976%0.7680%0.801SS**  trans-67.5129.4157.900000107.7F242A240-F242 PolarHBondContact O-N 3.38Å
241K38.8Very low38.2Very low172 Ų172148.9 Ų148.975%0.74880%0.801SS**  trans-81.3111.9166.3-108-169.2167-154.30108.1E243K241-E243 IonicContact NZ-OE2 2.77Å
242F35.3Very low38.4Very low165 Ų165149.5 Ų149.572%0.72479%0.794SS**  trans-83128.4162.5178.5-93.4000107.1A240 D244A240-F242 PolarHBondContact O-N 3.38Å; F242-D244 HydrophobicContact CE1-CB 4.02Å; F242-D244 WeakPolarHBondContact CE1-OD2 3.26Å; F242-D244 HydrophobicContact CZ-CB 4.34Å; F242-D244 WeakPolarHBondContact CZ-OD2 3.47Å
243E35Very low38.2Very low159 Ų159152 Ų15274%0.74380%0.801SS**  trans-142.4108.6169.6-127.9142.8-174.400107.9K241K241-E243 IonicContact NZ-OE2 2.77Å
244D35.9Very low39Very low126 Ų126148.3 Ų148.367%0.67478%0.781SS**  trans-78152.7-179.1-114.1-22.8000111.3F242F242-D244 HydrophobicContact CE1-CB 4.02Å; F242-D244 WeakPolarHBondContact CE1-OD2 3.26Å; F242-D244 HydrophobicContact CZ-CB 4.34Å; F242-D244 WeakPolarHBondContact CZ-OD2 3.47Å
245C42.5Very low40Very low124 Ų124144.5 Ų144.584%0.83877%0.773SS**  trans-54.4144.9-171.3-61.90000116.5
246S29Very low40.7Very low121 Ų121140.4 Ų140.485%0.84675%0.75SS**  trans-142.9131.5144600000111.8
247Y38.8Very low41.2Very low228 Ų228139.1 Ų139.189%0.89474%0.737SS**  trans-68.2126.5173.7-106.5-109.6000110.4
248A31Very low42.5Very low100 Ų100137.3 Ų137.383%0.82672%0.717SS**  trans-157.8105.4150.200000109.6
249N39.7Very low43.3Very low160 Ų160131.1 Ų131.186%0.85670%0.7SS**  trans-78.2126.9156.3-92-81.3000107.6
250S32.8Very low44.7Very low96 Ų96124.5 Ų124.567%0.67168%0.682SS**  trans-171.3109.8146.9168.70000109.6
251E45.1Very low46Very low184 Ų184124.6 Ų124.686%0.8667%0.669SS**  trans55.880.3133.5-57.6175.714800119
252H44.2Very low47.1Very low154 Ų154121.9 Ų121.971%0.71366%0.661SS**  trans-151.971.3139.3-162.1-88.7000109D254H252-D254 IonicContact CE1-OD1 3.79Å; H252-D254 IonicContact ND1-OD1 3.77Å; H252-D254 PolarHBondContact O-N 2.86Å
253L52.2Low48.5Very low164 Ų164118.1 Ų118.186%0.85966%0.656SS**  trans-72.290.9172.3-119.8141.4000107.3T255L253-T255 PolarHBondContact O-N 2.94Å
254D45.6Very low49.7Very low70 Ų70116 Ų11637%0.37465%0.648SS.*  trans-37.7113.5-173.7-139.32.7000112.3H252 S256 N257H252-D254 IonicContact CE1-OD1 3.79Å; H252-D254 IonicContact ND1-OD1 3.77Å; H252-D254 PolarHBondContact O-N 2.86Å; D254-S256 WeakPolarHBondContact CB-OG 3.44Å; D254-S256 PolarHBondContact O-N 3.41Å; D254-S256 PolarHBondContact OD1-OG 3.28Å; D254-S256 PolarHBondContact OD2-OG 3.18Å; D254-N257 WeakPolarHBondContact CB-ND2 3.33Å; D254-N257 WeakPolarHBondContact O-CB 3.46Å; D254-N257 PolarHBondContact O-N 3.45Å
255T54.5Low50.7Low102 Ų102116 Ų11663%0.62664%0.642SS**Hα-helixtrans-54.2-19.8172.12.80000111.9L253 S259L253-T255 PolarHBondContact O-N 2.94Å; T255-S259 PolarHBondContact O-N 2.86Å; T255-S259 PolarHBondContact O-OG 3.37Å
256S55.8Low51.2Low47 Ų47113 Ų11333%0.32963%0.633SS.*Hα-helixtrans-64.4-34.9171.271.80000113.5D254 S259 N260D254-S256 WeakPolarHBondContact CB-OG 3.44Å; D254-S256 PolarHBondContact O-N 3.41Å; D254-S256 PolarHBondContact OD1-OG 3.28Å; D254-S256 PolarHBondContact OD2-OG 3.18Å; S256-S259 PolarHBondContact O-N 3.24Å; S256-N260 PolarHBondContact O-N 3.03Å; S256-N260 PolarHBondContact O-ND2 3.38Å
257N58.2Low52.4Low86 Ų86112.1 Ų112.146%0.4663%0.627SS.*Hα-helixtrans-72-33.6179.9-74.8-51.3000111.6D254 L261D254-N257 WeakPolarHBondContact CB-ND2 3.33Å; D254-N257 WeakPolarHBondContact O-CB 3.46Å; D254-N257 PolarHBondContact O-N 3.45Å; N257-L261 VanDerWaalsContact O-CG 3.28Å; N257-L261 WeakPolarHBondContact O-CG 3.19Å; N257-L261 PolarHBondContact O-N 3.45Å; N257-L261 VanDerWaalsContact O-N 3.15Å
258I62Low53Low95 Ų95103.8 Ų103.849%0.48761%0.61SS.*Hα-helixtrans-70.5-44.1176-57.5173.9000110N260 L261 I262I258-N260 VanDerWaalsContact C-N 3.33Å; I258-N260 PolarHBondContact O-N 3.38Å; I258-L261 PolarHBondContact O-N 2.92Å; I258-I262 HydrophobicContact CG2-CD1 3.89Å; I258-I262 HydrophobicContact CG2-CG1 4.44Å; I258-I262 WeakPolarHBondContact O-CG1 3.41Å; I258-I262 PolarHBondContact O-N 3.43Å
259S59Low54.1Low75 Ų75104.2 Ų104.252%0.52459%0.593SS.*Hα-helixtrans-62.9-36.9176.5-68.20000113T255 S256 I262 S263T255-S259 PolarHBondContact O-N 2.86Å; T255-S259 PolarHBondContact O-OG 3.37Å; S256-S259 PolarHBondContact O-N 3.24Å; S259-I262 PolarHBondContact O-N 2.91Å; S259-S263 VanDerWaalsContact O-CB 3.32Å; S259-S263 WeakPolarHBondContact O-CB 3.47Å; S259-S263 PolarHBondContact O-N 3.29Å
260N64.5Low54.8Low95 Ų95101.4 Ų101.451%0.50859%0.586SS.*Hα-helixtrans-65.3-39.9173.3-76.7-24.5000112.2S256 I258 S263 I264S256-N260 PolarHBondContact O-N 3.03Å; S256-N260 PolarHBondContact O-ND2 3.38Å; I258-N260 VanDerWaalsContact C-N 3.33Å; I258-N260 PolarHBondContact O-N 3.38Å; N260-S263 PolarHBondContact O-N 3.06Å; N260-I264 WeakPolarHBondContact O-CB 3.28Å; N260-I264 WeakPolarHBondContact O-CD1 3.35Å; N260-I264 WeakPolarHBondContact O-CG1 3.33Å; N260-I264 PolarHBondContact O-N 2.99Å
261L65.6Low55.6Low93 Ų9399.5 Ų99.549%0.48758%0.582SS.*Hα-helixtrans-67.1-44.9176.2-70168.3000111.5N257 I258 S263 I264 F265N257-L261 VanDerWaalsContact O-CG 3.28Å; N257-L261 WeakPolarHBondContact O-CG 3.19Å; N257-L261 PolarHBondContact O-N 3.45Å; N257-L261 VanDerWaalsContact O-N 3.15Å; I258-L261 PolarHBondContact O-N 2.92Å; L261-S263 VanDerWaalsContact C-N 3.26Å; L261-S263 PolarHBondContact O-N 3.19Å; L261-I264 PolarHBondContact O-N 3.4Å; L261-I264 VanDerWaalsContact O-N 3.09Å; L261-F265 HydrophobicContact CB-CD2 4.47Å; L261-F265 HydrophobicContact CB-CE2 4.44Å; L261-F265 HydrophobicContact CD2-CE2 4.17Å; L261-F265 WeakPolarHBondContact O-CD2 3.29Å; L261-F265 PolarHBondContact O-N 3.08Å
262I62.1Low55.8Low115 Ų11595.5 Ų95.559%0.5957%0.566SS**Hα-helixtrans-62-36.9175.7-64.4170.1000110.6I258 S259 F265 G266I258-I262 HydrophobicContact CG2-CD1 3.89Å; I258-I262 HydrophobicContact CG2-CG1 4.44Å; I258-I262 WeakPolarHBondContact O-CG1 3.41Å; I258-I262 PolarHBondContact O-N 3.43Å; S259-I262 PolarHBondContact O-N 2.91Å; I262-F265 PolarHBondContact O-N 3.4Å; I262-G266 WeakPolarHBondContact O-CA 3.47Å; I262-G266 PolarHBondContact O-N 2.89Å
263S63.9Low56.1Low87 Ų8793 Ų9361%0.60856%0.561SS**Hα-helixtrans-69-30.3174.4-1700000113.4S259 N260 L261S259-S263 VanDerWaalsContact O-CB 3.32Å; S259-S263 WeakPolarHBondContact O-CB 3.47Å; S259-S263 PolarHBondContact O-N 3.29Å; N260-S263 PolarHBondContact O-N 3.06Å; L261-S263 VanDerWaalsContact C-N 3.26Å; L261-S263 PolarHBondContact O-N 3.19Å
264I60.8Low55.7Low113 Ų11389 Ų8958%0.57955%0.547SS*.Hα-helixtrans-77.1-34.6176.8-69.8162.6000111.1N260 L261N260-I264 WeakPolarHBondContact O-CB 3.28Å; N260-I264 WeakPolarHBondContact O-CD1 3.35Å; N260-I264 WeakPolarHBondContact O-CG1 3.33Å; N260-I264 PolarHBondContact O-N 2.99Å; L261-I264 PolarHBondContact O-N 3.4Å; L261-I264 VanDerWaalsContact O-N 3.09Å
265F57.8Low55.7Low126 Ų12694.4 Ų94.455%0.55356%0.562SS**Hα-helixtrans-90.5-24.4179.8-67.4-65.5000114.1L261 I262 S267 G268 F269L261-F265 HydrophobicContact CB-CD2 4.47Å; L261-F265 HydrophobicContact CB-CE2 4.44Å; L261-F265 HydrophobicContact CD2-CE2 4.17Å; L261-F265 WeakPolarHBondContact O-CD2 3.29Å; L261-F265 PolarHBondContact O-N 3.08Å; I262-F265 PolarHBondContact O-N 3.4Å; F265-S267 VanDerWaalsContact C-N 3.26Å; F265-S267 PolarHBondContact O-N 3.38Å; F265-G268 PolarHBondContact O-N 3.15Å; F265-F269 HydrophobicContact CD1-CE2 4.39Å
266G53Low55.2Low63 Ų6395.3 Ų95.365%0.64956%0.559SS**THydrogen-bonded Turntrans-66.9-20.2-175.600000114.9I262I262-G266 WeakPolarHBondContact O-CA 3.47Å; I262-G266 PolarHBondContact O-N 2.89Å
267S52.9Low54.4Low102 Ų10296.7 Ų96.771%0.71357%0.574SS**THydrogen-bonded Turntrans-110-4179.263.10000114.5F265F265-S267 VanDerWaalsContact C-N 3.26Å; F265-S267 PolarHBondContact O-N 3.38Å
268G52.3Low53.6Low52 Ų5297.4 Ų97.454%0.53658%0.578SS.*THydrogen-bonded Turntrans-101.5-12.9-167.100000116.7F265F265-G268 PolarHBondContact O-N 3.15Å
269F53.2Low52.8Low109 Ų10999.7 Ų99.748%0.47858%0.584SS.*  trans-114.1-1.8-168.3-93.2-98.7000115.9F265 G271 L272 V273F265-F269 HydrophobicContact CD1-CE2 4.39Å; F269-G271 PolarHBondContact O-N 3.26Å; F269-G271 VanDerWaalsContact O-N 3.07Å; F269-L272 HydrophobicContact CD1-CB 3.7Å; F269-L272 HydrophobicContact CD1-CD1 3.38Å; F269-L272 HydrophobicContact CD1-CG 4.11Å; F269-L272 HydrophobicContact CE1-CB 4.22Å; F269-L272 HydrophobicContact CE1-CD1 3.19Å; F269-L272 HydrophobicContact CE1-CG 4.31Å; F269-L272 HydrophobicContact CE2-CD1 4.47Å; F269-L272 HydrophobicContact CG-CD1 4.11Å; F269-L272 HydrophobicContact CZ-CD1 3.8Å; F269-L272 PolarHBondContact O-N 3.42Å; F269-V273 PolarHBondContact O-N 3.08Å; F269-V273 VanDerWaalsContact O-N 3.12Å
270S54.6Low52.1Low101 Ų101104.4 Ų104.471%0.70660%0.598SS**Hα-helixtrans-58.9-25.1177.9-69.30000113.4S274S270-S274 PolarHBondContact O-N 3.44Å
271G50Low51.1Low56 Ų56107.6 Ų107.658%0.57761%0.61SS**Hα-helixtrans-79.2-15.2172.900000115.3F269F269-G271 PolarHBondContact O-N 3.26Å; F269-G271 VanDerWaalsContact O-N 3.07Å
272L50.4Low50.1Low101 Ų101106.1 Ų106.153%0.52961%0.611SS.*Hα-helixtrans-98.5-31.3-179.1-67.6174.5000112.1F269F269-L272 HydrophobicContact CD1-CB 3.7Å; F269-L272 HydrophobicContact CD1-CD1 3.38Å; F269-L272 HydrophobicContact CD1-CG 4.11Å; F269-L272 HydrophobicContact CE1-CB 4.22Å; F269-L272 HydrophobicContact CE1-CD1 3.19Å; F269-L272 HydrophobicContact CE1-CG 4.31Å; F269-L272 HydrophobicContact CE2-CD1 4.47Å; F269-L272 HydrophobicContact CG-CD1 4.11Å; F269-L272 HydrophobicContact CZ-CD1 3.8Å; F269-L272 PolarHBondContact O-N 3.42Å
273V50.5Low49.2Very low100 Ų100108 Ų10861%0.60662%0.621SS**Hα-helixtrans-75.6-27.3172.1-176.80000111.6F269 R275 Q276F269-V273 PolarHBondContact O-N 3.08Å; F269-V273 VanDerWaalsContact O-N 3.12Å; V273-R275 PolarHBondContact O-N 2.99Å; V273-Q276 VanDerWaalsContact O-CB 3.24Å; V273-Q276 WeakPolarHBondContact O-CB 3.38Å; V273-Q276 PolarHBondContact O-N 3.37Å
274S42.3Very low48.3Very low81 Ų81110.9 Ų110.957%0.56663%0.63SS**THydrogen-bonded Turntrans-64.4-23.7174.7-171.40000113.5S270S270-S274 PolarHBondContact O-N 3.44Å
275R46.8Very low47.8Very low183 Ų183109.1 Ų109.169%0.69164%0.64SS**THydrogen-bonded Turntrans-86.3-10.3173.7-68.9-171.6178.1-971.7113.4V273 A277 D278V273-R275 PolarHBondContact O-N 2.99Å; R275-A277 VanDerWaalsContact C-N 3.29Å; R275-D278 PolarHBondContact O-N 3.02Å
276Q43.2Very low47.6Very low122 Ų122111.5 Ų111.557%0.5765%0.653SS**THydrogen-bonded Turntrans-72.2-26.4173.3-168.367.636.400111.4V273 D278 F279V273-Q276 VanDerWaalsContact O-CB 3.24Å; V273-Q276 WeakPolarHBondContact O-CB 3.38Å; V273-Q276 PolarHBondContact O-N 3.37Å; Q276-D278 VanDerWaalsContact C-N 3.3Å; Q276-D278 PolarHBondContact O-N 2.89Å; Q276-F279 WeakPolarHBondContact O-CB 3.4Å; Q276-F279 PolarHBondContact O-N 2.89Å
277A40.3Very low47.1Very low76 Ų76117.3 Ų117.363%0.62866%0.66SS**THydrogen-bonded Turntrans-71.3-23.3174.400000113.2R275R275-A277 VanDerWaalsContact C-N 3.29Å
278D40.8Very low47Very low101 Ų101116.8 Ų116.854%0.5466%0.656SS.*THydrogen-bonded Turntrans-84.8-12.4174.6-63.1-34.2000112.4R275 Q276 Q281 A282R275-D278 PolarHBondContact O-N 3.02Å; Q276-D278 VanDerWaalsContact C-N 3.3Å; Q276-D278 PolarHBondContact O-N 2.89Å; D278-Q281 PolarHBondContact O-N 3.48Å; D278-A282 PolarHBondContact O-N 3.2Å
279F45.7Very low46.7Very low142 Ų142118.4 Ų118.462%0.62366%0.659SS**THydrogen-bonded Turntrans-75.3-25.1-177.7-135-92.1000112.6Q276 Q281 A282Q276-F279 WeakPolarHBondContact O-CB 3.4Å; Q276-F279 PolarHBondContact O-N 2.89Å; F279-Q281 VanDerWaalsContact C-N 3.35Å; F279-A282 PolarHBondContact O-N 3.14Å
280E44.4Very low46.5Very low174 Ų174121.1 Ų121.181%0.81367%0.671SS**THydrogen-bonded Turntrans-77.7-18.9175.9-65.1-145.2149.700113.3
281Q43.2Very low46.4Very low163 Ų163123 Ų12376%0.76267%0.668SS**THydrogen-bonded Turntrans-86.3-16.3169.6-86.6176.911.600113.5D278 F279D278-Q281 PolarHBondContact O-N 3.48Å; F279-Q281 VanDerWaalsContact C-N 3.35Å
282A43.1Very low46.5Very low62 Ų62123.4 Ų123.451%0.51267%0.666SS.*THydrogen-bonded Turntrans-84.9-5.4-179.200000114.3D278 F279 N284D278-A282 PolarHBondContact O-N 3.2Å; F279-A282 PolarHBondContact O-N 3.14Å; A282-N284 PolarHBondContact O-N 3.43Å
283L44.8Very low46.7Very low154 Ų154124.4 Ų124.481%0.80667%0.671SS**THydrogen-bonded Turntrans-77.3-1.7176.7-152.675.6000113.4G285L283-G285 PolarHBondContact O-N 3.45Å
284N45.3Very low46.7Very low147 Ų147123.1 Ų123.179%0.78667%0.671SS**SBendtrans-94.871.3169.7-75.2-46.9000110.9A282 Q286A282-N284 PolarHBondContact O-N 3.43Å; N284-Q286 PolarHBondContact O-N 3.03Å
285G49.1Very low47.1Very low77 Ų77122.3 Ų122.379%0.79467%0.666SS**SBendtrans77.810.8135.800000121.5L283L283-G285 PolarHBondContact O-N 3.45Å
286Q53.2Low47.5Very low175 Ų175118.4 Ų118.482%0.81866%0.658SS**  trans-152.367.6-177-149163.40.600116.8N284N284-Q286 PolarHBondContact O-N 3.03Å
287F42.3Very low47.9Very low185 Ų185114.5 Ų114.581%0.81165%0.65SS**  trans-126.4108.9152.5-99.4-84.8000110.8
288C51.2Low48.5Very low92 Ų92114.1 Ų114.162%0.62265%0.647SS**  trans-65129.7-175.3-172.30000111K290 Q291C288-K290 PolarHBondContact O-N 3.46Å; C288-Q291 PolarHBondContact O-N 3.11Å
289S46.9Very low48.7Very low86 Ų86118.1 Ų118.160%0.60166%0.655SS**THydrogen-bonded Turntrans-58.4-11.2-171.274.60000115.5Q291S289-Q291 PolarHBondContact O-N 2.82Å
290K47.7Very low48.9Very low166 Ų166115.6 Ų115.672%0.72265%0.651SS**Hα-helixtrans-67.2-30.9-178.7-64.6-174.1178.3-175.20113.6C288 A294C288-K290 PolarHBondContact O-N 3.46Å; K290-A294 PolarHBondContact O-N 3.27Å
291Q52.9Low49.3Very low141 Ų141117.5 Ų117.566%0.65965%0.651SS**Hα-helixtrans-79.9-29.5-177.9-161.7159.97.300112.7C288 S289 S295C288-Q291 PolarHBondContact O-N 3.11Å; S289-Q291 PolarHBondContact O-N 2.82Å; Q291-S295 PolarHBondContact O-N 3.02Å
292A53.4Low49.5Very low63 Ų63112.1 Ų112.152%0.52164%0.635SS.*Hα-helixtrans-67.7-42174.800000112A294 S295 L296A292-A294 PolarHBondContact O-N 3.14Å; A292-S295 PolarHBondContact O-N 3.48Å; A292-S295 PolarHBondContact O-OG 3.19Å; A292-L296 PolarHBondContact O-N 3.07Å
293L53.2Low49.7Very low122 Ų122114.9 Ų114.964%0.63964%0.639SS**Hα-helixtrans-66.3-36.3178.3-76.2171.5000113.1S295 L296L293-S295 VanDerWaalsContact C-N 3.32Å; L293-S295 PolarHBondContact O-N 3.21Å; L293-L296 PolarHBondContact O-N 3.42Å
294A51.3Low49.9Very low74 Ų74113.4 Ų113.461%0.61264%0.637SS**Hα-helixtrans-64.5-36176.700000112.5K290 A292K290-A294 PolarHBondContact O-N 3.27Å; A292-A294 PolarHBondContact O-N 3.14Å
295S50.1Low49.8Very low64 Ų64110.5 Ų110.545%0.44863%0.633SS.*Hα-helixtrans-68.9-33.2177.275.20000113Q291 A292 L293 G297 A298 W299Q291-S295 PolarHBondContact O-N 3.02Å; A292-S295 PolarHBondContact O-N 3.48Å; A292-S295 PolarHBondContact O-OG 3.19Å; L293-S295 VanDerWaalsContact C-N 3.32Å; L293-S295 PolarHBondContact O-N 3.21Å; S295-G297 VanDerWaalsContact C-N 3.34Å; S295-G297 PolarHBondContact O-N 2.95Å; S295-A298 PolarHBondContact O-N 3.49Å; S295-W299 VanDerWaalsContact O-CD1 3.32Å
296L54.5Low49.4Very low101 Ų101118.6 Ų118.653%0.52965%0.647SS.*Hα-helixtrans-67.7-30.4178.9-11672.3000113.6A292 L293 A298 W299 T300A292-L296 PolarHBondContact O-N 3.07Å; L293-L296 PolarHBondContact O-N 3.42Å; L296-A298 VanDerWaalsContact C-N 3.3Å; L296-A298 PolarHBondContact O-N 3.36Å; L296-W299 PolarHBondContact O-N 3.46Å; L296-T300 PolarHBondContact O-N 3.46Å; L296-T300 PolarHBondContact O-OG1 3.46Å
297G53.3Low49.2Very low40 Ų40115.8 Ų115.841%0.41264%0.638SS.*Hα-helixtrans-64.6-33178.400000113.4S295 R301S295-G297 VanDerWaalsContact C-N 3.34Å; S295-G297 PolarHBondContact O-N 2.95Å; G297-R301 PolarHBondContact O-N 3.44Å
298A51.4Low49.6Very low68 Ų68112.2 Ų112.256%0.56263%0.629SS**Hα-helixtrans-70.5-38.9178.400000112.4S295 L296 T300 A302S295-A298 PolarHBondContact O-N 3.49Å; L296-A298 VanDerWaalsContact C-N 3.3Å; L296-A298 PolarHBondContact O-N 3.36Å; A298-T300 VanDerWaalsContact C-N 3.34Å; A298-T300 PolarHBondContact O-N 3.07Å; A298-A302 PolarHBondContact O-N 3.1Å
299W44.8Very low49.5Very low184 Ų184113.3 Ų113.370%0.69763%0.63SS**Hα-helixtrans-67-35.5177.1-7677000112.5S295 L296 I303S295-W299 VanDerWaalsContact O-CD1 3.32Å; L296-W299 PolarHBondContact O-N 3.46Å; W299-I303 WeakPolarHBondContact O-CD1 3.38Å; W299-I303 WeakPolarHBondContact O-CG1 3.21Å
300T50.3Low49.6Very low89 Ų89114.9 Ų114.955%0.54663%0.631SS.*Hα-helixtrans-69.8-35-177.7-46.40000112.2L296 A298L296-T300 PolarHBondContact O-N 3.46Å; L296-T300 PolarHBondContact O-OG1 3.46Å; A298-T300 VanDerWaalsContact C-N 3.34Å; A298-T300 PolarHBondContact O-N 3.07Å
301R53.1Low49.8Very low214 Ų214111.7 Ų111.781%0.80863%0.626SS**Hα-helixtrans-74.5-34.9176.7-69.3-168.1-165.5-157.64.5113.4G297 I303 V304G297-R301 PolarHBondContact O-N 3.44Å; R301-I303 VanDerWaalsContact C-N 3.27Å; R301-I303 PolarHBondContact O-N 3.14Å; R301-V304 PolarHBondContact O-N 3.13Å
302A47.5Very low49.5Very low51 Ų51109.7 Ų109.742%0.42162%0.623SS.*Hα-helixtrans-64.3-32.8-179.700000112.5A298 V304 A305 F306A298-A302 PolarHBondContact O-N 3.1Å; A302-V304 VanDerWaalsContact C-N 3.34Å; A302-V304 PolarHBondContact O-N 3.5Å; A302-A305 PolarHBondContact O-N 3.34Å; A302-F306 WeakPolarHBondContact O-CD2 3.01Å
303I46.3Very low49.3Very low119 Ų119113.1 Ų113.161%0.6163%0.631SS**Hα-helixtrans-72.8-24.5-177.7-65.1166.4000112.6W299 R301 A305W299-I303 WeakPolarHBondContact O-CD1 3.38Å; W299-I303 WeakPolarHBondContact O-CG1 3.21Å; R301-I303 VanDerWaalsContact C-N 3.27Å; R301-I303 PolarHBondContact O-N 3.14Å; I303-A305 VanDerWaalsContact C-N 3.33Å
304V50.2Low49Very low124 Ų124112.4 Ų112.475%0.75263%0.63SS**Hα-helixtrans-81.4-15.9179.4179.90000112.1R301 A302R301-V304 PolarHBondContact O-N 3.13Å; A302-V304 VanDerWaalsContact C-N 3.34Å; A302-V304 PolarHBondContact O-N 3.5Å
305A43.4Very low48.8Very low86 Ų86115.6 Ų115.671%0.71163%0.632SS**THydrogen-bonded Turntrans-93.11.5-175.900000114.7A302 I303A302-A305 PolarHBondContact O-N 3.34Å; I303-A305 VanDerWaalsContact C-N 3.33Å
306F40.3Very low48.6Very low247 Ų247120.3 Ų120.3100%1.08365%0.648SS**  trans-112.60174.6-75.6-79.7000111A302A302-F306 WeakPolarHBondContact O-CD2 3.01Å

Retrieved 306 of 306 residues in 526 ms (Link to these results)