A0A077ZGG4_TRITR Loading...

Putative cuticle collagen 2

AlphaFold DB , UniProt , Accession A0A077ZGG4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 377 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
1M75.5Confident91.5Very high185 Ų185122.5 Ų122.591%0.91159%0.594SS**  0-63.30-69.8-165.9-160.800111.6S3 D4 I5M1-S3 PolarHBondContact O-N 3.4Å; M1-D4 WeakPolarHBondContact CA-OD2 3.35Å; M1-D4 PolarHBondContact N-OD2 2.95Å; M1-D4 PolarHBondContact O-N 3.36Å; M1-I5 WeakPolarHBondContact O-CG1 3.48Å; M1-I5 PolarHBondContact O-N 2.92Å
2E89.9Confident91.9Very high145 Ų145124.8 Ų124.868%0.67860%0.599SS**Hα-helixtrans-59.3-43.3179.8-165.2109.812400113D4 I5 R6E2-D4 VanDerWaalsContact C-N 3.34Å; E2-D4 PolarHBondContact O-N 3.24Å; E2-I5 PolarHBondContact O-N 3.23Å; E2-R6 WeakPolarHBondContact O-CG 3.34Å; E2-R6 PolarHBondContact O-N 3.42Å; E2-R6 VanDerWaalsContact O-N 3.1Å
3S90.9Very high92.2Very high85 Ų85122.1 Ų122.159%0.59460%0.595SS**Hα-helixtrans-60.6-39.3176.7500000113.2M1 R6 L7M1-S3 PolarHBondContact O-N 3.4Å; S3-R6 PolarHBondContact O-N 3.1Å; S3-L7 WeakPolarHBondContact O-CB 3.14Å; S3-L7 PolarHBondContact O-N 3.44Å
4D92.6Very high92.5Very high85 Ų85116.9 Ų116.946%0.45558%0.582SS.*Hα-helixtrans-68.3-38.3-179.3-53.7-64.5000111.7M1 E2 L7 K8M1-D4 WeakPolarHBondContact CA-OD2 3.35Å; M1-D4 PolarHBondContact N-OD2 2.95Å; M1-D4 PolarHBondContact O-N 3.36Å; E2-D4 VanDerWaalsContact C-N 3.34Å; E2-D4 PolarHBondContact O-N 3.24Å; D4-L7 PolarHBondContact O-N 3.42Å; D4-K8 WeakPolarHBondContact O-CG 3.32Å; D4-K8 PolarHBondContact O-N 3.02Å
5I92.7Very high92.8Very high112 Ų112120.1 Ų120.157%0.57459%0.586SS**Hα-helixtrans-66.2-46.6176.1-63.7169.2000109.9M1 E2 L7 K8 A9M1-I5 WeakPolarHBondContact O-CG1 3.48Å; M1-I5 PolarHBondContact O-N 2.92Å; E2-I5 PolarHBondContact O-N 3.23Å; I5-L7 VanDerWaalsContact C-N 3.34Å; I5-L7 PolarHBondContact O-N 3.29Å; I5-K8 PolarHBondContact O-N 2.97Å; I5-A9 PolarHBondContact O-N 3.45Å
6R94.1Very high93Very high159 Ų159116.3 Ų116.360%0.658%0.575SS**Hα-helixtrans-59.4-45.3176.3-66.2-71.9-178.7175.5-0.4111.1E2 S3 K8 A9 Y10E2-R6 WeakPolarHBondContact O-CG 3.34Å; E2-R6 PolarHBondContact O-N 3.42Å; E2-R6 VanDerWaalsContact O-N 3.1Å; S3-R6 PolarHBondContact O-N 3.1Å; R6-K8 PolarHBondContact O-N 3.49Å; R6-A9 PolarHBondContact O-N 2.91Å; R6-Y10 WeakPolarHBondContact O-CD2 3.39Å; R6-Y10 PolarHBondContact O-N 3.21Å
7L93.5Very high93.2Very high92 Ų92113 Ų11348%0.48257%0.567SS.*Hα-helixtrans-62.3-41.1178.8-175.563.2000112.3S3 D4 I5 Y10 K11S3-L7 WeakPolarHBondContact O-CB 3.14Å; S3-L7 PolarHBondContact O-N 3.44Å; D4-L7 PolarHBondContact O-N 3.42Å; I5-L7 VanDerWaalsContact C-N 3.34Å; I5-L7 PolarHBondContact O-N 3.29Å; L7-Y10 PolarHBondContact O-N 3.45Å; L7-K11 HydrophobicContact CG-CD 4.42Å; L7-K11 WeakPolarHBondContact O-CB 3.35Å; L7-K11 VanDerWaalsContact O-CG 3.32Å; L7-K11 WeakPolarHBondContact O-CG 3.45Å; L7-K11 PolarHBondContact O-N 3.49Å
8K93.7Very high93.4Very high157 Ų157111.7 Ų111.768%0.68357%0.565SS**Hα-helixtrans-63.4-42.1174.4-74.4175.7-177.1178.10111.8D4 I5 R6 K11 F12D4-K8 WeakPolarHBondContact O-CG 3.32Å; D4-K8 PolarHBondContact O-N 3.02Å; I5-K8 PolarHBondContact O-N 2.97Å; R6-K8 PolarHBondContact O-N 3.49Å; K8-K11 PolarHBondContact O-N 3.25Å; K8-F12 WeakPolarHBondContact O-CB 3.38Å; K8-F12 PolarHBondContact O-N 2.92Å
9A94.2Very high93.6Very high53 Ų53108.6 Ų108.644%0.43856%0.558SS.*Hα-helixtrans-62.9-46.7176.800000111.8I5 R6 K11 F12 V13I5-A9 PolarHBondContact O-N 3.45Å; R6-A9 PolarHBondContact O-N 2.91Å; A9-K11 PolarHBondContact O-N 2.91Å; A9-F12 PolarHBondContact O-N 3.31Å; A9-V13 WeakPolarHBondContact O-CG2 3.43Å; A9-V13 PolarHBondContact O-N 2.97Å
10Y94.6Very high93.8Very high167 Ų167111 Ų11166%0.65557%0.565SS**Hα-helixtrans-61.7-42175.9-80.2-67.2000112.4R6 L7 V13 A14R6-Y10 WeakPolarHBondContact O-CD2 3.39Å; R6-Y10 PolarHBondContact O-N 3.21Å; L7-Y10 PolarHBondContact O-N 3.45Å; Y10-V13 PolarHBondContact O-N 3.39Å; Y10-A14 WeakPolarHBondContact O-CB 3.47Å; Y10-A14 PolarHBondContact O-N 2.88Å
11K95.1Very high94Very high108 Ų108109.1 Ų109.147%0.4756%0.562SS.*Hα-helixtrans-60.7-46174.6-76.7179177.6-176.70111.4L7 K8 A9 V13 A14 Y15L7-K11 HydrophobicContact CG-CD 4.42Å; L7-K11 WeakPolarHBondContact O-CB 3.35Å; L7-K11 VanDerWaalsContact O-CG 3.32Å; L7-K11 WeakPolarHBondContact O-CG 3.45Å; L7-K11 PolarHBondContact O-N 3.49Å; K8-K11 PolarHBondContact O-N 3.25Å; A9-K11 PolarHBondContact O-N 2.91Å; K11-V13 PolarHBondContact O-N 2.99Å; K11-A14 PolarHBondContact O-N 3.41Å; K11-Y15 HydrophobicContact CB-CD2 4.26Å; K11-Y15 HydrophobicContact CB-CE2 4.01Å; K11-Y15 WeakPolarHBondContact O-CB 3.49Å; K11-Y15 WeakPolarHBondContact O-CD2 3.26Å; K11-Y15 PolarHBondContact O-N 2.96Å
12F95.5Very high95Very high149 Ų149104.3 Ų104.365%0.65454%0.543SS*.Hα-helixtrans-59.8-44.8178.3-179-99.5000112.1K8 A9 Y15 S16K8-F12 WeakPolarHBondContact O-CB 3.38Å; K8-F12 PolarHBondContact O-N 2.92Å; A9-F12 PolarHBondContact O-N 3.31Å; F12-Y15 PolarHBondContact O-N 2.98Å; F12-S16 WeakPolarHBondContact O-CB 3.37Å; F12-S16 PolarHBondContact O-N 3.24Å; F12-S16 PolarHBondContact O-OG 3.4Å
13V96.5Very high95.4Very high90 Ų90101.8 Ų101.855%0.54554%0.537SS..Hα-helixtrans-65.1-42177.11750000111.7A9 Y10 K11 S16 S17A9-V13 WeakPolarHBondContact O-CG2 3.43Å; A9-V13 PolarHBondContact O-N 2.97Å; Y10-V13 PolarHBondContact O-N 3.39Å; K11-V13 PolarHBondContact O-N 2.99Å; V13-S16 WeakPolarHBondContact CA-OG 2.95Å; V13-S16 PolarHBondContact O-N 2.88Å; V13-S16 PolarHBondContact O-OG 3.43Å; V13-S17 PolarHBondContact O-N 2.91Å; V13-S17 PolarHBondContact O-OG 3.06Å
14A96.3Very high95.7Very high50 Ų5099.9 Ų99.941%0.41353%0.526SS..Hα-helixtrans-64.9-41.4176.900000112Y10 K11 S17 V18Y10-A14 WeakPolarHBondContact O-CB 3.47Å; Y10-A14 PolarHBondContact O-N 2.88Å; K11-A14 PolarHBondContact O-N 3.41Å; A14-S17 PolarHBondContact O-OG 3.44Å; A14-V18 VanDerWaalsContact O-CG2 3.26Å; A14-V18 WeakPolarHBondContact O-CG2 3.24Å; A14-V18 PolarHBondContact O-N 3.45Å
15Y96.6Very high95.9Very high164 Ų164100 Ų10064%0.64353%0.53SS*.Hα-helixtrans-67.6-39.9176.6-72.1-54.2000112.2K11 F12 V18 A19K11-Y15 HydrophobicContact CB-CD2 4.26Å; K11-Y15 HydrophobicContact CB-CE2 4.01Å; K11-Y15 WeakPolarHBondContact O-CB 3.49Å; K11-Y15 WeakPolarHBondContact O-CD2 3.26Å; K11-Y15 PolarHBondContact O-N 2.96Å; F12-Y15 PolarHBondContact O-N 2.98Å; Y15-V18 PolarHBondContact O-N 2.86Å; Y15-A19 VanDerWaalsContact O-CB 3.24Å; Y15-A19 WeakPolarHBondContact O-CB 3.45Å; Y15-A19 PolarHBondContact O-N 3.1Å
16S96.8Very high96.1Very high59 Ų5999.7 Ų99.741%0.41353%0.527SS..Hα-helixtrans-67.5-39.2177.866.10000111.9F12 V13 A19 F20F12-S16 WeakPolarHBondContact O-CB 3.37Å; F12-S16 PolarHBondContact O-N 3.24Å; F12-S16 PolarHBondContact O-OG 3.4Å; V13-S16 WeakPolarHBondContact CA-OG 2.95Å; V13-S16 PolarHBondContact O-N 2.88Å; V13-S16 PolarHBondContact O-OG 3.43Å; S16-A19 PolarHBondContact O-N 3.5Å; S16-F20 WeakPolarHBondContact O-CB 3.4Å; S16-F20 PolarHBondContact O-N 3.26Å
17S96.4Very high96.2Very high61 Ų6194.7 Ų94.743%0.42752%0.52SS..Hα-helixtrans-63.7-44.5174.762.90000111.9V13 A14 F20 S21V13-S17 PolarHBondContact O-N 2.91Å; V13-S17 PolarHBondContact O-OG 3.06Å; A14-S17 PolarHBondContact O-OG 3.44Å; S17-F20 PolarHBondContact O-N 2.93Å; S17-S21 PolarHBondContact O-N 3.49Å; S17-S21 PolarHBondContact O-OG 3.36Å; S17-S21 VanDerWaalsContact O-OG 3.1Å
18V97.1Very high96.4Very high89 Ų8993.9 Ų93.954%0.53952%0.519SS..Hα-helixtrans-65-44.3177.6172.70000110.8A14 Y15 F20 S21 V22A14-V18 VanDerWaalsContact O-CG2 3.26Å; A14-V18 WeakPolarHBondContact O-CG2 3.24Å; A14-V18 PolarHBondContact O-N 3.45Å; Y15-V18 PolarHBondContact O-N 2.86Å; V18-F20 VanDerWaalsContact C-N 3.33Å; V18-F20 PolarHBondContact O-N 3.44Å; V18-S21 PolarHBondContact O-N 2.93Å; V18-V22 HydrophobicContact CG1-CG2 4.26Å; V18-V22 VanDerWaalsContact O-CG2 3.27Å; V18-V22 WeakPolarHBondContact O-CG2 3.43Å; V18-V22 PolarHBondContact O-N 3.27Å
19A96.9Very high96.5Very high53 Ų5389.7 Ų89.744%0.43851%0.509SS..Hα-helixtrans-60.6-41.9177.500000112.1Y15 S16 V22 T23Y15-A19 VanDerWaalsContact O-CB 3.24Å; Y15-A19 WeakPolarHBondContact O-CB 3.45Å; Y15-A19 PolarHBondContact O-N 3.1Å; S16-A19 PolarHBondContact O-N 3.5Å; A19-V22 PolarHBondContact O-N 3.42Å; A19-T23 WeakPolarHBondContact O-CB 3.27Å; A19-T23 PolarHBondContact O-N 3.39Å; A19-T23 PolarHBondContact O-OG1 3.3Å
20F97.2Very high96.6Very high157 Ų15792.7 Ų92.769%0.68952%0.516SS*.Hα-helixtrans-64.8-44.5176.2-171.9-97.5000111.7S16 S17 V18 V22 T23 A24S16-F20 WeakPolarHBondContact O-CB 3.4Å; S16-F20 PolarHBondContact O-N 3.26Å; S17-F20 PolarHBondContact O-N 2.93Å; V18-F20 VanDerWaalsContact C-N 3.33Å; V18-F20 PolarHBondContact O-N 3.44Å; F20-V22 PolarHBondContact O-N 2.98Å; F20-T23 PolarHBondContact O-N 2.72Å; F20-A24 WeakPolarHBondContact O-CB 3.37Å; F20-A24 PolarHBondContact O-N 2.89Å
21S97.4Very high96.6Very high71 Ų7187.6 Ų87.650%0.49751%0.505SS..Hα-helixtrans-60.9-45175.9-63.10000112.3S17 V18 T23 A24 V25S17-S21 PolarHBondContact O-N 3.49Å; S17-S21 PolarHBondContact O-OG 3.36Å; S17-S21 VanDerWaalsContact O-OG 3.1Å; V18-S21 PolarHBondContact O-N 2.93Å; S21-T23 PolarHBondContact O-N 3.5Å; S21-A24 PolarHBondContact O-N 3.48Å; S21-V25 VanDerWaalsContact O-CG2 3.3Å; S21-V25 WeakPolarHBondContact O-CG2 3.39Å; S21-V25 PolarHBondContact O-N 2.95Å
22V97.5Very high96.6Very high84 Ų8487.7 Ų87.751%0.50951%0.51SS..Hα-helixtrans-62.6-44.3176.9173.30000110.5V18 A19 F20 A24 V25 M26V18-V22 HydrophobicContact CG1-CG2 4.26Å; V18-V22 VanDerWaalsContact O-CG2 3.27Å; V18-V22 WeakPolarHBondContact O-CG2 3.43Å; V18-V22 PolarHBondContact O-N 3.27Å; A19-V22 PolarHBondContact O-N 3.42Å; F20-V22 PolarHBondContact O-N 2.98Å; V22-A24 PolarHBondContact O-N 2.87Å; V22-V25 PolarHBondContact O-N 2.83Å; V22-M26 HydrophobicContact CG1-CG 4.39Å; V22-M26 WeakPolarHBondContact O-CB 3.35Å; V22-M26 VanDerWaalsContact O-CG 3.27Å; V22-M26 WeakPolarHBondContact O-CG 3.3Å; V22-M26 PolarHBondContact O-N 2.99Å
23T97.2Very high96.6Very high93 Ų9383.7 Ų83.757%0.57150%0.499SS*.Hα-helixtrans-63-41.8178.6-54.40000111.5A19 F20 S21 M26 A27A19-T23 WeakPolarHBondContact O-CB 3.27Å; A19-T23 PolarHBondContact O-N 3.39Å; A19-T23 PolarHBondContact O-OG1 3.3Å; F20-T23 PolarHBondContact O-N 2.72Å; S21-T23 PolarHBondContact O-N 3.5Å; T23-M26 PolarHBondContact O-N 3.31Å; T23-A27 WeakPolarHBondContact O-CB 3.35Å; T23-A27 PolarHBondContact O-N 2.9Å
24A97.4Very high96.5Very high44 Ų4486.2 Ų86.236%0.36451%0.507SS..Hα-helixtrans-64-45176.500000112F20 S21 V22 M26 A27 V28F20-A24 WeakPolarHBondContact O-CB 3.37Å; F20-A24 PolarHBondContact O-N 2.89Å; S21-A24 PolarHBondContact O-N 3.48Å; V22-A24 PolarHBondContact O-N 2.87Å; A24-M26 PolarHBondContact O-N 3.46Å; A24-A27 PolarHBondContact O-N 2.91Å; A24-V28 WeakPolarHBondContact O-CG2 3.27Å; A24-V28 PolarHBondContact O-N 3.41Å
25V97.5Very high96.4Very high87 Ų8786.3 Ų86.353%0.52751%0.508SS..Hα-helixtrans-61.5-45.3176172.90000110.6S21 V22 A27 V28 C29S21-V25 VanDerWaalsContact O-CG2 3.3Å; S21-V25 WeakPolarHBondContact O-CG2 3.39Å; S21-V25 PolarHBondContact O-N 2.95Å; V22-V25 PolarHBondContact O-N 2.83Å; V25-A27 PolarHBondContact O-N 3.22Å; V25-V28 PolarHBondContact O-N 3.44Å; V25-C29 WeakPolarHBondContact O-CB 3.47Å; V25-C29 PolarHBondContact O-N 3.22Å; V25-C29 PolarHBondContact O-SG 3.34Å
26M96.8Very high96.4Very high106 Ų10685.5 Ų85.552%0.52250%0.504SS..Hα-helixtrans-62.5-40.6177.1-69.7-58.8-66.600112.4V22 T23 A24 V28 C29 I30V22-M26 HydrophobicContact CG1-CG 4.39Å; V22-M26 WeakPolarHBondContact O-CB 3.35Å; V22-M26 VanDerWaalsContact O-CG 3.27Å; V22-M26 WeakPolarHBondContact O-CG 3.3Å; V22-M26 PolarHBondContact O-N 2.99Å; T23-M26 PolarHBondContact O-N 3.31Å; A24-M26 PolarHBondContact O-N 3.46Å; M26-V28 VanDerWaalsContact C-N 3.34Å; M26-V28 PolarHBondContact O-N 3.19Å; M26-C29 PolarHBondContact O-N 3.43Å; M26-I30 WeakPolarHBondContact O-CD1 3.36Å; M26-I30 VanDerWaalsContact O-CG1 3.25Å; M26-I30 WeakPolarHBondContact O-CG1 3.22Å; M26-I30 PolarHBondContact O-N 2.78Å
27A96.8Very high96.2Very high54 Ų5487.7 Ų87.745%0.44651%0.511SS..Hα-helixtrans-62.2-41.1175.400000112T23 A24 V25 I30 S31T23-A27 WeakPolarHBondContact O-CB 3.35Å; T23-A27 PolarHBondContact O-N 2.9Å; A24-A27 PolarHBondContact O-N 2.91Å; V25-A27 PolarHBondContact O-N 3.22Å; A27-I30 PolarHBondContact O-N 2.97Å; A27-S31 WeakPolarHBondContact O-CB 3.28Å; A27-S31 PolarHBondContact O-N 3.29Å; A27-S31 PolarHBondContact O-OG 2.93Å
28V97Very high96.2Very high75 Ų7592.7 Ų92.746%0.45552%0.522SS..Hα-helixtrans-66.3-43.6174.51740000110.9A24 V25 M26 I30 S31 L32A24-V28 WeakPolarHBondContact O-CG2 3.27Å; A24-V28 PolarHBondContact O-N 3.41Å; V25-V28 PolarHBondContact O-N 3.44Å; M26-V28 VanDerWaalsContact C-N 3.34Å; M26-V28 PolarHBondContact O-N 3.19Å; V28-I30 VanDerWaalsContact C-N 3.26Å; V28-I30 PolarHBondContact O-N 3.33Å; V28-S31 WeakPolarHBondContact CA-OG 3.39Å; V28-S31 PolarHBondContact O-N 3.3Å; V28-S31 PolarHBondContact O-OG 3.47Å; V28-L32 HydrophobicContact CG1-CD1 3.55Å; V28-L32 HydrophobicContact CG1-CG 3.9Å; V28-L32 WeakPolarHBondContact O-CB 3.39Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.48Å; V28-L32 PolarHBondContact O-N 2.96Å
29C96.2Very high96Very high69 Ų6992.6 Ų92.647%0.46652%0.521SS..Hα-helixtrans-63.5-28.5177.4-700000113.5V25 M26 P33V25-C29 WeakPolarHBondContact O-CB 3.47Å; V25-C29 PolarHBondContact O-N 3.22Å; V25-C29 PolarHBondContact O-SG 3.34Å; M26-C29 PolarHBondContact O-N 3.43Å; C29-P33 WeakPolarHBondContact O-CD 2.9Å; C29-P33 VanDerWaalsContact O-CG 3.22Å; C29-P33 WeakPolarHBondContact O-CG 3.25Å
30I95.4Very high95.7Very high116 Ų11693.6 Ų93.660%0.59552%0.517SS*.Hα-helixtrans-83.4-40.7175.9-65.4163.9000111.1M26 A27 V28M26-I30 WeakPolarHBondContact O-CD1 3.36Å; M26-I30 VanDerWaalsContact O-CG1 3.25Å; M26-I30 WeakPolarHBondContact O-CG1 3.22Å; M26-I30 PolarHBondContact O-N 2.78Å; A27-I30 PolarHBondContact O-N 2.97Å; V28-I30 VanDerWaalsContact C-N 3.26Å; V28-I30 PolarHBondContact O-N 3.33Å
31S95.6Very high95.4Very high61 Ų6192 Ų9243%0.42751%0.512SS..Hα-helixtrans-73.6-35.1-177.554.30000113.5A27 V28 M34 A35A27-S31 WeakPolarHBondContact O-CB 3.28Å; A27-S31 PolarHBondContact O-N 3.29Å; A27-S31 PolarHBondContact O-OG 2.93Å; V28-S31 WeakPolarHBondContact CA-OG 3.39Å; V28-S31 PolarHBondContact O-N 3.3Å; V28-S31 PolarHBondContact O-OG 3.47Å; S31-M34 PolarHBondContact O-N 3.46Å; S31-A35 VanDerWaalsContact O-CB 3.3Å; S31-A35 WeakPolarHBondContact O-CB 3.3Å; S31-A35 PolarHBondContact O-N 3.35Å
32L95.2Very high95.1Very high110 Ų11090.8 Ų90.858%0.57650%0.501SS*.Hα-helixtrans-62.5-49.1-179.1-74176.1000113.5V28 M34 A35 Y36V28-L32 HydrophobicContact CG1-CD1 3.55Å; V28-L32 HydrophobicContact CG1-CG 3.9Å; V28-L32 WeakPolarHBondContact O-CB 3.39Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.48Å; V28-L32 PolarHBondContact O-N 2.96Å; L32-M34 VanDerWaalsContact C-N 3.33Å; L32-M34 PolarHBondContact O-N 2.85Å; L32-A35 PolarHBondContact O-N 2.85Å; L32-Y36 WeakPolarHBondContact O-CB 3.26Å; L32-Y36 PolarHBondContact O-N 3.41Å
33P95.7Very high94.6Very high65 Ų6594.7 Ų94.742%0.42251%0.507SS..Hα-helixtrans-64-37.5175.4-22.233.5000112.6C29 Y36 N37C29-P33 WeakPolarHBondContact O-CD 2.9Å; C29-P33 VanDerWaalsContact O-CG 3.22Å; C29-P33 WeakPolarHBondContact O-CG 3.25Å; P33-Y36 PolarHBondContact O-N 3.33Å; P33-N37 WeakPolarHBondContact O-CB 3.32Å; P33-N37 VanDerWaalsContact O-CG 3.24Å; P33-N37 PolarHBondContact O-N 2.92Å; P33-N37 PolarHBondContact O-ND2 3.47Å
34M93.1Very high94.1Very high143 Ų14394 Ų9470%0.70451%0.506SS*.Hα-helixtrans-64.2-45.5177.7-168.2-179.6-172.100111S31 L32 N37 Y38S31-M34 PolarHBondContact O-N 3.46Å; L32-M34 VanDerWaalsContact C-N 3.33Å; L32-M34 PolarHBondContact O-N 2.85Å; M34-N37 PolarHBondContact O-N 3.48Å; M34-Y38 WeakPolarHBondContact O-CB 3.34Å; M34-Y38 PolarHBondContact O-N 2.87Å
35A95.3Very high93.5Very high52 Ų5297.2 Ų97.243%0.4351%0.513SS..Hα-helixtrans-64-42.5174.500000111.7S31 L32 Y38 V39S31-A35 VanDerWaalsContact O-CB 3.3Å; S31-A35 WeakPolarHBondContact O-CB 3.3Å; S31-A35 PolarHBondContact O-N 3.35Å; L32-A35 PolarHBondContact O-N 2.85Å; A35-Y38 PolarHBondContact O-N 3.37Å; A35-V39 WeakPolarHBondContact O-CB 3.34Å; A35-V39 VanDerWaalsContact O-CG2 3.26Å; A35-V39 WeakPolarHBondContact O-CG2 3.47Å; A35-V39 PolarHBondContact O-N 3.22Å
36Y95.8Very high92.7Very high147 Ų14798.5 Ų98.558%0.57652%0.515SS*.Hα-helixtrans-60.4-47.9176.4-177.5-97.2000111.8L32 P33 Y38 V39 Q40L32-Y36 WeakPolarHBondContact O-CB 3.26Å; L32-Y36 PolarHBondContact O-N 3.41Å; P33-Y36 PolarHBondContact O-N 3.33Å; Y36-Y38 VanDerWaalsContact C-N 3.35Å; Y36-Y38 PolarHBondContact O-N 2.87Å; Y36-V39 PolarHBondContact O-N 3.34Å; Y36-Q40 HydrophobicContact CD1-CG 4.23Å; Y36-Q40 HydrophobicContact CE1-CG 3.88Å; Y36-Q40 HydrophobicContact CE2-CG 4.48Å; Y36-Q40 WeakPolarHBondContact O-CB 3.04Å; Y36-Q40 VanDerWaalsContact O-CG 3.3Å; Y36-Q40 WeakPolarHBondContact O-CG 3.08Å; Y36-Q40 PolarHBondContact O-N 2.81Å; Y36-Q40 PolarHBondContact OH-NE2 3.31Å
37N93.4Very high92.2Very high104 Ų10496.5 Ų96.556%0.55651%0.509SS*.Hα-helixtrans-63.4-40.5177.2-73.2-27.3000111.9P33 M34 Q40 H41P33-N37 WeakPolarHBondContact O-CB 3.32Å; P33-N37 VanDerWaalsContact O-CG 3.24Å; P33-N37 PolarHBondContact O-N 2.92Å; P33-N37 PolarHBondContact O-ND2 3.47Å; M34-N37 PolarHBondContact O-N 3.48Å; N37-Q40 PolarHBondContact O-N 2.09Å; N37-H41 WeakPolarHBondContact O-CB 3.26Å; N37-H41 PolarHBondContact O-N 2.82Å
38Y94.8Very high91.4Very high166 Ų16699 Ų9965%0.65151%0.511SS*.Hα-helixtrans-62-48.4175.5-179.4-100.8000111.7M34 A35 Y36 Q40 H41 V42M34-Y38 WeakPolarHBondContact O-CB 3.34Å; M34-Y38 PolarHBondContact O-N 2.87Å; A35-Y38 PolarHBondContact O-N 3.37Å; Y36-Y38 VanDerWaalsContact C-N 3.35Å; Y36-Y38 PolarHBondContact O-N 2.87Å; Y38-Q40 VanDerWaalsContact C-N 3.31Å; Y38-Q40 PolarHBondContact O-N 2.94Å; Y38-H41 PolarHBondContact O-N 2.75Å; Y38-V42 HydrophobicContact CD1-CG2 4.21Å; Y38-V42 HydrophobicContact CD2-CG2 4.46Å; Y38-V42 HydrophobicContact CE1-CG2 3.82Å; Y38-V42 HydrophobicContact CE2-CG2 4.1Å; Y38-V42 WeakPolarHBondContact O-CG2 3.33Å; Y38-V42 PolarHBondContact O-N 3.28Å
39V94.7Very high90.6Very high87 Ų87100.3 Ų100.353%0.52751%0.512SS..Hα-helixtrans-61.5-40.2177.5172.10000111.1A35 Y36 R43A35-V39 WeakPolarHBondContact O-CB 3.34Å; A35-V39 VanDerWaalsContact O-CG2 3.26Å; A35-V39 WeakPolarHBondContact O-CG2 3.47Å; A35-V39 PolarHBondContact O-N 3.22Å; Y36-V39 PolarHBondContact O-N 3.34Å; V39-R43 VanDerWaalsContact O-CB 3.22Å; V39-R43 WeakPolarHBondContact O-CB 3.34Å; V39-R43 PolarHBondContact O-N 3Å
40Q90.4Very high89.8Confident75 Ų75102.5 Ų102.535%0.3552%0.518SS..Hα-helixtrans-65-42.1175.7-71.9-67.3-8.500112.3Y36 N37 Y38 R43 S44Y36-Q40 HydrophobicContact CD1-CG 4.23Å; Y36-Q40 HydrophobicContact CE1-CG 3.88Å; Y36-Q40 HydrophobicContact CE2-CG 4.48Å; Y36-Q40 WeakPolarHBondContact O-CB 3.04Å; Y36-Q40 VanDerWaalsContact O-CG 3.3Å; Y36-Q40 WeakPolarHBondContact O-CG 3.08Å; Y36-Q40 PolarHBondContact O-N 2.81Å; Y36-Q40 PolarHBondContact OH-NE2 3.31Å; N37-Q40 PolarHBondContact O-N 2.09Å; Y38-Q40 VanDerWaalsContact C-N 3.31Å; Y38-Q40 PolarHBondContact O-N 2.94Å; Q40-R43 PolarHBondContact O-N 2.05Å; Q40-S44 WeakPolarHBondContact O-CB 3.44Å; Q40-S44 PolarHBondContact O-N 3.01Å
41H90.7Very high88.9Confident124 Ų124104.6 Ų104.657%0.57452%0.523SS*.Hα-helixtrans-62.4-48.3175.8-175.9-81.3000111.6N37 Y38 R43 S44 Q45N37-H41 WeakPolarHBondContact O-CB 3.26Å; N37-H41 PolarHBondContact O-N 2.82Å; Y38-H41 PolarHBondContact O-N 2.75Å; H41-R43 VanDerWaalsContact C-N 3.34Å; H41-R43 PolarHBondContact O-N 3.38Å; H41-S44 WeakPolarHBondContact O-CB 3.18Å; H41-S44 PolarHBondContact O-N 3.22Å; H41-Q45 PolarHBondContact O-N 3.47Å
42V90.4Very high88.1Confident45 Ų45107.7 Ų107.727%0.27353%0.529SS..Hα-helixtrans-62.6-41.2177.3173.80000111.1Y38 S44 Q45 M46Y38-V42 HydrophobicContact CD1-CG2 4.21Å; Y38-V42 HydrophobicContact CD2-CG2 4.46Å; Y38-V42 HydrophobicContact CE1-CG2 3.82Å; Y38-V42 HydrophobicContact CE2-CG2 4.1Å; Y38-V42 WeakPolarHBondContact O-CG2 3.33Å; Y38-V42 PolarHBondContact O-N 3.28Å; V42-S44 PolarHBondContact O-N 2.92Å; V42-Q45 PolarHBondContact O-N 2.82Å; V42-M46 HydrophobicContact CG1-CG 4.24Å; V42-M46 WeakPolarHBondContact O-CB 3.3Å; V42-M46 VanDerWaalsContact O-CG 3.29Å; V42-M46 WeakPolarHBondContact O-CG 3.5Å; V42-M46 PolarHBondContact O-N 3.06Å
43R87.3Confident87.2Confident166 Ų166105.9 Ų105.963%0.62653%0.525SS*.Hα-helixtrans-61.4-44.3175.6-172.8178.9-178.31711111.3V39 Q40 H41 M46 T47V39-R43 VanDerWaalsContact O-CB 3.22Å; V39-R43 WeakPolarHBondContact O-CB 3.34Å; V39-R43 PolarHBondContact O-N 3Å; Q40-R43 PolarHBondContact O-N 2.05Å; H41-R43 VanDerWaalsContact C-N 3.34Å; H41-R43 PolarHBondContact O-N 3.38Å; R43-M46 PolarHBondContact O-N 3.2Å; R43-T47 VanDerWaalsContact O-CG2 3.27Å; R43-T47 WeakPolarHBondContact O-CG2 3.15Å; R43-T47 PolarHBondContact O-N 2.9Å; R43-T47 PolarHBondContact O-OG1 3.27Å
44S86.5Confident86.5Confident79 Ų79109.6 Ų109.655%0.55254%0.535SS*.Hα-helixtrans-58.7-50176-173.20000111.2Q40 H41 V42 M46 T47 H48Q40-S44 WeakPolarHBondContact O-CB 3.44Å; Q40-S44 PolarHBondContact O-N 3.01Å; H41-S44 WeakPolarHBondContact O-CB 3.18Å; H41-S44 PolarHBondContact O-N 3.22Å; V42-S44 PolarHBondContact O-N 2.92Å; S44-M46 PolarHBondContact O-N 3.4Å; S44-T47 PolarHBondContact O-N 3.38Å; S44-T47 PolarHBondContact O-OG1 2.96Å; S44-H48 PolarHBondContact O-N 2.88Å; S44-H48 VanDerWaalsContact O-N 3.11Å
45Q85.1Confident85.7Confident110 Ų110104.7 Ų104.751%0.51452%0.52SS..Hα-helixtrans-60.2-47.4178.7-170.1178.9-13.300112H41 V42 T47 H48 E49H41-Q45 PolarHBondContact O-N 3.47Å; V42-Q45 PolarHBondContact O-N 2.82Å; Q45-T47 VanDerWaalsContact C-N 3.34Å; Q45-T47 PolarHBondContact O-N 2.78Å; Q45-H48 WeakPolarHBondContact O-CB 3.46Å; Q45-H48 PolarHBondContact O-N 3.49Å; Q45-E49 PolarHBondContact O-N 2.93Å; Q45-E49 VanDerWaalsContact O-N 3.13Å
46M81.5Confident85Confident115 Ų115105.2 Ų105.257%0.56752%0.521SS*.Hα-helixtrans-61.6-39.9177.1-74-70.5-163.800112.3V42 R43 S44 H48 E49 L50V42-M46 HydrophobicContact CG1-CG 4.24Å; V42-M46 WeakPolarHBondContact O-CB 3.3Å; V42-M46 VanDerWaalsContact O-CG 3.29Å; V42-M46 WeakPolarHBondContact O-CG 3.5Å; V42-M46 PolarHBondContact O-N 3.06Å; R43-M46 PolarHBondContact O-N 3.2Å; S44-M46 PolarHBondContact O-N 3.4Å; M46-H48 VanDerWaalsContact C-N 3.29Å; M46-H48 PolarHBondContact O-N 3.06Å; M46-E49 PolarHBondContact O-N 3.36Å; M46-L50 VanDerWaalsContact O-CB 3.26Å; M46-L50 WeakPolarHBondContact O-CB 3.22Å; M46-L50 WeakPolarHBondContact O-CD1 3.38Å; M46-L50 WeakPolarHBondContact O-CG 3.39Å; M46-L50 PolarHBondContact O-N 2.9Å
47T84.6Confident84Confident64 Ų64102.7 Ų102.739%0.39352%0.521SS..Hα-helixtrans-68.6-28.2178.857.50000113.4R43 S44 Q45 K51R43-T47 VanDerWaalsContact O-CG2 3.27Å; R43-T47 WeakPolarHBondContact O-CG2 3.15Å; R43-T47 PolarHBondContact O-N 2.9Å; R43-T47 PolarHBondContact O-OG1 3.27Å; S44-T47 PolarHBondContact O-N 3.38Å; S44-T47 PolarHBondContact O-OG1 2.96Å; Q45-T47 VanDerWaalsContact C-N 3.34Å; Q45-T47 PolarHBondContact O-N 2.78Å; T47-K51 WeakPolarHBondContact O-CG 3.41Å; T47-K51 PolarHBondContact O-N 2.92Å
48H81.2Confident83.3Confident105 Ų105104.6 Ų104.649%0.48652%0.524SS..Hα-helixtrans-65.9-60.3171.5-169.5-98.8000108.7S44 Q45 M46 L50 K51 F52S44-H48 PolarHBondContact O-N 2.88Å; S44-H48 VanDerWaalsContact O-N 3.11Å; Q45-H48 WeakPolarHBondContact O-CB 3.46Å; Q45-H48 PolarHBondContact O-N 3.49Å; M46-H48 VanDerWaalsContact C-N 3.29Å; M46-H48 PolarHBondContact O-N 3.06Å; H48-L50 VanDerWaalsContact C-N 3.31Å; H48-L50 PolarHBondContact O-N 3.04Å; H48-K51 WeakPolarHBondContact O-CB 3.29Å; H48-K51 PolarHBondContact O-N 3.27Å; H48-F52 AromaticContact CD2-CE2 3.57Å; H48-F52 AromaticContact CE1-CD2 3.65Å; H48-F52 AromaticContact CE1-CE2 3.02Å; H48-F52 WeakPolarHBondContact CE1-CE2 3.41Å; H48-F52 AromaticContact CE1-CZ 3.69Å; H48-F52 AromaticContact CG-CD2 3.97Å; H48-F52 AromaticContact CG-CE2 3.66Å; H48-F52 AromaticContact ND1-CD2 3.51Å; H48-F52 AromaticContact ND1-CE2 3.32Å; H48-F52 VanDerWaalsContact ND1-CE2 3.32Å; H48-F52 WeakPolarHBondContact ND1-CE2 3.27Å; H48-F52 AromaticContact NE2-CE2 3.18Å; H48-F52 WeakPolarHBondContact NE2-CE2 3.34Å; H48-F52 AromaticContact NE2-CZ 3.75Å; H48-F52 WeakPolarHBondContact O-CD2 3.33Å; H48-F52 PolarHBondContact O-N 3.35Å
49E79.4Confident82.7Confident103 Ų103101.4 Ų101.448%0.48152%0.519SS..Hα-helixtrans-54.9-42.8179.6-63.4-55.2137.500112.9Q45 M46 K51 F52 C53Q45-E49 PolarHBondContact O-N 2.93Å; Q45-E49 VanDerWaalsContact O-N 3.13Å; M46-E49 PolarHBondContact O-N 3.36Å; E49-K51 VanDerWaalsContact C-N 3.33Å; E49-K51 PolarHBondContact O-N 2.78Å; E49-F52 PolarHBondContact O-N 3.48Å; E49-C53 WeakPolarHBondContact O-CB 3.44Å; E49-C53 PolarHBondContact O-N 3.4Å; E49-C53 PolarHBondContact O-SG 3.23Å
50L80.5Confident81.9Confident115 Ų115101.9 Ų101.960%0.60252%0.517SS*.Hα-helixtrans-63.3-35.5176.8-86.8155.1000113M46 H48 K54M46-L50 VanDerWaalsContact O-CB 3.26Å; M46-L50 WeakPolarHBondContact O-CB 3.22Å; M46-L50 WeakPolarHBondContact O-CD1 3.38Å; M46-L50 WeakPolarHBondContact O-CG 3.39Å; M46-L50 PolarHBondContact O-N 2.9Å; H48-L50 VanDerWaalsContact C-N 3.31Å; H48-L50 PolarHBondContact O-N 3.04Å; L50-K54 WeakPolarHBondContact O-CB 3.14Å; L50-K54 PolarHBondContact O-N 2.85Å
51K76.6Confident81.4Confident160 Ų160105.5 Ų105.570%0.69653%0.532SS*.Hα-helixtrans-69.4-42174.4-78.5176.4-173.9172.70111.2T47 H48 E49 K54 G55T47-K51 WeakPolarHBondContact O-CG 3.41Å; T47-K51 PolarHBondContact O-N 2.92Å; H48-K51 WeakPolarHBondContact O-CB 3.29Å; H48-K51 PolarHBondContact O-N 3.27Å; E49-K51 VanDerWaalsContact C-N 3.33Å; E49-K51 PolarHBondContact O-N 2.78Å; K51-K54 PolarHBondContact O-N 2.92Å; K51-G55 PolarHBondContact O-N 3.4Å
52F77.1Confident80.9Confident126 Ų126102.5 Ų102.555%0.55353%0.525SS*.Hα-helixtrans-62.6-49.1174.7-77-80.9000111.3H48 E49 K54 G55 S56H48-F52 AromaticContact CD2-CE2 3.57Å; H48-F52 AromaticContact CE1-CD2 3.65Å; H48-F52 AromaticContact CE1-CE2 3.02Å; H48-F52 WeakPolarHBondContact CE1-CE2 3.41Å; H48-F52 AromaticContact CE1-CZ 3.69Å; H48-F52 AromaticContact CG-CD2 3.97Å; H48-F52 AromaticContact CG-CE2 3.66Å; H48-F52 AromaticContact ND1-CD2 3.51Å; H48-F52 AromaticContact ND1-CE2 3.32Å; H48-F52 VanDerWaalsContact ND1-CE2 3.32Å; H48-F52 WeakPolarHBondContact ND1-CE2 3.27Å; H48-F52 AromaticContact NE2-CE2 3.18Å; H48-F52 WeakPolarHBondContact NE2-CE2 3.34Å; H48-F52 AromaticContact NE2-CZ 3.75Å; H48-F52 WeakPolarHBondContact O-CD2 3.33Å; H48-F52 PolarHBondContact O-N 3.35Å; E49-F52 PolarHBondContact O-N 3.48Å; F52-K54 PolarHBondContact O-N 3.46Å; F52-G55 PolarHBondContact O-N 2.87Å; F52-S56 WeakPolarHBondContact O-CB 3.47Å; F52-S56 PolarHBondContact O-N 3.49Å
53C78.2Confident80.2Confident73 Ų73103.3 Ų103.349%0.49353%0.525SS..Hα-helixtrans-58.9-45.8176-77.30000112E49 G55 S56 T57E49-C53 WeakPolarHBondContact O-CB 3.44Å; E49-C53 PolarHBondContact O-N 3.4Å; E49-C53 PolarHBondContact O-SG 3.23Å; C53-G55 VanDerWaalsContact C-N 3.32Å; C53-G55 PolarHBondContact O-N 3.36Å; C53-S56 PolarHBondContact O-N 2.97Å; C53-T57 PolarHBondContact O-N 3.42Å; C53-T57 PolarHBondContact O-OG1 3.24Å
54K80Confident79.9Confident143 Ų14399.4 Ų99.462%0.62252%0.52SS*.Hα-helixtrans-65.3-34178.5-171.9173-176.6173.30112.6L50 K51 F52 K58L50-K54 WeakPolarHBondContact O-CB 3.14Å; L50-K54 PolarHBondContact O-N 2.85Å; K51-K54 PolarHBondContact O-N 2.92Å; F52-K54 PolarHBondContact O-N 3.46Å; K54-K58 WeakPolarHBondContact O-CG 3.45Å; K54-K58 PolarHBondContact O-N 3.11Å
55G77.5Confident79.5Confident39 Ų3999.5 Ų99.540%0.40251%0.514SS..Hα-helixtrans-66.6-49.8171.700000111.6K51 F52 C53 T57 K58 D59K51-G55 PolarHBondContact O-N 3.4Å; F52-G55 PolarHBondContact O-N 2.87Å; C53-G55 VanDerWaalsContact C-N 3.32Å; C53-G55 PolarHBondContact O-N 3.36Å; G55-T57 PolarHBondContact O-N 3.5Å; G55-K58 WeakPolarHBondContact O-CB 3.26Å; G55-K58 PolarHBondContact O-N 3.43Å; G55-D59 PolarHBondContact O-N 2.97Å; G55-D59 VanDerWaalsContact O-N 3.11Å
56S78.8Confident79.1Confident63 Ų63101.6 Ų101.644%0.44152%0.518SS..Hα-helixtrans-62.6-41.1-179.6-177.20000112.7F52 C53 K58 D59 I60F52-S56 WeakPolarHBondContact O-CB 3.47Å; F52-S56 PolarHBondContact O-N 3.49Å; C53-S56 PolarHBondContact O-N 2.97Å; S56-K58 VanDerWaalsContact C-N 3.32Å; S56-K58 PolarHBondContact O-N 3.21Å; S56-D59 WeakPolarHBondContact O-CB 3.33Å; S56-D59 PolarHBondContact O-N 2.99Å; S56-I60 VanDerWaalsContact O-CG1 3.29Å; S56-I60 WeakPolarHBondContact O-CG1 3.46Å; S56-I60 PolarHBondContact O-N 3.03Å
57T75.8Confident78.6Confident94 Ų94100.5 Ų100.558%0.57751%0.514SS*.Hα-helixtrans-64.3-36.4176.5-50.80000112.1C53 G55 D59 F61C53-T57 PolarHBondContact O-N 3.42Å; C53-T57 PolarHBondContact O-OG1 3.24Å; G55-T57 PolarHBondContact O-N 3.5Å; T57-D59 VanDerWaalsContact C-N 3.34Å; T57-F61 VanDerWaalsContact O-CB 3.25Å; T57-F61 WeakPolarHBondContact O-CB 3.48Å; T57-F61 PolarHBondContact O-N 3.19Å
58K77.9Confident77.9Confident145 Ų145105.6 Ų105.663%0.6353%0.531SS*.Hα-helixtrans-64.6-42.3175.6-76.7177.7175.3-173.20111.4K54 G55 S56 F61 S62K54-K58 WeakPolarHBondContact O-CG 3.45Å; K54-K58 PolarHBondContact O-N 3.11Å; G55-K58 WeakPolarHBondContact O-CB 3.26Å; G55-K58 PolarHBondContact O-N 3.43Å; S56-K58 VanDerWaalsContact C-N 3.32Å; S56-K58 PolarHBondContact O-N 3.21Å; K58-F61 PolarHBondContact O-N 2.77Å; K58-S62 PolarHBondContact O-N 3.22Å; K58-S62 PolarHBondContact O-OG 3.46Å
59D82.3Confident77.3Confident99 Ų99106 Ų10653%0.52954%0.537SS..Hα-helixtrans-64.1-47.3179.5-16253.1000111.6G55 S56 T57 F61 S62 E63G55-D59 PolarHBondContact O-N 2.97Å; G55-D59 VanDerWaalsContact O-N 3.11Å; S56-D59 WeakPolarHBondContact O-CB 3.33Å; S56-D59 PolarHBondContact O-N 2.99Å; T57-D59 VanDerWaalsContact C-N 3.34Å; D59-F61 VanDerWaalsContact C-N 3.33Å; D59-F61 PolarHBondContact O-N 3.4Å; D59-S62 WeakPolarHBondContact CA-OG 3.18Å; D59-S62 PolarHBondContact O-N 3.13Å; D59-S62 PolarHBondContact O-OG 3.23Å; D59-E63 WeakPolarHBondContact O-CG 3.32Å; D59-E63 PolarHBondContact O-N 2.95Å
60I78.3Confident76.5Confident97 Ų97102.7 Ų102.750%0.49752%0.522SS..Hα-helixtrans-61.1-43.1174.5-64.1164.4000110.8S56 S62 E63 V64S56-I60 VanDerWaalsContact O-CG1 3.29Å; S56-I60 WeakPolarHBondContact O-CG1 3.46Å; S56-I60 PolarHBondContact O-N 3.03Å; I60-S62 VanDerWaalsContact C-N 3.34Å; I60-S62 PolarHBondContact O-N 3.41Å; I60-E63 PolarHBondContact O-N 3.33Å; I60-V64 HydrophobicContact CG2-CG2 4.24Å; I60-V64 WeakPolarHBondContact O-CB 3.34Å; I60-V64 VanDerWaalsContact O-CG2 3.29Å; I60-V64 WeakPolarHBondContact O-CG2 3.18Å; I60-V64 PolarHBondContact O-N 3.37Å
61F79.5Confident75.3Confident151 Ų151102.1 Ų102.166%0.66253%0.525SS*.Hα-helixtrans-65.3-37.2179.4-170-95.9000111.9T57 K58 D59 N65T57-F61 VanDerWaalsContact O-CB 3.25Å; T57-F61 WeakPolarHBondContact O-CB 3.48Å; T57-F61 PolarHBondContact O-N 3.19Å; K58-F61 PolarHBondContact O-N 2.77Å; D59-F61 VanDerWaalsContact C-N 3.33Å; D59-F61 PolarHBondContact O-N 3.4Å; F61-N65 WeakPolarHBondContact O-CB 3.16Å; F61-N65 PolarHBondContact O-N 3.45Å
62S79.6Confident74.3Confident60 Ų6098.9 Ų98.942%0.4252%0.523SS..Hα-helixtrans-66.1-41.7173.341.10000112.8K58 D59 I60 N65 Y66K58-S62 PolarHBondContact O-N 3.22Å; K58-S62 PolarHBondContact O-OG 3.46Å; D59-S62 WeakPolarHBondContact CA-OG 3.18Å; D59-S62 PolarHBondContact O-N 3.13Å; D59-S62 PolarHBondContact O-OG 3.23Å; I60-S62 VanDerWaalsContact C-N 3.34Å; I60-S62 PolarHBondContact O-N 3.41Å; S62-N65 PolarHBondContact O-N 3.02Å; S62-Y66 WeakPolarHBondContact O-CB 3.02Å; S62-Y66 PolarHBondContact O-N 3.19Å
63E76.6Confident73.4Confident62 Ų6296.8 Ų96.829%0.2954%0.536SS..Hα-helixtrans-64.2-47177.5-76-63147.300111.8D59 I60 N65 Y66 L67D59-E63 WeakPolarHBondContact O-CG 3.32Å; D59-E63 PolarHBondContact O-N 2.95Å; I60-E63 PolarHBondContact O-N 3.33Å; E63-N65 VanDerWaalsContact C-N 3.33Å; E63-N65 PolarHBondContact O-N 3.37Å; E63-Y66 WeakPolarHBondContact O-CB 3.41Å; E63-Y66 PolarHBondContact O-N 2.96Å; E63-L67 WeakPolarHBondContact O-CG 3.15Å; E63-L67 PolarHBondContact O-N 3.05Å
64V80.2Confident72.1Confident85 Ų85100.5 Ų100.552%0.51555%0.548SS..Hα-helixtrans-63.7-40.7177.5174.10000111I60 Y66 L67 K68I60-V64 HydrophobicContact CG2-CG2 4.24Å; I60-V64 WeakPolarHBondContact O-CB 3.34Å; I60-V64 VanDerWaalsContact O-CG2 3.29Å; I60-V64 WeakPolarHBondContact O-CG2 3.18Å; I60-V64 PolarHBondContact O-N 3.37Å; V64-Y66 VanDerWaalsContact C-N 3.35Å; V64-L67 PolarHBondContact O-N 3.24Å; V64-K68 WeakPolarHBondContact O-CB 3.43Å; V64-K68 PolarHBondContact O-N 2.78Å
65N78.4Confident70.8Confident80 Ų8099.8 Ų99.843%0.42855%0.547SS..Hα-helixtrans-68.5-35.1176.9-168.653.4000111.9F61 S62 E63 K68 N69F61-N65 WeakPolarHBondContact O-CB 3.16Å; F61-N65 PolarHBondContact O-N 3.45Å; S62-N65 PolarHBondContact O-N 3.02Å; E63-N65 VanDerWaalsContact C-N 3.33Å; E63-N65 PolarHBondContact O-N 3.37Å; N65-K68 PolarHBondContact O-N 3.22Å; N65-N69 PolarHBondContact O-N 3.39Å; N65-N69 PolarHBondContact O-ND2 3.34Å
66Y76.6Confident69.6Low154 Ų154102.4 Ų102.460%0.60457%0.565SS**Hα-helixtrans-63.3-50173.3-179.4-109000110.9S62 E63 V64 K68 N69 I70S62-Y66 WeakPolarHBondContact O-CB 3.02Å; S62-Y66 PolarHBondContact O-N 3.19Å; E63-Y66 WeakPolarHBondContact O-CB 3.41Å; E63-Y66 PolarHBondContact O-N 2.96Å; V64-Y66 VanDerWaalsContact C-N 3.35Å; Y66-K68 VanDerWaalsContact C-N 3.28Å; Y66-K68 PolarHBondContact O-N 2.84Å; Y66-N69 PolarHBondContact O-N 3.23Å; Y66-N69 VanDerWaalsContact O-N 3.13Å; Y66-I70 HydrophobicContact CD1-CD1 4.5Å; Y66-I70 HydrophobicContact CE1-CD1 4.29Å; Y66-I70 WeakPolarHBondContact O-CG1 3.17Å; Y66-I70 PolarHBondContact O-N 3.43Å
67L70.6Confident68Low92 Ų92106.4 Ų106.448%0.48258%0.582SS.*Hα-helixtrans-59.2-36.9177.3-70.8170000112.8E63 V64 N69 I70E63-L67 WeakPolarHBondContact O-CG 3.15Å; E63-L67 PolarHBondContact O-N 3.05Å; V64-L67 PolarHBondContact O-N 3.24Å; L67-N69 VanDerWaalsContact C-N 3.33Å; L67-N69 PolarHBondContact O-N 3.45Å; L67-I70 HydrophobicContact CD2-CD1 3.98Å; L67-I70 PolarHBondContact O-N 3.19Å
68K71.3Confident66.6Low172 Ų172109 Ų10975%0.74858%0.581SS**Hα-helixtrans-68.4-29.7178.6-170.3175.3-179.8-178.80113.3V64 N65 Y66 I70V64-K68 WeakPolarHBondContact O-CB 3.43Å; V64-K68 PolarHBondContact O-N 2.78Å; N65-K68 PolarHBondContact O-N 3.22Å; Y66-K68 VanDerWaalsContact C-N 3.28Å; Y66-K68 PolarHBondContact O-N 2.84Å; K68-I70 VanDerWaalsContact C-N 3.34Å
69N69Low64.8Low112 Ų112107.9 Ų107.960%0.59959%0.586SS**THydrogen-bonded Turntrans-88.80.9179.3-70.4-56000113.4N65 Y66 L67 P71N65-N69 PolarHBondContact O-N 3.39Å; N65-N69 PolarHBondContact O-ND2 3.34Å; Y66-N69 PolarHBondContact O-N 3.23Å; Y66-N69 VanDerWaalsContact O-N 3.13Å; L67-N69 VanDerWaalsContact C-N 3.33Å; L67-N69 PolarHBondContact O-N 3.45Å; N69-P71 WeakPolarHBondContact O-CD 3.37Å
70I62.3Low63.1Low35 Ų35114.5 Ų114.518%0.17960%0.604CS.*SBendtrans-74.1118.1172.6-56.7177.8000107.7Y66 L67 K68 S72Y66-I70 HydrophobicContact CD1-CD1 4.5Å; Y66-I70 HydrophobicContact CE1-CD1 4.29Å; Y66-I70 WeakPolarHBondContact O-CG1 3.17Å; Y66-I70 PolarHBondContact O-N 3.43Å; L67-I70 HydrophobicContact CD2-CD1 3.98Å; L67-I70 PolarHBondContact O-N 3.19Å; K68-I70 VanDerWaalsContact C-N 3.34Å; I70-S72 PolarHBondContact O-N 3.39Å
71P55.3Low61.5Low103 Ų103121 Ų12167%0.66962%0.622SS**  trans-58.6128.4179.822.5-31.2000109.6N69 G73 M74N69-P71 WeakPolarHBondContact O-CD 3.37Å; P71-G73 PolarHBondContact O-N 3.37Å; P71-M74 PolarHBondContact O-N 3.49Å; P71-M74 VanDerWaalsContact O-N 3.17Å
72S55.9Low59.8Low92 Ų92120.6 Ų120.664%0.64362%0.622SS**G310 helixtrans-53.7-13-173.7-49.80000114.8I70 M74 Q75I70-S72 PolarHBondContact O-N 3.39Å; S72-M74 PolarHBondContact O-N 2.95Å; S72-Q75 PolarHBondContact O-N 2.9Å
73G56.6Low58.1Low81 Ų81123.8 Ų123.884%0.83563%0.634SS**G310 helixtrans-65.4-13174.900000115.7P71P71-G73 PolarHBondContact O-N 3.37Å
74M51.7Low56.5Low151 Ų151128.7 Ų128.774%0.74466%0.662SS**G310 helixtrans-114.98.5178.4-148.8-177.5-75.200113.8P71 S72 A76P71-M74 PolarHBondContact O-N 3.49Å; P71-M74 VanDerWaalsContact O-N 3.17Å; S72-M74 PolarHBondContact O-N 2.95Å; M74-A76 VanDerWaalsContact C-N 3.27Å; M74-A76 PolarHBondContact O-N 3.47Å
75Q53.1Low54.5Low128 Ų128127.6 Ų127.660%0.59867%0.669SS**G310 helixtrans-75.2-14.3178.4-72.3-179.2-5.100113.4S72 N77S72-Q75 PolarHBondContact O-N 2.9Å; Q75-N77 VanDerWaalsContact C-N 3.3Å; Q75-N77 PolarHBondContact O-N 3.43Å
76A52.2Low52.4Low94 Ų94131.9 Ų131.978%0.77768%0.68SS**G310 helixtrans-72.8-14-17500000115M74M74-A76 VanDerWaalsContact C-N 3.27Å; M74-A76 PolarHBondContact O-N 3.47Å
77N45.1Very low50.4Low147 Ų147127.5 Ų127.579%0.78668%0.681SS**G310 helixtrans-131.224.5-169.4-97-17.5000116.5Q75 T79Q75-N77 VanDerWaalsContact C-N 3.3Å; Q75-N77 PolarHBondContact O-N 3.43Å; N77-T79 PolarHBondContact O-N 2.85Å
78R45.6Very low48.7Very low148 Ų148130.1 Ų130.156%0.55870%0.701SS**  trans-95.974.1168.2-93.5-173-178.1149.44.2112.1R80R78-R80 PolarHBondContact O-N 3.32Å
79T40.6Very low47Very low122 Ų122125.3 Ų125.375%0.74870%0.7SS**  trans-70.7100.8161200000109.8N77 R81N77-T79 PolarHBondContact O-N 2.85Å; T79-R81 PolarHBondContact O-N 3.08Å
80R46.5Very low45.7Very low239 Ų239126.4 Ų126.490%0.90271%0.713SS**SBendtrans33.26.3149.8-138.6172.685.9154.82.5122.8R78R78-R80 PolarHBondContact O-N 3.32Å
81R44.7Very low44.2Very low233 Ų233128 Ų12888%0.87974%0.739SS**  trans-108.46.2-178.1-81.6-166.9178.4-147.31.2114.9T79T79-R81 PolarHBondContact O-N 3.08Å
82Q42.9Very low43.1Very low142 Ų142130.6 Ų130.666%0.66475%0.752SS**  trans-110.418.8-175.2-146.7-179.2-12.300114.7
83L45.2Very low42Very low127 Ų127129.2 Ų129.267%0.66575%0.752SS**SBendtrans-89.5-5.5173.4-96.8131.1000113.9G85 Y86L83-G85 VanDerWaalsContact C-N 3.29Å; L83-G85 PolarHBondContact O-N 3.36Å; L83-Y86 HydrophobicContact CD2-CE2 4.09Å
84D43.2Very low41.3Very low165 Ų165132.1 Ų132.188%0.88276%0.757SS**SBendtrans-89.738.3179.9-64.7-48.5000113.8
85G37.2Very low40.3Very low63 Ų63128 Ų12865%0.64975%0.753SS**  trans-151.840.7-172.600000115.7L83 G87L83-G85 VanDerWaalsContact C-N 3.29Å; L83-G85 PolarHBondContact O-N 3.36Å; G85-G87 PolarHBondContact O-N 3.19Å
86Y35.6Very low39.2Very low169 Ų169125.8 Ų125.866%0.66377%0.765SS**  trans-86.687.1166.3-73.8-85.9000109.7L83L83-Y86 HydrophobicContact CD2-CE2 4.09Å
87G34.9Very low38.4Very low62 Ų62128.1 Ų128.164%0.63977%0.769SS**  trans-158.3117.6172.200000110.2G85G85-G87 PolarHBondContact O-N 3.19Å
88V34.3Very low37.8Very low148 Ų148124.3 Ų124.390%0.89776%0.764SS**  trans93.375.2173.5-163.50000113.9
89G35Very low37.6Very low70 Ų70123.9 Ų123.972%0.72278%0.78SS**  trans-65.7143.4153.100000110.7
90P42Very low37.3Very low135 Ų135121.3 Ų121.388%0.87778%0.778SS**  trans-90.3120.4179.633.4-28.3000110.4
91G31Very low36.5Very low69 Ų69113.8 Ų113.871%0.71178%0.775SS**  trans146.4102.615700000114.5
92V32.6Very low36.1Very low157 Ų157109.6 Ų109.695%0.95277%0.774SS**  -160.596.8125.2-157.40000105.6
93G32.3Very low35.7Very low63 Ų63105.9 Ų105.965%0.64977%0.774SS**  102.9115.89800000111.5G95G93-G95 PolarHBondContact O-N 3.41Å
94P41.4Very low35.5Very low143 Ų143106.4 Ų106.493%0.92979%0.785SS**  trans-8085.6-17832.3-31.3000110.2
95G31.8Very low35.1Very low64 Ų64102.1 Ų102.166%0.6678%0.781SS**  trans-87.698.8166.700000109.5G93 V97G93-G95 PolarHBondContact O-N 3.41Å; G95-V97 PolarHBondContact O-N 3.4Å
96G29.7Very low34.9Very low82 Ų82102.8 Ų102.885%0.84579%0.787SS**  trans-61.2123.7172.900000111.5
97V34.1Very low34.9Very low143 Ų143101.9 Ų101.987%0.86780%0.799SS**  trans-129.1116.5161.5-107.70000106.2G95G95-V97 PolarHBondContact O-N 3.4Å
98G33.8Very low34.9Very low66 Ų66102.2 Ų102.268%0.6880%0.803SS**  trans-68172.9-16500000115G100G98-G100 PolarHBondContact O-N 3.2Å
99P41.4Very low35.3Very low140 Ų140101.4 Ų101.491%0.90980%0.801SS**  trans-75.789.8-173.231.5-32.5000110.1G101P99-G101 PolarHBondContact O-N 3.21Å; P99-G101 VanDerWaalsContact O-N 3.13Å
100G32.9Very low35Very low68 Ų68102 Ų10270%0.70181%0.807SS**  trans-73.593.7164.100000109.3G98 V102G98-G100 PolarHBondContact O-N 3.2Å; G100-V102 PolarHBondContact O-N 3.41Å
101G30.7Very low34.6Very low80 Ų8099.2 Ų99.283%0.82580%0.803SS**  trans-61.8124.2169.900000110.6P99P99-G101 PolarHBondContact O-N 3.21Å; P99-G101 VanDerWaalsContact O-N 3.13Å
102V36.2Very low34.7Very low145 Ų145103.3 Ų103.388%0.87981%0.813SS**  trans-117.9111167.5-129.20000106.5G100G100-V102 PolarHBondContact O-N 3.41Å
103G34.1Very low34.8Very low64 Ų6499.2 Ų99.266%0.6680%0.803SS**  trans-69.7169.9-173.300000114.1G105G103-G105 PolarHBondContact O-N 2.84Å; G103-G105 VanDerWaalsContact O-N 3.15Å
104P42.6Very low35.4Very low138 Ų138102.7 Ų102.790%0.89681%0.814SS**  trans-78.2102.2-173.331.7-31.1000110.1G106P104-G106 PolarHBondContact O-N 3.45Å
105G34.2Very low34.9Very low76 Ų7699.8 Ų99.878%0.78481%0.809SS**  trans-73.7111.7167.800000109.9G103G103-G105 PolarHBondContact O-N 2.84Å; G103-G105 VanDerWaalsContact O-N 3.15Å
106G33.6Very low34.8Very low77 Ų77100.2 Ų100.279%0.79481%0.814SS**  trans-61.5148.3-17500000115P104P104-G106 PolarHBondContact O-N 3.45Å
107V34.4Very low34.7Very low149 Ų149105.7 Ų105.790%0.90382%0.815SS**  trans-84.7107.3173.7-148.10000107.6
108G34.5Very low34.7Very low70 Ų70105.5 Ų105.572%0.72281%0.814SS**  trans-82.3135.9172.200000111.1
109P42.4Very low35Very low131 Ų131108 Ų10885%0.85182%0.818SS**  trans-93.8151.5177.936.3-30.7000111.6
110G29.9Very low34.5Very low83 Ų83104.8 Ų104.886%0.85681%0.81SS**  trans121.2132.1166.200000112.4
111G32.8Very low34.4Very low76 Ų76104.8 Ų104.878%0.78481%0.81SS**  cis-160.5146.20.900000108.1G113G111-G113 PolarHBondContact O-N 2.95Å
112V33.1Very low34.3Very low155 Ų155108.7 Ų108.794%0.93982%0.818SS**  trans-77.1106.7174.4-99.70000108.6
113G35.8Very low34.2Very low70 Ų70104.5 Ų104.572%0.72280%0.804SS**  trans-98.9133.7165.700000110G111G111-G113 PolarHBondContact O-N 2.95Å
114P43.2Very low34.7Very low137 Ų137108.3 Ų108.389%0.8982%0.817SS**  trans-92.4143.517835.6-29.5000110.7
115G30.9Very low34.1Very low81 Ų81105 Ų10584%0.83581%0.808SS**  trans128.8129.2176.300000109.3
116G29.8Very low34Very low73 Ų73105.3 Ų105.375%0.75381%0.811SS**  cis174.5143.210.900000105
117F28.1Very low34.2Very low198 Ų198108.6 Ų108.687%0.86882%0.815SS**  trans-37.1131174.3-120.5-105.2000114.6
118V34.5Very low34.3Very low138 Ų138104.3 Ų104.384%0.83680%0.802SS**  trans-165.4120.2134.4-104.70000110.4
119P40.9Very low34.7Very low120 Ų120107.5 Ų107.578%0.77981%0.81SS**  trans-89.4103.4170.532.8-25.4000109.5
120G30.4Very low34.4Very low72 Ų72104.7 Ų104.774%0.74281%0.805SS**  trans-115.9125.315600000106
121G30Very low34.6Very low68 Ų68104.1 Ų104.170%0.70180%0.799SS**  88.5132.854.700000108
122V29.3Very low34.6Very low162 Ų162110.1 Ų110.198%0.98280%0.804SS**  trans84.2125.3-178.1-155.90000113.2
123G33.8Very low34.9Very low57 Ų57108.9 Ų108.959%0.58880%0.796SS**  cis176168.6800000107.2G125G123-G125 PolarHBondContact O-N 3.24Å
124P44.2Very low35.2Very low143 Ų143111.1 Ų111.193%0.92980%0.798SS**  trans-8194.4-169.432.5-30.9000110.8
125G31.1Very low34.9Very low69 Ų69108.2 Ų108.271%0.71179%0.793SS**  trans-85.3107.1169.400000110.2G123G123-G125 PolarHBondContact O-N 3.24Å
126G31.4Very low35.1Very low83 Ų83108.2 Ų108.286%0.85679%0.793SS**  trans-60.9134.8172.500000111.7
127V38.4Very low35.7Very low145 Ų145111.7 Ų111.788%0.87980%0.799SS**  trans-124.7123.7167.3-159.90000106.8
128G34.9Very low36.3Very low60 Ų60105.2 Ų105.262%0.61979%0.788SS**  trans-67.6176.5-163.400000116.2G130G128-G130 PolarHBondContact O-N 3.27Å
129P44.8Very low36.9Very low136 Ų136105 Ų10588%0.88379%0.79SS**  trans-75.395.4-171.231.4-32.2000109.9G131P129-G131 VanDerWaalsContact C-N 3.3Å; P129-G131 PolarHBondContact O-N 2.91Å
130G34.9Very low36.7Very low73 Ų73103.1 Ų103.175%0.75379%0.792SS**  trans-67.192.3160.500000108.8G128 F132G128-G130 PolarHBondContact O-N 3.27Å; G130-F132 PolarHBondContact O-N 3.11Å
131G33.5Very low37.1Very low71 Ų71103.5 Ų103.573%0.73280%0.796SS**  trans-61.4101.9174.300000110.5P129 V133P129-G131 VanDerWaalsContact C-N 3.3Å; P129-G131 PolarHBondContact O-N 2.91Å; G131-V133 PolarHBondContact O-N 3.49Å
132F34.1Very low37.6Very low201 Ų201107.3 Ų107.388%0.88281%0.805SS**  trans-81.3109169.1-141.2-94.4000107.8G130 P134G130-F132 PolarHBondContact O-N 3.11Å; F132-P134 WeakPolarHBondContact O-CD 3.5Å
133V38.3Very low38Very low130 Ų130102.5 Ų102.579%0.78879%0.788SS**  trans-72.9115.7177.2-137.40000107.8G131 G135G131-V133 PolarHBondContact O-N 3.49Å; V133-G135 PolarHBondContact O-N 2.96Å
134P42.6Very low38.6Very low117 Ų117106.1 Ų106.176%0.7680%0.801SS**  trans-74.9119.7179.727.8-29.9000109.8F132 G136F132-P134 WeakPolarHBondContact O-CD 3.5Å; P134-G136 PolarHBondContact O-N 3.29Å
135G36.8Very low38.2Very low76 Ų76103.3 Ų103.378%0.78480%0.799SS**  trans-61.2113.817300000110.8V133V133-G135 PolarHBondContact O-N 2.96Å
136G36.2Very low38.4Very low80 Ų80103.1 Ų103.183%0.82580%0.796SS**PPolyproline II helixtrans-77.3120.3172.300000110.6P134P134-G136 PolarHBondContact O-N 3.29Å
137V40.7Very low38.4Very low147 Ų147107.4 Ų107.489%0.89180%0.798SS**PPolyproline II helixtrans-99.6123.3166.2-177.60000107.2
138G40.9Very low38.3Very low62 Ų62103.8 Ų103.864%0.63979%0.79SS**PPolyproline II helixtrans-72.2163.6-167.800000115.5
139P46.9Very low38.6Very low134 Ų134107.1 Ų107.187%0.8780%0.801SS**PPolyproline II helixtrans-81.4123.6-174.231.4-32000111.9G141P139-G141 PolarHBondContact O-N 3.48Å
140G37.6Very low38.2Very low80 Ų80104.5 Ų104.583%0.82580%0.798SS**  trans-72.4109.9167.100000110.7
141G38.3Very low38Very low80 Ų80104.7 Ų104.783%0.82580%0.8SS**PPolyproline II helixtrans-84124.7170.100000111.1P139P139-G141 PolarHBondContact O-N 3.48Å
142V41.1Very low37.9Very low148 Ų148104.7 Ų104.790%0.89780%0.8SS**PPolyproline II helixtrans-98.6130.4170.3-177.30000108.2
143G37.1Very low38Very low60 Ų60101.7 Ų101.762%0.61980%0.801SS**PPolyproline II helixtrans-73.7168.3-170.200000115.8
144P46.3Very low37.5Very low133 Ų133103.9 Ų103.986%0.86480%0.803SS**PPolyproline II helixtrans-87117.9-169.533.2-30.5000111.6
145G36.5Very low37.3Very low85 Ų85105.5 Ų105.588%0.87680%0.803SS**  trans-82.7108.416400000109.8
146G33.9Very low37.3Very low64 Ų64107.1 Ų107.166%0.6680%0.8SS**  trans-85.6140.2-177.200000115
147I33.4Very low37.2Very low173 Ų173110.2 Ų110.289%0.88780%0.803SS**  trans46.6118.4132.1-2.3178000120
148G35.3Very low36.6Very low70 Ų70112.4 Ų112.472%0.72280%0.804SS**  trans-146.1118.9151.800000110
149P41.9Very low36.1Very low129 Ų129112.8 Ų112.884%0.83881%0.808SS**  trans-90.4115179.933-26.9000110
150G35.5Very low35.2Very low81 Ų81110.1 Ų110.184%0.83580%0.804SS**  trans-107.6110.6168.800000109.4
151G31.7Very low35.1Very low77 Ų77113.2 Ų113.279%0.79481%0.807SS**  trans-85.4157.2177.300000113.7
152G30.6Very low34.8Very low71 Ų71115.9 Ų115.973%0.73281%0.807SS**  trans62.9125.3148.600000117.9
153P37.1Very low34.5Very low138 Ų138113.9 Ų113.990%0.89681%0.806SS**  -136152.479.130.2-13.2000114.3
154E27.7Very low34.3Very low177 Ų177114.2 Ų114.283%0.82781%0.809SS**  trans-95.4155.3-176.2-56.7-178.679.400113.1
155I37.1Very low33.6Very low150 Ų150114 Ų11477%0.76981%0.806SS**  trans78.6138.6154-36-162.2000116.1
156P38.2Very low33.6Very low111 Ų111117.2 Ų117.272%0.72180%0.802SS**  cis-130.3149.724.219.95.9000119
157V32.7Very low33.6Very low145 Ų145119.8 Ų119.888%0.87981%0.806SS**  trans-71.7110.9164.1178.30000109.7
158Q28.1Very low33.7Very low193 Ų193115.2 Ų115.290%0.90280%0.802SS**  trans-143.7121.2162.3-98.2-179.430.800108.9
159G30.2Very low33.9Very low70 Ų70120.4 Ų120.472%0.72281%0.808SS**  trans157.480.417700000110.4V161G159-V161 PolarHBondContact O-N 3.31Å
160G29.1Very low33.7Very low77 Ų77118.1 Ų118.179%0.79481%0.808SS**  trans-56.6127.4179.400000111.9T162G160-T162 PolarHBondContact O-N 2.92Å
161V34.5Very low34.2Very low146 Ų146120.2 Ų120.289%0.88580%0.804SS**  trans-76.497.2165.8-73.70000108.1G159 A163G159-V161 PolarHBondContact O-N 3.31Å; V161-A163 PolarHBondContact O-N 3.34Å
162T33.6Very low34.7Very low135 Ų135118 Ų11883%0.82878%0.781SS**  trans-66.2114.8159.742.80000107.1G160 G164G160-T162 PolarHBondContact O-N 2.92Å; T162-G164 PolarHBondContact O-N 3.03Å
163A34.6Very low35.6Very low106 Ų106120.1 Ų120.188%0.87678%0.783SS**  trans-66.179.3172.700000109.4V161V161-A163 PolarHBondContact O-N 3.34Å
164G32Very low36.4Very low67 Ų67121.5 Ų121.569%0.69178%0.778SS**  trans-92.1101.3172.600000109.8T162 I166T162-G164 PolarHBondContact O-N 3.03Å; G164-I166 PolarHBondContact O-N 2.92Å
165T32.2Very low37.9Very low129 Ų129120 Ų12079%0.79178%0.775SS**  trans-2.6106.2157.5-50.10000116.8
166I35.4Very low39Very low153 Ų153115.4 Ų115.479%0.78576%0.756SS**  trans-14.9109.3150.3-16.9175000114.3G164G164-I166 PolarHBondContact O-N 2.92Å
167P35.4Very low40.1Very low117 Ų117111.5 Ų111.576%0.7673%0.731SS**  trans-81.2116147.115.80.2000107.1E169P167-E169 PolarHBondContact O-N 3.4Å
168G34.6Very low41.5Very low78 Ų78110.8 Ų110.880%0.80472%0.721SS**  trans-63.8101.7173.300000110.5
169E38.9Very low43.2Very low178 Ų178105.7 Ų105.783%0.83271%0.705SS**  trans-130.4124.2155.6-125.3159.692.200105.9P167 V171P167-E169 PolarHBondContact O-N 3.4Å; E169-V171 PolarHBondContact O-N 2.98Å
170G39.5Very low44.6Very low82 Ų82103 Ų10385%0.84568%0.678SS**  trans-55.3112.3-159.700000112.9G172G170-G172 PolarHBondContact O-N 2.73Å
171V44.9Very low46.4Very low125 Ų125106.4 Ų106.476%0.75868%0.677SS**  trans-68.185.1165.4-173.60000106.7E169E169-V171 PolarHBondContact O-N 2.98Å
172G42.3Very low48.1Very low29 Ų29103.3 Ų103.330%0.29966%0.66SS.*  trans-59.7154.8171.900000109.5G170 E174 D175G170-G172 PolarHBondContact O-N 2.73Å; G172-E174 PolarHBondContact O-N 3.21Å; G172-D175 PolarHBondContact O-N 3.15Å
173C49.7Very low49.9Very low117 Ų11797.1 Ų97.179%0.79162%0.623SS**G310 helixtrans-59.75.5176.6-59.90000114.5D175 C176C173-D175 VanDerWaalsContact C-N 3.33Å; C173-C176 PolarHBondContact O-N 2.82Å
174E54.2Low51.6Low167 Ų16796.4 Ų96.478%0.7861%0.609SS**G310 helixtrans-59.9-37.7173.2-77.1144.897.800112.4G172 C176 C177G172-E174 PolarHBondContact O-N 3.21Å; E174-C176 PolarHBondContact O-N 3.07Å; E174-C177 PolarHBondContact O-N 3.36Å
175D59.6Low53.4Low144 Ų14497.3 Ų97.377%0.7760%0.603SS**G310 helixtrans-71.3-14.4179.2-77.3-54.7000113.8G172 C173G172-D175 PolarHBondContact O-N 3.15Å; C173-D175 VanDerWaalsContact C-N 3.33Å
176C59.4Low55.4Low54 Ų5491.4 Ų91.437%0.36557%0.567SS.*G310 helixtrans-94.8-6.2-178-116.10000113.6C173 E174 C362C173-C176 PolarHBondContact O-N 2.82Å; E174-C176 PolarHBondContact O-N 3.07Å; C176-C362 HydrophobicContact CB-CB 4.15Å; C176-C362 WeakPolarHBondContact CB-SG 3.36Å; C176-C362 WeakPolarHBondContact SG-CB 3.34Å; C176-C362 CovalentContact SG-SG 2.05Å; C176-C362 PolarHBondContact SG-SG 3.4Å
177C62.2Low57Low30 Ų3088.5 Ų88.520%0.20356%0.558CS.*  trans-97102-177.9-168.20000110.1E174 P179 C225E174-C177 PolarHBondContact O-N 3.36Å; C177-P179 WeakPolarHBondContact O-CD 3.29Å; C177-C225 VanDerWaalsContact SG-SG 3.62Å
178I62.3Low58.6Low130 Ų13086.9 Ų86.967%0.66755%0.55SS**  trans-73.3112.4166.9-55.5179.3000107G180I178-G180 PolarHBondContact O-N 3.35Å
179P62.1Low60.2Low85 Ų8583.6 Ų83.655%0.55252%0.516SS*.PPolyproline II helixtrans-59.7141.3177.5-20.434.3000109.6C177C177-P179 WeakPolarHBondContact O-CD 3.29Å
180G60.3Low61.7Low15 Ų1585.6 Ų85.616%0.15552%0.516CS..PPolyproline II helixtrans-59.115517200000110.9I178 G228 E354I178-G180 PolarHBondContact O-N 3.35Å; G180-G228 WeakPolarHBondContact O-CA 3.49Å; G180-E354 WeakPolarHBondContact CA-O 3.37Å
181L66.9Low62.9Low148 Ų14886.4 Ų86.478%0.77551%0.506SS*.PPolyproline II helixtrans-52.5143178.2-69.9169.3000110.3G183 G353L181-G183 PolarHBondContact O-N 2.99Å; L181-G353 WeakPolarHBondContact O-CA 3.35Å
182P70.1Confident63.7Low81 Ų8180.9 Ų80.953%0.52647%0.474SS..PPolyproline II helixtrans-49.6137.4174.4-25.633.5000110.3
183G72.4Confident64.9Low5 Ų588 Ų885%0.05250%0.497CS..PPolyproline II helixtrans-57.7159.8176.600000111.5L181 G231L181-G183 PolarHBondContact O-N 2.99Å; G183-G231 WeakPolarHBondContact O-CA 3.2Å
184P69.5Low65.7Low91 Ų9186.6 Ų86.659%0.59149%0.486SS*.PPolyproline II helixtrans-55.3149.2174.324.9-33.4000110.5G186P184-G186 PolarHBondContact O-N 3.23Å
185P70.1Confident65.9Low86 Ų8679 Ų7956%0.55845%0.453SS*.PPolyproline II helixtrans-50.7142.7176.4-26.133.9000111.4
186G74.3Confident66Low5 Ų580.4 Ų80.45%0.05245%0.452CS..PPolyproline II helixtrans-58.9159177.400000112.3P184 P232 G234 G350P184-G186 PolarHBondContact O-N 3.23Å; G186-P232 PolarHBondContact N-O 3.47Å; G186-G234 WeakPolarHBondContact O-CA 3.14Å; G186-G350 VanDerWaalsContact CA-CA 3.49Å
187P68.6Low66Low91 Ų9180.9 Ų80.959%0.59146%0.455SS*.PPolyproline II helixtrans-56.1146.8172.726.3-33.8000109.9
188S69.2Low65.6Low84 Ų8480.9 Ų80.959%0.58746%0.46SS*.PPolyproline II helixtrans-51.2144.7178.2-50.50000111.3
189G67.6Low64.9Low8 Ų881.2 Ų81.28%0.08246%0.46CS..PPolyproline II helixtrans-53148.617400000111.7P235 G237 P345G189-P235 PolarHBondContact N-O 3.36Å; G189-P235 VanDerWaalsContact N-O 3.08Å; G189-G237 WeakPolarHBondContact O-CA 3.04Å; G189-P345 WeakPolarHBondContact CA-O 3.49Å
190R69.8Low64.4Low221 Ų22182.7 Ų82.783%0.83447%0.47SS*.PPolyproline II helixtrans-56.8142.6173-71.1-174.5178.3-160.7-0.3108.9
191P66Low63.6Low98 Ų9885.9 Ų85.964%0.63650%0.502SS*.PPolyproline II helixtrans-48.7144.8175.6-27.134.2000111.6
192G62Low62.4Low9 Ų984 Ų849%0.09350%0.497CS..PPolyproline II helixtrans-52.4145.1171.700000110.1Q238 G240 P342G192-Q238 PolarHBondContact N-O 2.98Å; G192-G240 WeakPolarHBondContact O-CA 3.25Å; G192-P342 WeakPolarHBondContact CA-O 3.47Å
193K65.9Low61Low179 Ų17986.1 Ų86.178%0.77851%0.511SS*.PPolyproline II helixtrans-59.6144.4172.8-66.4-178.9179.7-176.60108.5G195K193-G195 PolarHBondContact O-N 3.13Å
194P66.3Low59.3Low87 Ų8789.6 Ų89.657%0.56555%0.547SS*.PPolyproline II helixtrans-48.1143175.4-28.234.7000111.5D241P194-D241 WeakPolarHBondContact CA-O 3.29Å
195G58.9Low57.6Low8 Ų893.4 Ų93.48%0.08256%0.561CS.*PPolyproline II helixtrans-51.5140.1174.600000110K193 D241 G243 L339K193-G195 PolarHBondContact O-N 3.13Å; G195-D241 PolarHBondContact N-O 3.32Å; G195-G243 WeakPolarHBondContact O-CA 3.36Å; G195-L339 WeakPolarHBondContact CA-O 3.48Å
196K61.3Low56Low173 Ų17395.2 Ų95.275%0.75257%0.573SS**PPolyproline II helixtrans-64.5140173.6-67.8-177.9179.4-176.30108.2G198K196-G198 PolarHBondContact O-N 2.92Å
197P60.2Low54.1Low65 Ų6598.7 Ų98.742%0.42261%0.609SS.*PPolyproline II helixtrans-48.7137.4169.3-27.334.7000110.4M199 E244P197-M199 PolarHBondContact O-N 3.38Å; P197-E244 WeakPolarHBondContact CA-O 3.49Å; P197-E244 WeakPolarHBondContact CB-O 3.41Å; P197-E244 HydrophobicContact CG-CB 4.32Å
198G53Low52.6Low30 Ų30103 Ų10331%0.30962%0.624SS.*  trans-51.9112.2-178.100000110.4K196K196-G198 PolarHBondContact O-N 2.92Å
199M49.3Very low51.3Low137 Ų137105 Ų10568%0.67564%0.635SS**PPolyproline II helixtrans-79136.5179.2-77-179.261.300109.5P197 G201P197-M199 PolarHBondContact O-N 3.38Å; M199-G201 PolarHBondContact O-N 3.32Å
200P51Low49.8Very low116 Ų116109.4 Ų109.475%0.75367%0.67SS**PPolyproline II helixtrans-53.5128.8165.2-22.833000109.3T202P200-T202 PolarHBondContact O-N 2.84Å
201G42.6Very low48.5Very low81 Ų81108.3 Ų108.384%0.83567%0.674SS**PPolyproline II helixtrans-52.6123.5-169.900000112.7M199M199-G201 PolarHBondContact O-N 3.32Å
202T42.9Very low47.4Very low108 Ų108108.1 Ų108.166%0.66368%0.681SS**  trans-105.8127.6174.650.50000110P200P200-T202 PolarHBondContact O-N 2.84Å
203P40.1Very low46.5Very low127 Ų127113.1 Ų113.183%0.82571%0.712SS**PPolyproline II helixtrans-55.4142176.8-27.635.8000113.4
204G36.2Very low44.9Very low77 Ų77110.9 Ų110.979%0.79472%0.718SS**PPolyproline II helixtrans-65.2148.8-162.300000116.1
205L33.6Very low43.4Very low172 Ų172115.3 Ų115.390%0.90173%0.731SS**PPolyproline II helixtrans-101.1133.1176.3-73.7165.7000110.8
206P36.7Very low42.8Very low123 Ų123120.1 Ų120.180%0.79976%0.76SS**PPolyproline II helixtrans-72.4146.3174.9-16.331000113.3
207G35.1Very low41.8Very low79 Ų79119 Ų11981%0.81477%0.768SS**PPolyproline II helixtrans-74.8163.3-168.100000116.3
208M37.5Very low40.7Very low182 Ų182122 Ų12290%0.89779%0.785SS**  trans-124.9144.5172.2-63.7-176.982.700110.6
209P41.7Very low40.8Very low126 Ų126126 Ų12682%0.81881%0.805SS**  trans-94.5172.4-167.24.817.1000114.3
210A36.5Very low40.6Very low100 Ų100124.9 Ų124.983%0.82681%0.808SS**  trans-61.4147.3-167.600000116.2
211Q41.7Very low40.3Very low197 Ų197124.1 Ų124.192%0.92180%0.803SS**  trans-129.8139.7160.7-69.5-173.381.200110.2
212A42.4Very low40Very low95 Ų95126.6 Ų126.679%0.78581%0.807SS**  trans-92178.6-15700000113.1
213P43.7Very low40Very low113 Ų113130 Ų13073%0.73481%0.812SS**  trans-94.7160.2-159.237.8-33.2000113.8
214C31.9Very low40.7Very low133 Ų133129.1 Ų129.190%0.89981%0.807SS**  trans-116.5122.7168-60.80000109.8
215E34.5Very low41.3Very low180 Ų180126.9 Ų126.984%0.84178%0.778SS**  trans-102.7-161.7177.1-46-177.8115.300111.8
216P47.1Very low42.5Very low108 Ų108122.8 Ų122.870%0.70176%0.762SS**  -120.8167.8-126.328.2-3000114.2
217V40Very low43.9Very low150 Ų150119.8 Ų119.891%0.90974%0.743SS**  trans-147.5131.1164.5-171.70000111.2
218T37.9Very low45.4Very low128 Ų128116.1 Ų116.179%0.78570%0.704SS**  trans-102.8-156.6-174420000113
219P53.9Low47Very low113 Ų113111.1 Ų111.173%0.73469%0.686SS**  -113.3176.2-96.539.9-22.3000114.8
220P44.7Very low48.5Very low114 Ų114108.9 Ų108.974%0.7467%0.671SS**  -162.5-165.8101.939.4-17.2000114.7
221P45.6Very low50.2Low100 Ų100104.1 Ų104.165%0.64963%0.632SS**  -117.6169.1-53.234.1-17.1000114.3
222C36.9Very low51.7Low134 Ų13498.5 Ų98.591%0.90561%0.613SS**  trans14.4101.1170.1-54.50000119.2
223K42.5Very low53.2Low178 Ų17897.8 Ų97.877%0.77460%0.6SS**  trans-131.2154.9173.6-73.6176.7-173.1169.20110.5
224P55Low54.5Low110 Ų11092.5 Ų92.571%0.71457%0.566SS**SBendtrans-47.2146.4-173.7-27.733.9000113.3P226P224-P226 VanDerWaalsContact O-N 3.14Å
225C48.7Very low56.3Low29 Ų2989.6 Ų89.620%0.19655%0.545CS..SBendtrans-27.3112.1-177.9-68.20000110.3C177 C358C177-C225 VanDerWaalsContact SG-SG 3.62Å; C225-C358 WeakPolarHBondContact CB-SG 3.43Å; C225-C358 WeakPolarHBondContact SG-CB 3.49Å; C225-C358 CovalentContact SG-SG 2.09Å; C225-C358 PolarHBondContact SG-SG 3.11Å
226P59Low58Low87 Ų8784 Ų8457%0.56552%0.524SS*.  trans-59.5137.9-169.121.7-31.1000109P224 G228P224-P226 VanDerWaalsContact O-N 3.14Å; P226-G228 PolarHBondContact O-N 3.41Å
227P65.1Low59.2Low60 Ų6078.9 Ų78.939%0.3949%0.491SS..BIsolated β-bridgetrans-43.2141.7162-29.537.3000110.1A352 G353 K355P227-A352 HydrophobicContact CB-CB 3.61Å; P227-G353 WeakPolarHBondContact CB-O 3.05Å; P227-K355 HydrophobicContact CG-CG 4.28Å
228G67.8Low60.6Low1 Ų179.1 Ų79.11%0.0148%0.483CS..  trans-49.9151.4174.500000111.1G180 P226 G353 E354G180-G228 WeakPolarHBondContact O-CA 3.49Å; P226-G228 PolarHBondContact O-N 3.41Å; G228-G353 PolarHBondContact O-N 3.26Å; G228-E354 PolarHBondContact N-O 2.93Å
229P70.7Confident62.1Low77 Ų7776.8 Ų76.850%0.547%0.47SS..  trans-50.9144-177.522.3-32.8000110.2G231P229-G231 PolarHBondContact O-N 3.43Å
230P72.6Confident62.8Low79 Ų7971.5 Ų71.551%0.51344%0.436SS..  trans-46135.8174.3-28.535.2000110.5P349P230-P349 HydrophobicContact CB-CB 3.92Å
231G73.3Confident63.9Low1 Ų171.7 Ų71.71%0.0143%0.431CS..PPolyproline II helixtrans-53151.3174.600000110.6G183 P229 G350G183-G231 WeakPolarHBondContact O-CA 3.2Å; P229-G231 PolarHBondContact O-N 3.43Å; G231-G350 PolarHBondContact O-N 3.31Å
232P72.8Confident65.1Low79 Ų7970.2 Ų70.251%0.51342%0.421SS..PPolyproline II helixtrans-52149.9179.323.5-33.5000110.7G186 G234G186-P232 PolarHBondContact N-O 3.47Å; P232-G234 PolarHBondContact O-N 2.93Å
233P72.9Confident66.4Low80 Ų8064.1 Ų64.152%0.51938%0.381SS..PPolyproline II helixtrans-47.8137.1175.1-27.434.7000111.1A346P233-A346 HydrophobicContact CB-CB 4.22Å
234G72.1Confident67.5Low1 Ų162.8 Ų62.81%0.0138%0.378CS..PPolyproline II helixtrans-57153.6175.200000110.9G186 P232 G347G186-G234 WeakPolarHBondContact O-CA 3.14Å; P232-G234 PolarHBondContact O-N 2.93Å; G234-G347 PolarHBondContact O-N 3.28Å
235P69.1Low68.1Low72 Ų7262.5 Ų62.547%0.46838%0.376SS..PPolyproline II helixtrans-54.1149.6179.524.1-33.5000111G189G189-P235 PolarHBondContact N-O 3.36Å; G189-P235 VanDerWaalsContact N-O 3.08Å
236P71.3Confident68.6Low62 Ų6262.1 Ų62.140%0.40338%0.377SS..EExtended strand (participates in β ladder)trans-51.9142.8175.7-2533.7000111.7Q343P236-Q343 VanDerWaalsContact CB-CD 3.42Å; P236-Q343 HydrophobicContact CB-CG 3.79Å
237G70.5Confident68.7Low1 Ų166 Ų661%0.0139%0.393CS..EExtended strand (participates in β ladder)trans-59.4155.6178.100000111.6G189 Q343 G344G189-G237 WeakPolarHBondContact O-CA 3.04Å; G237-Q343 WeakPolarHBondContact O-CG 3.34Å; G237-G344 PolarHBondContact N-O 3.01Å; G237-G344 PolarHBondContact O-N 3.27Å
238Q70.8Confident68.4Low155 Ų15567.3 Ų67.372%0.72441%0.409SS*.PPolyproline II helixtrans-58.4151.8175.3-66.5-172.139.900110.9G192G192-Q238 PolarHBondContact N-O 2.98Å
239P69.1Low67.8Low79 Ų7970.3 Ų70.351%0.51344%0.439SS..PPolyproline II helixtrans-50.7144.1171.4-24.734.5000111.1
240G68.2Low66.8Low3 Ų376.7 Ų76.73%0.03146%0.459CS..BIsolated β-bridgetrans-69.5152.1176.100000111.3G192 G341G192-G240 WeakPolarHBondContact O-CA 3.25Å; G240-G341 PolarHBondContact N-O 3.02Å; G240-G341 PolarHBondContact O-N 3.3Å
241D69.1Low65.8Low117 Ų11779.4 Ų79.463%0.62647%0.465SS*.PPolyproline II helixtrans-53.9149.9177.7-63.1-61.4000111.8P194 G195P194-D241 WeakPolarHBondContact CA-O 3.29Å; G195-D241 PolarHBondContact N-O 3.32Å
242P69.9Low64.9Low70 Ų7081.8 Ų81.846%0.45549%0.49SS..PPolyproline II helixtrans-54.3144.1174.5-24.934.6000112.3
243G63.6Low63.6Low6 Ų687.9 Ų87.96%0.06251%0.508CS..BIsolated β-bridgetrans-71.3148.9179.800000112.6G195 G338G195-G243 WeakPolarHBondContact O-CA 3.36Å; G243-G338 PolarHBondContact N-O 3.43Å
244E66.9Low62.5Low150 Ų15089.6 Ų89.670%0.70151%0.513SS*.PPolyproline II helixtrans-58.4144.2179.2-65.5-175.7117.900111.8P197P197-E244 WeakPolarHBondContact CA-O 3.49Å; P197-E244 WeakPolarHBondContact CB-O 3.41Å; P197-E244 HydrophobicContact CG-CB 4.32Å
245P66.2Low61.5Low104 Ų10494.2 Ų94.268%0.67555%0.551SS**PPolyproline II helixtrans-56.3140.1178.3-25.634.1000113
246G60.6Low60.4Low21 Ų2198.6 Ų98.622%0.21657%0.57CS.*PPolyproline II helixtrans-62.7143.917900000113.3
247N59.6Low59.5Low169 Ų169101.3 Ų101.390%0.90459%0.587SS**PPolyproline II helixtrans-62.8141178.2-73.4-49.1000112.2
248A59.1Low58.8Low87 Ų87104.3 Ų104.372%0.71962%0.618SS**PPolyproline II helixtrans-59.5142.1-179.100000112.9
249G56.2Low58Low63 Ų63102.9 Ų102.965%0.64962%0.623SS**PPolyproline II helixtrans-59.3144.1178.100000113.1
250K50.1Low57.6Low212 Ų212105.2 Ų105.292%0.92264%0.637SS**PPolyproline II helixtrans-68.9137.8-179.7-66-174.3178.9-176.20111
251Q50.7Low57.1Low135 Ų135108.1 Ų108.163%0.63167%0.667SS**PPolyproline II helixtrans-57136.9179.7-179.5172.5-22.200111.9
252G53.4Low56.4Low52 Ų52108.9 Ų108.954%0.53668%0.679SS.*PPolyproline II helixtrans-60.1143175.600000112.1
253K45.9Very low56Low207 Ų207114.3 Ų114.390%0.970%0.698SS**PPolyproline II helixtrans-75.8130.2-175.4-43.9176.6-176.2176.30109
254D50.1Low55.9Low116 Ų116116.7 Ų116.762%0.6272%0.723SS**PPolyproline II helixtrans-56.9142.3-179.9-63.6-56.6000112
255A51.6Low55.4Low98 Ų98115.4 Ų115.481%0.8173%0.727SS**PPolyproline II helixtrans-69.8140.2177.800000111.3
256L45.9Very low55.3Low163 Ų163116.6 Ų116.685%0.85374%0.735SS**PPolyproline II helixtrans-65.3145.9-179.7-68169.9000111.5
257P52.3Low55.3Low120 Ų120118.7 Ų118.778%0.77976%0.757SS**PPolyproline II helixtrans-55.1140.8175.1-24.433.9000112.5
258G54.9Low55.2Low64 Ų64116.6 Ų116.666%0.6675%0.752SS**PPolyproline II helixtrans-66.7157.6179.700000113.2
259P55.2Low55.5Low125 Ų125118.4 Ų118.481%0.81276%0.757SS**PPolyproline II helixtrans-66.8153.5-178.727.7-34.2000112.7
260P59.4Low55.7Low127 Ų127119 Ų11983%0.82576%0.763SS**PPolyproline II helixtrans-57.3146.9176.1-23.933.9000113.3
261G59.6Low55.9Low64 Ų64117.2 Ų117.266%0.6676%0.763SS**PPolyproline II helixtrans-68.1158.2179.600000113.6
262P54Low56.3Low133 Ų133115.5 Ų115.586%0.86477%0.772SS**PPolyproline II helixtrans-67.9151.9179.928.1-34.1000112.8
263Q60.6Low56.7Low184 Ų184116.1 Ų116.186%0.8678%0.778SS**PPolyproline II helixtrans-61.1137.1179-174.3174.331.500111.9
264G61Low57.1Low56 Ų56112.7 Ų112.758%0.57778%0.777SS**PPolyproline II helixtrans-67.4156.9178.300000113.8
265P57.2Low57.5Low123 Ų123116.5 Ų116.580%0.79979%0.791SS**PPolyproline II helixtrans-68.5156-176.727.7-34.4000113.2
266P64.2Low57.9Low129 Ų129115 Ų11584%0.83879%0.786SS**PPolyproline II helixtrans-58.7144.6177.3-23.433.7000113.4
267G60.4Low58.3Low65 Ų65112.7 Ų112.767%0.6778%0.783SS**PPolyproline II helixtrans-67.1157.9178.700000113.7
268P57.6Low58.7Low125 Ų125113.1 Ų113.181%0.81279%0.785SS**PPolyproline II helixtrans-68155.5-177.527.6-34.1000112.9
269P64.3Low59Low125 Ų125113.5 Ų113.581%0.81279%0.79SS**PPolyproline II helixtrans-58144.9177.3-23.733.8000113.3
270G60.7Low58.8Low76 Ų76115.3 Ų115.378%0.78479%0.792SS**PPolyproline II helixtrans-63.9152.4177.500000113.1
271L54.3Low58.6Low175 Ų175115 Ų11592%0.91679%0.791SS**PPolyproline II helixtrans-68.8146.9-179.5-62.4175.9000111.6
272A60.2Low58.5Low99 Ų99115.7 Ų115.782%0.81880%0.797SS**PPolyproline II helixtrans-60.5141.2177.100000111.3
273G60.6Low58Low65 Ų65115.7 Ų115.767%0.6780%0.795SS**PPolyproline II helixtrans-65.8154.2179.600000112.6
274P55.9Low57.4Low135 Ų135113.1 Ų113.188%0.87779%0.794SS**PPolyproline II helixtrans-65.8148-18027.3-33.5000112.2
275E58.7Low57Low195 Ų195115.3 Ų115.391%0.91181%0.807SS**PPolyproline II helixtrans-62139.7178.5-169.5173.1175.900111.5
276G60.1Low56.3Low68 Ų68116 Ų11670%0.70181%0.809SS**PPolyproline II helixtrans-65.8142.5-177.600000112.5
277S53.2Low55Low114 Ų114114.1 Ų114.180%0.79780%0.804SS**PPolyproline II helixtrans-68.2139.6178.647.10000112.1
278P60.4Low54.4Low128 Ų128117 Ų11783%0.83181%0.811SS**PPolyproline II helixtrans-57.7142177.7-25.134.1000113.3
279G61.4Low54.1Low73 Ų73116.8 Ų116.875%0.75381%0.809SS**PPolyproline II helixtrans-67.8151.1-177.700000114.1
280D51.3Low53.3Low162 Ų162116 Ų11687%0.86680%0.804SS**PPolyproline II helixtrans-67.3138.5-176.2-70.2-55.2000112.9
281P55.2Low52.7Low122 Ų122119 Ų11979%0.79281%0.807SS**PPolyproline II helixtrans-61.9135.9178.2-24.234.1000113.8
282G57.2Low52.3Low77 Ų77116.8 Ų116.879%0.79480%0.803SS**PPolyproline II helixtrans-60.1142.8-178.500000114.4
283T44.6Very low52Low134 Ų134115.6 Ų115.682%0.82280%0.8SS**PPolyproline II helixtrans-70.1139.4-177.248.80000112.9
284P47.3Very low51.7Low129 Ų129121.5 Ų121.584%0.83881%0.81SS**PPolyproline II helixtrans-74.5125.8-174.8-11.627000113.1
285A51.6Low51.9Low102 Ų102121 Ų12184%0.84381%0.807SS**PPolyproline II helixtrans-91.7137.8168.300000111.3
286V42.4Very low52.1Low139 Ų139115.2 Ų115.284%0.84280%0.8SS**  trans-76.5115.9-173.6173.70000111.7
287A38.3Very low51.8Low88 Ų88120.8 Ų120.873%0.72781%0.808SS**SBendtrans58.9154.3151.800000121.2
288P48.3Very low52.1Low127 Ų127121.3 Ų121.383%0.82581%0.808SS**  cis-112179.9-37.137.6-20.7000112.4
289P49.5Very low52.3Low120 Ų120118.7 Ų118.778%0.77980%0.804SS**  trans-109.3-169.8-139.445-40.4000116.4
290P47.7Very low51.7Low108 Ų108123.1 Ų123.170%0.70181%0.811SS**  cis-130.3147.8-25.528.2-8.4000114.9
291V49Very low52Low139 Ų139121 Ų12184%0.84281%0.809SS**  trans-146.1116.3140.4-99.30000107.6
292P46.5Very low52.2Low129 Ų129118.1 Ų118.184%0.83880%0.801SS**PPolyproline II helixtrans-59.3137.1176.2-25.235.2000112.3
293G53.2Low52Low73 Ų73120.1 Ų120.175%0.75380%0.8SS**PPolyproline II helixtrans-73.9160.2-170.200000115.6
294E54.7Low52.8Low189 Ų189119.8 Ų119.888%0.88380%0.8SS**PPolyproline II helixtrans-78.9132.6165.1-63.7-174.5116.700108.8G296E294-G296 PolarHBondContact O-N 3.22Å
295P60.3Low53.4Low125 Ų125116.7 Ų116.781%0.81279%0.791SS**PPolyproline II helixtrans-53.7130.9170.9-24.734.1000110.2E297P295-E297 PolarHBondContact O-N 3.26Å
296G62.8Low53.4Low73 Ų73118 Ų11875%0.75379%0.791SS**PPolyproline II helixtrans-56.6136175.100000110.4E294E294-G296 PolarHBondContact O-N 3.22Å
297E53.5Low54.3Low186 Ų186120.5 Ų120.587%0.86979%0.794SS**PPolyproline II helixtrans-56.3141.1179.2-67.8-177.9114.400110.5P295 G299P295-E297 PolarHBondContact O-N 3.26Å; E297-G299 PolarHBondContact O-N 3.4Å
298P59.4Low55.3Low125 Ų125118.9 Ų118.981%0.81279%0.785SS**PPolyproline II helixtrans-51.8128.9174.5-25.333.9000110.4D300P298-D300 PolarHBondContact O-N 2.99Å
299G63.3Low55.5Low72 Ų72118.4 Ų118.474%0.74278%0.783SS**PPolyproline II helixtrans-57.6139.217700000110.8E297 S301E297-G299 PolarHBondContact O-N 3.4Å; G299-S301 PolarHBondContact O-N 3.22Å
300D49.3Very low56.1Low166 Ų166118.8 Ų118.889%0.88879%0.785SS**PPolyproline II helixtrans-52.1140178.3-78.5-47.6000111.2P298 G302P298-D300 PolarHBondContact O-N 2.99Å; D300-G302 PolarHBondContact O-N 3.29Å; D300-G302 VanDerWaalsContact O-N 3.16Å
301S57.4Low56.6Low118 Ų118117 Ų11783%0.82579%0.786SS**PPolyproline II helixtrans-52.7123.5175.4-64.60000109.5G299G299-S301 PolarHBondContact O-N 3.22Å
302G60.1Low56.6Low61 Ų61115.5 Ų115.563%0.62978%0.782SS**PPolyproline II helixtrans-54.1145.5176.100000110.8D300D300-G302 PolarHBondContact O-N 3.29Å; D300-G302 VanDerWaalsContact O-N 3.16Å
303P52.9Low57.2Low119 Ų119115 Ų11577%0.77378%0.779SS**PPolyproline II helixtrans-56.3147.9-179.523.1-32.9000110.6G305P303-G305 PolarHBondContact O-N 3.26Å
304P61.8Low57.4Low127 Ų127114.6 Ų114.683%0.82577%0.774SS**PPolyproline II helixtrans-48.7129176.8-26.833.7000110.6
305G59.9Low57.2Low64 Ų64117.2 Ų117.266%0.6678%0.776SS**PPolyproline II helixtrans-54.4148.5177.400000110.9P303 Q307P303-G305 PolarHBondContact O-N 3.26Å; G305-Q307 PolarHBondContact O-N 3.24Å
306P51.8Low57.1Low129 Ų129118.9 Ų118.984%0.83878%0.778SS**PPolyproline II helixtrans-55.5143-179.723.5-32.9000110.4G308P306-G308 PolarHBondContact O-N 2.8Å; P306-G308 VanDerWaalsContact O-N 3.12Å
307Q60.9Low56.8Low193 Ų193118.6 Ų118.690%0.90278%0.776SS**PPolyproline II helixtrans-48.1121.9175.7-177176.716.600109.1G305G305-Q307 PolarHBondContact O-N 3.24Å
308G59.2Low56.8Low53 Ų53118.6 Ų118.655%0.54678%0.775SS.*PPolyproline II helixtrans-54.4147.1176.700000110.5P306P306-G308 PolarHBondContact O-N 2.8Å; P306-G308 VanDerWaalsContact O-N 3.12Å
309P53.1Low56.7Low118 Ų118118.5 Ų118.577%0.76678%0.775SS**PPolyproline II helixtrans-54.6146.1-179.322.9-32.8000110.4G311P309-G311 PolarHBondContact O-N 3.25Å
310P61.7Low56.3Low127 Ų127118.2 Ų118.283%0.82577%0.772SS**PPolyproline II helixtrans-49.2131.6176.8-2633.3000110.2S312P310-S312 PolarHBondContact O-N 3.47Å
311G57Low56.3Low70 Ų70119.5 Ų119.572%0.72277%0.772SS**PPolyproline II helixtrans-51.9138.4176.100000109.9P309P309-G311 PolarHBondContact O-N 3.25Å
312S49.3Very low56.1Low108 Ų108123.1 Ų123.176%0.75577%0.773SS**PPolyproline II helixtrans-50.3137.7176.248.30000109.8P310 G314P310-S312 PolarHBondContact O-N 3.47Å; S312-G314 PolarHBondContact O-N 2.9Å
313P59.8Low55.9Low119 Ų119122.6 Ų122.677%0.77377%0.768SS**PPolyproline II helixtrans-47131.4175.7-27.534.1000110.1R315P313-R315 PolarHBondContact O-N 3.45Å
314G57.1Low55.5Low64 Ų64123.1 Ų123.166%0.6677%0.771SS**PPolyproline II helixtrans-51.9136.6174.500000109S312 D316S312-G314 PolarHBondContact O-N 2.9Å; G314-D316 PolarHBondContact O-N 3.42Å
315R51.3Low54.9Low244 Ų244124.2 Ų124.292%0.92177%0.765SS**PPolyproline II helixtrans-52.3136175.1-77.7-177145.8173.2-6.3108.7P313 G317P313-R315 PolarHBondContact O-N 3.45Å; R315-G317 PolarHBondContact O-N 3.22Å
316D58Low54.6Low160 Ų160123.6 Ų123.686%0.85676%0.759SS**PPolyproline II helixtrans-47.5127.8173.5-64.9-38.9000108.4G314 E318G314-D316 PolarHBondContact O-N 3.42Å; D316-E318 PolarHBondContact O-N 3.3Å
317G56Low54.3Low68 Ų68123.5 Ų123.570%0.70176%0.758SS**PPolyproline II helixtrans-54.9135.617700000108.9R315R315-G317 PolarHBondContact O-N 3.22Å
318E52.9Low53.9Low185 Ų185122.4 Ų122.486%0.86475%0.75SS**PPolyproline II helixtrans-52137.3177-70.7-170.9102.800109.2D316 G320D316-E318 PolarHBondContact O-N 3.3Å; E318-G320 PolarHBondContact O-N 2.98Å; E318-G320 VanDerWaalsContact O-N 3.11Å
319P57.7Low53.6Low123 Ų123122.4 Ų122.480%0.79975%0.75SS**PPolyproline II helixtrans-49.8125.3177.5-26.533.8000109.4E321P319-E321 PolarHBondContact O-N 3.45Å
320G56.2Low53.2Low66 Ų66125.9 Ų125.968%0.6876%0.757SS**PPolyproline II helixtrans-51.2135178.400000109.6E318 K322E318-G320 PolarHBondContact O-N 2.98Å; E318-G320 VanDerWaalsContact O-N 3.11Å; G320-K322 PolarHBondContact O-N 2.66Å
321E48.3Very low52.8Low193 Ų193130.5 Ų130.590%0.90276%0.757SS**PPolyproline II helixtrans-50.1133.2-179.1-70.1-167.4124.300109.6P319 G323P319-E321 PolarHBondContact O-N 3.45Å; E321-G323 PolarHBondContact O-N 3.48Å
322K53.5Low52.8Low195 Ų195128.8 Ų128.885%0.84874%0.74SS**  trans-51.3114.8177-179-179.2177.6-178.40107.4G320G320-K322 PolarHBondContact O-N 2.66Å
323G55.1Low52.9Low50 Ų50129.3 Ų129.352%0.51574%0.741SS.*PPolyproline II helixtrans-49.2141.3176.500000109.7E321 Q325E321-G323 PolarHBondContact O-N 3.48Å; G323-Q325 PolarHBondContact O-N 3.48Å
324P45.4Very low52.8Low129 Ų129129.5 Ų129.584%0.83874%0.742SS**PPolyproline II helixtrans-51.8138.8-175.621.1-32.3000109.5G326P324-G326 PolarHBondContact O-N 3.32Å
325Q49.5Very low52.9Low151 Ų151128.2 Ų128.271%0.70673%0.729SS**PPolyproline II helixtrans-49.9120176-178.6173.430.700107.8G323G323-Q325 PolarHBondContact O-N 3.48Å
326G53.2Low53.1Low50 Ų50124.9 Ų124.952%0.51572%0.724SS.*PPolyproline II helixtrans-51.7141.217600000109.1P324 K328P324-G326 PolarHBondContact O-N 3.32Å; G326-K328 PolarHBondContact O-N 3.13Å
327P44.9Very low53.3Low128 Ų128124.4 Ų124.483%0.83172%0.716SS**PPolyproline II helixtrans-52.2135.6-17721.8-32.5000109.4G329P327-G329 PolarHBondContact O-N 3.37Å
328K52.5Low53.5Low169 Ų169121.3 Ų121.374%0.73569%0.685SS**PPolyproline II helixtrans-49.5119175.9-179.1176.6-178172.70107.5G326 E330G326-K328 PolarHBondContact O-N 3.13Å; K328-E330 PolarHBondContact O-N 3.24Å
329G53.1Low54Low53 Ų53119.5 Ų119.555%0.54668%0.68SS.*PPolyproline II helixtrans-48.7132.4177.600000109.4P327 R331P327-G329 PolarHBondContact O-N 3.37Å; G329-R331 PolarHBondContact O-N 3.21Å
330E46Very low54.6Low192 Ų192117.8 Ų117.890%0.89767%0.669SS**PPolyproline II helixtrans-52.8138.3-176.5-67.1-172.1148.700109.7K328 G332K328-E330 PolarHBondContact O-N 3.24Å; E330-G332 PolarHBondContact O-N 3.39Å
331R52.4Low55Low223 Ų223114.8 Ų114.884%0.84264%0.638SS**PPolyproline II helixtrans-57.1117.9174.4-178.4-173.7-66.1-161.9-0.3106.3G329G329-R331 PolarHBondContact O-N 3.21Å
332G55.9Low56Low35 Ų35110.7 Ų110.736%0.36163%0.628SS.*PPolyproline II helixtrans-50.7143.5173.400000109.7E330E330-G332 PolarHBondContact O-N 3.39Å
333P53.4Low56.8Low119 Ų119107.4 Ų107.477%0.77362%0.616SS**PPolyproline II helixtrans-53.2147.5-177.422.4-32.8000110.3G335P333-G335 PolarHBondContact O-N 3.02Å
334P57.5Low57.5Low122 Ų122105.2 Ų105.279%0.79259%0.593SS**PPolyproline II helixtrans-48134.8169.8-24.233.4000109.4E336P334-E336 PolarHBondContact O-N 3.17Å
335G57.5Low58.8Low37 Ų37104.1 Ų104.138%0.38159%0.586SS.*PPolyproline II helixtrans-54.6141.1174.500000109.6P333 E337P333-G335 PolarHBondContact O-N 3.02Å; G335-E337 PolarHBondContact O-N 2.8Å
336E57.5Low59.9Low175 Ų17599.6 Ų99.682%0.81858%0.575SS**PPolyproline II helixtrans-54.9140.9177.3-63.6-171.2120.900109.9P334 G338P334-E336 PolarHBondContact O-N 3.17Å; E336-G338 PolarHBondContact O-N 3.41Å
337E61.6Low60.8Low150 Ų15097.4 Ų97.470%0.70155%0.552SS**PPolyproline II helixtrans-53.8129177-169.7175.3175.500109G335 L339G335-E337 PolarHBondContact O-N 2.8Å; E337-L339 PolarHBondContact O-N 3.25Å
338G60Low62.1Low3 Ų395.4 Ų95.43%0.03154%0.539CS..BIsolated β-bridgetrans-59.6126.9-177.500000109.7G243 E336G243-G338 PolarHBondContact N-O 3.43Å; E336-G338 PolarHBondContact O-N 3.41Å
339L64Low63.1Low146 Ų14691.2 Ų91.276%0.76453%0.529SS*.PPolyproline II helixtrans-50.9142178.9-66.1175.5000110.5G195 E337 G341G195-L339 WeakPolarHBondContact CA-O 3.48Å; E337-L339 PolarHBondContact O-N 3.25Å; L339-G341 PolarHBondContact O-N 3.4Å
340P68.5Low64.1Low87 Ų8789 Ų8957%0.56551%0.506SS*.PPolyproline II helixtrans-48.8136.4173.6-27.434.3000110.8
341G65.5Low65.3Low3 Ų384 Ų843%0.03149%0.49CS..BIsolated β-bridgetrans-56.2144.8178.600000110.4G240 L339G240-G341 PolarHBondContact N-O 3.02Å; G240-G341 PolarHBondContact O-N 3.3Å; L339-G341 PolarHBondContact O-N 3.4Å
342P69Low66.2Low108 Ų10876.2 Ų76.270%0.70147%0.473SS*.PPolyproline II helixtrans-55.3148.117925.1-34.1000110.3G192 G344G192-P342 WeakPolarHBondContact CA-O 3.47Å; P342-G344 PolarHBondContact O-N 3.35Å
343Q70.6Confident66.8Low125 Ų12574.9 Ų74.958%0.58446%0.459SS*.PPolyproline II helixtrans-51.1132.4177.5-165.7172.632.200110P236 G237P236-Q343 VanDerWaalsContact CB-CD 3.42Å; P236-Q343 HydrophobicContact CB-CG 3.79Å; G237-Q343 WeakPolarHBondContact O-CG 3.34Å
344G70.4Confident67.4Low4 Ų477.4 Ų77.44%0.04146%0.461CS..EExtended strand (participates in β ladder)trans-59.1149.1178.300000111G237 P342G237-G344 PolarHBondContact N-O 3.01Å; G237-G344 PolarHBondContact O-N 3.27Å; P342-G344 PolarHBondContact O-N 3.35Å
345P71.3Confident67.4Low106 Ų10678.8 Ų78.869%0.68846%0.455SS*.EExtended strand (participates in β ladder)trans-56.7154.8177.225.9-34000110.7G189G189-P345 WeakPolarHBondContact CA-O 3.49Å
346A72.8Confident67.4Low57 Ų5777.4 Ų77.447%0.47144%0.441SS..EExtended strand (participates in β ladder)trans-51.3142.6172.800000110.7P233P233-A346 HydrophobicContact CB-CB 4.22Å
347G72.2Confident67.1Low4 Ų475.9 Ų75.94%0.04144%0.437CS..PPolyproline II helixtrans-60.7156.3176.600000111.1G234G234-G347 PolarHBondContact O-N 3.28Å
348P73.4Confident66.8Low86 Ų8672.2 Ų72.256%0.55843%0.427SS*.PPolyproline II helixtrans-55.7152.2173.926.4-33.7000110.2
349P73.9Confident66.4Low81 Ų8175.2 Ų75.253%0.52645%0.446SS..PPolyproline II helixtrans-50.2145172.7-26.234.6000111.6P230P230-P349 HydrophobicContact CB-CB 3.92Å
350G72.6Confident65.7Low5 Ų577.3 Ų77.35%0.05245%0.449CS..PPolyproline II helixtrans-61.3161.5177.400000112G186 G231G186-G350 VanDerWaalsContact CA-CA 3.49Å; G231-G350 PolarHBondContact O-N 3.31Å
351P71.7Confident64.8Low89 Ų8981.9 Ų81.958%0.57846%0.456SS*.PPolyproline II helixtrans-53.8149.2172.725.6-33.3000110.1
352A71.7Confident63.6Low58 Ų5884.6 Ų84.648%0.47947%0.474SS..PPolyproline II helixtrans-56.714417800000110.6P227P227-A352 HydrophobicContact CB-CB 3.61Å
353G68.5Low62.5Low7 Ų782 Ų827%0.07246%0.462CS..PPolyproline II helixtrans-61.5168.2-179.200000112.4L181 P227 G228L181-G353 WeakPolarHBondContact O-CA 3.35Å; P227-G353 WeakPolarHBondContact CB-O 3.05Å; G228-G353 PolarHBondContact O-N 3.26Å
354E65.5Low61.4Low173 Ų17384.4 Ų84.481%0.80848%0.478SS*.PPolyproline II helixtrans-56.6150.9175.8-65.3-172.7129.100111G180 G228 G356G180-E354 WeakPolarHBondContact CA-O 3.37Å; G228-E354 PolarHBondContact N-O 2.93Å; E354-G356 PolarHBondContact O-N 3.35Å
355K58Low60.3Low150 Ų15091.6 Ų91.665%0.65252%0.515SS*.BIsolated β-bridgetrans-62.1131.7180-72.3-178.3-177.5178.70109.7P227P227-K355 HydrophobicContact CG-CG 4.28Å
356G56.7Low59.4Low9 Ų990.2 Ų90.29%0.09352%0.52CS..PPolyproline II helixtrans-57.5140.817300000111.1E354 C358E354-G356 PolarHBondContact O-N 3.35Å; G356-C358 PolarHBondContact O-N 3.35Å
357I52.3Low58Low143 Ų14389.4 Ų89.473%0.73352%0.517SS*.  trans-87.7111.4177.3-59.8164.1000106.4P359I357-P359 WeakPolarHBondContact O-CD 3.41Å
358C55.1Low57Low72 Ų7294.5 Ų94.549%0.48655%0.547SS..  trans-77.4108.2170.9-14.40000105.9C225 G356 K360C225-C358 WeakPolarHBondContact CB-SG 3.43Å; C225-C358 WeakPolarHBondContact SG-CB 3.49Å; C225-C358 CovalentContact SG-SG 2.09Å; C225-C358 PolarHBondContact SG-SG 3.11Å; G356-C358 PolarHBondContact O-N 3.35Å; C358-K360 PolarHBondContact O-N 3.25Å
359P51Low55.5Low67 Ų6795.8 Ų95.844%0.43554%0.544SS..  trans-60.7130.7-177.322.4-29.8000109.1I357 Y361 C362I357-P359 WeakPolarHBondContact O-CD 3.41Å; P359-Y361 PolarHBondContact O-N 3.21Å; P359-C362 PolarHBondContact O-N 3.36Å
360K50Low54.1Low189 Ų18998.4 Ų98.482%0.82255%0.548SS*.THydrogen-bonded Turntrans-61.6-3.7-170-138.7-171.2-176.71790114.6C358C358-K360 PolarHBondContact O-N 3.25Å
361Y47.9Very low53.2Low183 Ų183104.7 Ų104.772%0.71859%0.59SS**THydrogen-bonded Turntrans-134.553.8-175.1-40-73.9000109.7P359 A363P359-Y361 PolarHBondContact O-N 3.21Å; Y361-A363 PolarHBondContact O-N 3.26Å
362C41.9Very low52.3Low60 Ų60105.5 Ų105.541%0.40559%0.59SS.*  trans-70.787.5159.5-870000107.7C176 P359C176-C362 HydrophobicContact CB-CB 4.15Å; C176-C362 WeakPolarHBondContact CB-SG 3.36Å; C176-C362 WeakPolarHBondContact SG-CB 3.34Å; C176-C362 CovalentContact SG-SG 2.05Å; C176-C362 PolarHBondContact SG-SG 3.4Å; P359-C362 PolarHBondContact O-N 3.36Å
363A44.1Very low51.2Low55 Ų55105.4 Ų105.446%0.45559%0.594SS.*  trans-64.1133.7163.600000107.8Y361 D365Y361-A363 PolarHBondContact O-N 3.26Å; A363-D365 PolarHBondContact O-N 3.12Å
364L49.1Very low50Low175 Ų175108 Ų10892%0.91661%0.609SS**THydrogen-bonded Turntrans-58.43.4-178.2-76.8152.1000115.1
365D47.6Very low48.8Very low155 Ų155108.1 Ų108.183%0.82960%0.602SS**THydrogen-bonded Turntrans-121.828.3-173.3-67.7-56.1000113.8A363 G367A363-D365 PolarHBondContact O-N 3.12Å; D365-G367 PolarHBondContact O-N 3.47Å
366G50.5Low48.3Very low76 Ų76111.5 Ų111.578%0.78461%0.611SS**  trans64.915.1167.100000116
367G44Very low48.1Very low40 Ų40124.5 Ų124.541%0.41266%0.657SS.*  trans-89.2105.5177.500000111.8D365 F369D365-G367 PolarHBondContact O-N 3.47Å; G367-F369 PolarHBondContact O-N 3.22Å
368V51.1Low47.8Very low112 Ų112123.6 Ų123.668%0.67965%0.653SS**  trans-69.8101.4170-174.20000108.4F370V368-F370 HydrophobicContact CG1-CE2 4.21Å; V368-F370 HydrophobicContact CG1-CZ 4.3Å
369F41.2Very low47.5Very low112 Ų112126.3 Ų126.349%0.49166%0.662SS.*  trans-78.9120.6165.6-85.8-92000108.8G367 R375G367-F369 PolarHBondContact O-N 3.22Å; F369-R375 HydrophobicContact CE1-CB 3.8Å; F369-R375 HydrophobicContact CZ-CB 3.95Å; F369-R375 HydrophobicContact CZ-CG 4.23Å
370F44.7Very low47.3Very low137 Ų137129.6 Ų129.660%0.60168%0.675SS**  trans-73.8159.5170-73.4-87000110.1V368 D372 G373V368-F370 HydrophobicContact CG1-CE2 4.21Å; V368-F370 HydrophobicContact CG1-CZ 4.3Å; F370-D372 PolarHBondContact O-N 3.16Å; F370-G373 PolarHBondContact O-N 3.35Å
371S54.8Low47.1Very low136 Ų136126.1 Ų126.195%0.95167%0.666SS**THydrogen-bonded Turntrans-59.3-10.5-175.4340000115G373S371-G373 VanDerWaalsContact C-N 3.32Å
372D53.4Low47.1Very low107 Ų107122.5 Ų122.557%0.57266%0.663SS**THydrogen-bonded Turntrans-87.30.8172.976.7-14000113.7F370 T374F370-D372 PolarHBondContact O-N 3.16Å; D372-T374 PolarHBondContact O-N 3.48Å; D372-T374 PolarHBondContact OD1-N 3.48Å; D372-T374 PolarHBondContact OD1-OG1 3.26Å; D372-T374 PolarHBondContact OD2-OG1 3.43Å
373G47.4Very low47.4Very low55 Ų55126.7 Ų126.757%0.56768%0.68SS**  trans71.67.6179.800000114.1F370 S371F370-G373 PolarHBondContact O-N 3.35Å; S371-G373 VanDerWaalsContact C-N 3.32Å
374T43.7Very low47.6Very low63 Ų63131.8 Ų131.839%0.38770%0.696SS.*  trans-90.2132.9178.866.50000112.2D372D372-T374 PolarHBondContact O-N 3.48Å; D372-T374 PolarHBondContact OD1-N 3.48Å; D372-T374 PolarHBondContact OD1-OG1 3.26Å; D372-T374 PolarHBondContact OD2-OG1 3.43Å
375R39.6Very low47.5Very low174 Ų174128.5 Ų128.566%0.65768%0.679SS**  trans-88.3102.3172.2-175.5-174.2-176.2-175.25.7107.9F369F369-R375 HydrophobicContact CE1-CB 3.8Å; F369-R375 HydrophobicContact CZ-CB 3.95Å; F369-R375 HydrophobicContact CZ-CG 4.23Å
376R47.1Very low47.5Very low222 Ų222126.3 Ų126.384%0.83867%0.667SS**  trans-86.1111.6165-68.3-159.4-178-162.42.2108.4
377R52.6Low47.2Very low281 Ų281130.8 Ų130.8100%1.0666%0.656SS**  trans-68.50163.5-81.2-170.3-173.7-167.32.3109.8

Retrieved 377 of 377 residues in 111.2 ms (Link to these results)