A0A090N8Q3_HUMAN Loading...

Transmembrane and ubiquitin-like domain-containing protein 1

Involved in sterol-regulated ubiquitination and degradation of HMG-CoA reductase HMGCR. Involved in positive regulation of AMPA-selective glutamate receptor GRIA2 recycling to the cell surface. Acts as a negative regulator of hepatocyte growth during regeneration. May contribute to the regulation of translation during cell-cycle progression. May contribute to the regulation of cell proliferation. May be involved in centrosome assembly. Modulates stabilization and nucleolar localization of tumor suppressor CDKN2A and enhances association between CDKN2A and NPM1.

AlphaFold DB (Q9BVT8), UniProt , Accession A0A090N8Q3, Species HUMAN (Homo sapiens, Human), Gene C7orf21, Length 246 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
1M42.9Very low58.9Low227 Ų227123.9 Ų123.9100%1.11869%0.692SS**  01070-27.6-47.9167.800106.3L3M1-L3 PolarHBondContact O-N 3.24Å
2T49Very low59.2Low128 Ų128117.1 Ų117.179%0.78566%0.656SS**  trans-8569.3-153.744.50000114.2
3L53.7Low59.8Low163 Ų163114 Ų11485%0.85364%0.642SS**  trans-87.97.2179.2-95156.2000115.1M1M1-L3 PolarHBondContact O-N 3.24Å
4I56.5Low60.3Low140 Ų140114.6 Ų114.672%0.71864%0.641SS**  trans-139.348.2-168.9-45168.4000112V7I4-V7 HydrophobicContact CG2-CB 4.33Å; I4-V7 HydrophobicContact CG2-CG2 4.19Å
5E59.3Low60.4Low177 Ų177113.6 Ų113.683%0.82763%0.628SS**SBendtrans-98.7-7.1167.8-101.9174.5159.300113.1
6G58.9Low60.6Low46 Ų46110.6 Ų110.647%0.47462%0.617SS.*SBendtrans-100.8-21.3-178.400000116.5G8 E10G6-G8 PolarHBondContact O-N 3.4Å; G6-E10 WeakPolarHBondContact O-CG 3.26Å
7V60Low61.1Low93 Ų93108.5 Ų108.556%0.56461%0.608SS**Hα-helixtrans-72.2-30.2-171-178.90000112.3I4 V11I4-V7 HydrophobicContact CG2-CB 4.33Å; I4-V7 HydrophobicContact CG2-CG2 4.19Å; V7-V11 WeakPolarHBondContact O-CG2 3.26Å; V7-V11 PolarHBondContact O-N 2.63Å
8G62.9Low61.3Low46 Ų46108.6 Ų108.647%0.47461%0.606SS.*Hα-helixtrans-75.3-35.8-176.700000114.4G6 T12G6-G8 PolarHBondContact O-N 3.4Å; G8-T12 PolarHBondContact O-N 3.48Å; G8-T12 PolarHBondContact O-OG1 2.85Å
9D67.9Low61.3Low113 Ų113105.1 Ų105.160%0.60459%0.592SS**Hα-helixtrans-74.6-44.7-178.1-165.536.2000111.3V11 T12 V13D9-V11 VanDerWaalsContact C-N 3.3Å; D9-V11 PolarHBondContact O-N 3.27Å; D9-T12 WeakPolarHBondContact O-CA 3.35Å; D9-T12 WeakPolarHBondContact O-CB 3.29Å; D9-T12 PolarHBondContact O-N 3.13Å; D9-V13 WeakPolarHBondContact O-CG2 3.39Å; D9-V13 PolarHBondContact O-N 3.22Å
10E73.5Confident61.5Low141 Ų141103.7 Ų103.766%0.65959%0.589SS**Hα-helixtrans-54.6-43.7175.1-70.6-73163.600112.4G6 T12 V13 L14G6-E10 WeakPolarHBondContact O-CG 3.26Å; E10-T12 VanDerWaalsContact C-N 3.29Å; E10-T12 PolarHBondContact O-N 3.3Å; E10-V13 PolarHBondContact O-N 2.89Å; E10-L14 WeakPolarHBondContact O-CB 3.45Å; E10-L14 PolarHBondContact O-N 2.91Å
11V63.4Low61.8Low89 Ų89103.7 Ų103.754%0.53959%0.587SS.*Hα-helixtrans-66.1-35.2177.9174.50000111.1V7 D9 F15V7-V11 WeakPolarHBondContact O-CG2 3.26Å; V7-V11 PolarHBondContact O-N 2.63Å; D9-V11 VanDerWaalsContact C-N 3.3Å; D9-V11 PolarHBondContact O-N 3.27Å; V11-F15 WeakPolarHBondContact O-CB 3.43Å; V11-F15 PolarHBondContact O-N 3.16Å
12T62.1Low63Low42 Ų4296.8 Ų96.826%0.25855%0.554SS.*Hα-helixtrans-70.2-43.2177.7-54.70000111.1G8 D9 E10 F15 S16 A225G8-T12 PolarHBondContact O-N 3.48Å; G8-T12 PolarHBondContact O-OG1 2.85Å; D9-T12 WeakPolarHBondContact O-CA 3.35Å; D9-T12 WeakPolarHBondContact O-CB 3.29Å; D9-T12 PolarHBondContact O-N 3.13Å; E10-T12 VanDerWaalsContact C-N 3.29Å; E10-T12 PolarHBondContact O-N 3.3Å; T12-F15 PolarHBondContact O-N 2.81Å; T12-S16 VanDerWaalsContact O-CB 3.25Å; T12-S16 WeakPolarHBondContact O-CB 3.5Å; T12-S16 PolarHBondContact O-N 2.95Å; T12-A225 HydrophobicContact CG2-CB 4.47Å
13V66.7Low63.9Low77 Ų7794.8 Ų94.847%0.46754%0.541SS..Hα-helixtrans-61-47.1173.9174.10000110.1D9 E10 F15 S16 V17D9-V13 WeakPolarHBondContact O-CG2 3.39Å; D9-V13 PolarHBondContact O-N 3.22Å; E10-V13 PolarHBondContact O-N 2.89Å; V13-F15 PolarHBondContact O-N 3.29Å; V13-S16 PolarHBondContact O-N 2.76Å; V13-V17 HydrophobicContact CG1-CG2 4.32Å; V13-V17 WeakPolarHBondContact O-CB 3.47Å; V13-V17 VanDerWaalsContact O-CG2 3.25Å; V13-V17 WeakPolarHBondContact O-CG2 3.26Å; V13-V17 PolarHBondContact O-N 2.74Å
14L66.9Low64.9Low122 Ų12292.8 Ų92.864%0.63953%0.531SS*.Hα-helixtrans-59-46.2177.7-178.967.2000111.9E10 V17 L18E10-L14 WeakPolarHBondContact O-CB 3.45Å; E10-L14 PolarHBondContact O-N 2.91Å; L14-V17 PolarHBondContact O-N 3.43Å; L14-L18 WeakPolarHBondContact O-CB 3.5Å; L14-L18 PolarHBondContact O-N 2.59Å
15F62.7Low65.6Low100 Ų10088.5 Ų88.544%0.43952%0.516SS..Hα-helixtrans-67.2-40.2179.8-166.6-92.4000112V11 T12 V13 L18 A19 L210V11-F15 WeakPolarHBondContact O-CB 3.43Å; V11-F15 PolarHBondContact O-N 3.16Å; T12-F15 PolarHBondContact O-N 2.81Å; V13-F15 PolarHBondContact O-N 3.29Å; F15-L18 PolarHBondContact O-N 3.09Å; F15-A19 WeakPolarHBondContact O-CB 3.44Å; F15-A19 PolarHBondContact O-N 3.01Å; F15-L210 HydrophobicContact CE1-CD2 4.19Å; F15-L210 HydrophobicContact CZ-CD2 4.34Å; F15-L210 HydrophobicContact CZ-CG 4.24Å
16S62.7Low66.1Low66 Ų6683 Ų8346%0.46249%0.492SS..Hα-helixtrans-61.8-45.9174.8-177.20000111.6T12 V13 A19 C20T12-S16 VanDerWaalsContact O-CB 3.25Å; T12-S16 WeakPolarHBondContact O-CB 3.5Å; T12-S16 PolarHBondContact O-N 2.95Å; V13-S16 PolarHBondContact O-N 2.76Å; S16-A19 PolarHBondContact O-N 2.83Å; S16-C20 WeakPolarHBondContact O-CB 3.05Å; S16-C20 PolarHBondContact O-N 2.83Å; S16-C20 PolarHBondContact O-SG 2.97Å; S16-C20 VanDerWaalsContact O-SG 3.41Å
17V69.1Low66.8Low74 Ų7483.2 Ų83.245%0.44849%0.489SS..Hα-helixtrans-63.1-44.5175.9170.80000110.9V13 L14 A19 C20 L21V13-V17 HydrophobicContact CG1-CG2 4.32Å; V13-V17 WeakPolarHBondContact O-CB 3.47Å; V13-V17 VanDerWaalsContact O-CG2 3.25Å; V13-V17 WeakPolarHBondContact O-CG2 3.26Å; V13-V17 PolarHBondContact O-N 2.74Å; L14-V17 PolarHBondContact O-N 3.43Å; V17-A19 VanDerWaalsContact C-N 3.34Å; V17-A19 PolarHBondContact O-N 2.84Å; V17-C20 PolarHBondContact O-N 2.82Å; V17-L21 HydrophobicContact CG1-CD1 4.03Å; V17-L21 HydrophobicContact CG1-CG 4.38Å; V17-L21 WeakPolarHBondContact O-CB 3.27Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 2.81Å
18L64.6Low67.5Low111 Ų11186.9 Ų86.958%0.58149%0.493SS*.Hα-helixtrans-62.4-42178-171.172.5000111.6L14 F15 L21 L22L14-L18 WeakPolarHBondContact O-CB 3.5Å; L14-L18 PolarHBondContact O-N 2.59Å; F15-L18 PolarHBondContact O-N 3.09Å; L18-L21 PolarHBondContact O-N 3.24Å; L18-L22 WeakPolarHBondContact O-CB 3.31Å; L18-L22 PolarHBondContact O-N 2.86Å
19A62.7Low67.9Low41 Ų4189.2 Ų89.234%0.33950%0.498SS..Hα-helixtrans-64.8-44.1175.500000111.6F15 S16 V17 L21 L22 V23F15-A19 WeakPolarHBondContact O-CB 3.44Å; F15-A19 PolarHBondContact O-N 3.01Å; S16-A19 PolarHBondContact O-N 2.83Å; V17-A19 VanDerWaalsContact C-N 3.34Å; V17-A19 PolarHBondContact O-N 2.84Å; A19-L21 PolarHBondContact O-N 3.41Å; A19-L22 PolarHBondContact O-N 3.23Å; A19-V23 VanDerWaalsContact O-CG2 3.32Å; A19-V23 WeakPolarHBondContact O-CG2 3.39Å; A19-V23 PolarHBondContact O-N 2.81Å
20C64.9Low67.9Low78 Ų7887 Ų8753%0.52749%0.491SS..Hα-helixtrans-60-44.5174.2-78.70000112S16 V17 V23 L24S16-C20 WeakPolarHBondContact O-CB 3.05Å; S16-C20 PolarHBondContact O-N 2.83Å; S16-C20 PolarHBondContact O-SG 2.97Å; S16-C20 VanDerWaalsContact O-SG 3.41Å; V17-C20 PolarHBondContact O-N 2.82Å; C20-V23 PolarHBondContact O-N 3.32Å; C20-L24 WeakPolarHBondContact O-CB 3.22Å; C20-L24 PolarHBondContact O-N 3.32Å
21L68.4Low68Low104 Ų10485.6 Ų85.655%0.54549%0.492SS..Hα-helixtrans-64.5-39.4176.3-74.2174.5000112V17 L18 A19 L24 A25V17-L21 HydrophobicContact CG1-CD1 4.03Å; V17-L21 HydrophobicContact CG1-CG 4.38Å; V17-L21 WeakPolarHBondContact O-CB 3.27Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 2.81Å; L18-L21 PolarHBondContact O-N 3.24Å; A19-L21 PolarHBondContact O-N 3.41Å; L21-L24 PolarHBondContact O-N 2.98Å; L21-A25 VanDerWaalsContact O-CB 3.29Å; L21-A25 WeakPolarHBondContact O-CB 3.12Å; L21-A25 PolarHBondContact O-N 3.16Å
22L66.8Low67.2Low82 Ų8286.3 Ų86.343%0.42949%0.49SS..Hα-helixtrans-65.1-42.9175.5-176.169.1000111.2L18 A19 L24 A25 L26 L206L18-L22 WeakPolarHBondContact O-CB 3.31Å; L18-L22 PolarHBondContact O-N 2.86Å; A19-L22 PolarHBondContact O-N 3.23Å; L22-L24 VanDerWaalsContact C-N 3.34Å; L22-A25 PolarHBondContact O-N 3.39Å; L22-L26 HydrophobicContact CG-CD1 4.21Å; L22-L26 WeakPolarHBondContact O-CB 3.33Å; L22-L26 VanDerWaalsContact O-CG 3.29Å; L22-L26 WeakPolarHBondContact O-CG 3.16Å; L22-L26 PolarHBondContact O-N 3.43Å; L22-L206 HydrophobicContact CD2-CD2 4.09Å
23V69.2Low66.6Low85 Ų8589.7 Ų89.752%0.51551%0.51SS..Hα-helixtrans-63.2-41.8174.6170.80000110.6A19 C20 L26 A27A19-V23 VanDerWaalsContact O-CG2 3.32Å; A19-V23 WeakPolarHBondContact O-CG2 3.39Å; A19-V23 PolarHBondContact O-N 2.81Å; C20-V23 PolarHBondContact O-N 3.32Å; V23-L26 PolarHBondContact O-N 3.49Å; V23-A27 VanDerWaalsContact O-CB 3.24Å; V23-A27 WeakPolarHBondContact O-CB 3.44Å; V23-A27 PolarHBondContact O-N 3.43Å
24L74.2Confident65.6Low122 Ų12289.8 Ų89.864%0.63952%0.519SS*.Hα-helixtrans-64.1-41.8175.4-127.573.2000111.7C20 L21 L22 A27 W28C20-L24 WeakPolarHBondContact O-CB 3.22Å; C20-L24 PolarHBondContact O-N 3.32Å; L21-L24 PolarHBondContact O-N 2.98Å; L22-L24 VanDerWaalsContact C-N 3.34Å; L24-A27 PolarHBondContact O-N 3.31Å; L24-W28 WeakPolarHBondContact O-CB 3.5Å; L24-W28 PolarHBondContact O-N 2.96Å
25A69.7Low64.7Low50 Ų5093.1 Ų93.141%0.41353%0.531SS..Hα-helixtrans-65.3-42.2176.700000111.2L21 L22 W28 V29L21-A25 VanDerWaalsContact O-CB 3.29Å; L21-A25 WeakPolarHBondContact O-CB 3.12Å; L21-A25 PolarHBondContact O-N 3.16Å; L22-A25 PolarHBondContact O-N 3.39Å; A25-W28 PolarHBondContact O-N 2.79Å; A25-V29 WeakPolarHBondContact O-CB 3.32Å; A25-V29 VanDerWaalsContact O-CG2 3.22Å; A25-V29 WeakPolarHBondContact O-CG2 3.31Å; A25-V29 PolarHBondContact O-N 3.37Å
26L70.1Confident63.9Low62 Ų6292.1 Ų92.133%0.32555%0.549SS..Hα-helixtrans-67.7-39.4175.3-72.8172.1000111.7L22 V23 W28 V29 S30L22-L26 HydrophobicContact CG-CD1 4.21Å; L22-L26 WeakPolarHBondContact O-CB 3.33Å; L22-L26 VanDerWaalsContact O-CG 3.29Å; L22-L26 WeakPolarHBondContact O-CG 3.16Å; L22-L26 PolarHBondContact O-N 3.43Å; V23-L26 PolarHBondContact O-N 3.49Å; L26-W28 VanDerWaalsContact C-N 3.32Å; L26-V29 PolarHBondContact O-N 3.28Å; L26-S30 WeakPolarHBondContact O-CB 3.44Å; L26-S30 PolarHBondContact O-N 2.98Å
27A73.6Confident62.9Low49 Ų4992.4 Ų92.441%0.40556%0.563SS.*Hα-helixtrans-64.4-39.7173.400000111V23 L24 S30 T31V23-A27 VanDerWaalsContact O-CB 3.24Å; V23-A27 WeakPolarHBondContact O-CB 3.44Å; V23-A27 PolarHBondContact O-N 3.43Å; L24-A27 PolarHBondContact O-N 3.31Å; A27-S30 PolarHBondContact O-N 3.18Å; A27-T31 VanDerWaalsContact O-CB 3.32Å; A27-T31 WeakPolarHBondContact O-CB 3.37Å; A27-T31 PolarHBondContact O-N 3.38Å; A27-T31 PolarHBondContact O-OG1 2.91Å
28W76.5Confident61.5Low171 Ų17196.3 Ų96.365%0.64858%0.581SS**Hα-helixtrans-66.5-47.5176-166.984.5000111.3L24 A25 L26 S30 T31 H32L24-W28 WeakPolarHBondContact O-CB 3.5Å; L24-W28 PolarHBondContact O-N 2.96Å; A25-W28 PolarHBondContact O-N 2.79Å; L26-W28 VanDerWaalsContact C-N 3.32Å; W28-S30 VanDerWaalsContact C-N 3.32Å; W28-S30 PolarHBondContact O-N 3.09Å; W28-T31 CarbonylContact O-C 3.49Å; W28-T31 PolarHBondContact O-N 2.94Å; W28-T31 VanDerWaalsContact O-N 3.13Å; W28-H32 HydrophobicContact CE3-CB 4.49Å; W28-H32 AromaticContact CH2-CD2 3.45Å; W28-H32 VanDerWaalsContact CH2-CD2 3.45Å; W28-H32 WeakPolarHBondContact CH2-CD2 3.4Å; W28-H32 AromaticContact CZ2-CD2 3.88Å; W28-H32 HydrophobicContact CZ3-CB 4.48Å; W28-H32 AromaticContact CZ3-CD2 3.79Å; W28-H32 VanDerWaalsContact O-CB 3.27Å; W28-H32 WeakPolarHBondContact O-CB 3.37Å; W28-H32 PolarHBondContact O-N 2.9Å
29V70.4Confident60.6Low95 Ų9596.1 Ų96.158%0.57659%0.587SS**Hα-helixtrans-62.8-38.6174.4171.20000111.2A25 L26 T31 H32A25-V29 WeakPolarHBondContact O-CB 3.32Å; A25-V29 VanDerWaalsContact O-CG2 3.22Å; A25-V29 WeakPolarHBondContact O-CG2 3.31Å; A25-V29 PolarHBondContact O-N 3.37Å; L26-V29 PolarHBondContact O-N 3.28Å; V29-T31 VanDerWaalsContact C-N 3.29Å; V29-T31 PolarHBondContact O-N 2.98Å; V29-H32 PolarHBondContact O-N 2.78Å
30S68.7Low60.2Low66 Ų66102.1 Ų102.146%0.46261%0.612SS.*Hα-helixtrans-66.8-30.7175.1-176.50000112.4L26 A27 W28L26-S30 WeakPolarHBondContact O-CB 3.44Å; L26-S30 PolarHBondContact O-N 2.98Å; A27-S30 PolarHBondContact O-N 3.18Å; W28-S30 VanDerWaalsContact C-N 3.32Å; W28-S30 PolarHBondContact O-N 3.09Å
31T75.6Confident59.5Low111 Ų111103.7 Ų103.768%0.68162%0.621SS**Hα-helixtrans-86.5-21176.4-53.10000111.4A27 W28 V29 T33A27-T31 VanDerWaalsContact O-CB 3.32Å; A27-T31 WeakPolarHBondContact O-CB 3.37Å; A27-T31 PolarHBondContact O-N 3.38Å; A27-T31 PolarHBondContact O-OG1 2.91Å; W28-T31 CarbonylContact O-C 3.49Å; W28-T31 PolarHBondContact O-N 2.94Å; W28-T31 VanDerWaalsContact O-N 3.13Å; V29-T31 VanDerWaalsContact C-N 3.29Å; V29-T31 PolarHBondContact O-N 2.98Å; T31-T33 PolarHBondContact O-N 3.23Å
32H46.7Very low58.4Low105 Ų105107.1 Ų107.149%0.48663%0.634SS.*  trans-78.168.6175.2-161.3-66.6000109.9W28 V29 A34W28-H32 HydrophobicContact CE3-CB 4.49Å; W28-H32 AromaticContact CH2-CD2 3.45Å; W28-H32 VanDerWaalsContact CH2-CD2 3.45Å; W28-H32 WeakPolarHBondContact CH2-CD2 3.4Å; W28-H32 AromaticContact CZ2-CD2 3.88Å; W28-H32 HydrophobicContact CZ3-CB 4.48Å; W28-H32 AromaticContact CZ3-CD2 3.79Å; W28-H32 VanDerWaalsContact O-CB 3.27Å; W28-H32 WeakPolarHBondContact O-CB 3.37Å; W28-H32 PolarHBondContact O-N 2.9Å; V29-H32 PolarHBondContact O-N 2.78Å; H32-A34 PolarHBondContact O-N 3.11Å
33T47.7Very low57.8Low113 Ų113109 Ų10969%0.69365%0.652SS**  trans-60.9105.9155.651.50000106.1T31 E35T31-T33 PolarHBondContact O-N 3.23Å; T33-E35 PolarHBondContact O-N 3.49Å
34A47.6Very low56.5Low78 Ų78110.6 Ų110.665%0.64567%0.666SS**  trans-54.1107.7175.200000108.7H32 G36H32-A34 PolarHBondContact O-N 3.11Å; A34-G36 PolarHBondContact O-N 3.16Å
35E46.3Very low55.2Low192 Ų192107.8 Ų107.890%0.89767%0.667SS**  trans-65.482.1159-75.5169.5110.500106.3T33 G37T33-E35 PolarHBondContact O-N 3.49Å; E35-G37 PolarHBondContact O-N 3.44Å
36G47.5Very low54Low80 Ų80111.3 Ų111.383%0.82568%0.684SS**  trans-71.893.7177.400000110.1A34A34-G36 PolarHBondContact O-N 3.16Å
37G39.9Very low52.7Low72 Ų72113.9 Ų113.974%0.74270%0.704SS**  trans108.975.4147.600000117.1E35E35-G37 PolarHBondContact O-N 3.44Å
38D40.6Very low51.3Low156 Ų156117.4 Ų117.483%0.83472%0.721SS**  trans-73.1160.3135.2-118.3-43.3000108.3
39P46.8Very low49.6Very low107 Ų107114.3 Ų114.370%0.69572%0.723SS**  cis-142.1162-0.238.2-18.6000115.3
40L53.7Low48.2Very low166 Ų166115.1 Ų115.187%0.86973%0.733SS**  trans-146.9133.1140.7-157.672.1000110.9Q42L40-Q42 PolarHBondContact O-N 3.22Å
41P50.7Low47.1Very low112 Ų112120.5 Ų120.573%0.72775%0.751SS**  trans-73.3128.9-168.4-7.324.3000110.9P43P41-P43 VanDerWaalsContact O-CD 3.28Å; P41-P43 WeakPolarHBondContact O-CD 3.38Å
42Q44Very low45.4Very low175 Ų175121.3 Ų121.382%0.81876%0.757SS**  trans-85.9110.8164.7-131.5178.86.200107.9L40 S44L40-Q42 PolarHBondContact O-N 3.22Å; Q42-S44 PolarHBondContact O-N 3.42Å; Q42-S44 VanDerWaalsContact O-N 3.12Å
43P54.6Low45.3Very low123 Ų123121.7 Ų121.780%0.79977%0.772SS**  trans-77.798.1164.929.2-24.4000107.5P41 G45P41-P43 VanDerWaalsContact O-CD 3.28Å; P41-P43 WeakPolarHBondContact O-CD 3.38Å; P43-G45 PolarHBondContact O-N 3.23Å
44S42.7Very low45.1Very low117 Ų117120 Ų12082%0.81877%0.77SS**  trans-64.2109.3164.9-56.80000109.8Q42Q42-S44 PolarHBondContact O-N 3.42Å; Q42-S44 VanDerWaalsContact O-N 3.12Å
45G45.8Very low44.8Very low63 Ų63121.7 Ų121.765%0.64978%0.784SS**  trans-169130.516200000106.7P43P43-G45 PolarHBondContact O-N 3.23Å
46T44.8Very low44.8Very low124 Ų124120.9 Ų120.976%0.76178%0.782SS**  cis-163.2144.810.3-68.70000104.7
47P42.3Very low44.5Very low117 Ų117121.7 Ų121.776%0.7678%0.781SS**  trans-76.2126175.631.4-30.8000108.9
48T45.5Very low44.5Very low123 Ų123122.7 Ų122.776%0.75578%0.782SS**  trans-157.3114.8153.8-52.90000111
49P40Very low44.9Very low106 Ų106121.6 Ų121.669%0.68878%0.781SS**  trans-83.3161.8165.327.8-18000111.1
50S41.5Very low44.6Very low112 Ų112123.5 Ų123.578%0.78379%0.785SS**  trans72.8117.1162.760.10000119.3
51Q44.3Very low44.1Very low179 Ų179120.4 Ų120.484%0.83678%0.778SS**  135.3121.8119-155.6173.74.800113.5
52P39.6Very low44.1Very low127 Ų127123.7 Ų123.783%0.82579%0.786SS**  trans-87.8120.5176.332.7-27.5000110
53S45.1Very low43.8Very low114 Ų114127.1 Ų127.180%0.79779%0.791SS**  trans-158.6125.5166.4-162.30000112.9
54A43.9Very low43.2Very low78 Ų78124.5 Ų124.565%0.64579%0.787SS**  trans62.986148.500000119M56A54-M56 PolarHBondContact O-N 2.81Å
55A40.7Very low42.9Very low113 Ų113127.7 Ų127.793%0.93479%0.789SS**  trans-77.6108.3147.100000109
56M45.8Very low42.9Very low175 Ų175129 Ų12986%0.86279%0.793SS**  trans-122.7117.1167.3-112.4-166.4-72.800107.2A54A54-M56 PolarHBondContact O-N 2.81Å
57A41.4Very low42.6Very low97 Ų97129.3 Ų129.380%0.80280%0.798SS**  trans171.2118.1132.400000111.6
58A41.5Very low42.5Very low93 Ų93127.1 Ų127.177%0.76980%0.796SS**  trans69.5115.713500000119.6
59T48Very low42.4Very low133 Ų133125.8 Ų125.882%0.81680%0.797SS**  159.992117.7-57.60000106.4
60D40.4Very low42.7Very low146 Ų146129.3 Ų129.378%0.78181%0.805SS**  73.4102.589.2-161.921.5000113.6
61S43.5Very low43.1Very low101 Ų101129.6 Ų129.671%0.70680%0.802SS**  trans164.4127.4133.9-90.20000114.4
62M50.6Low42.8Very low182 Ų182127.1 Ų127.190%0.89780%0.801SS**  trans85104.8140.5-65.3-71.2-77.700120.6
63R38Very low43Very low246 Ų246126 Ų12693%0.92880%0.796SS**  trans-73150.7176.3169.3180-177.2157.30.9115.5
64G41.4Very low43Very low69 Ų69127.8 Ų127.871%0.71180%0.796SS**  trans123.5138154.800000112.5
65E36.5Very low43.1Very low183 Ų183134.7 Ų134.786%0.85581%0.805SS**  cis-173.5132.20.1179.186.795.900105.9
66A45.4Very low43.2Very low90 Ų90138.7 Ų138.774%0.74481%0.805SS**  trans62.4154.7151.400000124.5
67P40.4Very low42.7Very low132 Ų132142.1 Ų142.186%0.85781%0.808SS**  trans-122.8162.2-14639.9-23.8000116.8
68G39.6Very low42.6Very low70 Ų70140.6 Ų140.672%0.72280%0.802SS**  trans-172.8111.2162.600000109
69A43.1Very low42.5Very low95 Ų95145.1 Ų145.179%0.78581%0.807SS**  91.4139.678.800000112.8
70E47.4Very low42Very low180 Ų180143.2 Ų143.284%0.84181%0.805SS**  trans88.6131.9164.9-43.3-159.7110.200116.4
71T48.2Very low42.1Very low119 Ų119141.1 Ų141.173%0.7381%0.807SS**  cis-173.2147.3311.30000108.5
72P39.5Very low42.1Very low127 Ų127144.9 Ų144.983%0.82581%0.814SS**  trans-122.6135.9153.134.4-21.5000111.7
73S42.4Very low41.6Very low102 Ų102141.5 Ų141.571%0.71381%0.806SS**  trans-161.3146.7-179.3-86.10000107.3
74L45.8Very low42.2Very low152 Ų152138.6 Ų138.680%0.79680%0.803SS**  cis-168.8154.810.3-109.4158.8000107.7
75R44.9Very low42.1Very low223 Ų223140.5 Ų140.584%0.84280%0.802SS**  trans-44.4157.7167.9-71.8168.4156.6127.9-5.2114.3
76H43.3Very low42.3Very low198 Ų198137.5 Ų137.592%0.91780%0.802SS**  -162.2136.2120.8-107.160.5000113.4
77R35.2Very low42.1Very low246 Ų246140.5 Ų140.593%0.92881%0.811SS**  trans-125.2141.5-177.8163.1177172.6101.4-3.3107.5
78G39.4Very low41.9Very low65 Ų65137.5 Ų137.567%0.6780%0.804SS**  trans130.2145.6170.200000111.8
79Q40.5Very low41.7Very low189 Ų189144 Ų14488%0.88381%0.813SS**  cis-176.5141.97.2-169150.2-21.400109.4
80A36.6Very low41.7Very low93 Ų93145.3 Ų145.377%0.76981%0.811SS**  trans72.9145.1144.100000125.2
81A43.1Very low41.3Very low101 Ų101141 Ų14184%0.83581%0.807SS**  trans86.7123.8162.100000115.8
82Q43Very low40.9Very low180 Ų180141.4 Ų141.484%0.84181%0.809SS**  cis-170.2148.222-169.7172.55.200109.1
83P39.4Very low41.7Very low112 Ų112140.3 Ų140.373%0.72780%0.802SS**  trans-106.1141.5176.135.9-25.6000112.6
84E50.6Low42.2Very low185 Ų185141.6 Ų141.686%0.86481%0.808SS**  trans-148.3128.5159.9-85.6-82.784.500108.9
85P39.7Very low42.2Very low109 Ų109138.3 Ų138.371%0.70880%0.803SS**  trans-99.6141.4179.535.9-27.9000111.4
86S41.7Very low42.5Very low120 Ų120134 Ų13484%0.83980%0.803SS**  trans-165.5106.7154.7-86.30000112.7
87T40.3Very low42.6Very low152 Ų152131.9 Ų131.993%0.93380%0.799SS**  trans9.2118.8138.5-38.50000118.1
88G36.1Very low43.3Very low70 Ų70124.7 Ų124.772%0.72279%0.786SS**  trans-176.589166.900000111.8T90G88-T90 PolarHBondContact O-N 2.85Å
89F36.1Very low44.1Very low205 Ų205127.3 Ų127.390%0.89979%0.792SS**  trans-63.7112.7174.3-154.1-93000108.9
90T42.5Very low45.3Very low123 Ų123124 Ų12476%0.75578%0.776SS**  trans-144113.7163.5-58.50000107.6G88 T92G88-T90 PolarHBondContact O-N 2.85Å; T90-T92 PolarHBondContact O-N 2.8Å; T90-T92 VanDerWaalsContact O-N 3.13Å
91A39.9Very low47.2Very low91 Ų91127.5 Ų127.575%0.75278%0.777SS**  trans-63.4107.2179.200000110.1
92T39.8Very low49.1Very low127 Ų127126 Ų12678%0.77976%0.758SS**PPolyproline II helixtrans-81.4130.5170.7-53.60000109.1T90T90-T92 PolarHBondContact O-N 2.8Å; T90-T92 VanDerWaalsContact O-N 3.13Å
93P55.2Low51.1Low104 Ų104118.4 Ų118.468%0.67572%0.723SS**PPolyproline II helixtrans-66.8150.3176-2.516.7000110.6A95P93-A95 PolarHBondContact O-N 3.2Å
94P53.1Low53.4Low129 Ų129115.1 Ų115.184%0.83870%0.701SS**PPolyproline II helixtrans-63.6127.5-179.927.2-32.1000110
95A45.3Very low55.3Low83 Ų83106.3 Ų106.369%0.68666%0.66SS**PPolyproline II helixtrans-60.1140.1170.100000109.6P93 D97P93-A95 PolarHBondContact O-N 3.2Å; A95-D97 PolarHBondContact O-N 3.3Å
96P52.2Low57.7Low131 Ų131105.8 Ų105.885%0.85164%0.644SS**PPolyproline II helixtrans-65.9125.2178.626.9-31.3000109.7
97D45.8Very low60.1Low155 Ų155100 Ų10083%0.82960%0.604SS**PPolyproline II helixtrans-49.6140177.8-80.9-63.3000113.7A95A95-D97 PolarHBondContact O-N 3.3Å
98S49.2Very low62.5Low94 Ų9495.8 Ų95.866%0.65757%0.572SS**  trans10.5133.9156.9-480000119Q100S98-Q100 PolarHBondContact O-N 2.95Å
99P56.5Low65.1Low121 Ų12194 Ų9479%0.78655%0.545SS*.  trans-58.8107.7177.826.3-33.5000110.2E101P99-E101 PolarHBondContact O-N 3.45Å
100Q64.7Low67.4Low120 Ų12091.1 Ų91.156%0.56154%0.538SS*.PPolyproline II helixtrans-62.2120.3173.4-70.8178.8-13.900108S98 W120 H122S98-Q100 PolarHBondContact O-N 2.95Å; Q100-W120 VanDerWaalsContact O-CZ3 3.26Å; Q100-W120 WeakPolarHBondContact O-CZ3 3.46Å; Q100-H122 PolarHBondContact OE1-CE1 2.86Å; Q100-H122 PolarHBondContact OE1-ND1 2.79Å
101E77Confident69.5Low166 Ų16690.8 Ų90.878%0.77653%0.532SS*.PPolyproline II helixtrans-79.3142.9178.8-71.1179.2125.600110.9P99 L103P99-E101 PolarHBondContact O-N 3.45Å; E101-L103 PolarHBondContact O-N 3.13Å
102P82.5Confident71.7Confident68 Ų6892.4 Ų92.444%0.44253%0.528SS..PPolyproline II helixtrans-66.5128.9175.927.5-33.5000110.4W120P102-W120 HydrophobicContact CB-CE3 4.29Å; P102-W120 HydrophobicContact CB-CH2 4.31Å; P102-W120 HydrophobicContact CB-CZ3 4.17Å
103L84.7Confident74Confident21 Ų2188.6 Ų88.611%0.1151%0.506CS..EExtended strand (participates in β ladder)trans-79123.8176.8-168.469.2000109.7E101 L105 A119 L161 P163E101-L103 PolarHBondContact O-N 3.13Å; L103-L105 HydrophobicContact CD2-CD2 3.65Å; L103-L105 HydrophobicContact CD2-CG 4.18Å; L103-L105 HydrophobicContact CG-CD2 4.03Å; L103-L105 HydrophobicContact CG-CG 4.23Å; L103-A119 WeakPolarHBondContact CA-O 3.42Å; L103-A119 VanDerWaalsContact CB-O 3.29Å; L103-A119 WeakPolarHBondContact CB-O 3.32Å; L103-A119 PolarHBondContact N-O 3.05Å; L103-A119 PolarHBondContact O-N 3.44Å; L103-A119 VanDerWaalsContact O-O 3.06Å; L103-L161 HydrophobicContact CD2-CB 4.08Å; L103-P163 VanDerWaalsContact CD1-CA 3.46Å; L103-P163 HydrophobicContact CD1-CB 4.01Å
104V88.2Confident75.7Confident44 Ų4488.1 Ų88.127%0.26750%0.495SS..EExtended strand (participates in β ladder)trans-92.7119.3173.6-176.50000108.4V116 N164V104-V116 HydrophobicContact CG1-CG1 3.34Å; V104-N164 WeakPolarHBondContact O-CA 3.1Å; V104-N164 PolarHBondContact O-N 3.44Å
105L90.3Very high77.5Confident0 Ų085.4 Ų85.40%047%0.471CS..EExtended strand (participates in β ladder)trans-114140.5-177.6-60.6161000109.2L103 L107 V116 A117 A119 L128 L156 L161 C165 L167L103-L105 HydrophobicContact CD2-CD2 3.65Å; L103-L105 HydrophobicContact CD2-CG 4.18Å; L103-L105 HydrophobicContact CG-CD2 4.03Å; L103-L105 HydrophobicContact CG-CG 4.23Å; L105-L107 HydrophobicContact CB-CD1 4.2Å; L105-V116 CarbonylContact O-C 3.48Å; L105-V116 WeakPolarHBondContact O-CA 3.46Å; L105-A117 HydrophobicContact CB-CB 4.38Å; L105-A117 PolarHBondContact N-O 2.78Å; L105-A117 PolarHBondContact O-N 2.89Å; L105-A119 HydrophobicContact CD1-CB 3.98Å; L105-L128 HydrophobicContact CD1-CD1 4.07Å; L105-L128 HydrophobicContact CD1-CD2 4.02Å; L105-L156 HydrophobicContact CD1-CD1 3.99Å; L105-L156 HydrophobicContact CD1-CD2 4.22Å; L105-L161 HydrophobicContact CD2-CD1 4.21Å; L105-C165 WeakPolarHBondContact CD2-SG 3.37Å; L105-L167 HydrophobicContact CD2-CD1 4.03Å
106R91.2Very high79.6Confident97 Ų9785.9 Ų85.937%0.36647%0.465SS..EExtended strand (participates in β ladder)trans-103.6107.6173.8-74.7172.369.5-171.33.2109.6K108 E114 Q115 V116 C165 V166 L167R106-K108 PolarHBondContact O-N 3.22Å; R106-E114 IonicContact CZ-OE2 3.28Å; R106-E114 VanDerWaalsContact CZ-OE2 3.28Å; R106-E114 IonicContact NE-OE2 3.16Å; R106-E114 PolarHBondContact NE-OE2 2.78Å; R106-E114 VanDerWaalsContact NE-OE2 3.16Å; R106-E114 VanDerWaalsContact NH2-CD 3.34Å; R106-E114 IonicContact NH2-OE1 3.27Å; R106-E114 PolarHBondContact NH2-OE1 2.9Å; R106-E114 IonicContact NH2-OE2 2.63Å; R106-E114 PolarHBondContact NH2-OE2 3.38Å; R106-Q115 CarbonylContact C-O 3.56Å; R106-V116 HydrophobicContact CG-CG2 4.37Å; R106-C165 PolarHBondContact N-O 2.8Å; R106-V166 HydrophobicContact CB-CG2 4.09Å; R106-V166 CarbonylContact O-C 3.6Å; R106-V166 VanDerWaalsContact O-CA 3.22Å; R106-V166 WeakPolarHBondContact O-CA 3.36Å; R106-L167 PolarHBondContact O-N 3.29Å
107L91.6Very high81.4Confident0 Ų079.7 Ų79.70%043%0.425CS..EExtended strand (participates in β ladder)trans-83.5107.7175.3-75.475.4000108.2L105 F109 E114 Q115 A117 Q132 F133 L167 C169L105-L107 HydrophobicContact CB-CD1 4.2Å; L107-F109 HydrophobicContact CB-CE2 4.33Å; L107-E114 CarbonylContact O-C 3.55Å; L107-E114 VanDerWaalsContact O-CA 3.31Å; L107-E114 WeakPolarHBondContact O-CA 3.25Å; L107-Q115 HydrophobicContact CB-CB 4.32Å; L107-Q115 WeakPolarHBondContact CB-O 3.14Å; L107-Q115 PolarHBondContact N-O 2.82Å; L107-Q115 PolarHBondContact O-N 3.46Å; L107-A117 HydrophobicContact CD1-CB 3.28Å; L107-Q132 HydrophobicContact CD2-CB 4.22Å; L107-Q132 HydrophobicContact CD2-CG 4.07Å; L107-F133 HydrophobicContact CD2-CE2 3.6Å; L107-F133 HydrophobicContact CD2-CZ 3.65Å; L107-L167 CarbonylContact C-O 3.59Å; L107-L167 WeakPolarHBondContact CA-O 3.36Å; L107-C169 WeakPolarHBondContact CB-SG 3.34Å; L107-C169 VanDerWaalsContact CG-SG 3.52Å
108K91.7Very high83.4Confident62 Ų6281.8 Ų81.827%0.2742%0.421SS..EExtended strand (participates in β ladder)trans-95.1117.2175.5-175.7169.3-178173.30109.7R106 D112 E114 V166 L167 H168 C169R106-K108 PolarHBondContact O-N 3.22Å; K108-D112 IonicContact NZ-OD1 2.72Å; K108-E114 HydrophobicContact CB-CG 4.36Å; K108-E114 HydrophobicContact CG-CG 4.23Å; K108-V166 HydrophobicContact CB-CG1 3.64Å; K108-V166 HydrophobicContact CD-CG1 4.46Å; K108-L167 PolarHBondContact N-O 2.82Å; K108-H168 CarbonylContact O-C 3.54Å; K108-H168 WeakPolarHBondContact O-CA 3.29Å; K108-C169 PolarHBondContact O-N 2.78Å
109F89.4Confident85.2Confident33 Ų3377.5 Ų77.515%0.14539%0.391CS..EExtended strand (participates in β ladder)trans-87163.5177.3-64.5-87.2000111.3L107 N111 D112 S113 Q115 F133 C169 V171L107-F109 HydrophobicContact CB-CE2 4.33Å; F109-N111 WeakPolarHBondContact CB-OD1 3.2Å; F109-N111 PolarHBondContact O-N 2.72Å; F109-D112 PolarHBondContact O-N 3.44Å; F109-S113 WeakPolarHBondContact CB-OG 3.33Å; F109-S113 WeakPolarHBondContact CD2-O 3.49Å; F109-S113 WeakPolarHBondContact CD2-OG 3.2Å; F109-S113 PolarHBondContact N-O 3.1Å; F109-Q115 HydrophobicContact CE2-CB 3.7Å; F109-Q115 HydrophobicContact CZ-CB 4.47Å; F109-F133 AromaticContact CE1-CE1 3.38Å; F109-F133 HydrophobicContact CE1-CE1 3.38Å; F109-F133 AromaticContact CE1-CZ 3.48Å; F109-F133 HydrophobicContact CE1-CZ 3.48Å; F109-F133 VanDerWaalsContact CE1-CZ 3.48Å; F109-F133 AromaticContact CZ-CE1 3.4Å; F109-F133 HydrophobicContact CZ-CE1 3.4Å; F109-F133 AromaticContact CZ-CZ 3.42Å; F109-F133 HydrophobicContact CZ-CZ 3.42Å; F109-F133 VanDerWaalsContact CZ-CZ 3.42Å; F109-C169 HydrophobicContact CD1-CB 3.79Å; F109-C169 HydrophobicContact CE1-CB 3.83Å; F109-C169 HydrophobicContact CG-CB 4.4Å; F109-C169 HydrophobicContact CZ-CB 4.47Å; F109-V171 HydrophobicContact CD1-CG2 4.33Å; F109-V171 HydrophobicContact CE1-CG2 4.37Å
110L85.1Confident86.7Confident145 Ų14577.1 Ų77.176%0.75937%0.374SS*.THydrogen-bonded Turntrans-63.1-22.1178.4-17066.2000113.5D112L110-D112 PolarHBondContact O-N 3.19Å
111N87.1Confident87.7Confident115 Ų11573.3 Ų73.362%0.61536%0.36SS*.THydrogen-bonded Turntrans-85.519.7177.967.4-15000113.4F109 S113F109-N111 WeakPolarHBondContact CB-OD1 3.2Å; F109-N111 PolarHBondContact O-N 2.72Å; N111-S113 VanDerWaalsContact CG-OG 3.29Å; N111-S113 PolarHBondContact ND2-OG 2.88Å; N111-S113 PolarHBondContact O-N 3.14Å; N111-S113 VanDerWaalsContact OD1-CB 3.27Å; N111-S113 WeakPolarHBondContact OD1-CB 3.32Å; N111-S113 PolarHBondContact OD1-N 2.9Å; N111-S113 VanDerWaalsContact OD1-N 3.09Å; N111-S113 PolarHBondContact OD1-OG 2.68Å
112D85.7Confident88.2Confident126 Ų12670.1 Ų70.167%0.67435%0.345SS*.SBendtrans58.310-173.1-66.5-56.7000115.4K108 F109 L110K108-D112 IonicContact NZ-OD1 2.72Å; F109-D112 PolarHBondContact O-N 3.44Å; L110-D112 PolarHBondContact O-N 3.19Å
113S88.5Confident88.4Confident46 Ų4668.6 Ų68.632%0.32233%0.333SS..  trans-77142.7170.471.50000110.5F109 N111F109-S113 WeakPolarHBondContact CB-OG 3.33Å; F109-S113 WeakPolarHBondContact CD2-O 3.49Å; F109-S113 WeakPolarHBondContact CD2-OG 3.2Å; F109-S113 PolarHBondContact N-O 3.1Å; N111-S113 VanDerWaalsContact CG-OG 3.29Å; N111-S113 PolarHBondContact ND2-OG 2.88Å; N111-S113 PolarHBondContact O-N 3.14Å; N111-S113 VanDerWaalsContact OD1-CB 3.27Å; N111-S113 WeakPolarHBondContact OD1-CB 3.32Å; N111-S113 PolarHBondContact OD1-N 2.9Å; N111-S113 VanDerWaalsContact OD1-N 3.09Å; N111-S113 PolarHBondContact OD1-OG 2.68Å
114E90.1Very high88.7Confident94 Ų9469.9 Ų69.944%0.43934%0.342SS..EExtended strand (participates in β ladder)trans-121135.4176.2-63.8-174.2176.100109.9R106 L107 K108R106-E114 IonicContact CZ-OE2 3.28Å; R106-E114 VanDerWaalsContact CZ-OE2 3.28Å; R106-E114 IonicContact NE-OE2 3.16Å; R106-E114 PolarHBondContact NE-OE2 2.78Å; R106-E114 VanDerWaalsContact NE-OE2 3.16Å; R106-E114 VanDerWaalsContact NH2-CD 3.34Å; R106-E114 IonicContact NH2-OE1 3.27Å; R106-E114 PolarHBondContact NH2-OE1 2.9Å; R106-E114 IonicContact NH2-OE2 2.63Å; R106-E114 PolarHBondContact NH2-OE2 3.38Å; L107-E114 CarbonylContact O-C 3.55Å; L107-E114 VanDerWaalsContact O-CA 3.31Å; L107-E114 WeakPolarHBondContact O-CA 3.25Å; K108-E114 HydrophobicContact CB-CG 4.36Å; K108-E114 HydrophobicContact CG-CG 4.23Å
115Q90Very high88.8Confident73 Ų7367.8 Ų67.834%0.34133%0.329SS..EExtended strand (participates in β ladder)trans-124.5130.4177.7-179.2177.858.600109.7R106 L107 F109R106-Q115 CarbonylContact C-O 3.56Å; L107-Q115 HydrophobicContact CB-CB 4.32Å; L107-Q115 WeakPolarHBondContact CB-O 3.14Å; L107-Q115 PolarHBondContact N-O 2.82Å; L107-Q115 PolarHBondContact O-N 3.46Å; F109-Q115 HydrophobicContact CE2-CB 3.7Å; F109-Q115 HydrophobicContact CZ-CB 4.47Å
116V90.4Very high88.7Confident93 Ų9368.6 Ų68.656%0.56434%0.337SS*.EExtended strand (participates in β ladder)trans-88.8116.6177.2-178.40000109.1V104 L105 R106V104-V116 HydrophobicContact CG1-CG1 3.34Å; L105-V116 CarbonylContact O-C 3.48Å; L105-V116 WeakPolarHBondContact O-CA 3.46Å; R106-V116 HydrophobicContact CG-CG2 4.37Å
117A88.9Confident88.6Confident0 Ų065.9 Ų65.90%033%0.333CS..EExtended strand (participates in β ladder)trans-101.8138.3173.100000110.6L105 L107 L128 Q132L105-A117 HydrophobicContact CB-CB 4.38Å; L105-A117 PolarHBondContact N-O 2.78Å; L105-A117 PolarHBondContact O-N 2.89Å; L107-A117 HydrophobicContact CD1-CB 3.28Å; A117-L128 HydrophobicContact CB-CD1 4.12Å; A117-Q132 HydrophobicContact CB-CG 3.81Å
118R89.3Confident88.5Confident200 Ų20066 Ų6676%0.75533%0.334SS*.EExtended strand (participates in β ladder)trans-101.6125.1167.4-65.3-179.7177.7177.9-1.6107.8
119A87.4Confident88.4Confident3 Ų363.5 Ų63.53%0.02532%0.323CS..EExtended strand (participates in β ladder)trans-144.2158.3176.500000110.1L103 L105 L128 L156L103-A119 WeakPolarHBondContact CA-O 3.42Å; L103-A119 VanDerWaalsContact CB-O 3.29Å; L103-A119 WeakPolarHBondContact CB-O 3.32Å; L103-A119 PolarHBondContact N-O 3.05Å; L103-A119 PolarHBondContact O-N 3.44Å; L103-A119 VanDerWaalsContact O-O 3.06Å; L105-A119 HydrophobicContact CD1-CB 3.98Å; A119-L128 HydrophobicContact CB-CD1 3.73Å; A119-L156 HydrophobicContact CB-CD1 3.44Å; A119-L156 VanDerWaalsContact CB-CD1 3.44Å
120W87.3Confident88.3Confident113 Ų11370.1 Ų70.143%0.42835%0.347SS..  trans-91.2150.3178.5-57.492.1000110.6Q100 P102 H122 D123Q100-W120 VanDerWaalsContact O-CZ3 3.26Å; Q100-W120 WeakPolarHBondContact O-CZ3 3.46Å; P102-W120 HydrophobicContact CB-CE3 4.29Å; P102-W120 HydrophobicContact CB-CH2 4.31Å; P102-W120 HydrophobicContact CB-CZ3 4.17Å; W120-H122 WeakPolarHBondContact CB-CE1 3.35Å; W120-H122 WeakPolarHBondContact CB-NE2 3.33Å; W120-H122 AromaticContact CD2-CE1 4Å; W120-H122 AromaticContact CG-CE1 3.64Å; W120-H122 AromaticContact CG-NE2 3.74Å; W120-H122 PolarHBondContact O-N 3.29Å; W120-H122 VanDerWaalsContact O-N 3.11Å; W120-D123 VanDerWaalsContact CD1-OD2 3.29Å; W120-D123 PolarHBondContact N-OD2 2.98Å; W120-D123 WeakPolarHBondContact O-CB 3.47Å; W120-D123 PolarHBondContact O-N 3.1Å
121P85.9Confident88.5Confident41 Ų4167.8 Ų67.827%0.26634%0.339SS..THydrogen-bonded Turntrans-60-23.5176.823.3-33.4000113G157P121-G157 WeakPolarHBondContact O-CA 3.46Å; P121-G157 PolarHBondContact O-N 3.4Å
122H86.8Confident88.5Confident98 Ų9864.1 Ų64.145%0.45432%0.318SS..THydrogen-bonded Turntrans-86.4-9.2175.357-101.4000114Q100 W120Q100-H122 PolarHBondContact OE1-CE1 2.86Å; Q100-H122 PolarHBondContact OE1-ND1 2.79Å; W120-H122 WeakPolarHBondContact CB-CE1 3.35Å; W120-H122 WeakPolarHBondContact CB-NE2 3.33Å; W120-H122 AromaticContact CD2-CE1 4Å; W120-H122 AromaticContact CG-CE1 3.64Å; W120-H122 AromaticContact CG-NE2 3.74Å; W120-H122 PolarHBondContact O-N 3.29Å; W120-H122 VanDerWaalsContact O-N 3.11Å
123D88Confident88.5Confident36 Ų3659.2 Ų59.219%0.19329%0.291CS..  trans-69.7145.2176.2-74.9-31.8000110.7W120 T155 L156W120-D123 VanDerWaalsContact CD1-OD2 3.29Å; W120-D123 PolarHBondContact N-OD2 2.98Å; W120-D123 WeakPolarHBondContact O-CB 3.47Å; W120-D123 PolarHBondContact O-N 3.1Å; D123-T155 WeakPolarHBondContact O-CA 3.48Å; D123-L156 HydrophobicContact CB-CD1 4.19Å; D123-L156 PolarHBondContact O-N 2.84Å
124T91Very high88.4Confident48 Ų4861.9 Ų61.929%0.29431%0.307SS..BIsolated β-bridgetrans-82.5159.3174.665.10000112.2G126 S127 L128 D152 T153 Q154 T155T124-G126 PolarHBondContact O-N 3.46Å; T124-S127 WeakPolarHBondContact O-CB 3.35Å; T124-S127 PolarHBondContact O-N 2.64Å; T124-S127 VanDerWaalsContact O-N 3.09Å; T124-S127 PolarHBondContact OG1-N 2.99Å; T124-L128 PolarHBondContact O-N 3.15Å; T124-D152 WeakPolarHBondContact CB-O 3.32Å; T124-D152 PolarHBondContact OG1-O 3.33Å; T124-T153 WeakPolarHBondContact CG2-O 2.77Å; T124-Q154 CarbonylContact C-O 3.49Å; T124-Q154 WeakPolarHBondContact CA-O 3.33Å; T124-T155 HydrophobicContact CG2-CG2 4.47Å
125I89.6Confident88Confident1 Ų160.9 Ų60.91%0.00532%0.322CS..Hα-helixtrans-56.4-38.5172.1-61.5-51000111.3L128 K129 L142 L149 Q154 L156 L159I125-L128 PolarHBondContact O-N 3.18Å; I125-K129 HydrophobicContact CG2-CD 4.2Å; I125-K129 HydrophobicContact CG2-CG 4.45Å; I125-K129 WeakPolarHBondContact O-CB 3.46Å; I125-K129 WeakPolarHBondContact O-CG 3.28Å; I125-K129 PolarHBondContact O-N 3.27Å; I125-L142 HydrophobicContact CG2-CD1 3.81Å; I125-L149 HydrophobicContact CD1-CD2 3.73Å; I125-L149 HydrophobicContact CG1-CD2 4.28Å; I125-L149 HydrophobicContact CG2-CB 4.46Å; I125-Q154 HydrophobicContact CG1-CB 4.39Å; I125-Q154 WeakPolarHBondContact CG1-O 3.23Å; I125-Q154 PolarHBondContact N-O 2.99Å; I125-L156 HydrophobicContact CD1-CD2 3.39Å; I125-L156 HydrophobicContact CD1-CG 4.18Å; I125-L159 HydrophobicContact CD1-CD1 3.65Å; I125-L159 HydrophobicContact CG1-CD1 3.95Å
126G88.1Confident87.6Confident16 Ų1664.6 Ų64.617%0.16533%0.333CS..Hα-helixtrans-62.4-42.4174.300000113.1T124 K129 R130 D152T124-G126 PolarHBondContact O-N 3.46Å; G126-K129 PolarHBondContact O-N 3.25Å; G126-R130 WeakPolarHBondContact O-CB 3.44Å; G126-R130 PolarHBondContact O-N 3.31Å; G126-D152 PolarHBondContact N-O 3.12Å
127S88.7Confident87.3Confident40 Ų4062.8 Ų62.828%0.2832%0.318SS..Hα-helixtrans-60.7-46174.4169.40000111.8T124 R130 T131T124-S127 WeakPolarHBondContact O-CB 3.35Å; T124-S127 PolarHBondContact O-N 2.64Å; T124-S127 VanDerWaalsContact O-N 3.09Å; T124-S127 PolarHBondContact OG1-N 2.99Å; S127-R130 PolarHBondContact O-N 3.02Å; S127-T131 WeakPolarHBondContact O-CB 3.41Å; S127-T131 PolarHBondContact O-N 2.93Å; S127-T131 PolarHBondContact O-OG1 2.82Å
128L89.1Confident86.9Confident3 Ų369 Ų692%0.01635%0.347CS..Hα-helixtrans-60.8-47.3176.8179.171.5000111.2L105 A117 A119 T124 I125 R130 T131 Q132 L142 L156L105-L128 HydrophobicContact CD1-CD1 4.07Å; L105-L128 HydrophobicContact CD1-CD2 4.02Å; A117-L128 HydrophobicContact CB-CD1 4.12Å; A119-L128 HydrophobicContact CB-CD1 3.73Å; T124-L128 PolarHBondContact O-N 3.15Å; I125-L128 PolarHBondContact O-N 3.18Å; L128-R130 VanDerWaalsContact C-N 3.32Å; L128-R130 PolarHBondContact O-N 3.47Å; L128-T131 PolarHBondContact O-N 3.34Å; L128-Q132 HydrophobicContact CD1-CG 4.09Å; L128-Q132 PolarHBondContact O-N 2.96Å; L128-L142 HydrophobicContact CD2-CD1 4.1Å; L128-L156 HydrophobicContact CD2-CD1 4.49Å; L128-L156 HydrophobicContact CD2-CD2 3.98Å
129K89.9Confident86.6Confident10 Ų1061.2 Ų61.24%0.04332%0.319CS..Hα-helixtrans-59.1-43.4177.7-76.1175.5-177.8170.60111.3I125 G126 T131 F133 E137 V140 L142 L149 D152I125-K129 HydrophobicContact CG2-CD 4.2Å; I125-K129 HydrophobicContact CG2-CG 4.45Å; I125-K129 WeakPolarHBondContact O-CB 3.46Å; I125-K129 WeakPolarHBondContact O-CG 3.28Å; I125-K129 PolarHBondContact O-N 3.27Å; G126-K129 PolarHBondContact O-N 3.25Å; K129-T131 VanDerWaalsContact C-N 3.35Å; K129-T131 PolarHBondContact O-N 2.96Å; K129-F133 CarbonylContact O-C 3.48Å; K129-F133 VanDerWaalsContact O-CA 3.31Å; K129-F133 WeakPolarHBondContact O-CA 3.46Å; K129-F133 WeakPolarHBondContact O-CB 3.3Å; K129-F133 PolarHBondContact O-N 3.45Å; K129-E137 HydrophobicContact CB-CB 4.3Å; K129-E137 HydrophobicContact CB-CG 4.26Å; K129-V140 WeakPolarHBondContact CE-O 3.27Å; K129-L142 HydrophobicContact CD-CD1 4.39Å; K129-L142 HydrophobicContact CG-CD1 3.75Å; K129-L142 HydrophobicContact CG-CG 4.45Å; K129-L149 PolarHBondContact NZ-O 3.31Å; K129-D152 IonicContact NZ-OD1 3.81Å; K129-D152 PolarHBondContact NZ-OD1 2.99Å
130R87.7Confident86.6Confident172 Ų17261.2 Ų61.265%0.64932%0.319SS*.Hα-helixtrans-66.4-36.4179.3-174.3152.5-173.7172.73.2113.2G126 S127 L128 E137G126-R130 WeakPolarHBondContact O-CB 3.44Å; G126-R130 PolarHBondContact O-N 3.31Å; S127-R130 PolarHBondContact O-N 3.02Å; L128-R130 VanDerWaalsContact C-N 3.32Å; L128-R130 PolarHBondContact O-N 3.47Å; R130-E137 WeakPolarHBondContact CA-OE1 3.39Å; R130-E137 HydrophobicContact CB-CG 4.13Å; R130-E137 WeakPolarHBondContact CB-OE1 3.06Å; R130-E137 WeakPolarHBondContact CD-OE1 2.91Å; R130-E137 WeakPolarHBondContact CG-OE1 3.27Å; R130-E137 IonicContact NE-OE1 3.9Å
131T88.7Confident86.7Confident96 Ų9662.3 Ų62.359%0.58932%0.323SS*.Hα-helixtrans-73.8-43179.5-55.60000111.8S127 L128 K129S127-T131 WeakPolarHBondContact O-CB 3.41Å; S127-T131 PolarHBondContact O-N 2.93Å; S127-T131 PolarHBondContact O-OG1 2.82Å; L128-T131 PolarHBondContact O-N 3.34Å; K129-T131 VanDerWaalsContact C-N 3.35Å; K129-T131 PolarHBondContact O-N 2.96Å
132Q86.5Confident86.8Confident38 Ų3860.4 Ų60.418%0.17831%0.311CS..Hα-helixtrans-84.8-30.2-178.3-66.1-62.5-36.900113.4L107 A117 L128L107-Q132 HydrophobicContact CD2-CB 4.22Å; L107-Q132 HydrophobicContact CD2-CG 4.07Å; A117-Q132 HydrophobicContact CB-CG 3.81Å; L128-Q132 HydrophobicContact CD1-CG 4.09Å; L128-Q132 PolarHBondContact O-N 2.96Å
133F87.1Confident87Confident23 Ų2358.3 Ų58.310%0.10130%0.302CS..SBendtrans-133.662.6-171.7-52.9-71.6000112.7L107 F109 K129 G135 R136 E137 V140L107-F133 HydrophobicContact CD2-CE2 3.6Å; L107-F133 HydrophobicContact CD2-CZ 3.65Å; F109-F133 AromaticContact CE1-CE1 3.38Å; F109-F133 HydrophobicContact CE1-CE1 3.38Å; F109-F133 AromaticContact CE1-CZ 3.48Å; F109-F133 HydrophobicContact CE1-CZ 3.48Å; F109-F133 VanDerWaalsContact CE1-CZ 3.48Å; F109-F133 AromaticContact CZ-CE1 3.4Å; F109-F133 HydrophobicContact CZ-CE1 3.4Å; F109-F133 AromaticContact CZ-CZ 3.42Å; F109-F133 HydrophobicContact CZ-CZ 3.42Å; F109-F133 VanDerWaalsContact CZ-CZ 3.42Å; K129-F133 CarbonylContact O-C 3.48Å; K129-F133 VanDerWaalsContact O-CA 3.31Å; K129-F133 WeakPolarHBondContact O-CA 3.46Å; K129-F133 WeakPolarHBondContact O-CB 3.3Å; K129-F133 PolarHBondContact O-N 3.45Å; F133-G135 PolarHBondContact O-N 2.82Å; F133-G135 VanDerWaalsContact O-N 3.16Å; F133-R136 HydrophobicContact CB-CB 4.31Å; F133-R136 PolarHBondContact O-N 2.88Å; F133-E137 PolarHBondContact O-N 2.83Å; F133-V140 HydrophobicContact CB-CG2 3.97Å; F133-V140 HydrophobicContact CD1-CG2 4.01Å; F133-V140 HydrophobicContact CD2-CB 4.13Å; F133-V140 HydrophobicContact CD2-CG1 3.85Å; F133-V140 HydrophobicContact CD2-CG2 3.84Å; F133-V140 HydrophobicContact CE1-CG2 4.48Å; F133-V140 HydrophobicContact CE2-CB 4.48Å; F133-V140 HydrophobicContact CE2-CG1 3.72Å; F133-V140 HydrophobicContact CE2-CG2 4.32Å; F133-V140 HydrophobicContact CG-CB 4.43Å; F133-V140 HydrophobicContact CG-CG1 4.5Å; F133-V140 HydrophobicContact CG-CG2 3.66Å; F133-V140 HydrophobicContact CZ-CG1 4.27Å
134P85.6Confident87Confident101 Ų10157.9 Ų57.966%0.65630%0.298SS*.THydrogen-bonded Turntrans-57.3123.5-177.824.3-34.2000111.1R136P134-R136 PolarHBondContact O-N 3Å
135G81.1Confident86.7Confident73 Ų7363 Ų6375%0.75332%0.318SS*.THydrogen-bonded Turntrans77.8-3-179.600000115.7F133F133-G135 PolarHBondContact O-N 2.82Å; F133-G135 VanDerWaalsContact O-N 3.16Å
136R82.5Confident86.4Confident152 Ų15266.5 Ų66.557%0.57436%0.355SS*.THydrogen-bonded Turntrans-118.113.7175.4-62.9-174.4-173.1176.91113.2F133 P134 Q138 Q139 V140F133-R136 HydrophobicContact CB-CB 4.31Å; F133-R136 PolarHBondContact O-N 2.88Å; P134-R136 PolarHBondContact O-N 3Å; R136-Q138 VanDerWaalsContact C-N 3.3Å; R136-Q138 PolarHBondContact O-N 3.06Å; R136-Q139 HydrophobicContact CB-CB 4.39Å; R136-Q139 WeakPolarHBondContact O-CA 3.21Å; R136-Q139 VanDerWaalsContact O-CB 3.32Å; R136-Q139 WeakPolarHBondContact O-CB 3.22Å; R136-Q139 PolarHBondContact O-N 3.42Å; R136-V140 WeakPolarHBondContact O-CG2 3.45Å; R136-V140 PolarHBondContact O-N 3.08Å
137E84.2Confident86.3Confident54 Ų5472 Ų7225%0.25238%0.376SS..G310 helixtrans-50.5-46.3-175.6-64.1162.6-141.600113K129 R130 F133 Q139 V140K129-E137 HydrophobicContact CB-CB 4.3Å; K129-E137 HydrophobicContact CB-CG 4.26Å; R130-E137 WeakPolarHBondContact CA-OE1 3.39Å; R130-E137 HydrophobicContact CB-CG 4.13Å; R130-E137 WeakPolarHBondContact CB-OE1 3.06Å; R130-E137 WeakPolarHBondContact CD-OE1 2.91Å; R130-E137 WeakPolarHBondContact CG-OE1 3.27Å; R130-E137 IonicContact NE-OE1 3.9Å; F133-E137 PolarHBondContact O-N 2.83Å; E137-Q139 VanDerWaalsContact C-N 3.27Å; E137-Q139 PolarHBondContact O-N 3.08Å; E137-V140 PolarHBondContact O-N 3.17Å
138Q80.3Confident86.2Confident131 Ų13174.7 Ų74.761%0.61239%0.387SS*.G310 helixtrans-73.3-18.4-179.9-63.5-175.1-29.800113.9R136R136-Q138 VanDerWaalsContact C-N 3.3Å; R136-Q138 PolarHBondContact O-N 3.06Å
139Q84Confident86Confident37 Ų3774.9 Ų74.917%0.17339%0.388CS..G310 helixtrans-84.7-21177.2-65.6177.611.600111.2R136 E137 V171 S172 V175R136-Q139 HydrophobicContact CB-CB 4.39Å; R136-Q139 WeakPolarHBondContact O-CA 3.21Å; R136-Q139 VanDerWaalsContact O-CB 3.32Å; R136-Q139 WeakPolarHBondContact O-CB 3.22Å; R136-Q139 PolarHBondContact O-N 3.42Å; E137-Q139 VanDerWaalsContact C-N 3.27Å; E137-Q139 PolarHBondContact O-N 3.08Å; Q139-V171 HydrophobicContact CB-CG1 4.34Å; Q139-V171 CarbonylContact O-C 3.53Å; Q139-S172 WeakPolarHBondContact CB-O 3.32Å; Q139-S172 VanDerWaalsContact CG-O 3.25Å; Q139-S172 WeakPolarHBondContact CG-O 3.31Å; Q139-S172 PolarHBondContact O-N 2.8Å; Q139-V175 HydrophobicContact CG-CG2 3.8Å
140V87.5Confident85.6Confident3 Ų376.7 Ų76.72%0.01841%0.409CS..EExtended strand (participates in β ladder)trans-94.9115.9-173.7-178.50000111.1K129 F133 R136 E137 L142 H170 V171K129-V140 WeakPolarHBondContact CE-O 3.27Å; F133-V140 HydrophobicContact CB-CG2 3.97Å; F133-V140 HydrophobicContact CD1-CG2 4.01Å; F133-V140 HydrophobicContact CD2-CB 4.13Å; F133-V140 HydrophobicContact CD2-CG1 3.85Å; F133-V140 HydrophobicContact CD2-CG2 3.84Å; F133-V140 HydrophobicContact CE1-CG2 4.48Å; F133-V140 HydrophobicContact CE2-CB 4.48Å; F133-V140 HydrophobicContact CE2-CG1 3.72Å; F133-V140 HydrophobicContact CE2-CG2 4.32Å; F133-V140 HydrophobicContact CG-CB 4.43Å; F133-V140 HydrophobicContact CG-CG1 4.5Å; F133-V140 HydrophobicContact CG-CG2 3.66Å; F133-V140 HydrophobicContact CZ-CG1 4.27Å; R136-V140 WeakPolarHBondContact O-CG2 3.45Å; R136-V140 PolarHBondContact O-N 3.08Å; E137-V140 PolarHBondContact O-N 3.17Å; V140-L142 HydrophobicContact CG1-CD2 4.3Å; V140-L142 HydrophobicContact CG1-CG 4.34Å; V140-H170 WeakPolarHBondContact CA-O 3.38Å; V140-V171 HydrophobicContact CG2-CG1 4.42Å; V140-V171 HydrophobicContact CG2-CG2 4.2Å
141R87.8Confident85.5Confident136 Ų13671.8 Ų71.851%0.51340%0.396SS..EExtended strand (participates in β ladder)trans-96.6116.4169.3-71.4-174.4-174.8-172.10.4108.6L148 H170R141-L148 HydrophobicContact CB-CD1 3.58Å; R141-L148 HydrophobicContact CG-CD1 3.91Å; R141-H170 HydrophobicContact CB-CB 4.3Å; R141-H170 PolarHBondContact N-O 2.72Å; R141-H170 PolarHBondContact O-N 3.39Å
142L89.5Confident85.4Confident1 Ų170.6 Ų70.61%0.00539%0.386CS..EExtended strand (participates in β ladder)trans-91132.2174.5-69.9170.6000108.6I125 L128 K129 V140 L149 L167 C169I125-L142 HydrophobicContact CG2-CD1 3.81Å; L128-L142 HydrophobicContact CD2-CD1 4.1Å; K129-L142 HydrophobicContact CD-CD1 4.39Å; K129-L142 HydrophobicContact CG-CD1 3.75Å; K129-L142 HydrophobicContact CG-CG 4.45Å; V140-L142 HydrophobicContact CG1-CD2 4.3Å; V140-L142 HydrophobicContact CG1-CG 4.34Å; L142-L149 HydrophobicContact CB-CB 4.04Å; L142-L149 WeakPolarHBondContact O-CB 3.24Å; L142-L149 PolarHBondContact O-N 2.82Å; L142-L167 HydrophobicContact CB-CD2 4.38Å; L142-L167 HydrophobicContact CD1-CD2 4.5Å; L142-L167 HydrophobicContact CD2-CD2 4.23Å; L142-C169 HydrophobicContact CD2-CB 4.43Å; L142-C169 WeakPolarHBondContact CD2-SG 3.22Å
143I89.7Confident85.4Confident53 Ų5373.9 Ų73.927%0.27241%0.408SS..EExtended strand (participates in β ladder)trans-128.4126-175.6-58.1158.2000108.2Q147 L148 H168 H170I143-Q147 VanDerWaalsContact CA-O 3.3Å; I143-Q147 WeakPolarHBondContact CA-O 3.49Å; I143-L148 HydrophobicContact CG1-CD1 4.09Å; I143-H168 HydrophobicContact CB-CB 4.04Å; I143-H168 PolarHBondContact N-O 3.33Å; I143-H168 PolarHBondContact O-N 2.79Å; I143-H170 HydrophobicContact CD1-CB 4.38Å
144Y88.4Confident85.4Confident28 Ų2876.5 Ų76.511%0.1142%0.421CS..EExtended strand (participates in β ladder)trans-132.8130177.3178.8-108.5000109.1G146 Q147 L149 L161 P162 C165 L167Y144-G146 PolarHBondContact O-N 2.85Å; Y144-G146 VanDerWaalsContact O-N 3.1Å; Y144-Q147 PolarHBondContact N-O 2.98Å; Y144-Q147 WeakPolarHBondContact O-CB 3.48Å; Y144-Q147 PolarHBondContact O-N 3.28Å; Y144-L149 VanDerWaalsContact CB-CD1 3.45Å; Y144-L149 VanDerWaalsContact N-CD1 3.32Å; Y144-L161 HydrophobicContact CD1-CD2 3.43Å; Y144-L161 VanDerWaalsContact CD1-CD2 3.43Å; Y144-L161 HydrophobicContact CD2-CD2 3.7Å; Y144-L161 HydrophobicContact CE1-CD2 3.39Å; Y144-L161 HydrophobicContact CE2-CD2 3.68Å; Y144-L161 HydrophobicContact CG-CD2 3.57Å; Y144-P162 WeakPolarHBondContact OH-CD 3.29Å; Y144-C165 HydrophobicContact CE2-CB 4.03Å; Y144-L167 HydrophobicContact CD2-CD1 4.31Å
145Q84.8Confident85.5Confident155 Ų15574.1 Ų74.172%0.72441%0.405SS*.THydrogen-bonded Turntrans50.434.1-177.6-61.2-174.56.100114.6Q147Q145-Q147 PolarHBondContact O-N 2.75Å
146G83.1Confident85.7Confident74 Ų7470.7 Ų70.776%0.76337%0.369SS*.THydrogen-bonded Turntrans76.70.2-17700000114.8Y144Y144-G146 PolarHBondContact O-N 2.85Å; Y144-G146 VanDerWaalsContact O-N 3.1Å
147Q85.7Confident85.8Confident132 Ų13265 Ų6562%0.61736%0.358SS*.EExtended strand (participates in β ladder)trans-94.6136173.7-62.4-173.7-29.700110.4I143 Y144 Q145 L149I143-Q147 VanDerWaalsContact CA-O 3.3Å; I143-Q147 WeakPolarHBondContact CA-O 3.49Å; Y144-Q147 PolarHBondContact N-O 2.98Å; Y144-Q147 WeakPolarHBondContact O-CB 3.48Å; Y144-Q147 PolarHBondContact O-N 3.28Å; Q145-Q147 PolarHBondContact O-N 2.75Å; Q147-L149 WeakPolarHBondContact O-CD1 3.22Å
148L87.5Confident85.8Confident96 Ų9665.4 Ų65.450%0.50337%0.367SS..EExtended strand (participates in β ladder)trans-81119.4173.4177.366.5000109.7R141 I143 G150R141-L148 HydrophobicContact CB-CD1 3.58Å; R141-L148 HydrophobicContact CG-CD1 3.91Å; I143-L148 HydrophobicContact CG1-CD1 4.09Å; L148-G150 PolarHBondContact O-N 3.46Å
149L84.7Confident85.7Confident8 Ų860.7 Ų60.74%0.04235%0.346CS..EExtended strand (participates in β ladder)trans-83.973.4175-72.879.4000108.3I125 K129 L142 Y144 Q147 L159 L167I125-L149 HydrophobicContact CD1-CD2 3.73Å; I125-L149 HydrophobicContact CG1-CD2 4.28Å; I125-L149 HydrophobicContact CG2-CB 4.46Å; K129-L149 PolarHBondContact NZ-O 3.31Å; L142-L149 HydrophobicContact CB-CB 4.04Å; L142-L149 WeakPolarHBondContact O-CB 3.24Å; L142-L149 PolarHBondContact O-N 2.82Å; Y144-L149 VanDerWaalsContact CB-CD1 3.45Å; Y144-L149 VanDerWaalsContact N-CD1 3.32Å; Q147-L149 WeakPolarHBondContact O-CD1 3.22Å; L149-L159 HydrophobicContact CD2-CD1 3.44Å; L149-L159 VanDerWaalsContact CD2-CD1 3.44Å; L149-L159 HydrophobicContact CD2-CD2 3.98Å; L149-L159 HydrophobicContact CD2-CG 4.3Å; L149-L159 HydrophobicContact CG-CD1 4.28Å; L149-L159 HydrophobicContact CG-CD2 4.13Å; L149-L167 HydrophobicContact CD2-CD2 4.45Å
150G81.2Confident85.6Confident47 Ų4766.8 Ų66.849%0.48537%0.374SS..  trans-83.9-24.7179.700000113.7L148 D152L148-G150 PolarHBondContact O-N 3.46Å; G150-D152 PolarHBondContact O-N 2.87Å
151D85.7Confident85.3Confident70 Ų7067.2 Ų67.237%0.37438%0.376SS..  trans-79.9101.7-177.3-168.5-11.2000110.7T153 Q154D151-T153 PolarHBondContact O-N 3.45Å; D151-T153 VanDerWaalsContact O-N 3.15Å; D151-T153 WeakPolarHBondContact OD1-CB 3.22Å; D151-T153 PolarHBondContact OD1-N 2.89Å; D151-T153 PolarHBondContact OD1-OG1 3.28Å; D151-Q154 HydrophobicContact CB-CB 4.44Å; D151-Q154 HydrophobicContact CB-CG 3.94Å; D151-Q154 PolarHBondContact O-N 3.5Å
152D85.8Confident85Confident71 Ų7163.7 Ų63.738%0.3837%0.371SS..THydrogen-bonded Turntrans-65.1-13.8179.4-70.4-20000112.8T124 G126 K129 G150T124-D152 WeakPolarHBondContact CB-O 3.32Å; T124-D152 PolarHBondContact OG1-O 3.33Å; G126-D152 PolarHBondContact N-O 3.12Å; K129-D152 IonicContact NZ-OD1 3.81Å; K129-D152 PolarHBondContact NZ-OD1 2.99Å; G150-D152 PolarHBondContact O-N 2.87Å
153T86.9Confident84.6Confident106 Ų10668.2 Ų68.265%0.6540%0.4SS*.THydrogen-bonded Turntrans-91.2-16.6179.472.20000114T124 D151T124-T153 WeakPolarHBondContact CG2-O 2.77Å; D151-T153 PolarHBondContact O-N 3.45Å; D151-T153 VanDerWaalsContact O-N 3.15Å; D151-T153 WeakPolarHBondContact OD1-CB 3.22Å; D151-T153 PolarHBondContact OD1-N 2.89Å; D151-T153 PolarHBondContact OD1-OG1 3.28Å
154Q87.3Confident84.4Confident78 Ų7870.4 Ų70.436%0.36441%0.412SS..SBendtrans-66.8140.3178.3-80.4-171.718.200111.7T124 I125 D151 L159T124-Q154 CarbonylContact C-O 3.49Å; T124-Q154 WeakPolarHBondContact CA-O 3.33Å; I125-Q154 HydrophobicContact CG1-CB 4.39Å; I125-Q154 WeakPolarHBondContact CG1-O 3.23Å; I125-Q154 PolarHBondContact N-O 2.99Å; D151-Q154 HydrophobicContact CB-CB 4.44Å; D151-Q154 HydrophobicContact CB-CG 3.94Å; D151-Q154 PolarHBondContact O-N 3.5Å; Q154-L159 HydrophobicContact CB-CD1 4.43Å
155T88.3Confident84.4Confident51 Ų5169.6 Ų69.631%0.31341%0.41SS..BIsolated β-bridgetrans-82.1146.3175630000111D123 T124 G157 S158 L159D123-T155 WeakPolarHBondContact O-CA 3.48Å; T124-T155 HydrophobicContact CG2-CG2 4.47Å; T155-G157 PolarHBondContact O-N 3.09Å; T155-S158 PolarHBondContact N-OG 3.29Å; T155-S158 PolarHBondContact O-N 3.42Å; T155-S158 VanDerWaalsContact O-N 3.1Å; T155-S158 PolarHBondContact O-OG 3.46Å; T155-S158 WeakPolarHBondContact OG1-CB 3.46Å; T155-S158 PolarHBondContact OG1-N 2.93Å; T155-S158 VanDerWaalsContact OG1-N 3.14Å; T155-S158 PolarHBondContact OG1-OG 3.1Å; T155-L159 PolarHBondContact O-N 3.32Å
156L85.1Confident84.6Confident1 Ų164.5 Ų64.51%0.00539%0.39CS..THydrogen-bonded Turntrans-58.4-32.5175-69.1168.9000112L105 A119 D123 I125 L128 L159 L161L105-L156 HydrophobicContact CD1-CD1 3.99Å; L105-L156 HydrophobicContact CD1-CD2 4.22Å; A119-L156 HydrophobicContact CB-CD1 3.44Å; A119-L156 VanDerWaalsContact CB-CD1 3.44Å; D123-L156 HydrophobicContact CB-CD1 4.19Å; D123-L156 PolarHBondContact O-N 2.84Å; I125-L156 HydrophobicContact CD1-CD2 3.39Å; I125-L156 HydrophobicContact CD1-CG 4.18Å; L128-L156 HydrophobicContact CD2-CD1 4.49Å; L128-L156 HydrophobicContact CD2-CD2 3.98Å; L156-L159 PolarHBondContact O-N 3.48Å; L156-L161 HydrophobicContact CB-CD1 4.3Å; L156-L161 HydrophobicContact CD2-CD1 3.5Å
157G83.7Confident84.9Confident33 Ų3361 Ų6134%0.3435%0.354SS..THydrogen-bonded Turntrans-67.6-38.6175.200000113.4P121 T155 L159 H160P121-G157 WeakPolarHBondContact O-CA 3.46Å; P121-G157 PolarHBondContact O-N 3.4Å; T155-G157 PolarHBondContact O-N 3.09Å; G157-L159 PolarHBondContact O-N 3.37Å; G157-H160 PolarHBondContact O-N 2.81Å
158S83.7Confident85.2Confident63 Ų6359.5 Ų59.544%0.44135%0.346SS..THydrogen-bonded Turntrans-65.8-23.9176.952.40000113.7T155 H160T155-S158 PolarHBondContact N-OG 3.29Å; T155-S158 PolarHBondContact O-N 3.42Å; T155-S158 VanDerWaalsContact O-N 3.1Å; T155-S158 PolarHBondContact O-OG 3.46Å; T155-S158 WeakPolarHBondContact OG1-CB 3.46Å; T155-S158 PolarHBondContact OG1-N 2.93Å; T155-S158 VanDerWaalsContact OG1-N 3.14Å; T155-S158 PolarHBondContact OG1-OG 3.1Å; S158-H160 PolarHBondContact O-N 3.48Å
159L79.5Confident85.3Confident32 Ų3255.1 Ų55.117%0.16832%0.324CS..THydrogen-bonded Turntrans-82.81.1175.5-74.1147.6000112.9I125 L149 Q154 T155 L156 G157 L161I125-L159 HydrophobicContact CD1-CD1 3.65Å; I125-L159 HydrophobicContact CG1-CD1 3.95Å; L149-L159 HydrophobicContact CD2-CD1 3.44Å; L149-L159 VanDerWaalsContact CD2-CD1 3.44Å; L149-L159 HydrophobicContact CD2-CD2 3.98Å; L149-L159 HydrophobicContact CD2-CG 4.3Å; L149-L159 HydrophobicContact CG-CD1 4.28Å; L149-L159 HydrophobicContact CG-CD2 4.13Å; Q154-L159 HydrophobicContact CB-CD1 4.43Å; T155-L159 PolarHBondContact O-N 3.32Å; L156-L159 PolarHBondContact O-N 3.48Å; G157-L159 PolarHBondContact O-N 3.37Å; L159-L161 HydrophobicContact CB-CD1 4.29Å; L159-L161 HydrophobicContact CB-CD2 4.21Å; L159-L161 HydrophobicContact CB-CG 3.82Å; L159-L161 PolarHBondContact O-N 2.76Å; L159-L161 VanDerWaalsContact O-N 3.16Å
160H81.4Confident85.5Confident164 Ų16458.3 Ų58.376%0.75934%0.338SS*.THydrogen-bonded Turntrans47.642.3-177.6-71.1-84.1000112.7G157 S158 P162G157-H160 PolarHBondContact O-N 2.81Å; S158-H160 PolarHBondContact O-N 3.48Å; H160-P162 WeakPolarHBondContact O-CD 3.29Å
161L81.4Confident85.7Confident13 Ų1358.7 Ų58.77%0.06833%0.331CS..PPolyproline II helixtrans-69.8118.2179.2-64.1177.5000109.5L103 L105 Y144 L156 L159 L167L103-L161 HydrophobicContact CD2-CB 4.08Å; L105-L161 HydrophobicContact CD2-CD1 4.21Å; Y144-L161 HydrophobicContact CD1-CD2 3.43Å; Y144-L161 VanDerWaalsContact CD1-CD2 3.43Å; Y144-L161 HydrophobicContact CD2-CD2 3.7Å; Y144-L161 HydrophobicContact CE1-CD2 3.39Å; Y144-L161 HydrophobicContact CE2-CD2 3.68Å; Y144-L161 HydrophobicContact CG-CD2 3.57Å; L156-L161 HydrophobicContact CB-CD1 4.3Å; L156-L161 HydrophobicContact CD2-CD1 3.5Å; L159-L161 HydrophobicContact CB-CD1 4.29Å; L159-L161 HydrophobicContact CB-CD2 4.21Å; L159-L161 HydrophobicContact CB-CG 3.82Å; L159-L161 PolarHBondContact O-N 2.76Å; L159-L161 VanDerWaalsContact O-N 3.16Å; L161-L167 HydrophobicContact CD1-CD1 4.38Å; L161-L167 HydrophobicContact CD2-CD1 4.46Å
162P81.2Confident85.3Confident62 Ų6256.8 Ų56.840%0.40332%0.324SS..PPolyproline II helixtrans-69.2158.917727-30.6000110.8Y144 H160 N164 C165Y144-P162 WeakPolarHBondContact OH-CD 3.29Å; H160-P162 WeakPolarHBondContact O-CD 3.29Å; P162-N164 PolarHBondContact O-N 3.43Å; P162-C165 HydrophobicContact CG-CB 3.89Å; P162-C165 WeakPolarHBondContact O-CB 3.15Å; P162-C165 PolarHBondContact O-N 3.31Å
163P82.3Confident84.5Confident95 Ų9559.8 Ų59.862%0.61734%0.344SS*.THydrogen-bonded Turntrans-60.4135.6172.625.9-33.3000110.8L103 C165L103-P163 VanDerWaalsContact CD1-CA 3.46Å; L103-P163 HydrophobicContact CD1-CB 4.01Å; P163-C165 VanDerWaalsContact C-N 3.35Å
164N85.1Confident83.2Confident100 Ų10061.6 Ų61.654%0.53534%0.339SS..THydrogen-bonded Turntrans68.125-176-49.7-73.8000115.1V104 P162V104-N164 WeakPolarHBondContact O-CA 3.1Å; V104-N164 PolarHBondContact O-N 3.44Å; P162-N164 PolarHBondContact O-N 3.43Å
165C87.8Confident81.6Confident10 Ų1062.2 Ų62.27%0.06835%0.348CS..PPolyproline II helixtrans-67.5153.817577.60000112.3L105 R106 Y144 P162 P163 L167L105-C165 WeakPolarHBondContact CD2-SG 3.37Å; R106-C165 PolarHBondContact N-O 2.8Å; Y144-C165 HydrophobicContact CE2-CB 4.03Å; P162-C165 HydrophobicContact CG-CB 3.89Å; P162-C165 WeakPolarHBondContact O-CB 3.15Å; P162-C165 PolarHBondContact O-N 3.31Å; P163-C165 VanDerWaalsContact C-N 3.35Å; C165-L167 WeakPolarHBondContact SG-CD1 3.39Å
166V89.3Confident79.8Confident49 Ų4962.1 Ų62.130%0.29736%0.358SS..EExtended strand (participates in β ladder)trans-100.3119.9178.4-179.70000109.4R106 K108R106-V166 HydrophobicContact CB-CG2 4.09Å; R106-V166 CarbonylContact O-C 3.6Å; R106-V166 VanDerWaalsContact O-CA 3.22Å; R106-V166 WeakPolarHBondContact O-CA 3.36Å; K108-V166 HydrophobicContact CB-CG1 3.64Å; K108-V166 HydrophobicContact CD-CG1 4.46Å
167L90.3Very high78.3Confident0 Ų067.5 Ų67.50%039%0.392CS..EExtended strand (participates in β ladder)trans-103.1124.6171.3-85.674.4000108.9L105 R106 L107 K108 L142 Y144 L149 L161 C165 C169L105-L167 HydrophobicContact CD2-CD1 4.03Å; R106-L167 PolarHBondContact O-N 3.29Å; L107-L167 CarbonylContact C-O 3.59Å; L107-L167 WeakPolarHBondContact CA-O 3.36Å; K108-L167 PolarHBondContact N-O 2.82Å; L142-L167 HydrophobicContact CB-CD2 4.38Å; L142-L167 HydrophobicContact CD1-CD2 4.5Å; L142-L167 HydrophobicContact CD2-CD2 4.23Å; Y144-L167 HydrophobicContact CD2-CD1 4.31Å; L149-L167 HydrophobicContact CD2-CD2 4.45Å; L161-L167 HydrophobicContact CD1-CD1 4.38Å; L161-L167 HydrophobicContact CD2-CD1 4.46Å; C165-L167 WeakPolarHBondContact SG-CD1 3.39Å; L167-C169 PolarHBondContact O-N 3.4Å; L167-C169 PolarHBondContact O-SG 2.78Å
168H91.2Very high76.9Confident100 Ų10071 Ų7146%0.46341%0.41SS..EExtended strand (participates in β ladder)trans-76.5121.4173.2-71.4-105.6000108.9K108 I143K108-H168 CarbonylContact O-C 3.54Å; K108-H168 WeakPolarHBondContact O-CA 3.29Å; I143-H168 HydrophobicContact CB-CB 4.04Å; I143-H168 PolarHBondContact N-O 3.33Å; I143-H168 PolarHBondContact O-N 2.79Å
169C89.4Confident75.4Confident5 Ų575.3 Ų75.33%0.03443%0.427CS..EExtended strand (participates in β ladder)trans-107.8119.8-177.4-60.10000109.3L107 K108 F109 L142 L167L107-C169 WeakPolarHBondContact CB-SG 3.34Å; L107-C169 VanDerWaalsContact CG-SG 3.52Å; K108-C169 PolarHBondContact O-N 2.78Å; F109-C169 HydrophobicContact CD1-CB 3.79Å; F109-C169 HydrophobicContact CE1-CB 3.83Å; F109-C169 HydrophobicContact CG-CB 4.4Å; F109-C169 HydrophobicContact CZ-CB 4.47Å; L142-C169 HydrophobicContact CD2-CB 4.43Å; L142-C169 WeakPolarHBondContact CD2-SG 3.22Å; L167-C169 PolarHBondContact O-N 3.4Å; L167-C169 PolarHBondContact O-SG 2.78Å
170H89.1Confident74.2Confident74 Ų7478.4 Ų78.434%0.34345%0.45SS..EExtended strand (participates in β ladder)trans-113.9121.9176.3-176-96.8000110V140 R141 I143 S172V140-H170 WeakPolarHBondContact CA-O 3.38Å; R141-H170 HydrophobicContact CB-CB 4.3Å; R141-H170 PolarHBondContact N-O 2.72Å; R141-H170 PolarHBondContact O-N 3.39Å; I143-H170 HydrophobicContact CD1-CB 4.38Å; H170-S172 PolarHBondContact CE1-OG 2.79Å; H170-S172 PolarHBondContact ND1-OG 2.87Å
171V84.3Confident72.6Confident56 Ų5677.1 Ų77.134%0.33946%0.456SS..EExtended strand (participates in β ladder)trans-101.7104-178.7-169.30000109.1F109 Q139 V140F109-V171 HydrophobicContact CD1-CG2 4.33Å; F109-V171 HydrophobicContact CE1-CG2 4.37Å; Q139-V171 HydrophobicContact CB-CG1 4.34Å; Q139-V171 CarbonylContact O-C 3.53Å; V140-V171 HydrophobicContact CG2-CG1 4.42Å; V140-V171 HydrophobicContact CG2-CG2 4.2Å
172S78.5Confident70.8Confident30 Ų3082.1 Ų82.121%0.2149%0.49CS..  trans-86.3128177.6-64.20000111Q139 H170 R174Q139-S172 WeakPolarHBondContact CB-O 3.32Å; Q139-S172 VanDerWaalsContact CG-O 3.25Å; Q139-S172 WeakPolarHBondContact CG-O 3.31Å; Q139-S172 PolarHBondContact O-N 2.8Å; H170-S172 PolarHBondContact CE1-OG 2.79Å; H170-S172 PolarHBondContact ND1-OG 2.87Å; S172-R174 PolarHBondContact O-N 3.13Å; S172-R174 VanDerWaalsContact O-N 3.13Å
173T69.3Low69.5Low133 Ų13384.2 Ų84.282%0.81650%0.504SS*.SBendtrans-78.49.8-174.751.30000115.3
174R58.3Low68Low145 Ų14586.2 Ų86.255%0.54752%0.517SS..  trans-114.9113-178.9-67-135-172.71572.5112.2S172 G176 S191S172-R174 PolarHBondContact O-N 3.13Å; S172-R174 VanDerWaalsContact O-N 3.13Å; R174-G176 PolarHBondContact O-N 3.39Å; R174-S191 WeakPolarHBondContact CD-OG 3.26Å; R174-S191 VanDerWaalsContact CG-OG 3.27Å; R174-S191 WeakPolarHBondContact CG-OG 3.19Å; R174-S191 PolarHBondContact NE-OG 3.46Å; R174-S191 PolarHBondContact NH1-OG 3.16Å; R174-S191 PolarHBondContact NH2-O 3.31Å
175V54.1Low66.1Low90 Ų9085.3 Ų85.355%0.54553%0.531SS..  trans-89.993165.5-176.20000107.1Q139Q139-V175 HydrophobicContact CG-CG2 3.8Å
176G51.7Low64.2Low50 Ų5089.7 Ų89.752%0.51556%0.562SS.*  trans-79.6143.4161.300000109R174R174-G176 PolarHBondContact O-N 3.39Å
177P53.6Low62.4Low113 Ų11396.3 Ų96.373%0.73459%0.59SS**  trans-58.2147.1176.923.9-31.9000111.1N179P177-N179 PolarHBondContact O-N 3.13Å
178P54Low60.7Low108 Ų108102 Ų10270%0.70163%0.627SS**  trans-66.799.9-179.427.2-32.6000109.4
179N52.2Low58.8Low152 Ų15299.9 Ų99.981%0.81363%0.632SS**  trans-83.7141.4174.8-126.39.5000109.7P177P177-N179 PolarHBondContact O-N 3.13Å
180P53.8Low57.1Low98 Ų98105.2 Ų105.264%0.63667%0.666SS**  trans-63.3162.2-178.625.4-32.1000112.8C182P180-C182 PolarHBondContact O-N 3.36Å
181P48Very low55.1Low136 Ų136104.2 Ų104.288%0.88367%0.668SS**  trans-63.3110.8-169.325.1-33.7000111.3
182C43.2Very low53.3Low118 Ų118104.7 Ų104.780%0.79768%0.684SS**  trans-113.4149.1168.8-106.20000110.2P180P180-C182 PolarHBondContact O-N 3.36Å
183P55Low52Low106 Ų106109.1 Ų109.169%0.68870%0.704SS**  trans-64.2162.2-164.325.5-33.9000114.3G185P183-G185 PolarHBondContact O-N 2.94Å
184P50.1Low51.6Low138 Ų138109.8 Ų109.890%0.89670%0.698SS**SBendtrans-66.8124.1-173.429.2-34000109.9
185G45.9Very low51.9Low80 Ų80109 Ų10983%0.82570%0.704SS**  trans158.33172.700000118.7P183P183-G185 PolarHBondContact O-N 2.94Å
186S46.3Very low52.5Low103 Ų103106.7 Ų106.772%0.7270%0.698SS**  trans-132.693.8173.237.10000109.7P188S186-P188 WeakPolarHBondContact O-CD 3.36Å; S186-P188 VanDerWaalsContact O-N 3.13Å
187E52.4Low53.5Low188 Ų188107.9 Ų107.988%0.87970%0.698SS**  trans-52.9109.4162.4-76.1-103.987.800108.4G189E187-G189 PolarHBondContact O-N 3.28Å
188P53.3Low54.3Low120 Ų120107.1 Ų107.178%0.77969%0.687SS**  trans-80.586.2166.68.212.8000104.6S186S186-P188 WeakPolarHBondContact O-CD 3.36Å; S186-P188 VanDerWaalsContact O-N 3.13Å
189G51.6Low55.3Low55 Ų55105.2 Ų105.257%0.56767%0.671SS**  trans-47.2133.7176.500000109.8E187 S191E187-G189 PolarHBondContact O-N 3.28Å; G189-S191 PolarHBondContact O-N 2.86Å
190P54.2Low56.3Low116 Ų11699.3 Ų99.375%0.75364%0.639SS**  trans-68.4102.4-173.630-33000107.4G192P190-G192 VanDerWaalsContact C-N 3.26Å; P190-G192 PolarHBondContact O-N 2.97Å
191S47.4Very low57.3Low54 Ų5497.9 Ų97.938%0.37863%0.63SS.*  6129.9119.7-590000117.9R174 G189R174-S191 WeakPolarHBondContact CD-OG 3.26Å; R174-S191 VanDerWaalsContact CG-OG 3.27Å; R174-S191 WeakPolarHBondContact CG-OG 3.19Å; R174-S191 PolarHBondContact NE-OG 3.46Å; R174-S191 PolarHBondContact NH1-OG 3.16Å; R174-S191 PolarHBondContact NH2-O 3.31Å; G189-S191 PolarHBondContact O-N 2.86Å
192G46.9Very low58.6Low65 Ų6596 Ų9667%0.6761%0.612SS**  trans-103.764.7176.500000110.5P190 E194P190-G192 VanDerWaalsContact C-N 3.26Å; P190-G192 PolarHBondContact O-N 2.97Å; G192-E194 PolarHBondContact O-N 3.31Å; G192-E194 VanDerWaalsContact O-N 3.17Å
193L50.5Low60.2Low123 Ų12392 Ų9264%0.64458%0.583SS**  trans39.165.9163.6-140.9157.2000114I195 L198L193-I195 PolarHBondContact O-N 3.14Å; L193-L198 HydrophobicContact CD2-CD1 3.08Å
194E60.2Low61.5Low147 Ų14790.7 Ų90.769%0.68757%0.569SS**  trans-2.882.5173.1-69.9-82.6138.500113.6G192 G196 S197 L198G192-E194 PolarHBondContact O-N 3.31Å; G192-E194 VanDerWaalsContact O-N 3.17Å; E194-G196 PolarHBondContact O-N 2.92Å; E194-G196 VanDerWaalsContact O-N 3.08Å; E194-S197 WeakPolarHBondContact O-CA 3.49Å; E194-S197 WeakPolarHBondContact O-CB 3.48Å; E194-S197 PolarHBondContact O-N 3.4Å; E194-L198 PolarHBondContact O-N 3.38Å; E194-L198 VanDerWaalsContact O-N 3.08Å
195I65.7Low62.9Low130 Ų13089.2 Ų89.267%0.66755%0.553SS**Hα-helixtrans-57.2-32.5-177.1-143.375.2000109.8L193 L198 L199L193-I195 PolarHBondContact O-N 3.14Å; I195-L198 PolarHBondContact O-N 3.43Å; I195-L199 WeakPolarHBondContact O-CB 3.45Å; I195-L199 PolarHBondContact O-N 3.34Å
196G67.2Low64.4Low41 Ų4188.2 Ų88.242%0.42353%0.529SS..Hα-helixtrans-66.3-36.8172.100000113.9E194 L199 L200E194-G196 PolarHBondContact O-N 2.92Å; E194-G196 VanDerWaalsContact O-N 3.08Å; G196-L199 PolarHBondContact O-N 2.92Å; G196-L200 PolarHBondContact O-N 2.91Å; G196-L200 VanDerWaalsContact O-N 3.1Å
197S70.8Confident66.2Low74 Ų7484.1 Ų84.152%0.51750%0.499SS..Hα-helixtrans-71.4-27.2176-172.70000112.7E194 P201E194-S197 WeakPolarHBondContact O-CA 3.49Å; E194-S197 WeakPolarHBondContact O-CB 3.48Å; E194-S197 PolarHBondContact O-N 3.4Å; S197-P201 WeakPolarHBondContact O-CD 3.32Å; S197-P201 WeakPolarHBondContact O-CG 3.37Å
198L70.4Confident67.5Low98 Ų9880.8 Ų80.851%0.51349%0.486SS..Hα-helixtrans-83.8-31.4168.7-103110.4000113.4L193 E194 I195 L200 P201 L202L193-L198 HydrophobicContact CD2-CD1 3.08Å; E194-L198 PolarHBondContact O-N 3.38Å; E194-L198 VanDerWaalsContact O-N 3.08Å; I195-L198 PolarHBondContact O-N 3.43Å; L198-L200 VanDerWaalsContact C-N 3.31Å; L198-L200 PolarHBondContact O-N 2.94Å; L198-P201 VanDerWaalsContact C-CD 3.49Å; L198-P201 WeakPolarHBondContact O-CD 3.32Å; L198-P201 VanDerWaalsContact O-CG 3.24Å; L198-P201 WeakPolarHBondContact O-CG 3.05Å; L198-L202 VanDerWaalsContact O-CB 3.23Å; L198-L202 WeakPolarHBondContact O-CB 3.39Å; L198-L202 PolarHBondContact O-N 2.89Å; L198-L202 VanDerWaalsContact O-N 3.09Å
199L75.2Confident68.7Low68 Ų6879.7 Ų79.736%0.35647%0.473SS..Hα-helixtrans-62.6-40.3177.4-177.167.5000111.1I195 G196 L202 L203I195-L199 WeakPolarHBondContact O-CB 3.45Å; I195-L199 PolarHBondContact O-N 3.34Å; G196-L199 PolarHBondContact O-N 2.92Å; L199-L202 PolarHBondContact O-N 3.42Å; L199-L203 WeakPolarHBondContact O-CB 3.3Å; L199-L203 PolarHBondContact O-N 2.89Å
200L74.1Confident70Confident27 Ų2778.9 Ų78.914%0.14146%0.456CS..Hα-helixtrans-61.8-52.3179.3-168.964.7000114.1G196 L198 L202 L203 L204 A240 Y244G196-L200 PolarHBondContact O-N 2.91Å; G196-L200 VanDerWaalsContact O-N 3.1Å; L198-L200 VanDerWaalsContact C-N 3.31Å; L198-L200 PolarHBondContact O-N 2.94Å; L200-L202 VanDerWaalsContact C-N 3.32Å; L200-L202 PolarHBondContact O-N 3.38Å; L200-L203 PolarHBondContact O-N 3.46Å; L200-L204 HydrophobicContact CG-CD1 4.43Å; L200-L204 VanDerWaalsContact O-CG 3.32Å; L200-L204 WeakPolarHBondContact O-CG 3.49Å; L200-L204 PolarHBondContact O-N 3.36Å; L200-A240 HydrophobicContact CD1-CB 4.23Å; L200-Y244 HydrophobicContact CD2-CD2 4.34Å; L200-Y244 HydrophobicContact CD2-CE2 3.61Å
201P75.7Confident71.3Confident69 Ų6978.1 Ų78.145%0.44844%0.438SS..Hα-helixtrans-66.3-33.5175.326.5-34.1000111.9S197 L198 L203 L204 L205S197-P201 WeakPolarHBondContact O-CD 3.32Å; S197-P201 WeakPolarHBondContact O-CG 3.37Å; L198-P201 VanDerWaalsContact C-CD 3.49Å; L198-P201 WeakPolarHBondContact O-CD 3.32Å; L198-P201 VanDerWaalsContact O-CG 3.24Å; L198-P201 WeakPolarHBondContact O-CG 3.05Å; P201-L203 VanDerWaalsContact C-N 3.34Å; P201-L204 PolarHBondContact O-N 2.88Å; P201-L205 VanDerWaalsContact O-CB 3.29Å; P201-L205 WeakPolarHBondContact O-CB 3.34Å; P201-L205 PolarHBondContact O-N 3.3Å
202L75.3Confident72.7Confident95 Ų9582.2 Ų82.250%0.49745%0.446SS..Hα-helixtrans-62.8-42.8173.4-178.968.1000111.4L198 L199 L200 L205 L206L198-L202 VanDerWaalsContact O-CB 3.23Å; L198-L202 WeakPolarHBondContact O-CB 3.39Å; L198-L202 PolarHBondContact O-N 2.89Å; L198-L202 VanDerWaalsContact O-N 3.09Å; L199-L202 PolarHBondContact O-N 3.42Å; L200-L202 VanDerWaalsContact C-N 3.32Å; L200-L202 PolarHBondContact O-N 3.38Å; L202-L205 WeakPolarHBondContact O-CB 3.44Å; L202-L205 PolarHBondContact O-N 2.84Å; L202-L206 WeakPolarHBondContact O-CB 3.36Å; L202-L206 PolarHBondContact O-N 2.88Å
203L76.8Confident73.9Confident36 Ų3681.2 Ų81.219%0.18843%0.428CS..Hα-helixtrans-67.7-39.2178.2-176.661.8000111.6L199 L200 P201 L206 L207 F232 L236L199-L203 WeakPolarHBondContact O-CB 3.3Å; L199-L203 PolarHBondContact O-N 2.89Å; L200-L203 PolarHBondContact O-N 3.46Å; P201-L203 VanDerWaalsContact C-N 3.34Å; L203-L206 PolarHBondContact O-N 3.28Å; L203-L207 WeakPolarHBondContact O-CB 3.24Å; L203-L207 PolarHBondContact O-N 3.5Å; L203-F232 HydrophobicContact CD1-CE1 4.34Å; L203-F232 HydrophobicContact CD1-CZ 3.94Å; L203-L236 HydrophobicContact CD1-CD2 3.97Å; L203-L236 HydrophobicContact CD2-CD1 4Å; L203-L236 HydrophobicContact CD2-CD2 3.93Å; L203-L236 HydrophobicContact CD2-CG 3.66Å; L203-L236 HydrophobicContact CG-CD1 4.43Å; L203-L236 HydrophobicContact CG-CD2 3.54Å; L203-L236 HydrophobicContact CG-CG 3.9Å
204L81.8Confident75.2Confident77 Ų7775.7 Ų75.740%0.40340%0.399SS..Hα-helixtrans-65.6-38.7172.1-70.9169.6000112.2L200 P201 L207 L208L200-L204 HydrophobicContact CG-CD1 4.43Å; L200-L204 VanDerWaalsContact O-CG 3.32Å; L200-L204 WeakPolarHBondContact O-CG 3.49Å; L200-L204 PolarHBondContact O-N 3.36Å; P201-L204 PolarHBondContact O-N 2.88Å; L204-L207 WeakPolarHBondContact O-CB 3.33Å; L204-L207 PolarHBondContact O-N 2.86Å; L204-L208 PolarHBondContact O-N 3.46Å
205L79.4Confident76Confident108 Ų10873.4 Ų73.457%0.56539%0.391SS*.Hα-helixtrans-64.5-44.2174.7178.467000111.4P201 L202 L207 L208 L209P201-L205 VanDerWaalsContact O-CB 3.29Å; P201-L205 WeakPolarHBondContact O-CB 3.34Å; P201-L205 PolarHBondContact O-N 3.3Å; L202-L205 WeakPolarHBondContact O-CB 3.44Å; L202-L205 PolarHBondContact O-N 2.84Å; L205-L207 VanDerWaalsContact C-N 3.32Å; L205-L207 PolarHBondContact O-N 3.35Å; L205-L208 WeakPolarHBondContact O-CB 3.44Å; L205-L208 PolarHBondContact O-N 2.85Å; L205-L209 PolarHBondContact O-N 3.35Å
206L78Confident76.6Confident59 Ų5972.7 Ų72.731%0.30939%0.385SS..Hα-helixtrans-60.2-45.3174.2-177.563.3000110.3L22 L202 L203 L208 L209 L210L22-L206 HydrophobicContact CD2-CD2 4.09Å; L202-L206 WeakPolarHBondContact O-CB 3.36Å; L202-L206 PolarHBondContact O-N 2.88Å; L203-L206 PolarHBondContact O-N 3.28Å; L206-L208 VanDerWaalsContact C-N 3.33Å; L206-L208 PolarHBondContact O-N 3.03Å; L206-L209 WeakPolarHBondContact O-CB 3.27Å; L206-L209 PolarHBondContact O-N 2.91Å; L206-L209 VanDerWaalsContact O-N 3.14Å; L206-L210 HydrophobicContact CD1-CD1 3.72Å; L206-L210 HydrophobicContact CG-CD1 3.85Å; L206-L210 WeakPolarHBondContact O-CD1 3.33Å; L206-L210 PolarHBondContact O-N 3.23Å
207L83.1Confident76.7Confident16 Ų1676.8 Ų76.88%0.08439%0.388CS..Hα-helixtrans-59.1-42.5176.5-175.869.6000112.5L203 L204 L205 L209 L210 W211 L229 F232 T233 L236L203-L207 WeakPolarHBondContact O-CB 3.24Å; L203-L207 PolarHBondContact O-N 3.5Å; L204-L207 WeakPolarHBondContact O-CB 3.33Å; L204-L207 PolarHBondContact O-N 2.86Å; L205-L207 VanDerWaalsContact C-N 3.32Å; L205-L207 PolarHBondContact O-N 3.35Å; L207-L209 VanDerWaalsContact C-N 3.34Å; L207-L210 PolarHBondContact O-N 3.32Å; L207-W211 PolarHBondContact O-N 2.83Å; L207-L229 HydrophobicContact CD1-CD1 3.71Å; L207-F232 HydrophobicContact CD1-CD1 3.69Å; L207-F232 HydrophobicContact CD1-CE1 4.17Å; L207-T233 HydrophobicContact CD2-CG2 4.07Å; L207-L236 HydrophobicContact CB-CD2 4.14Å; L207-L236 HydrophobicContact CD1-CD2 4.28Å; L207-L236 HydrophobicContact CD2-CD2 3.93Å; L207-L236 HydrophobicContact CG-CD2 4.36Å
208L80.8Confident76.5Confident118 Ų11881.2 Ų81.262%0.61839%0.394SS*.Hα-helixtrans-62-41.7175.5-175.471.6000111.5L204 L205 L206 W211 Y212L204-L208 PolarHBondContact O-N 3.46Å; L205-L208 WeakPolarHBondContact O-CB 3.44Å; L205-L208 PolarHBondContact O-N 2.85Å; L206-L208 VanDerWaalsContact C-N 3.33Å; L206-L208 PolarHBondContact O-N 3.03Å; L208-W211 PolarHBondContact O-N 3.44Å; L208-Y212 WeakPolarHBondContact O-CB 3.32Å; L208-Y212 PolarHBondContact O-N 3.15Å
209L76.7Confident76.3Confident98 Ų9881.9 Ų81.951%0.51340%0.404SS..Hα-helixtrans-64.6-40.2176.7-174.663.7000111.7L205 L206 L207 Y212 C213L205-L209 PolarHBondContact O-N 3.35Å; L206-L209 WeakPolarHBondContact O-CB 3.27Å; L206-L209 PolarHBondContact O-N 2.91Å; L206-L209 VanDerWaalsContact O-N 3.14Å; L207-L209 VanDerWaalsContact C-N 3.34Å; L209-Y212 WeakPolarHBondContact O-CB 3.32Å; L209-Y212 PolarHBondContact O-N 3.33Å; L209-C213 PolarHBondContact O-N 2.89Å; L209-C213 PolarHBondContact O-SG 3.32Å; L209-C213 VanDerWaalsContact O-SG 3.38Å
210L80Confident75.9Confident38 Ų3886.3 Ų86.320%0.19942%0.42CS..Hα-helixtrans-63.7-41.8174.6-88.673.4000111.4F15 L206 L207 C213 Q214 L229F15-L210 HydrophobicContact CE1-CD2 4.19Å; F15-L210 HydrophobicContact CZ-CD2 4.34Å; F15-L210 HydrophobicContact CZ-CG 4.24Å; L206-L210 HydrophobicContact CD1-CD1 3.72Å; L206-L210 HydrophobicContact CG-CD1 3.85Å; L206-L210 WeakPolarHBondContact O-CD1 3.33Å; L206-L210 PolarHBondContact O-N 3.23Å; L207-L210 PolarHBondContact O-N 3.32Å; L210-C213 PolarHBondContact O-N 2.9Å; L210-Q214 WeakPolarHBondContact O-CB 3.35Å; L210-Q214 WeakPolarHBondContact O-CG 3.43Å; L210-Q214 PolarHBondContact O-N 3.48Å; L210-L229 HydrophobicContact CB-CD1 3.75Å; L210-L229 HydrophobicContact CB-CD2 4.25Å; L210-L229 HydrophobicContact CD2-CD1 3.89Å; L210-L229 HydrophobicContact CG-CD1 4.48Å
211W82.4Confident75.6Confident99 Ų9987.5 Ų87.538%0.37543%0.425SS..Hα-helixtrans-62.9-40.2173.3-96.9101.4000112.6L207 L208 Q214 I215 L229 T233L207-W211 PolarHBondContact O-N 2.83Å; L208-W211 PolarHBondContact O-N 3.44Å; W211-Q214 WeakPolarHBondContact O-CB 3.21Å; W211-Q214 PolarHBondContact O-N 3.02Å; W211-I215 HydrophobicContact CE3-CD1 4.42Å; W211-I215 VanDerWaalsContact O-CG1 3.32Å; W211-I215 WeakPolarHBondContact O-CG1 3.39Å; W211-I215 PolarHBondContact O-N 3.3Å; W211-L229 HydrophobicContact CD2-CD2 4.1Å; W211-L229 HydrophobicContact CG-CD2 3.96Å; W211-T233 PolarHBondContact NE1-OG1 3.44Å
212Y76.9Confident75.4Confident140 Ų14086.7 Ų86.755%0.54942%0.419SS..Hα-helixtrans-62.8-47.9175.6177.1-98.1000111.5L208 L209 Q214 I215 Q216L208-Y212 WeakPolarHBondContact O-CB 3.32Å; L208-Y212 PolarHBondContact O-N 3.15Å; L209-Y212 WeakPolarHBondContact O-CB 3.32Å; L209-Y212 PolarHBondContact O-N 3.33Å; Y212-Q214 VanDerWaalsContact C-N 3.28Å; Y212-Q214 PolarHBondContact O-N 3.18Å; Y212-I215 PolarHBondContact O-N 2.73Å; Y212-I215 VanDerWaalsContact O-N 3.13Å; Y212-Q216 PolarHBondContact O-N 3.37Å
213C71.2Confident75.3Confident44 Ų4488.8 Ų88.830%0.29743%0.43SS..Hα-helixtrans-58.7-41.2175.1-72.50000111.5L209 L210 I215 Q216 Y217L209-C213 PolarHBondContact O-N 2.89Å; L209-C213 PolarHBondContact O-SG 3.32Å; L209-C213 VanDerWaalsContact O-SG 3.38Å; L210-C213 PolarHBondContact O-N 2.9Å; C213-I215 VanDerWaalsContact C-N 3.34Å; C213-I215 PolarHBondContact O-N 3.4Å; C213-Q216 PolarHBondContact O-N 2.8Å; C213-Y217 HydrophobicContact CB-CD2 4.35Å; C213-Y217 WeakPolarHBondContact O-CA 3.42Å; C213-Y217 VanDerWaalsContact O-CB 3.27Å; C213-Y217 WeakPolarHBondContact O-CB 3.43Å; C213-Y217 WeakPolarHBondContact O-CD2 3.47Å; C213-Y217 PolarHBondContact O-N 3.37Å
214Q78.3Confident75.1Confident7 Ų792.5 Ų92.53%0.03345%0.454CS..Hα-helixtrans-60.9-37.8174.9-92.2-93.135.700114.2L210 W211 Y212 R218 F221 T226 L229L210-Q214 WeakPolarHBondContact O-CB 3.35Å; L210-Q214 WeakPolarHBondContact O-CG 3.43Å; L210-Q214 PolarHBondContact O-N 3.48Å; W211-Q214 WeakPolarHBondContact O-CB 3.21Å; W211-Q214 PolarHBondContact O-N 3.02Å; Y212-Q214 VanDerWaalsContact C-N 3.28Å; Y212-Q214 PolarHBondContact O-N 3.18Å; Q214-R218 WeakPolarHBondContact O-CA 3.36Å; Q214-R218 WeakPolarHBondContact O-CG 3.27Å; Q214-R218 PolarHBondContact O-N 2.9Å; Q214-R218 VanDerWaalsContact O-N 3.15Å; Q214-F221 HydrophobicContact CG-CD1 3.83Å; Q214-F221 HydrophobicContact CG-CD2 3.89Å; Q214-F221 HydrophobicContact CG-CE1 3.74Å; Q214-F221 HydrophobicContact CG-CE2 3.87Å; Q214-F221 HydrophobicContact CG-CG 3.85Å; Q214-F221 HydrophobicContact CG-CZ 3.78Å; Q214-F221 VanDerWaalsContact OE1-CD1 3.28Å; Q214-T226 PolarHBondContact NE2-OG1 3.29Å; Q214-T226 PolarHBondContact OE1-OG1 3.49Å; Q214-L229 HydrophobicContact CB-CD2 4.26Å; Q214-L229 HydrophobicContact CG-CD2 3.67Å
215I77.1Confident74.6Confident99 Ų9989.8 Ų89.851%0.50844%0.443SS..Hα-helixtrans-74.7-43.2178.4-67.4164.5000110.7W211 Y212 C213 R218W211-I215 HydrophobicContact CE3-CD1 4.42Å; W211-I215 VanDerWaalsContact O-CG1 3.32Å; W211-I215 WeakPolarHBondContact O-CG1 3.39Å; W211-I215 PolarHBondContact O-N 3.3Å; Y212-I215 PolarHBondContact O-N 2.73Å; Y212-I215 VanDerWaalsContact O-N 3.13Å; C213-I215 VanDerWaalsContact C-N 3.34Å; C213-I215 PolarHBondContact O-N 3.4Å; I215-R218 WeakPolarHBondContact O-CG 3.42Å
216Q77.3Confident74.5Confident115 Ų11587 Ų8754%0.53743%0.431SS..Hα-helixtrans-76-37.4-176.4-169.960.745.600112.6Y212 C213Y212-Q216 PolarHBondContact O-N 3.37Å; C213-Q216 PolarHBondContact O-N 2.8Å
217Y68.7Low74.4Confident127 Ų12789.7 Ų89.750%0.49845%0.445SS..THydrogen-bonded Turntrans-106.531.5179.7-57.3-78.6000111.7C213 P219 F220 F221C213-Y217 HydrophobicContact CB-CD2 4.35Å; C213-Y217 WeakPolarHBondContact O-CA 3.42Å; C213-Y217 VanDerWaalsContact O-CB 3.27Å; C213-Y217 WeakPolarHBondContact O-CB 3.43Å; C213-Y217 WeakPolarHBondContact O-CD2 3.47Å; C213-Y217 PolarHBondContact O-N 3.37Å; Y217-P219 VanDerWaalsContact C-N 3.25Å; Y217-P219 VanDerWaalsContact O-N 3.09Å; Y217-F220 AromaticContact CD1-CD2 3.94Å; Y217-F220 HydrophobicContact CD1-CD2 3.94Å; Y217-F220 HydrophobicContact CD1-CE2 4.2Å; Y217-F220 HydrophobicContact CG-CD2 4.44Å; Y217-F220 WeakPolarHBondContact O-CA 3.39Å; Y217-F220 WeakPolarHBondContact O-CB 3.49Å; Y217-F220 PolarHBondContact O-N 2.89Å; Y217-F221 PolarHBondContact O-N 3.23Å
218R67.2Low74Confident168 Ų16891 Ų9163%0.63446%0.463SS*.G310 helixtrans-35.9-47.9170.4-85.8-79.5174.7126.3-2.6114.2Q214 I215 F220 F221Q214-R218 WeakPolarHBondContact O-CA 3.36Å; Q214-R218 WeakPolarHBondContact O-CG 3.27Å; Q214-R218 PolarHBondContact O-N 2.9Å; Q214-R218 VanDerWaalsContact O-N 3.15Å; I215-R218 WeakPolarHBondContact O-CG 3.42Å; R218-F220 PolarHBondContact O-N 2.93Å; R218-F221 PolarHBondContact O-N 3.31Å
219P65.7Low74Confident112 Ų11286 Ų8673%0.72744%0.436SS*.G310 helixtrans-70.7-16.7-178.525.9-34.5000114.5Y217Y217-P219 VanDerWaalsContact C-N 3.25Å; Y217-P219 VanDerWaalsContact O-N 3.09Å
220F67.4Low73.9Confident160 Ų16083.8 Ų83.870%0.70243%0.432SS*.G310 helixtrans-96.6-10179.1-60.8-81.3000113Y217 R218 P222Y217-F220 AromaticContact CD1-CD2 3.94Å; Y217-F220 HydrophobicContact CD1-CD2 3.94Å; Y217-F220 HydrophobicContact CD1-CE2 4.2Å; Y217-F220 HydrophobicContact CG-CD2 4.44Å; Y217-F220 WeakPolarHBondContact O-CA 3.39Å; Y217-F220 WeakPolarHBondContact O-CB 3.49Å; Y217-F220 PolarHBondContact O-N 2.89Å; R218-F220 PolarHBondContact O-N 2.93Å; F220-P222 VanDerWaalsContact O-CD 3.28Å; F220-P222 WeakPolarHBondContact O-CD 3.48Å
221F68Low73.7Confident53 Ų5383.9 Ų83.923%0.23244%0.442CS..SBendtrans-99.9106.7-176.2-122.6-87.2000111.3Q214 Y217 R218 A225Q214-F221 HydrophobicContact CG-CD1 3.83Å; Q214-F221 HydrophobicContact CG-CD2 3.89Å; Q214-F221 HydrophobicContact CG-CE1 3.74Å; Q214-F221 HydrophobicContact CG-CE2 3.87Å; Q214-F221 HydrophobicContact CG-CG 3.85Å; Q214-F221 HydrophobicContact CG-CZ 3.78Å; Q214-F221 VanDerWaalsContact OE1-CD1 3.28Å; Y217-F221 PolarHBondContact O-N 3.23Å; R218-F221 PolarHBondContact O-N 3.31Å; F221-A225 HydrophobicContact CD1-CB 3.3Å; F221-A225 HydrophobicContact CE1-CB 3.18Å; F221-A225 HydrophobicContact CG-CB 4.46Å; F221-A225 HydrophobicContact CZ-CB 4.22Å
222P70.6Confident73.5Confident52 Ų5282.5 Ų82.534%0.33844%0.439SS..  trans-67.1155.8178.227.4-33.4000111F220 T224 A225 T226F220-P222 VanDerWaalsContact O-CD 3.28Å; F220-P222 WeakPolarHBondContact O-CD 3.48Å; P222-T224 PolarHBondContact O-N 2.82Å; P222-T224 VanDerWaalsContact O-N 3.09Å; P222-A225 HydrophobicContact CG-CB 4.02Å; P222-A225 PolarHBondContact O-N 2.8Å; P222-T226 PolarHBondContact O-N 2.95Å
223L74.5Confident73.8Confident139 Ų13977.9 Ų77.973%0.72843%0.425SS*.Hα-helixtrans-50.3-39.4-178.4-175.467.6000112.6A225 T226 L227L223-A225 VanDerWaalsContact C-N 3.34Å; L223-A225 PolarHBondContact O-N 2.97Å; L223-T226 PolarHBondContact O-N 3.43Å; L223-L227 HydrophobicContact CD1-CD1 4.2Å; L223-L227 HydrophobicContact CG-CD1 4.17Å; L223-L227 WeakPolarHBondContact O-CD1 3.37Å; L223-L227 PolarHBondContact O-N 2.89Å
224T73Confident74.2Confident113 Ų11381.2 Ų81.269%0.69344%0.44SS*.Hα-helixtrans-59.2-42.5178.4-46.70000112.5P222 T226 L227 G228P222-T224 PolarHBondContact O-N 2.82Å; P222-T224 VanDerWaalsContact O-N 3.09Å; T224-T226 VanDerWaalsContact C-N 3.32Å; T224-L227 PolarHBondContact O-N 3.31Å; T224-G228 PolarHBondContact O-N 3.4Å
225A70.6Confident74.2Confident20 Ų2086.1 Ų86.117%0.16547%0.465CS..Hα-helixtrans-75.1-27.8-176.700000111.1T12 F221 P222 L223 G228 L229T12-A225 HydrophobicContact CG2-CB 4.47Å; F221-A225 HydrophobicContact CD1-CB 3.3Å; F221-A225 HydrophobicContact CE1-CB 3.18Å; F221-A225 HydrophobicContact CG-CB 4.46Å; F221-A225 HydrophobicContact CZ-CB 4.22Å; P222-A225 HydrophobicContact CG-CB 4.02Å; P222-A225 PolarHBondContact O-N 2.8Å; L223-A225 VanDerWaalsContact C-N 3.34Å; L223-A225 PolarHBondContact O-N 2.97Å; A225-G228 PolarHBondContact O-N 3.43Å; A225-L229 PolarHBondContact O-N 3.31Å
226T76.8Confident74.2Confident50 Ų5081.9 Ų81.931%0.30744%0.444SS..Hα-helixtrans-68.3-42.1168-51.30000112.9Q214 P222 L223 T224 G228 L229 A230Q214-T226 PolarHBondContact NE2-OG1 3.29Å; Q214-T226 PolarHBondContact OE1-OG1 3.49Å; P222-T226 PolarHBondContact O-N 2.95Å; L223-T226 PolarHBondContact O-N 3.43Å; T224-T226 VanDerWaalsContact C-N 3.32Å; T226-G228 VanDerWaalsContact C-N 3.31Å; T226-G228 PolarHBondContact O-N 3.44Å; T226-L229 PolarHBondContact O-N 2.94Å; T226-A230 WeakPolarHBondContact O-CB 3.5Å; T226-A230 PolarHBondContact O-N 2.86Å
227L76.5Confident74.3Confident116 Ų11680 Ų8061%0.60744%0.444SS*.Hα-helixtrans-61.2-41.9171.8-100.275.8000111.5L223 T224 A230 G231L223-L227 HydrophobicContact CD1-CD1 4.2Å; L223-L227 HydrophobicContact CG-CD1 4.17Å; L223-L227 WeakPolarHBondContact O-CD1 3.37Å; L223-L227 PolarHBondContact O-N 2.89Å; T224-L227 PolarHBondContact O-N 3.31Å; L227-A230 PolarHBondContact O-N 3.41Å; L227-G231 PolarHBondContact O-N 3.44Å
228G73.4Confident74.8Confident44 Ų4478.9 Ų78.945%0.45445%0.446SS..Hα-helixtrans-59.9-47.9176.100000112.7T224 A225 T226 A230 G231 F232T224-G228 PolarHBondContact O-N 3.4Å; A225-G228 PolarHBondContact O-N 3.43Å; T226-G228 VanDerWaalsContact C-N 3.31Å; T226-G228 PolarHBondContact O-N 3.44Å; G228-A230 VanDerWaalsContact C-N 3.33Å; G228-A230 PolarHBondContact O-N 2.88Å; G228-G231 PolarHBondContact O-N 3.33Å; G228-F232 WeakPolarHBondContact O-CB 3.33Å; G228-F232 PolarHBondContact O-N 2.98Å
229L80.8Confident75.4Confident12 Ų1275.2 Ų75.26%0.06344%0.438CS..Hα-helixtrans-63.8-38.1177.2-175.262.3000112.3L207 L210 W211 Q214 A225 T226 F232 T233L207-L229 HydrophobicContact CD1-CD1 3.71Å; L210-L229 HydrophobicContact CB-CD1 3.75Å; L210-L229 HydrophobicContact CB-CD2 4.25Å; L210-L229 HydrophobicContact CD2-CD1 3.89Å; L210-L229 HydrophobicContact CG-CD1 4.48Å; W211-L229 HydrophobicContact CD2-CD2 4.1Å; W211-L229 HydrophobicContact CG-CD2 3.96Å; Q214-L229 HydrophobicContact CB-CD2 4.26Å; Q214-L229 HydrophobicContact CG-CD2 3.67Å; A225-L229 PolarHBondContact O-N 3.31Å; T226-L229 PolarHBondContact O-N 2.94Å; L229-F232 PolarHBondContact O-N 2.87Å; L229-T233 WeakPolarHBondContact O-CB 3.37Å; L229-T233 PolarHBondContact O-N 3.24Å; L229-T233 PolarHBondContact O-OG1 3.33Å
230A76.5Confident75.9Confident51 Ų5170.5 Ų70.542%0.42141%0.409SS..Hα-helixtrans-64-43.5175.300000111.6T226 L227 G228 T233 L234T226-A230 WeakPolarHBondContact O-CB 3.5Å; T226-A230 PolarHBondContact O-N 2.86Å; L227-A230 PolarHBondContact O-N 3.41Å; G228-A230 VanDerWaalsContact C-N 3.33Å; G228-A230 PolarHBondContact O-N 2.88Å; A230-T233 WeakPolarHBondContact O-CB 3.25Å; A230-T233 PolarHBondContact O-N 3.39Å; A230-L234 PolarHBondContact O-N 3.02Å
231G74.5Confident76.5Confident41 Ų4169.1 Ų69.142%0.42340%0.403SS..Hα-helixtrans-62.9-43.1175.100000112.9L227 G228 L234 L235L227-G231 PolarHBondContact O-N 3.44Å; G228-G231 PolarHBondContact O-N 3.33Å; G231-L234 PolarHBondContact O-N 3.35Å; G231-L235 PolarHBondContact O-N 2.95Å
232F78.2Confident77Confident70 Ų7069.6 Ų69.631%0.30742%0.416SS..Hα-helixtrans-65.1-40.8176.1-173.1-109.6000111.9L203 L207 G228 L229 L234 L235 L236L203-F232 HydrophobicContact CD1-CE1 4.34Å; L203-F232 HydrophobicContact CD1-CZ 3.94Å; L207-F232 HydrophobicContact CD1-CD1 3.69Å; L207-F232 HydrophobicContact CD1-CE1 4.17Å; G228-F232 WeakPolarHBondContact O-CB 3.33Å; G228-F232 PolarHBondContact O-N 2.98Å; L229-F232 PolarHBondContact O-N 2.87Å; F232-L234 VanDerWaalsContact C-N 3.3Å; F232-L234 PolarHBondContact O-N 3.45Å; F232-L235 PolarHBondContact O-N 2.96Å; F232-L236 HydrophobicContact CD1-CD1 4.04Å; F232-L236 HydrophobicContact CD1-CD2 3.91Å; F232-L236 HydrophobicContact CD2-CD1 3.82Å; F232-L236 HydrophobicContact CE1-CD1 3.69Å; F232-L236 HydrophobicContact CE1-CD2 3.39Å; F232-L236 HydrophobicContact CE1-CG 4.2Å; F232-L236 HydrophobicContact CE2-CD1 3.45Å; F232-L236 VanDerWaalsContact CE2-CD1 3.45Å; F232-L236 HydrophobicContact CG-CD1 4.1Å; F232-L236 HydrophobicContact CZ-CD1 3.39Å; F232-L236 HydrophobicContact CZ-CD2 3.86Å; F232-L236 HydrophobicContact CZ-CG 4.27Å; F232-L236 WeakPolarHBondContact O-CB 3.34Å; F232-L236 WeakPolarHBondContact O-CD1 3.2Å; F232-L236 PolarHBondContact O-N 3.09Å
233T83Confident77.1Confident42 Ų4273.6 Ų73.626%0.25843%0.432SS..Hα-helixtrans-56.2-45.2172.3-57.20000111.1L207 W211 L229 A230 S237L207-T233 HydrophobicContact CD2-CG2 4.07Å; W211-T233 PolarHBondContact NE1-OG1 3.44Å; L229-T233 WeakPolarHBondContact O-CB 3.37Å; L229-T233 PolarHBondContact O-N 3.24Å; L229-T233 PolarHBondContact O-OG1 3.33Å; A230-T233 WeakPolarHBondContact O-CB 3.25Å; A230-T233 PolarHBondContact O-N 3.39Å; T233-S237 WeakPolarHBondContact O-CB 3.25Å; T233-S237 PolarHBondContact O-N 2.95Å
234L80.4Confident77Confident115 Ų11575.5 Ų75.560%0.60243%0.431SS*.Hα-helixtrans-65.6-44179.2-173.4126.8000111.9A230 G231 F232 S237 L238A230-L234 PolarHBondContact O-N 3.02Å; G231-L234 PolarHBondContact O-N 3.35Å; F232-L234 VanDerWaalsContact C-N 3.3Å; F232-L234 PolarHBondContact O-N 3.45Å; L234-S237 PolarHBondContact O-N 3.29Å; L234-L238 HydrophobicContact CD2-CD1 3.89Å; L234-L238 WeakPolarHBondContact O-CG 3.41Å; L234-L238 PolarHBondContact O-N 3.46Å
235L77.1Confident77Confident109 Ų10978.6 Ų78.657%0.57143%0.43SS*.Hα-helixtrans-62.4-45.6176.5-175.668.8000111.9G231 F232 S237 L238 L239G231-L235 PolarHBondContact O-N 2.95Å; F232-L235 PolarHBondContact O-N 2.96Å; L235-S237 VanDerWaalsContact C-N 3.32Å; L235-S237 PolarHBondContact O-N 3.48Å; L235-L238 PolarHBondContact O-N 2.92Å; L235-L239 PolarHBondContact O-N 3.41Å
236L77.7Confident76Confident10 Ų1086.7 Ų86.75%0.05248%0.481CS..Hα-helixtrans-62.4-40.4175.9-95.855.4000111.6L203 L207 F232 L238 L239 A240L203-L236 HydrophobicContact CD1-CD2 3.97Å; L203-L236 HydrophobicContact CD2-CD1 4Å; L203-L236 HydrophobicContact CD2-CD2 3.93Å; L203-L236 HydrophobicContact CD2-CG 3.66Å; L203-L236 HydrophobicContact CG-CD1 4.43Å; L203-L236 HydrophobicContact CG-CD2 3.54Å; L203-L236 HydrophobicContact CG-CG 3.9Å; L207-L236 HydrophobicContact CB-CD2 4.14Å; L207-L236 HydrophobicContact CD1-CD2 4.28Å; L207-L236 HydrophobicContact CD2-CD2 3.93Å; L207-L236 HydrophobicContact CG-CD2 4.36Å; F232-L236 HydrophobicContact CD1-CD1 4.04Å; F232-L236 HydrophobicContact CD1-CD2 3.91Å; F232-L236 HydrophobicContact CD2-CD1 3.82Å; F232-L236 HydrophobicContact CE1-CD1 3.69Å; F232-L236 HydrophobicContact CE1-CD2 3.39Å; F232-L236 HydrophobicContact CE1-CG 4.2Å; F232-L236 HydrophobicContact CE2-CD1 3.45Å; F232-L236 VanDerWaalsContact CE2-CD1 3.45Å; F232-L236 HydrophobicContact CG-CD1 4.1Å; F232-L236 HydrophobicContact CZ-CD1 3.39Å; F232-L236 HydrophobicContact CZ-CD2 3.86Å; F232-L236 HydrophobicContact CZ-CG 4.27Å; F232-L236 WeakPolarHBondContact O-CB 3.34Å; F232-L236 WeakPolarHBondContact O-CD1 3.2Å; F232-L236 PolarHBondContact O-N 3.09Å; L236-L238 VanDerWaalsContact C-N 3.34Å; L236-L239 PolarHBondContact O-N 3.27Å; L236-A240 VanDerWaalsContact O-CB 3.26Å; L236-A240 WeakPolarHBondContact O-CB 3.42Å; L236-A240 PolarHBondContact O-N 2.98Å
237S80.3Confident75.9Confident77 Ų7788.5 Ų88.554%0.53849%0.489SS..Hα-helixtrans-63.8-39.5175.3-174.60000111.9T233 L234 L235 F241T233-S237 WeakPolarHBondContact O-CB 3.25Å; T233-S237 PolarHBondContact O-N 2.95Å; L234-S237 PolarHBondContact O-N 3.29Å; L235-S237 VanDerWaalsContact C-N 3.32Å; L235-S237 PolarHBondContact O-N 3.48Å; S237-F241 VanDerWaalsContact O-CB 3.27Å; S237-F241 WeakPolarHBondContact O-CB 3.37Å; S237-F241 PolarHBondContact O-N 2.92Å
238L78.7Confident75.9Confident102 Ų10287.1 Ų87.153%0.53448%0.483SS..Hα-helixtrans-67.5-41.5175.6-73.5171.9000111.6L234 L235 L236 F241 A242L234-L238 HydrophobicContact CD2-CD1 3.89Å; L234-L238 WeakPolarHBondContact O-CG 3.41Å; L234-L238 PolarHBondContact O-N 3.46Å; L235-L238 PolarHBondContact O-N 2.92Å; L236-L238 VanDerWaalsContact C-N 3.34Å; L238-F241 PolarHBondContact O-N 3.41Å; L238-A242 WeakPolarHBondContact O-CB 3.43Å; L238-A242 PolarHBondContact O-N 2.88Å
239L79.4Confident76.1Confident91 Ų9189.4 Ų89.448%0.47649%0.485SS..Hα-helixtrans-65.2-45.3176.1-176.662.5000111.1L235 L236 F241 A242 M243L235-L239 PolarHBondContact O-N 3.41Å; L236-L239 PolarHBondContact O-N 3.27Å; L239-F241 VanDerWaalsContact C-N 3.32Å; L239-F241 PolarHBondContact O-N 2.86Å; L239-A242 PolarHBondContact O-N 3.39Å; L239-M243 WeakPolarHBondContact O-CB 3.36Å; L239-M243 VanDerWaalsContact O-CG 3.3Å; L239-M243 WeakPolarHBondContact O-CG 3.45Å; L239-M243 PolarHBondContact O-N 2.99Å
240A76.4Confident75.8Confident14 Ų1494 Ų9412%0.11651%0.51CS..Hα-helixtrans-57.7-47.7173.100000110.1L200 L236 A242 M243 Y244L200-A240 HydrophobicContact CD1-CB 4.23Å; L236-A240 VanDerWaalsContact O-CB 3.26Å; L236-A240 WeakPolarHBondContact O-CB 3.42Å; L236-A240 PolarHBondContact O-N 2.98Å; A240-A242 VanDerWaalsContact C-N 3.33Å; A240-A242 PolarHBondContact O-N 2.91Å; A240-M243 PolarHBondContact O-N 3.26Å; A240-M243 VanDerWaalsContact O-N 3.16Å; A240-Y244 HydrophobicContact CB-CD2 4.32Å; A240-Y244 WeakPolarHBondContact O-CB 3.46Å; A240-Y244 WeakPolarHBondContact O-CD2 3.47Å; A240-Y244 PolarHBondContact O-N 3.3Å
241F81Confident75.7Confident130 Ų13096.7 Ų96.757%0.5752%0.515SS*.Hα-helixtrans-60.8-40177.1-176.8-98.2000112.8S237 L238 L239 M243 Y244 R245S237-F241 VanDerWaalsContact O-CB 3.27Å; S237-F241 WeakPolarHBondContact O-CB 3.37Å; S237-F241 PolarHBondContact O-N 2.92Å; L238-F241 PolarHBondContact O-N 3.41Å; L239-F241 VanDerWaalsContact C-N 3.32Å; L239-F241 PolarHBondContact O-N 2.86Å; F241-M243 VanDerWaalsContact C-N 3.33Å; F241-Y244 PolarHBondContact O-N 3.42Å; F241-R245 WeakPolarHBondContact O-CB 3.28Å; F241-R245 PolarHBondContact O-N 3.17Å
242A76.9Confident75.8Confident63 Ų63100.4 Ų100.452%0.52152%0.521SS..Hα-helixtrans-64.5-37.7175.600000112.1L238 L239 A240L238-A242 WeakPolarHBondContact O-CB 3.43Å; L238-A242 PolarHBondContact O-N 2.88Å; L239-A242 PolarHBondContact O-N 3.39Å; A240-A242 VanDerWaalsContact C-N 3.33Å; A240-A242 PolarHBondContact O-N 2.91Å
243M73.4Confident75.6Confident137 Ų137102.6 Ų102.668%0.67554%0.537SS*.Hα-helixtrans-77.2-32.1177.3-68.3-59.3-58.800113.4L239 A240 F241L239-M243 WeakPolarHBondContact O-CB 3.36Å; L239-M243 VanDerWaalsContact O-CG 3.3Å; L239-M243 WeakPolarHBondContact O-CG 3.45Å; L239-M243 PolarHBondContact O-N 2.99Å; A240-M243 PolarHBondContact O-N 3.26Å; A240-M243 VanDerWaalsContact O-N 3.16Å; F241-M243 VanDerWaalsContact C-N 3.33Å
244Y73Confident75.1Confident178 Ų178107.2 Ų107.270%0.69856%0.558SS**Hα-helixtrans-85-7.9178.3-84-74.8000113.3L200 A240 F241 P246L200-Y244 HydrophobicContact CD2-CD2 4.34Å; L200-Y244 HydrophobicContact CD2-CE2 3.61Å; A240-Y244 HydrophobicContact CB-CD2 4.32Å; A240-Y244 WeakPolarHBondContact O-CB 3.46Å; A240-Y244 WeakPolarHBondContact O-CD2 3.47Å; A240-Y244 PolarHBondContact O-N 3.3Å; F241-Y244 PolarHBondContact O-N 3.42Å; Y244-P246 VanDerWaalsContact O-CD 3.31Å; Y244-P246 WeakPolarHBondContact O-CD 3.42Å
245R73.5Confident74.6Confident179 Ų179106.6 Ų106.668%0.67556%0.555SS**  trans-85.2111.5173-169.7179.2-179.7146.62.2108.7F241F241-R245 WeakPolarHBondContact O-CB 3.28Å; F241-R245 PolarHBondContact O-N 3.17Å
246P48.5Very low74.4Confident189 Ų189106.4 Ų106.4100%1.22755%0.553SS**  trans-69017931.5-36.4000112.7Y244Y244-P246 VanDerWaalsContact O-CD 3.31Å; Y244-P246 WeakPolarHBondContact O-CD 3.42Å

Retrieved 246 of 246 residues in 38.7 ms (Link to these results)