A0A087YM01_POEFO Loading...

Large ribosomal subunit protein bL32m

Component of the mitochondrial large ribosomal subunit (mt-LSU). The mitochondrial ribosome (mitoribosome) is a large ribonucleoprotein complex responsible for the synthesis of proteins inside mitochondria.

AlphaFold DB , UniProt , Accession A0A087YM01, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 186 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1R36.2Very low56.9Low300 Ų300149.6 Ų149.6100%1.13277%0.765SS**  091.30-157.4177.5-170.4176.21.6106.1
2A39.4Very low58.9Low98 Ų98142.6 Ų142.681%0.8173%0.729SS**  trans-87.6113.1-176.500000108.3I4A2-I4 PolarHBondContact O-N 3.2Å
3E40.3Very low60.7Low190 Ų190138.8 Ų138.889%0.88872%0.717SS**  trans-74.9111172.2-75.5-177.7163.800108.8K5E3-K5 PolarHBondContact O-N 3.28Å
4I50.6Low62Low156 Ų156137.6 Ų137.680%0.871%0.706SS**  trans-68103.4169.6-62.8170.3000106.3A2 M6A2-I4 PolarHBondContact O-N 3.2Å; I4-M6 PolarHBondContact O-N 3.26Å
5K54.3Low63.2Low196 Ų196132.9 Ų132.985%0.85269%0.69SS**  trans-63.4104.1174.3-148.9173.5-170.2175.70107.3E3 M7E3-K5 PolarHBondContact O-N 3.28Å; K5-M7 PolarHBondContact O-N 3.01Å
6M53Low64.6Low176 Ų176130.1 Ų130.187%0.86768%0.676SS**  trans-58.5111177.5-67.2-138-62.400108.7I4 N8I4-M6 PolarHBondContact O-N 3.26Å; M6-N8 PolarHBondContact O-N 3.2Å
7M60.8Low65.7Low143 Ų143132.6 Ų132.670%0.70467%0.674SS**  trans-62.8121.3173.4-79161.464.200107.9K5 L9 L12K5-M7 PolarHBondContact O-N 3.01Å; M7-L9 PolarHBondContact O-N 3.07Å; M7-L12 HydrophobicContact CE-CD1 3.57Å
8N72.5Confident66.3Low119 Ų119128.4 Ų128.464%0.63666%0.658SS**  trans-65.2103.6-177.7-144.9-14.9000108M6 S10 A11 L12M6-N8 PolarHBondContact O-N 3.2Å; N8-S10 PolarHBondContact O-N 3.46Å; N8-S10 VanDerWaalsContact O-N 3.13Å; N8-S10 PolarHBondContact OD1-OG 3.07Å; N8-A11 HydrophobicContact CB-CB 4.22Å; N8-A11 WeakPolarHBondContact O-CA 3.16Å; N8-A11 WeakPolarHBondContact O-CB 3Å; N8-A11 PolarHBondContact O-N 2.81Å; N8-L12 PolarHBondContact O-N 2.81Å; N8-L12 VanDerWaalsContact O-N 3.11Å
9L71.3Confident67.2Low129 Ų129124.2 Ų124.268%0.67564%0.641SS**Hα-helixtrans-57.6-30.9-171-71.9168.3000112M7 L12 V13M7-L9 PolarHBondContact O-N 3.07Å; L9-L12 PolarHBondContact O-N 3.49Å; L9-V13 WeakPolarHBondContact O-CB 3.3Å; L9-V13 WeakPolarHBondContact O-CG2 3.43Å; L9-V13 PolarHBondContact O-N 2.93Å
10S72.7Confident68.1Low80 Ų80123.2 Ų123.256%0.55964%0.636SS**Hα-helixtrans-63.1-41.5173.455.90000112.8N8 V13 H14N8-S10 PolarHBondContact O-N 3.46Å; N8-S10 VanDerWaalsContact O-N 3.13Å; N8-S10 PolarHBondContact OD1-OG 3.07Å; S10-V13 PolarHBondContact O-N 3.02Å; S10-H14 VanDerWaalsContact O-CB 3.26Å; S10-H14 WeakPolarHBondContact O-CB 3.49Å; S10-H14 PolarHBondContact O-N 2.82Å
11A75.3Confident68.6Low59 Ų59121.8 Ų121.849%0.48863%0.63SS.*Hα-helixtrans-70.6-34.717700000111.7N8 S15N8-A11 HydrophobicContact CB-CB 4.22Å; N8-A11 WeakPolarHBondContact O-CA 3.16Å; N8-A11 WeakPolarHBondContact O-CB 3Å; N8-A11 PolarHBondContact O-N 2.81Å; A11-S15 WeakPolarHBondContact O-CB 3.19Å; A11-S15 PolarHBondContact O-N 3.08Å; A11-S15 PolarHBondContact O-OG 2.83Å
12L80.2Confident70.6Confident65 Ų65116.3 Ų116.334%0.3461%0.609SS.*Hα-helixtrans-67.9-44.7173.6-170.4108.7000111.6M7 N8 L9 H14 S15 L16M7-L12 HydrophobicContact CE-CD1 3.57Å; N8-L12 PolarHBondContact O-N 2.81Å; N8-L12 VanDerWaalsContact O-N 3.11Å; L9-L12 PolarHBondContact O-N 3.49Å; L12-H14 VanDerWaalsContact C-N 3.31Å; L12-H14 PolarHBondContact O-N 2.83Å; L12-S15 PolarHBondContact O-N 3.26Å; L12-S15 PolarHBondContact O-OG 3.31Å; L12-L16 HydrophobicContact CD2-CD1 3.81Å; L12-L16 HydrophobicContact CG-CD1 4.05Å; L12-L16 VanDerWaalsContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.21Å; L12-L16 WeakPolarHBondContact O-CD1 3.49Å; L12-L16 VanDerWaalsContact O-CG 3.23Å; L12-L16 WeakPolarHBondContact O-CG 3.47Å; L12-L16 PolarHBondContact O-N 2.8Å
13V82.5Confident72.7Confident94 Ų94116 Ų11657%0.5759%0.593SS**Hα-helixtrans-66-37.5176.8171.50000110.7L9 S10 R17L9-V13 WeakPolarHBondContact O-CB 3.3Å; L9-V13 WeakPolarHBondContact O-CG2 3.43Å; L9-V13 PolarHBondContact O-N 2.93Å; S10-V13 PolarHBondContact O-N 3.02Å; V13-R17 VanDerWaalsContact O-CB 3.3Å; V13-R17 WeakPolarHBondContact O-CB 3.34Å; V13-R17 PolarHBondContact O-N 3.17Å
14H79.1Confident74.5Confident122 Ų122112.5 Ų112.557%0.56558%0.576SS**Hα-helixtrans-66.9-43.7175.1-172.171000112S10 L12 R17 C18S10-H14 VanDerWaalsContact O-CB 3.26Å; S10-H14 WeakPolarHBondContact O-CB 3.49Å; S10-H14 PolarHBondContact O-N 2.82Å; L12-H14 VanDerWaalsContact C-N 3.31Å; L12-H14 PolarHBondContact O-N 2.83Å; H14-R17 PolarHBondContact O-N 2.95Å; H14-C18 WeakPolarHBondContact O-CB 3.39Å; H14-C18 PolarHBondContact O-N 3.46Å; H14-C18 PolarHBondContact O-SG 3.5Å
15S79.9Confident75.4Confident66 Ų66107.8 Ų107.846%0.46256%0.557SS.*Hα-helixtrans-66.9-37.1177.570.40000112.2A11 L12 C18 S19A11-S15 WeakPolarHBondContact O-CB 3.19Å; A11-S15 PolarHBondContact O-N 3.08Å; A11-S15 PolarHBondContact O-OG 2.83Å; L12-S15 PolarHBondContact O-N 3.26Å; L12-S15 PolarHBondContact O-OG 3.31Å; S15-C18 PolarHBondContact O-N 3.18Å; S15-S19 WeakPolarHBondContact O-CB 3.46Å; S15-S19 PolarHBondContact O-N 3.06Å; S15-S19 PolarHBondContact O-OG 2.88Å
16L86.2Confident76.3Confident88 Ų88105.9 Ų105.946%0.46155%0.545SS..Hα-helixtrans-66.3-41.3173-75.2167.8000112.1L12 C18 S19 L20L12-L16 HydrophobicContact CD2-CD1 3.81Å; L12-L16 HydrophobicContact CG-CD1 4.05Å; L12-L16 VanDerWaalsContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.21Å; L12-L16 WeakPolarHBondContact O-CD1 3.49Å; L12-L16 VanDerWaalsContact O-CG 3.23Å; L12-L16 WeakPolarHBondContact O-CG 3.47Å; L12-L16 PolarHBondContact O-N 2.8Å; L16-C18 VanDerWaalsContact C-N 3.35Å; L16-S19 WeakPolarHBondContact CA-OG 3.42Å; L16-S19 PolarHBondContact O-N 3.16Å; L16-S19 PolarHBondContact O-OG 2.79Å; L16-L20 WeakPolarHBondContact O-CB 3.48Å; L16-L20 WeakPolarHBondContact O-CG 3.46Å; L16-L20 PolarHBondContact O-N 2.96Å
17R82.8Confident77.4Confident174 Ų174102.5 Ų102.566%0.65753%0.53SS*.Hα-helixtrans-62.5-44.5174.6-175.4177.7177-178.8-1.3111.1V13 H14 L20 L21V13-R17 VanDerWaalsContact O-CB 3.3Å; V13-R17 WeakPolarHBondContact O-CB 3.34Å; V13-R17 PolarHBondContact O-N 3.17Å; H14-R17 PolarHBondContact O-N 2.95Å; R17-L20 PolarHBondContact O-N 2.81Å; R17-L21 HydrophobicContact CG-CD1 4.26Å; R17-L21 VanDerWaalsContact O-CG 3.28Å; R17-L21 WeakPolarHBondContact O-CG 3.36Å; R17-L21 PolarHBondContact O-N 3.39Å
18C76.9Confident77.7Confident56 Ų56100.4 Ų100.438%0.37852%0.521SS..Hα-helixtrans-67.3-34.7178.3-71.60000112.6H14 S15 L16 R22H14-C18 WeakPolarHBondContact O-CB 3.39Å; H14-C18 PolarHBondContact O-N 3.46Å; H14-C18 PolarHBondContact O-SG 3.5Å; S15-C18 PolarHBondContact O-N 3.18Å; L16-C18 VanDerWaalsContact C-N 3.35Å; C18-R22 WeakPolarHBondContact O-CB 3.39Å; C18-R22 PolarHBondContact O-N 3.49Å
19S82.1Confident77.4Confident49 Ų49100.6 Ų100.634%0.34352%0.518SS..Hα-helixtrans-73-39.817666.80000111.9S15 L16 R22 I23S15-S19 WeakPolarHBondContact O-CB 3.46Å; S15-S19 PolarHBondContact O-N 3.06Å; S15-S19 PolarHBondContact O-OG 2.88Å; L16-S19 WeakPolarHBondContact CA-OG 3.42Å; L16-S19 PolarHBondContact O-N 3.16Å; L16-S19 PolarHBondContact O-OG 2.79Å; S19-R22 WeakPolarHBondContact O-CB 3.41Å; S19-R22 PolarHBondContact O-N 3.26Å; S19-I23 VanDerWaalsContact O-CG1 3.26Å; S19-I23 WeakPolarHBondContact O-CG1 3.36Å; S19-I23 PolarHBondContact O-N 3.28Å
20L86.4Confident77.2Confident103 Ų103101 Ų10154%0.53952%0.519SS..Hα-helixtrans-64.3-44.3176.4-72171.3000112.2L16 R17 R22 I23 E24L16-L20 WeakPolarHBondContact O-CB 3.48Å; L16-L20 WeakPolarHBondContact O-CG 3.46Å; L16-L20 PolarHBondContact O-N 2.96Å; R17-L20 PolarHBondContact O-N 2.81Å; L20-R22 PolarHBondContact O-N 3.06Å; L20-I23 PolarHBondContact O-N 3.41Å; L20-I23 VanDerWaalsContact O-N 3.12Å; L20-E24 PolarHBondContact O-N 3.27Å
21L79Confident76.8Confident95 Ų95100.2 Ų100.250%0.49751%0.514SS..Hα-helixtrans-60.9-34.4173.9-70.7171.2000112.2R17 S25R17-L21 HydrophobicContact CG-CD1 4.26Å; R17-L21 VanDerWaalsContact O-CG 3.28Å; R17-L21 WeakPolarHBondContact O-CG 3.36Å; R17-L21 PolarHBondContact O-N 3.39Å; L21-S25 PolarHBondContact O-N 3.35Å; L21-S25 VanDerWaalsContact O-N 3.11Å; L21-S25 PolarHBondContact O-OG 3.04Å
22R76.8Confident75.9Confident185 Ų18599.4 Ų99.470%0.69851%0.511SS*.Hα-helixtrans-73.6-32.7176.9-161.9178.8-71-144.1-1.3112.1C18 S19 L20 S25 R26C18-R22 WeakPolarHBondContact O-CB 3.39Å; C18-R22 PolarHBondContact O-N 3.49Å; S19-R22 WeakPolarHBondContact O-CB 3.41Å; S19-R22 PolarHBondContact O-N 3.26Å; L20-R22 PolarHBondContact O-N 3.06Å; R22-S25 WeakPolarHBondContact CA-OG 3.13Å; R22-S25 PolarHBondContact O-OG 3.18Å; R22-R26 VanDerWaalsContact O-CG 3.26Å; R22-R26 WeakPolarHBondContact O-CG 3.32Å; R22-R26 PolarHBondContact O-N 3.48Å
23I84.4Confident74.7Confident92 Ų92102.8 Ų102.847%0.47253%0.529SS..Hα-helixtrans-72.2-43.4174.5-69.2162.7000110.5S19 L20 S25 R26 L27S19-I23 VanDerWaalsContact O-CG1 3.26Å; S19-I23 WeakPolarHBondContact O-CG1 3.36Å; S19-I23 PolarHBondContact O-N 3.28Å; L20-I23 PolarHBondContact O-N 3.41Å; L20-I23 VanDerWaalsContact O-N 3.12Å; I23-S25 PolarHBondContact O-N 3Å; I23-R26 PolarHBondContact O-N 3.5Å; I23-L27 HydrophobicContact CG2-CD1 3.74Å; I23-L27 HydrophobicContact CG2-CG 4.26Å; I23-L27 WeakPolarHBondContact O-CB 3.43Å; I23-L27 WeakPolarHBondContact O-CG 3.4Å; I23-L27 PolarHBondContact O-N 3.28Å
24E77.6Confident73.2Confident116 Ų116104.5 Ų104.554%0.54254%0.535SS..Hα-helixtrans-58.3-48.6175.5-79.5-177.6155.100111.8L20 R26 L27 L28L20-E24 PolarHBondContact O-N 3.27Å; E24-R26 VanDerWaalsContact C-N 3.29Å; E24-R26 PolarHBondContact O-N 3.42Å; E24-L27 PolarHBondContact O-N 3.08Å; E24-L28 WeakPolarHBondContact O-CB 3.44Å; E24-L28 WeakPolarHBondContact O-CG 3.29Å; E24-L28 PolarHBondContact O-N 3.13Å
25S69.8Low71.9Confident57 Ų57102.3 Ų102.340%0.39953%0.533SS..Hα-helixtrans-61.9-34.7177.551.90000113.2L21 R22 I23 Q29L21-S25 PolarHBondContact O-N 3.35Å; L21-S25 VanDerWaalsContact O-N 3.11Å; L21-S25 PolarHBondContact O-OG 3.04Å; R22-S25 WeakPolarHBondContact CA-OG 3.13Å; R22-S25 PolarHBondContact O-OG 3.18Å; I23-S25 PolarHBondContact O-N 3Å; S25-Q29 WeakPolarHBondContact O-CG 3.49Å; S25-Q29 PolarHBondContact O-N 3.26Å
26R73.1Confident70.5Confident156 Ų156106.6 Ų106.659%0.58955%0.546SS*.Hα-helixtrans-73.2-39.3174.6-72.1-66.6-170.8-175.54.1112.6R22 I23 E24 L28 Q29 I30R22-R26 VanDerWaalsContact O-CG 3.26Å; R22-R26 WeakPolarHBondContact O-CG 3.32Å; R22-R26 PolarHBondContact O-N 3.48Å; I23-R26 PolarHBondContact O-N 3.5Å; E24-R26 VanDerWaalsContact C-N 3.29Å; E24-R26 PolarHBondContact O-N 3.42Å; R26-L28 VanDerWaalsContact C-N 3.35Å; R26-Q29 PolarHBondContact O-N 2.77Å; R26-I30 WeakPolarHBondContact O-CD1 3.37Å; R26-I30 WeakPolarHBondContact O-CG1 3.36Å; R26-I30 PolarHBondContact O-N 3.38Å
27L75.3Confident68.7Low105 Ų105111.5 Ų111.555%0.5557%0.572SS.*Hα-helixtrans-65.8-37.6175.8-75.9170.7000111.9I23 E24 I30 S31I23-L27 HydrophobicContact CG2-CD1 3.74Å; I23-L27 HydrophobicContact CG2-CG 4.26Å; I23-L27 WeakPolarHBondContact O-CB 3.43Å; I23-L27 WeakPolarHBondContact O-CG 3.4Å; I23-L27 PolarHBondContact O-N 3.28Å; E24-L27 PolarHBondContact O-N 3.08Å; L27-I30 PolarHBondContact O-N 3.04Å; L27-S31 VanDerWaalsContact O-CB 3.31Å; L27-S31 WeakPolarHBondContact O-CB 3.25Å; L27-S31 PolarHBondContact O-N 3.36Å; L27-S31 PolarHBondContact O-OG 3.18Å
28L68Low67Low98 Ų98106.6 Ų106.651%0.51357%0.569SS.*Hα-helixtrans-64.3-39.3173.3-71.8171.6000112.1E24 R26 S31E24-L28 WeakPolarHBondContact O-CB 3.44Å; E24-L28 WeakPolarHBondContact O-CG 3.29Å; E24-L28 PolarHBondContact O-N 3.13Å; R26-L28 VanDerWaalsContact C-N 3.35Å; L28-S31 PolarHBondContact O-OG 3.29Å
29Q65.4Low65.4Low123 Ų123110.4 Ų110.458%0.57559%0.593SS**Hα-helixtrans-67.7-35174.3-74.4-173.7-6.300113.5S25 R26S25-Q29 WeakPolarHBondContact O-CG 3.49Å; S25-Q29 PolarHBondContact O-N 3.26Å; R26-Q29 PolarHBondContact O-N 2.77Å
30I68.2Low63.9Low138 Ų138111.9 Ų111.971%0.70861%0.608SS**Hα-helixtrans-79-37.8-178.7-66.5163.4000111.8R26 L27 G32R26-I30 WeakPolarHBondContact O-CD1 3.37Å; R26-I30 WeakPolarHBondContact O-CG1 3.36Å; R26-I30 PolarHBondContact O-N 3.38Å; L27-I30 PolarHBondContact O-N 3.04Å; I30-G32 PolarHBondContact O-N 3.46Å
31S64.5Low61.8Low63 Ų63114.4 Ų114.444%0.44162%0.621SS.*Hα-helixtrans-72.4-11-177.857.80000113.8L27 L28 L33L27-S31 VanDerWaalsContact O-CB 3.31Å; L27-S31 WeakPolarHBondContact O-CB 3.25Å; L27-S31 PolarHBondContact O-N 3.36Å; L27-S31 PolarHBondContact O-OG 3.18Å; L28-S31 PolarHBondContact O-OG 3.29Å; S31-L33 PolarHBondContact O-N 3.08Å
32G56.7Low60.2Low43 Ų43114.5 Ų114.544%0.44364%0.635SS.*  trans63.48.6-178.900000113.9I30 D34 S35I30-G32 PolarHBondContact O-N 3.46Å; G32-D34 PolarHBondContact O-N 2.87Å; G32-S35 PolarHBondContact O-N 3.16Å; G32-S35 PolarHBondContact O-OG 3.04Å
33L55.1Low58.6Low136 Ų136112.2 Ų112.271%0.71264%0.642SS**THydrogen-bonded Turntrans-73.7-0.2174.1-101.394.1000113.1S31 S35S31-L33 PolarHBondContact O-N 3.08Å; L33-S35 PolarHBondContact O-N 3.37Å
34D50.3Low56.8Low129 Ų129115.4 Ų115.469%0.6966%0.66SS**THydrogen-bonded Turntrans-7115.7163.4-141.912.7000112.3G32 Q36G32-D34 PolarHBondContact O-N 2.87Å; D34-Q36 PolarHBondContact O-N 3.27Å
35S51.5Low55.5Low76 Ų76112.4 Ų112.453%0.53166%0.66SS.*SBendtrans-89.292.4164.545.50000110G32 L33G32-S35 PolarHBondContact O-N 3.16Å; G32-S35 PolarHBondContact O-OG 3.04Å; L33-S35 PolarHBondContact O-N 3.37Å
36Q50.2Low54.4Low156 Ų156115.6 Ų115.673%0.72968%0.679SS**  trans65.679.7142-54.8177.7-2.600117.2D34D34-Q36 PolarHBondContact O-N 3.27Å
37L48.5Very low53.2Low191 Ų191113.7 Ų113.7100%169%0.69SS**SBendtrans-118.49.1148.6-99.5102.2000114.6
38A47.9Very low51.7Low72 Ų72116.3 Ų116.360%0.59570%0.703SS**SBendtrans-130.4145164.900000108.8A40A38-A40 PolarHBondContact O-N 2.78Å
39P43.7Very low50.6Low136 Ų136119.1 Ų119.188%0.88372%0.718SS**  trans-59.8131.7-174.525.9-32.4000110L41P39-L41 PolarHBondContact O-N 2.86Å
40A49.2Very low49.3Very low79 Ų79118.8 Ų118.865%0.65373%0.727SS**  trans-63.1121.9-167.300000113.8A38A38-A40 PolarHBondContact O-N 2.78Å
41L42.7Very low48Very low157 Ų157121.3 Ų121.382%0.82274%0.736SS**  trans-138.989149.4-100.2154.4000106.6P39P39-L41 PolarHBondContact O-N 2.86Å
42A45.1Very low46.8Very low96 Ų96125.7 Ų125.779%0.79375%0.752SS**  trans-85.9115179.500000110.2
43V43.4Very low45.7Very low138 Ų138132.5 Ų132.584%0.83677%0.773SS**  trans-133.791.2149.8-177.20000107.1
44N47.2Very low44.8Very low159 Ų159135 Ų13585%0.8578%0.781SS**  trans-116.687.9162.7-109.6-29.3000106.7
45G50.3Low43.8Very low53 Ų53136.7 Ų136.755%0.54679%0.789SS.*  trans-98.1144.3166.300000109.5S47G45-S47 PolarHBondContact O-N 2.76Å
46P45.3Very low43.3Very low123 Ų123138.2 Ų138.280%0.79980%0.798SS**  trans-65.1127.5178.925.8-31.1000110.5L48P46-L48 PolarHBondContact O-N 3.13Å
47S48.7Very low42.4Very low117 Ų117139 Ų13982%0.81880%0.802SS**  trans-66.586.4175.854.80000111G45G45-S47 PolarHBondContact O-N 2.76Å
48L43Very low41.6Very low159 Ų159136.4 Ų136.483%0.83278%0.784SS**  trans-119.555.1164.7-67.3179.8000109.5P46P46-L48 PolarHBondContact O-N 3.13Å
49L44.8Very low40.8Very low158 Ų158140 Ų14083%0.82779%0.793SS**  trans-98136.8165-68.3177.7000108.8Q51L49-Q51 PolarHBondContact O-N 2.87Å
50P38.8Very low40.8Very low115 Ų115142.5 Ų142.575%0.74779%0.793SS**  trans-61.4130.8177.7-16.629.3000110.2I52P50-I52 PolarHBondContact O-N 3.32Å
51Q39.9Very low40.6Very low192 Ų192147.3 Ų147.390%0.89780%0.802SS**  trans-70.9108.5167.8-65.6-161.6-38.300107.7L49 E53L49-Q51 PolarHBondContact O-N 2.87Å; Q51-E53 PolarHBondContact O-N 3.37Å
52I39.5Very low40.2Very low155 Ų155149 Ų14980%0.79581%0.806SS**  trans-75.7113.5166.6-64171.2000105.7P50 Q54P50-I52 PolarHBondContact O-N 3.32Å; I52-Q54 PolarHBondContact O-N 2.95Å
53E35.1Very low39.8Very low186 Ų186150.9 Ų150.987%0.86980%0.803SS**  trans-58.8127.7175.4-66.6172.4160.800109.3Q51Q51-E53 PolarHBondContact O-N 3.37Å
54Q36.2Very low39.7Very low189 Ų189150.1 Ų150.188%0.88380%0.801SS**  trans-92.2110.6175.9-70178.1-43.800108.9I52I52-Q54 PolarHBondContact O-N 2.95Å
55D27.9Very low40Very low163 Ų163151 Ų15187%0.87280%0.8SS**  trans-83.4138.5157.2-83-33.6000109.3
56P41.1Very low40.3Very low109 Ų109156.4 Ų156.471%0.70881%0.811SS**  trans-98.1123.917933.9-25.1000110.6
57Q32.1Very low40.8Very low173 Ų173156.7 Ų156.781%0.80881%0.81SS**  trans163.7136.7159.7-93.6167.5-62.500104.9
58Q30.7Very low41.2Very low136 Ų136156.1 Ų156.164%0.63680%0.804SS**  cis-175.3158.26.5-121.6167-42.400104.3
59D30.9Very low42Very low146 Ų146150.3 Ų150.378%0.78178%0.782SS**  trans85.9133.5154.2-50.7-24.9000119.9
60E44.4Very low42.8Very low189 Ų189149.4 Ų149.488%0.88378%0.777SS**  trans-80.3175.6-168.4-57.2-162.7115.400113.3
61E44.5Very low43.7Very low180 Ų180150.1 Ų150.184%0.84177%0.774SS**  trans83.980173.7-58.6-176.6151.500116.1
62Q34.9Very low44.5Very low193 Ų193143.4 Ų143.490%0.90275%0.745SS**  trans-159143.5140.1-104.5145.853.200110
63D37.1Very low45.6Very low136 Ų136140.2 Ų140.273%0.72774%0.736SS**  trans-32.4156.3-172.7-73.7-68.9000117.2E65D63-E65 PolarHBondContact O-N 3.42Å
64P41.9Very low46.8Very low122 Ų122135.3 Ų135.379%0.79272%0.715SS**  trans-71.768.8171.933.4-33.5000109.8Q66P64-Q66 PolarHBondContact O-N 3.22Å
65E52.2Low47.9Very low178 Ų178132.9 Ų132.983%0.83271%0.707SS**  trans-67.7102.3164.3-77.2-160.7155.300107.4D63 T67D63-E65 PolarHBondContact O-N 3.42Å; E65-T67 PolarHBondContact O-N 2.97Å; E65-T67 VanDerWaalsContact O-N 3.09Å
66Q56.7Low49.5Very low166 Ų166135.8 Ų135.878%0.77671%0.706SS**  trans-45.9112.5178.5-63.2166.71.700109.6P64 P68P64-Q66 PolarHBondContact O-N 3.22Å; Q66-P68 WeakPolarHBondContact O-CD 3.49Å; Q66-P68 VanDerWaalsContact O-N 3.15Å
67T55.9Low50.8Low128 Ų128137.3 Ų137.379%0.78571%0.705SS**  trans-55.1121.3162.7480000106.7E65 G69E65-T67 PolarHBondContact O-N 2.97Å; E65-T67 VanDerWaalsContact O-N 3.09Å; T67-G69 PolarHBondContact O-N 3.4Å
68P56.6Low53.2Low106 Ų106134.1 Ų134.169%0.68871%0.709SS**  trans-67.2105.4-170.824.1-32000108.1Q66 D72Q66-P68 WeakPolarHBondContact O-CD 3.49Å; Q66-P68 VanDerWaalsContact O-N 3.15Å; P68-D72 WeakPolarHBondContact CA-OD2 3.43Å; P68-D72 HydrophobicContact CB-CB 3.84Å
69G61.5Low55.8Low36 Ų36131.7 Ų131.737%0.37171%0.712SS.*  trans-62.6164.8-176.600000109.9T67 L71 D72 S73T67-G69 PolarHBondContact O-N 3.4Å; G69-L71 PolarHBondContact O-N 3.03Å; G69-D72 PolarHBondContact N-OD2 2.7Å; G69-D72 WeakPolarHBondContact O-CA 3.36Å; G69-D72 WeakPolarHBondContact O-CB 3.38Å; G69-D72 PolarHBondContact O-N 3.46Å; G69-S73 PolarHBondContact O-N 2.97Å
70L59.9Low58.7Low140 Ų140130.6 Ų130.673%0.73371%0.713SS**Hα-helixtrans-51.2-28.1173.8-162.3154.6000112S73 I74L70-S73 WeakPolarHBondContact O-CB 3.36Å; L70-S73 PolarHBondContact O-N 3.48Å; L70-I74 HydrophobicContact CD2-CD1 3.63Å; L70-I74 HydrophobicContact CD2-CG1 4.31Å; L70-I74 WeakPolarHBondContact O-CG1 3.49Å; L70-I74 PolarHBondContact O-N 2.97Å
71L58.3Low60.9Low129 Ų129130.5 Ų130.568%0.67571%0.709SS**Hα-helixtrans-66.9-32.1173.6-58.8176.3000114G69 I74 L75G69-L71 PolarHBondContact O-N 3.03Å; L71-I74 PolarHBondContact O-N 3.43Å; L71-L75 WeakPolarHBondContact O-CG 3.45Å; L71-L75 PolarHBondContact O-N 2.91Å
72D57.8Low63.3Low52 Ų52130 Ų13028%0.27871%0.705SS.*Hα-helixtrans-67.5-38.3171.8-75.6-30.5000110.5P68 G69 I74 L75 W76P68-D72 WeakPolarHBondContact CA-OD2 3.43Å; P68-D72 HydrophobicContact CB-CB 3.84Å; G69-D72 PolarHBondContact N-OD2 2.7Å; G69-D72 WeakPolarHBondContact O-CA 3.36Å; G69-D72 WeakPolarHBondContact O-CB 3.38Å; G69-D72 PolarHBondContact O-N 3.46Å; D72-I74 VanDerWaalsContact C-N 3.29Å; D72-I74 PolarHBondContact O-N 3.15Å; D72-L75 PolarHBondContact O-N 3.49Å; D72-W76 PolarHBondContact O-N 3.07Å; D72-W76 VanDerWaalsContact O-N 3.16Å
73S61.4Low66.2Low87 Ų87132.3 Ų132.361%0.60871%0.705SS**Hα-helixtrans-63-34.9174.4-164.40000113.1G69 L70 M77G69-S73 PolarHBondContact O-N 2.97Å; L70-S73 WeakPolarHBondContact O-CB 3.36Å; L70-S73 PolarHBondContact O-N 3.48Å; S73-M77 WeakPolarHBondContact O-CG 3.21Å; S73-M77 PolarHBondContact O-N 2.9Å
74I61.2Low69Low84 Ų84132.8 Ų132.843%0.43170%0.696SS.*Hα-helixtrans-74.1-37.8178.8-65.1166.9000111.8L70 L71 D72 W76 M77L70-I74 HydrophobicContact CD2-CD1 3.63Å; L70-I74 HydrophobicContact CD2-CG1 4.31Å; L70-I74 WeakPolarHBondContact O-CG1 3.49Å; L70-I74 PolarHBondContact O-N 2.97Å; L71-I74 PolarHBondContact O-N 3.43Å; D72-I74 VanDerWaalsContact C-N 3.29Å; D72-I74 PolarHBondContact O-N 3.15Å; I74-W76 VanDerWaalsContact C-N 3.28Å; I74-W76 PolarHBondContact O-N 2.93Å; I74-M77 WeakPolarHBondContact O-CB 3.26Å; I74-M77 PolarHBondContact O-N 2.8Å
75L58.1Low71.7Confident138 Ų138130.4 Ų130.472%0.72368%0.68SS**Hα-helixtrans-69.9-25.9177.6-76.4164.3000112.8L71 D72 M77L71-L75 WeakPolarHBondContact O-CG 3.45Å; L71-L75 PolarHBondContact O-N 2.91Å; D72-L75 PolarHBondContact O-N 3.49Å; L75-M77 VanDerWaalsContact C-N 3.34Å
76W63Low73.9Confident223 Ų223126.1 Ų126.185%0.84566%0.662SS**THydrogen-bonded Turntrans-87.8-0.5175.9-72.366.6000113.6D72 I74 A78D72-W76 PolarHBondContact O-N 3.07Å; D72-W76 VanDerWaalsContact O-N 3.16Å; I74-W76 VanDerWaalsContact C-N 3.28Å; I74-W76 PolarHBondContact O-N 2.93Å; W76-A78 PolarHBondContact O-N 3.37Å
77M68.4Low75.8Confident142 Ų142123.7 Ų123.770%0.765%0.65SS**SBendtrans-73.9111172.4-71.7-134.366.900110.7S73 I74 L75 A79S73-M77 WeakPolarHBondContact O-CG 3.21Å; S73-M77 PolarHBondContact O-N 2.9Å; I74-M77 WeakPolarHBondContact O-CB 3.26Å; I74-M77 PolarHBondContact O-N 2.8Å; L75-M77 VanDerWaalsContact C-N 3.34Å; M77-A79 PolarHBondContact O-N 3.41Å
78A81.4Confident77.8Confident106 Ų106121.1 Ų121.188%0.87663%0.634SS**  trans-61101.3176.100000111.2W76W76-A78 PolarHBondContact O-N 3.37Å
79A85.8Confident79.8Confident85 Ų85117.7 Ų117.770%0.70261%0.61SS**  trans-96139.317400000111M77 K81M77-A79 PolarHBondContact O-N 3.41Å; A79-K81 PolarHBondContact O-N 3.3Å
80P91.3Very high81.5Confident123 Ų123122.3 Ų122.380%0.79962%0.616SS**  trans-59.2114.7173.7-22.832.9000111.2K82P80-K82 PolarHBondContact O-N 3.28Å; P80-K82 VanDerWaalsContact O-N 3.17Å
81K90.9Very high83.3Confident187 Ų187120.8 Ų120.881%0.81361%0.613SS**SBendtrans-61.3-28.4-176.3-170.861.6172.2-173.30113.7A79A79-K81 PolarHBondContact O-N 3.3Å
82K94.8Very high85.2Confident170 Ų170119 Ų11974%0.73960%0.597SS**SBendtrans-142145.4-178.2-61-66.2174.6-178.50111.6P80P80-K82 PolarHBondContact O-N 3.28Å; P80-K82 VanDerWaalsContact O-N 3.17Å
83R95.5Very high87Confident241 Ų241124.4 Ų124.491%0.90961%0.614SS**PPolyproline II helixtrans-67132.3170.3-176.4-178.7179.6-166.91.7109.5
84R96.9Very high88.7Confident145 Ų145128.6 Ų128.655%0.54762%0.616SS.*PPolyproline II helixtrans-68.7138.2174.2-65.1-177.5-174.5171.71.5110.7V88 N89 R92R84-V88 HydrophobicContact CB-CG1 4.36Å; R84-V88 HydrophobicContact CG-CG1 4.46Å; R84-N89 PolarHBondContact O-ND2 3.45Å; R84-R92 VanDerWaalsContact NH1-CD 3.34Å
85T97.9Very high90.4Very high72 Ų72125.5 Ų125.544%0.44260%0.603SS.*PPolyproline II helixtrans-67.6167176790000111.6E87 V88 N89T85-E87 VanDerWaalsContact C-N 3.33Å; T85-E87 WeakPolarHBondContact CB-OE2 3.27Å; T85-E87 PolarHBondContact OG1-OE2 3.32Å; T85-V88 WeakPolarHBondContact OG1-CG2 3.24Å; T85-V88 PolarHBondContact OG1-N 2.86Å; T85-N89 WeakPolarHBondContact O-CB 3.39Å; T85-N89 PolarHBondContact O-N 3.34Å; T85-N89 VanDerWaalsContact O-N 3.12Å; T85-N89 PolarHBondContact O-ND2 2.91Å
86I97.8Very high92.3Very high88 Ų88126.9 Ų126.945%0.45161%0.606SS.*Hα-helixtrans-66-37.7178.9-177.368.3000111.2N89 R90I86-N89 PolarHBondContact O-N 3.4Å; I86-R90 HydrophobicContact CD1-CG 4.34Å; I86-R90 HydrophobicContact CG1-CG 4.29Å; I86-R90 WeakPolarHBondContact O-CB 3.18Å; I86-R90 VanDerWaalsContact O-CG 3.28Å; I86-R90 WeakPolarHBondContact O-CG 3.43Å; I86-R90 PolarHBondContact O-N 2.73Å
87E98.2Very high93.8Very high115 Ų115125.8 Ų125.854%0.53760%0.602SS.*Hα-helixtrans-62-50.6178.5-56.373.6-155.300110.3T85 N89 R90 T91T85-E87 VanDerWaalsContact C-N 3.33Å; T85-E87 WeakPolarHBondContact CB-OE2 3.27Å; T85-E87 PolarHBondContact OG1-OE2 3.32Å; E87-N89 VanDerWaalsContact C-N 3.28Å; E87-N89 PolarHBondContact O-N 2.94Å; E87-R90 PolarHBondContact O-N 2.85Å; E87-R90 VanDerWaalsContact O-N 3.12Å; E87-T91 PolarHBondContact O-N 2.84Å; E87-T91 PolarHBondContact O-OG1 3.16Å
88V97.6Very high95.1Very high75 Ų75123.6 Ų123.646%0.45559%0.588SS.*Hα-helixtrans-59.1-42.5177.9174.40000110.8R84 T85 R92R84-V88 HydrophobicContact CB-CG1 4.36Å; R84-V88 HydrophobicContact CG-CG1 4.46Å; T85-V88 WeakPolarHBondContact OG1-CG2 3.24Å; T85-V88 PolarHBondContact OG1-N 2.86Å; V88-R92 WeakPolarHBondContact O-CB 3.4Å; V88-R92 PolarHBondContact O-N 3.23Å
89N97.8Very high95.8Very high34 Ų34123.4 Ų123.418%0.18257%0.572CS.*Hα-helixtrans-67.8-39.2177.7-77.4-42.6000112.6R84 T85 I86 E87 R92 R93R84-N89 PolarHBondContact O-ND2 3.45Å; T85-N89 WeakPolarHBondContact O-CB 3.39Å; T85-N89 PolarHBondContact O-N 3.34Å; T85-N89 VanDerWaalsContact O-N 3.12Å; T85-N89 PolarHBondContact O-ND2 2.91Å; I86-N89 PolarHBondContact O-N 3.4Å; E87-N89 VanDerWaalsContact C-N 3.28Å; E87-N89 PolarHBondContact O-N 2.94Å; N89-R92 PolarHBondContact O-N 3.02Å; N89-R93 VanDerWaalsContact O-CB 3.31Å; N89-R93 WeakPolarHBondContact O-CB 3.34Å; N89-R93 VanDerWaalsContact O-CG 3.23Å; N89-R93 WeakPolarHBondContact O-CG 3.41Å; N89-R93 PolarHBondContact O-N 3.33Å
90R97.9Very high96.4Very high132 Ų132127.4 Ų127.450%0.49858%0.58SS.*Hα-helixtrans-64.9-50.9177-77.4174.9-179.9173.63.1110.8I86 E87 R92 R93 R94I86-R90 HydrophobicContact CD1-CG 4.34Å; I86-R90 HydrophobicContact CG1-CG 4.29Å; I86-R90 WeakPolarHBondContact O-CB 3.18Å; I86-R90 VanDerWaalsContact O-CG 3.28Å; I86-R90 WeakPolarHBondContact O-CG 3.43Å; I86-R90 PolarHBondContact O-N 2.73Å; E87-R90 PolarHBondContact O-N 2.85Å; E87-R90 VanDerWaalsContact O-N 3.12Å; R90-R92 VanDerWaalsContact C-N 3.29Å; R90-R92 PolarHBondContact O-N 2.82Å; R90-R93 PolarHBondContact O-N 3.24Å; R90-R93 VanDerWaalsContact O-N 3.1Å; R90-R94 WeakPolarHBondContact O-CB 3.4Å; R90-R94 WeakPolarHBondContact O-CG 3.31Å; R90-R94 PolarHBondContact O-N 3.27Å
91T97.5Very high96.6Very high108 Ų108130.1 Ų130.166%0.66358%0.579SS**Hα-helixtrans-58.8-42.6176.5-55.90000111.1E87 R93 A95E87-T91 PolarHBondContact O-N 2.84Å; E87-T91 PolarHBondContact O-OG1 3.16Å; T91-R93 PolarHBondContact O-N 2.8Å; T91-A95 WeakPolarHBondContact O-CB 3.21Å; T91-A95 PolarHBondContact O-N 3.28Å
92R97.1Very high96.8Very high91 Ų91127.6 Ų127.634%0.34358%0.579SS.*Hα-helixtrans-64.9-35.6176.5-173.9-172.668.388.91.3113.1R84 V88 N89 R90 K98R84-R92 VanDerWaalsContact NH1-CD 3.34Å; V88-R92 WeakPolarHBondContact O-CB 3.4Å; V88-R92 PolarHBondContact O-N 3.23Å; N89-R92 PolarHBondContact O-N 3.02Å; R90-R92 VanDerWaalsContact C-N 3.29Å; R90-R92 PolarHBondContact O-N 2.82Å; R92-K98 WeakPolarHBondContact O-CD 3.39Å; R92-K98 WeakPolarHBondContact O-CE 3.47Å; R92-K98 PolarHBondContact O-NZ 3.06Å
93R97.2Very high96.9Very high166 Ų166126.3 Ų126.363%0.62657%0.574SS**Hα-helixtrans-85.3-38-176.8-73.9176.2-174.6177.62.4112.7N89 R90 T91N89-R93 VanDerWaalsContact O-CB 3.31Å; N89-R93 WeakPolarHBondContact O-CB 3.34Å; N89-R93 VanDerWaalsContact O-CG 3.23Å; N89-R93 WeakPolarHBondContact O-CG 3.41Å; N89-R93 PolarHBondContact O-N 3.33Å; R90-R93 PolarHBondContact O-N 3.24Å; R90-R93 VanDerWaalsContact O-N 3.1Å; T91-R93 PolarHBondContact O-N 2.8Å
94R97.1Very high96.9Very high175 Ų175121 Ų12166%0.6657%0.568SS**Hα-helixtrans-94.37.3-176-59.8-178.1179.2-179.4-2.4113.8R90 E96R90-R94 WeakPolarHBondContact O-CB 3.4Å; R90-R94 WeakPolarHBondContact O-CG 3.31Å; R90-R94 PolarHBondContact O-N 3.27Å; R94-E96 PolarHBondContact O-N 3.35Å
95A97.1Very high96.9Very high19 Ų19116.3 Ų116.316%0.15755%0.554CS.*  trans-56.4138.5171.500000110T91 R97 K98 L99T91-A95 WeakPolarHBondContact O-CB 3.21Å; T91-A95 PolarHBondContact O-N 3.28Å; A95-R97 HydrophobicContact CB-CG 4.18Å; A95-R97 PolarHBondContact O-N 3Å; A95-R97 VanDerWaalsContact O-N 3.12Å; A95-K98 WeakPolarHBondContact O-CA 3.32Å; A95-K98 WeakPolarHBondContact O-CB 3.44Å; A95-K98 PolarHBondContact O-N 3.29Å; A95-L99 PolarHBondContact O-N 2.85Å
96E96.3Very high96.8Very high168 Ų168117.6 Ų117.679%0.78556%0.557SS**G310 helixtrans-53.1-38.8-175.2-171.8179.4-179.900113.2R94 K98 L99R94-E96 PolarHBondContact O-N 3.35Å; E96-K98 PolarHBondContact O-N 2.9Å; E96-L99 WeakPolarHBondContact O-CB 3.41Å; E96-L99 PolarHBondContact O-N 3.34Å
97R95.8Very high96.7Very high200 Ų200116.2 Ų116.276%0.75555%0.549SS*.G310 helixtrans-58.4-20.2175.369.8179.8179.8-93.76.8115.1A95A95-R97 HydrophobicContact CB-CG 4.18Å; A95-R97 PolarHBondContact O-N 3Å; A95-R97 VanDerWaalsContact O-N 3.12Å
98K95.8Very high96.7Very high95 Ų95114.9 Ų114.941%0.41355%0.55SS.*G310 helixtrans-103-10.6178.8-60.4-164.2-176.3175.80113.1R92 A95 E96R92-K98 WeakPolarHBondContact O-CD 3.39Å; R92-K98 WeakPolarHBondContact O-CE 3.47Å; R92-K98 PolarHBondContact O-NZ 3.06Å; A95-K98 WeakPolarHBondContact O-CA 3.32Å; A95-K98 WeakPolarHBondContact O-CB 3.44Å; A95-K98 PolarHBondContact O-N 3.29Å; E96-K98 PolarHBondContact O-N 2.9Å
99L96.6Very high96.6Very high103 Ų103111.8 Ų111.854%0.53953%0.531SS..SBendtrans-72.7147.3173.8-64.2173.5000108.9A95 E96 K101A95-L99 PolarHBondContact O-N 2.85Å; E96-L99 WeakPolarHBondContact O-CB 3.41Å; E96-L99 PolarHBondContact O-N 3.34Å; L99-K101 PolarHBondContact O-N 3.19Å
100I96.4Very high96.5Very high168 Ų168115.4 Ų115.486%0.86256%0.557SS**PPolyproline II helixtrans-71.7121.7175.2-60.6170.9000107.3
101K96.3Very high96.3Very high180 Ų180116.9 Ų116.978%0.78357%0.57SS**PPolyproline II helixtrans-69.1137.2177.1-64.5-174.2178.7-175.60110.2L99L99-K101 PolarHBondContact O-N 3.19Å
102V96.1Very high96.1Very high135 Ų135113.7 Ų113.782%0.81855%0.551SS**PPolyproline II helixtrans-65.4134.1174.4-178.40000109.3
103K95.2Very high96Very high143 Ų143111.8 Ų111.862%0.62256%0.56SS**PPolyproline II helixtrans-100.7121.6178.4-71.3-174.9179.9-178.80109.6N105K103-N105 WeakPolarHBondContact CB-OD1 3.37Å
104T96.1Very high96Very high130 Ų130108.3 Ų108.380%0.79855%0.55SS**  trans-102.410.2-179.354.60000113.2
105N96.3Very high96Very high45 Ų45106.4 Ų106.424%0.24155%0.552CS.*  trans-10029.1-17364.5-23.8000113.1K103 Q117 K118K103-N105 WeakPolarHBondContact CB-OD1 3.37Å; N105-Q117 VanDerWaalsContact ND2-CG 3.34Å; N105-Q117 WeakPolarHBondContact ND2-CG 3.4Å; N105-Q117 PolarHBondContact ND2-NE2 3.3Å; N105-Q117 CarbonylContact O-C 3.57Å; N105-Q117 WeakPolarHBondContact O-CA 3.28Å; N105-K118 HydrophobicContact CB-CB 4.28Å; N105-K118 HydrophobicContact CB-CD 4.31Å; N105-K118 HydrophobicContact CB-CG 4.4Å; N105-K118 PolarHBondContact O-N 3.46Å
106I96.6Very high95.9Very high100 Ų100107.6 Ų107.651%0.51355%0.554SS.*EExtended strand (participates in β ladder)trans-100.8126.8178.7-58.3169.3000108.1L115 K116I106-L115 HydrophobicContact CG2-CB 3.9Å; I106-L115 HydrophobicContact CG2-CD1 4.32Å; I106-L115 HydrophobicContact CG2-CD2 4.2Å; I106-L115 HydrophobicContact CG2-CG 4.36Å; I106-K116 WeakPolarHBondContact CA-O 3.26Å
107E96.1Very high95.9Very high58 Ų58103 Ų10327%0.27153%0.533SS..EExtended strand (participates in β ladder)trans-135.1150.4-179.265.5-177.9-168.700110.6K116 K118E107-K116 HydrophobicContact CG-CG 4.04Å; E107-K116 PolarHBondContact N-O 2.9Å; E107-K116 WeakPolarHBondContact O-CG 3.5Å; E107-K116 PolarHBondContact O-N 3.39Å; E107-K116 WeakPolarHBondContact OE1-CE 3.21Å; E107-K116 IonicContact OE1-NZ 2.73Å; E107-K116 PolarHBondContact OE1-NZ 3.22Å; E107-K118 HydrophobicContact CG-CG 4.16Å; E107-K118 WeakPolarHBondContact OE2-CG 3.5Å
108P97.1Very high95.8Very high88 Ų8898 Ų9857%0.57152%0.516SS*.EExtended strand (participates in β ladder)trans-69.6143.4173.629.4-33.6000111
109C96.9Very high95.8Very high9 Ų9102.7 Ų102.76%0.06154%0.539CS..  trans-72.9134174.7177.90000110.6E111 C112 G113 H114 K116 C122C109-E111 VanDerWaalsContact C-N 3.28Å; C109-E111 PolarHBondContact O-N 2.87Å; C109-C112 VanDerWaalsContact SG-SG 3.68Å; C109-G113 VanDerWaalsContact O-CA 3.26Å; C109-G113 WeakPolarHBondContact O-CA 3.48Å; C109-G113 PolarHBondContact O-N 2.85Å; C109-H114 WeakPolarHBondContact CB-O 3.34Å; C109-H114 PolarHBondContact N-O 3.02Å; C109-K116 HydrophobicContact CB-CD 4.22Å; C109-K116 HydrophobicContact CB-CG 4.3Å; C109-C122 HydrophobicContact CB-CB 4.08Å
110P94.4Very high95.8Very high110 Ų110102 Ų10271%0.71454%0.535SS*.THydrogen-bonded Turntrans-66-29-179.425.7-34.6000113.5
111E93.7Very high95.8Very high164 Ų164100.5 Ų100.577%0.76653%0.528SS*.THydrogen-bonded Turntrans-83-43-176.2-60.9-59.314500113.3C109C109-E111 VanDerWaalsContact C-N 3.28Å; C109-E111 PolarHBondContact O-N 2.87Å
112C94.4Very high95.8Very high40 Ų4092.4 Ų92.427%0.2750%0.495SS..THydrogen-bonded Turntrans-125-2-169.169.60000114.6C109 H114 C122 F124 C125C109-C112 VanDerWaalsContact SG-SG 3.68Å; C112-H114 PolarHBondContact O-N 3.05Å; C112-H114 PolarHBondContact O-ND1 3.49Å; C112-C122 VanDerWaalsContact SG-SG 3.61Å; C112-F124 HydrophobicContact CB-CD1 4.18Å; C112-C125 PolarHBondContact SG-SG 3.23Å
113G95.1Very high95.8Very high51 Ų5188.6 Ų88.653%0.52648%0.482SS..  trans71.2-8.7-179.200000116C109C109-G113 VanDerWaalsContact O-CA 3.26Å; C109-G113 WeakPolarHBondContact O-CA 3.48Å; C109-G113 PolarHBondContact O-N 2.85Å
114H96.6Very high95.9Very high94 Ų9487.3 Ų87.344%0.43548%0.477SS..  trans-66.7145.7178.5-71.974.3000111.5C109 C112 K116 F124C109-H114 WeakPolarHBondContact CB-O 3.34Å; C109-H114 PolarHBondContact N-O 3.02Å; C112-H114 PolarHBondContact O-N 3.05Å; C112-H114 PolarHBondContact O-ND1 3.49Å; H114-K116 PolarHBondContact O-N 3.48Å; H114-F124 HydrophobicContact CB-CB 4.48Å; H114-F124 AromaticContact CE1-CG 4Å
115L96.6Very high95.9Very high134 Ų13482.6 Ų82.670%0.70245%0.449SS*.EExtended strand (participates in β ladder)trans-65128.1176.1-60.9178.2000110.6I106I106-L115 HydrophobicContact CG2-CB 3.9Å; I106-L115 HydrophobicContact CG2-CD1 4.32Å; I106-L115 HydrophobicContact CG2-CD2 4.2Å; I106-L115 HydrophobicContact CG2-CG 4.36Å
116K96.6Very high96Very high45 Ų4586.9 Ų86.920%0.19646%0.462CS..EExtended strand (participates in β ladder)trans-127.6164.7172.563.8165.8-174.8128.40110I106 E107 C109 H114 C122I106-K116 WeakPolarHBondContact CA-O 3.26Å; E107-K116 HydrophobicContact CG-CG 4.04Å; E107-K116 PolarHBondContact N-O 2.9Å; E107-K116 WeakPolarHBondContact O-CG 3.5Å; E107-K116 PolarHBondContact O-N 3.39Å; E107-K116 WeakPolarHBondContact OE1-CE 3.21Å; E107-K116 IonicContact OE1-NZ 2.73Å; E107-K116 PolarHBondContact OE1-NZ 3.22Å; C109-K116 HydrophobicContact CB-CD 4.22Å; C109-K116 HydrophobicContact CB-CG 4.3Å; H114-K116 PolarHBondContact O-N 3.48Å; K116-C122 HydrophobicContact CB-CB 4.34Å; K116-C122 HydrophobicContact CD-CB 4.3Å
117Q95.8Very high96Very high72 Ų7284.1 Ų84.134%0.33646%0.455SS..EExtended strand (participates in β ladder)trans-87145.7172-169.3179.2-41.300110.2N105 I120N105-Q117 VanDerWaalsContact ND2-CG 3.34Å; N105-Q117 WeakPolarHBondContact ND2-CG 3.4Å; N105-Q117 PolarHBondContact ND2-NE2 3.3Å; N105-Q117 CarbonylContact O-C 3.57Å; N105-Q117 WeakPolarHBondContact O-CA 3.28Å; Q117-I120 HydrophobicContact CB-CB 4.19Å; Q117-I120 HydrophobicContact CB-CD1 3.93Å; Q117-I120 HydrophobicContact CB-CG1 4.14Å; Q117-I120 VanDerWaalsContact CD-CD1 3.5Å; Q117-I120 HydrophobicContact CG-CD1 4.07Å; Q117-I120 HydrophobicContact CG-CG1 4.39Å; Q117-I120 PolarHBondContact O-N 2.8Å; Q117-I120 VanDerWaalsContact O-N 3.16Å
118K94.4Very high96Very high94 Ų9486.4 Ų86.441%0.40946%0.464SS..THydrogen-bonded Turntrans-55139169.4-69.5-178177.9-175.20110.4N105 E107 I120N105-K118 HydrophobicContact CB-CB 4.28Å; N105-K118 HydrophobicContact CB-CD 4.31Å; N105-K118 HydrophobicContact CB-CG 4.4Å; N105-K118 PolarHBondContact O-N 3.46Å; E107-K118 HydrophobicContact CG-CG 4.16Å; E107-K118 WeakPolarHBondContact OE2-CG 3.5Å; K118-I120 PolarHBondContact O-N 3Å
119H94.9Very high96Very high193 Ų19385.3 Ų85.389%0.89445%0.453SS*.THydrogen-bonded Turntrans63.312.2-176.6-44.3-69.6000115.7
120I96.1Very high96.1Very high88 Ų8887.2 Ų87.245%0.45147%0.465SS..SBendtrans-121.5143174.3-52.9-172.3000109Q117 K118Q117-I120 HydrophobicContact CB-CB 4.19Å; Q117-I120 HydrophobicContact CB-CD1 3.93Å; Q117-I120 HydrophobicContact CB-CG1 4.14Å; Q117-I120 VanDerWaalsContact CD-CD1 3.5Å; Q117-I120 HydrophobicContact CG-CD1 4.07Å; Q117-I120 HydrophobicContact CG-CG1 4.39Å; Q117-I120 PolarHBondContact O-N 2.8Å; Q117-I120 VanDerWaalsContact O-N 3.16Å; K118-I120 PolarHBondContact O-N 3Å
121L96.1Very high96.2Very high137 Ų13789.6 Ų89.672%0.71746%0.464SS*.  trans-63.1150.9173.2-62.8177.3000110.8G123L121-G123 PolarHBondContact O-N 3.22Å
122C97.2Very high96.3Very high11 Ų1182 Ų827%0.07443%0.429CS..  trans-67124.1176.4-179.10000110.3C109 C112 K116 F124 C125 Y126C109-C122 HydrophobicContact CB-CB 4.08Å; C112-C122 VanDerWaalsContact SG-SG 3.61Å; K116-C122 HydrophobicContact CB-CB 4.34Å; K116-C122 HydrophobicContact CD-CB 4.3Å; C122-F124 VanDerWaalsContact C-N 3.27Å; C122-F124 PolarHBondContact O-N 3.11Å; C122-C125 HydrophobicContact CB-CB 4.06Å; C122-C125 PolarHBondContact O-N 2.89Å; C122-Y126 VanDerWaalsContact O-CB 3.24Å; C122-Y126 WeakPolarHBondContact O-CB 3.49Å; C122-Y126 PolarHBondContact O-N 3.24Å
123G96.5Very high96.4Very high54 Ų5482.3 Ų82.356%0.55743%0.43SS*.Hα-helixtrans-60.7-34.4-18000000113.4L121 A127L121-G123 PolarHBondContact O-N 3.22Å; G123-A127 VanDerWaalsContact O-CB 3.27Å; G123-A127 WeakPolarHBondContact O-CB 3.31Å; G123-A127 PolarHBondContact O-N 3.34Å
124F97.3Very high96.5Very high116 Ų11681 Ų8151%0.50942%0.417SS..Hα-helixtrans-70.3-50.8178.5-176.8-97.4000112.2C112 H114 C122 Y126 A127 K128C112-F124 HydrophobicContact CB-CD1 4.18Å; H114-F124 HydrophobicContact CB-CB 4.48Å; H114-F124 AromaticContact CE1-CG 4Å; C122-F124 VanDerWaalsContact C-N 3.27Å; C122-F124 PolarHBondContact O-N 3.11Å; F124-Y126 VanDerWaalsContact C-N 3.3Å; F124-Y126 PolarHBondContact O-N 2.99Å; F124-A127 PolarHBondContact O-N 2.98Å; F124-K128 PolarHBondContact O-N 3.12Å; F124-K128 VanDerWaalsContact O-N 3.08Å
125C96.5Very high96.5Very high31 Ų3179.4 Ų79.421%0.20941%0.411CS..Hα-helixtrans-60-43176.2-62.90000111.1C112 C122 K128 I129C112-C125 PolarHBondContact SG-SG 3.23Å; C122-C125 HydrophobicContact CB-CB 4.06Å; C122-C125 PolarHBondContact O-N 2.89Å; C125-K128 WeakPolarHBondContact O-CB 3.48Å; C125-K128 PolarHBondContact O-N 3.3Å; C125-I129 WeakPolarHBondContact O-CG1 3.49Å; C125-I129 PolarHBondContact O-N 3.2Å; C125-I129 VanDerWaalsContact O-N 3.13Å
126Y97.3Very high96.5Very high135 Ų13573.9 Ų73.953%0.52938%0.382SS..Hα-helixtrans-61.7-45.9177.4-176.7-111.3000111.8C122 F124 K128 I129 C130C122-Y126 VanDerWaalsContact O-CB 3.24Å; C122-Y126 WeakPolarHBondContact O-CB 3.49Å; C122-Y126 PolarHBondContact O-N 3.24Å; F124-Y126 VanDerWaalsContact C-N 3.3Å; F124-Y126 PolarHBondContact O-N 2.99Å; Y126-K128 VanDerWaalsContact C-N 3.27Å; Y126-K128 PolarHBondContact O-N 3.46Å; Y126-I129 PolarHBondContact O-N 3.26Å; Y126-I129 VanDerWaalsContact O-N 3.08Å; Y126-C130 WeakPolarHBondContact CE1-SG 3.28Å; Y126-C130 PolarHBondContact O-N 2.88Å; Y126-C130 PolarHBondContact O-SG 3.37Å
127A97.4Very high96.4Very high43 Ų4380.2 Ų80.236%0.35541%0.405SS..Hα-helixtrans-59.8-37177.100000112.6G123 F124 C130 K131G123-A127 VanDerWaalsContact O-CB 3.27Å; G123-A127 WeakPolarHBondContact O-CB 3.31Å; G123-A127 PolarHBondContact O-N 3.34Å; F124-A127 PolarHBondContact O-N 2.98Å; A127-C130 PolarHBondContact O-N 3.05Å; A127-K131 WeakPolarHBondContact O-CG 3.38Å; A127-K131 PolarHBondContact O-N 2.93Å
128K96.1Very high96.4Very high105 Ų10582 Ų8246%0.45741%0.413SS..Hα-helixtrans-61.9-44.9174-175.8-173.2-176.9-171.60111.7F124 C125 Y126 K131 E132 W183F124-K128 PolarHBondContact O-N 3.12Å; F124-K128 VanDerWaalsContact O-N 3.08Å; C125-K128 WeakPolarHBondContact O-CB 3.48Å; C125-K128 PolarHBondContact O-N 3.3Å; Y126-K128 VanDerWaalsContact C-N 3.27Å; Y126-K128 PolarHBondContact O-N 3.46Å; K128-K131 PolarHBondContact O-N 3.44Å; K128-E132 PolarHBondContact O-N 2.92Å; K128-W183 VanDerWaalsContact NZ-NE1 3.19Å
129I96.8Very high96.5Very high66 Ų6680 Ų8034%0.33841%0.405SS..Hα-helixtrans-66.5-42.5178.2-62.3167.8000110.6C125 Y126 K131 E132 T133 W183C125-I129 WeakPolarHBondContact O-CG1 3.49Å; C125-I129 PolarHBondContact O-N 3.2Å; C125-I129 VanDerWaalsContact O-N 3.13Å; Y126-I129 PolarHBondContact O-N 3.26Å; Y126-I129 VanDerWaalsContact O-N 3.08Å; I129-K131 VanDerWaalsContact C-N 3.29Å; I129-K131 PolarHBondContact O-N 3.32Å; I129-E132 PolarHBondContact O-N 2.88Å; I129-T133 HydrophobicContact CG2-CG2 4.09Å; I129-T133 WeakPolarHBondContact O-CB 3.26Å; I129-T133 WeakPolarHBondContact O-CG2 3.42Å; I129-T133 PolarHBondContact O-N 3.49Å; I129-T133 PolarHBondContact O-OG1 2.94Å; I129-W183 HydrophobicContact CB-CH2 4.3Å; I129-W183 HydrophobicContact CD1-CZ3 4.42Å; I129-W183 HydrophobicContact CG1-CE3 4.22Å; I129-W183 HydrophobicContact CG1-CH2 3.8Å; I129-W183 HydrophobicContact CG1-CZ2 4.32Å; I129-W183 HydrophobicContact CG1-CZ3 3.75Å; I129-W183 HydrophobicContact CG2-CH2 4.34Å; I129-W183 HydrophobicContact CG2-CZ3 4.4Å
130C97.8Very high96.5Very high48 Ų4872.3 Ų72.332%0.32437%0.37SS..Hα-helixtrans-59.9-38.8176.4-68.80000112.4Y126 A127 T133 G134Y126-C130 WeakPolarHBondContact CE1-SG 3.28Å; Y126-C130 PolarHBondContact O-N 2.88Å; Y126-C130 PolarHBondContact O-SG 3.37Å; A127-C130 PolarHBondContact O-N 3.05Å; C130-T133 WeakPolarHBondContact CA-OG1 3.37Å; C130-T133 PolarHBondContact O-OG1 3.48Å; C130-G134 PolarHBondContact O-N 3.36Å
131K96.8Very high96.4Very high160 Ų16075.8 Ų75.870%0.69638%0.382SS*.Hα-helixtrans-63.7-49.1175.7-74175.1-178.6-174.90111.4A127 K128 I129 G134 L135A127-K131 WeakPolarHBondContact O-CG 3.38Å; A127-K131 PolarHBondContact O-N 2.93Å; K128-K131 PolarHBondContact O-N 3.44Å; I129-K131 VanDerWaalsContact C-N 3.29Å; I129-K131 PolarHBondContact O-N 3.32Å; K131-G134 PolarHBondContact O-N 2.95Å; K131-L135 WeakPolarHBondContact O-CG 3.2Å; K131-L135 PolarHBondContact O-N 2.98Å; K131-L135 VanDerWaalsContact O-N 3.13Å
132E95.8Very high96.3Very high5 Ų575.7 Ų75.72%0.02338%0.378CS..Hα-helixtrans-64.5-47.4-179.2-169.365.1-157.400111.7K128 I129 G134 L135 I136 Y159 R178 W183K128-E132 PolarHBondContact O-N 2.92Å; I129-E132 PolarHBondContact O-N 2.88Å; E132-G134 VanDerWaalsContact C-N 3.28Å; E132-G134 PolarHBondContact O-N 2.9Å; E132-L135 PolarHBondContact O-N 3.27Å; E132-L135 VanDerWaalsContact O-N 3.16Å; E132-I136 HydrophobicContact CG-CD1 4.4Å; E132-I136 WeakPolarHBondContact O-CG1 3.36Å; E132-I136 PolarHBondContact O-N 2.96Å; E132-Y159 WeakPolarHBondContact OE1-CE1 3.4Å; E132-Y159 PolarHBondContact OE1-OH 2.86Å; E132-R178 IonicContact OE2-CZ 3.2Å; E132-R178 IonicContact OE2-NH1 3.87Å; E132-R178 PolarHBondContact OE2-NH1 3.18Å; E132-W183 HydrophobicContact CB-CH2 4.27Å; E132-W183 HydrophobicContact CB-CZ2 4.24Å; E132-W183 HydrophobicContact CG-CH2 4.37Å; E132-W183 HydrophobicContact CG-CZ2 4.35Å
133T96.4Very high96Very high46 Ų4679.1 Ų79.128%0.28239%0.394SS..Hα-helixtrans-65.6-31176.753.70000112.7I129 C130 I136 R137I129-T133 HydrophobicContact CG2-CG2 4.09Å; I129-T133 WeakPolarHBondContact O-CB 3.26Å; I129-T133 WeakPolarHBondContact O-CG2 3.42Å; I129-T133 PolarHBondContact O-N 3.49Å; I129-T133 PolarHBondContact O-OG1 2.94Å; C130-T133 WeakPolarHBondContact CA-OG1 3.37Å; C130-T133 PolarHBondContact O-OG1 3.48Å; T133-I136 PolarHBondContact O-N 2.83Å; T133-R137 WeakPolarHBondContact O-CB 3.4Å; T133-R137 VanDerWaalsContact O-CG 3.25Å; T133-R137 WeakPolarHBondContact O-CG 3.3Å; T133-R137 PolarHBondContact O-N 3.1Å
134G97.5Very high95.8Very high25 Ų2579.1 Ų79.126%0.25838%0.379SS..Hα-helixtrans-60.9-44.4171.300000112.2C130 K131 E132 R137 Q138C130-G134 PolarHBondContact O-N 3.36Å; K131-G134 PolarHBondContact O-N 2.95Å; E132-G134 VanDerWaalsContact C-N 3.28Å; E132-G134 PolarHBondContact O-N 2.9Å; G134-R137 PolarHBondContact O-N 3.36Å; G134-Q138 WeakPolarHBondContact O-CG 3.23Å; G134-Q138 PolarHBondContact O-N 2.99Å
135L96.4Very high95.5Very high60 Ų6077 Ų7731%0.31439%0.39SS..Hα-helixtrans-66.9-39.2176.2-63.9171.8000112.1K131 E132 R137 Q138 Q139K131-L135 WeakPolarHBondContact O-CG 3.2Å; K131-L135 PolarHBondContact O-N 2.98Å; K131-L135 VanDerWaalsContact O-N 3.13Å; E132-L135 PolarHBondContact O-N 3.27Å; E132-L135 VanDerWaalsContact O-N 3.16Å; L135-R137 VanDerWaalsContact C-N 3.34Å; L135-R137 PolarHBondContact O-N 3.06Å; L135-Q138 WeakPolarHBondContact O-CB 3.31Å; L135-Q138 PolarHBondContact O-N 3.32Å; L135-Q139 PolarHBondContact O-N 3.17Å
136I96.3Very high95.1Very high18 Ų1877 Ų779%0.09240%0.395CS..Hα-helixtrans-61.6-44174.9-66.4165000110.5E132 T133 Q138 Q139 I140 V157 V174 R176 F184E132-I136 HydrophobicContact CG-CD1 4.4Å; E132-I136 WeakPolarHBondContact O-CG1 3.36Å; E132-I136 PolarHBondContact O-N 2.96Å; T133-I136 PolarHBondContact O-N 2.83Å; I136-Q138 VanDerWaalsContact C-N 3.31Å; I136-Q138 PolarHBondContact O-N 3.12Å; I136-Q139 WeakPolarHBondContact O-CB 3.17Å; I136-Q139 PolarHBondContact O-N 3.16Å; I136-I140 HydrophobicContact CG2-CD1 3.94Å; I136-I140 WeakPolarHBondContact O-CG1 3.41Å; I136-I140 PolarHBondContact O-N 2.89Å; I136-V157 HydrophobicContact CD1-CG1 4.16Å; I136-V157 HydrophobicContact CD1-CG2 4.3Å; I136-V157 HydrophobicContact CG1-CG1 4.33Å; I136-V157 HydrophobicContact CG2-CG2 4.01Å; I136-V174 HydrophobicContact CG2-CG1 4.42Å; I136-R176 HydrophobicContact CG1-CG 4.24Å; I136-F184 HydrophobicContact CD1-CE1 4.49Å
137R95.9Very high94.9Very high178 Ų17876.4 Ų76.467%0.67241%0.408SS*.Hα-helixtrans-63.7-35.4176.6-72.3169.8-177170.81.4112.7T133 G134 L135 I140 K141T133-R137 WeakPolarHBondContact O-CB 3.4Å; T133-R137 VanDerWaalsContact O-CG 3.25Å; T133-R137 WeakPolarHBondContact O-CG 3.3Å; T133-R137 PolarHBondContact O-N 3.1Å; G134-R137 PolarHBondContact O-N 3.36Å; L135-R137 VanDerWaalsContact C-N 3.34Å; L135-R137 PolarHBondContact O-N 3.06Å; R137-I140 PolarHBondContact O-N 3.43Å; R137-K141 WeakPolarHBondContact O-CB 3.49Å; R137-K141 PolarHBondContact O-N 3.12Å
138Q95.6Very high94.5Very high109 Ų10983 Ų8351%0.50944%0.436SS..Hα-helixtrans-62.6-46.1173.6-73.3170.8-100110.8G134 L135 I136 I140 K141 E142G134-Q138 WeakPolarHBondContact O-CG 3.23Å; G134-Q138 PolarHBondContact O-N 2.99Å; L135-Q138 WeakPolarHBondContact O-CB 3.31Å; L135-Q138 PolarHBondContact O-N 3.32Å; I136-Q138 VanDerWaalsContact C-N 3.31Å; I136-Q138 PolarHBondContact O-N 3.12Å; Q138-I140 PolarHBondContact O-N 2.92Å; Q138-K141 WeakPolarHBondContact O-CB 3.5Å; Q138-K141 PolarHBondContact O-N 3.48Å; Q138-K141 VanDerWaalsContact O-N 3.15Å; Q138-E142 WeakPolarHBondContact O-CG 3.48Å; Q138-E142 PolarHBondContact O-N 3.33Å
139Q95.4Very high94.3Very high52 Ų5281.7 Ų81.724%0.24344%0.437CS..Hα-helixtrans-60.3-44.1176.3-162.96925.100112.2L135 I136 K141 E142 M143 V174L135-Q139 PolarHBondContact O-N 3.17Å; I136-Q139 WeakPolarHBondContact O-CB 3.17Å; I136-Q139 PolarHBondContact O-N 3.16Å; Q139-K141 VanDerWaalsContact C-N 3.29Å; Q139-K141 PolarHBondContact O-N 2.83Å; Q139-E142 PolarHBondContact O-N 2.96Å; Q139-M143 HydrophobicContact CG-SD 4.32Å; Q139-M143 WeakPolarHBondContact O-CG 3.15Å; Q139-M143 PolarHBondContact O-N 3.32Å; Q139-V174 HydrophobicContact CB-CG1 3.86Å; Q139-V174 HydrophobicContact CG-CG1 3.73Å
140I94.9Very high94Very high32 Ų3282.5 Ų82.516%0.16445%0.454CS..Hα-helixtrans-60.3-42.9176.6-69167.4000110.5I136 R137 Q138 E142 M143 E144 V174I136-I140 HydrophobicContact CG2-CD1 3.94Å; I136-I140 WeakPolarHBondContact O-CG1 3.41Å; I136-I140 PolarHBondContact O-N 2.89Å; R137-I140 PolarHBondContact O-N 3.43Å; Q138-I140 PolarHBondContact O-N 2.92Å; I140-E142 VanDerWaalsContact C-N 3.35Å; I140-E142 PolarHBondContact O-N 3.12Å; I140-M143 PolarHBondContact O-N 3.35Å; I140-E144 HydrophobicContact CG2-CG 4.28Å; I140-E144 WeakPolarHBondContact CG2-OE1 3.1Å; I140-E144 WeakPolarHBondContact O-CB 3.2Å; I140-E144 WeakPolarHBondContact O-CG 3.23Å; I140-E144 PolarHBondContact O-N 2.79Å; I140-V174 HydrophobicContact CD1-CG2 4.4Å; I140-V174 HydrophobicContact CG1-CG1 4.23Å; I140-V174 HydrophobicContact CG1-CG2 3.79Å
141K94.3Very high93.8Very high160 Ų16082.4 Ų82.470%0.69645%0.453SS*.Hα-helixtrans-63.9-40.1178.9-173.5-178.4178.4-174.40112.1R137 Q138 Q139 M143 E144 G145R137-K141 WeakPolarHBondContact O-CB 3.49Å; R137-K141 PolarHBondContact O-N 3.12Å; Q138-K141 WeakPolarHBondContact O-CB 3.5Å; Q138-K141 PolarHBondContact O-N 3.48Å; Q138-K141 VanDerWaalsContact O-N 3.15Å; Q139-K141 VanDerWaalsContact C-N 3.29Å; Q139-K141 PolarHBondContact O-N 2.83Å; K141-M143 VanDerWaalsContact C-N 3.35Å; K141-E144 PolarHBondContact O-N 3.07Å; K141-G145 PolarHBondContact O-N 2.72Å
142E93.7Very high93.6Very high136 Ų13681.3 Ų81.364%0.63646%0.462SS*.Hα-helixtrans-64.6-39.8175.6-71.8170.4-166.200111.6Q138 Q139 I140Q138-E142 WeakPolarHBondContact O-CG 3.48Å; Q138-E142 PolarHBondContact O-N 3.33Å; Q139-E142 PolarHBondContact O-N 2.96Å; I140-E142 VanDerWaalsContact C-N 3.35Å; I140-E142 PolarHBondContact O-N 3.12Å
143M92Very high93.6Very high82 Ų8284.4 Ų84.440%0.40448%0.481SS..Hα-helixtrans-67.9-39.3175.8-72.9168.129.500113.4Q139 I140 K141 R172 V174Q139-M143 HydrophobicContact CG-SD 4.32Å; Q139-M143 WeakPolarHBondContact O-CG 3.15Å; Q139-M143 PolarHBondContact O-N 3.32Å; I140-M143 PolarHBondContact O-N 3.35Å; K141-M143 VanDerWaalsContact C-N 3.35Å; M143-R172 HydrophobicContact CE-CG 3.71Å; M143-V174 HydrophobicContact CE-CG2 3.92Å; M143-V174 HydrophobicContact SD-CG1 4.38Å; M143-V174 HydrophobicContact SD-CG2 4.19Å
144E92.1Very high93.4Very high54 Ų5488.1 Ų88.125%0.25250%0.495SS..Hα-helixtrans-75.7-26.6-179.5-71.8175.8178.400112.3I140 K141 G146 R172I140-E144 HydrophobicContact CG2-CG 4.28Å; I140-E144 WeakPolarHBondContact CG2-OE1 3.1Å; I140-E144 WeakPolarHBondContact O-CB 3.2Å; I140-E144 WeakPolarHBondContact O-CG 3.23Å; I140-E144 PolarHBondContact O-N 2.79Å; K141-E144 PolarHBondContact O-N 3.07Å; E144-G146 PolarHBondContact O-N 3.32Å; E144-R172 IonicContact OE1-CZ 3.91Å; E144-R172 IonicContact OE1-NH1 3.92Å; E144-R172 PolarHBondContact OE1-NH1 3.35Å; E144-R172 IonicContact OE1-NH2 2.88Å; E144-R172 PolarHBondContact OE1-NH2 3.31Å
145G90.3Very high93.3Very high72 Ų7290.2 Ų90.274%0.74250%0.503SS*.  trans68.4-6.2171.800000115.8K141K141-G145 PolarHBondContact O-N 2.72Å
146G89.1Confident93.2Very high30 Ų3088.6 Ų88.631%0.30950%0.495SS..SBendtrans-171.4171-177.600000114.7E144E144-G146 PolarHBondContact O-N 3.32Å
147P91.3Very high93.1Very high123 Ų12388.9 Ų88.980%0.79950%0.498SS*.THydrogen-bonded Turntrans-71.8146.7172.730.6-33.3000111.3T149P147-T149 VanDerWaalsContact C-N 3.33Å; P147-T149 PolarHBondContact O-N 3.4Å
148L90.5Very high93.1Very high181 Ų18181.2 Ų81.295%0.94847%0.47SS*.THydrogen-bonded Turntrans67.121.7176.7-50.4177000115.9
149T91.9Very high93.1Very high79 Ų7976.4 Ų76.449%0.48545%0.447SS..  trans-103.542.8178.8-36.40000111.5P147P147-T149 VanDerWaalsContact C-N 3.33Å; P147-T149 PolarHBondContact O-N 3.4Å
150A90.6Very high93Very high82 Ų8279 Ų7968%0.67846%0.46SS*.  trans-76.6124.6-179.700000110.2
151P92.1Very high92.7Very high47 Ų4781.8 Ų81.831%0.30550%0.496SS..  trans-77.6154.3179.331.4-34.1000111.6V153 R172P151-V153 HydrophobicContact CB-CG2 4.06Å; P151-V153 HydrophobicContact CG-CG2 4.48Å; P151-V153 PolarHBondContact O-N 3.29Å; P151-R172 VanDerWaalsContact CD-NH1 3.32Å; P151-R172 VanDerWaalsContact CG-NH1 3.29Å
152P93.7Very high92.5Very high137 Ų13776.5 Ų76.589%0.8947%0.474SS*.SBendtrans-82.66.8177.734.9-36.4000113.7
153V94.6Very high92.3Very high70 Ų7075.9 Ų75.942%0.42448%0.479SS..SBendtrans-104.6151.7-177.3-62.80000111.7P151 R172P151-V153 HydrophobicContact CB-CG2 4.06Å; P151-V153 HydrophobicContact CG-CG2 4.48Å; P151-V153 PolarHBondContact O-N 3.29Å; V153-R172 HydrophobicContact CG2-CB 3.81Å
154E94Very high92.1Very high124 Ų12475.5 Ų75.558%0.57948%0.483SS*.  trans-63.9158.5174.9-63.2-174.3170.100112K171 R172E154-K171 HydrophobicContact CB-CD 4.06Å; E154-K171 HydrophobicContact CB-CG 4.14Å; E154-K171 WeakPolarHBondContact OE2-CE 3.34Å; E154-K171 IonicContact OE2-NZ 2.81Å; E154-K171 PolarHBondContact OE2-NZ 3.16Å; E154-R172 WeakPolarHBondContact O-CB 3.48Å; E154-R172 PolarHBondContact O-N 3.03Å
155T93.9Very high91.9Very high69 Ų6976 Ų7642%0.42349%0.492SS..EExtended strand (participates in β ladder)trans-113.4134.3178.856.70000112.6R172T155-R172 CarbonylContact C-O 3.56Å; T155-R172 VanDerWaalsContact CA-O 3.29Å; T155-R172 WeakPolarHBondContact CA-O 3.39Å; T155-R172 HydrophobicContact CG2-CB 4.28Å; T155-R172 HydrophobicContact CG2-CG 4.44Å
156V94.8Very high91.6Very high25 Ų2581.9 Ų81.915%0.15250%0.5CS..EExtended strand (participates in β ladder)trans-119.4134.7172.8179.40000108.7L158 D168 K171 R172 I173 V174V156-L158 HydrophobicContact CG1-CD2 4.14Å; V156-L158 HydrophobicContact CG1-CG 4.44Å; V156-D168 HydrophobicContact CG2-CB 4.3Å; V156-K171 HydrophobicContact CG2-CB 3.84Å; V156-K171 HydrophobicContact CG2-CD 3.5Å; V156-K171 VanDerWaalsContact CG2-CD 3.5Å; V156-K171 HydrophobicContact CG2-CG 4.3Å; V156-R172 PolarHBondContact N-O 3.34Å; V156-I173 CarbonylContact O-C 3.55Å; V156-I173 WeakPolarHBondContact O-CA 3.49Å; V156-V174 PolarHBondContact O-N 3.47Å
157V95.3Very high91.4Very high25 Ų2588.2 Ų88.215%0.15252%0.522CS..EExtended strand (participates in β ladder)trans-99.4122.3177-177.20000108.4I136 Y159 V174 R176 F184I136-V157 HydrophobicContact CD1-CG1 4.16Å; I136-V157 HydrophobicContact CD1-CG2 4.3Å; I136-V157 HydrophobicContact CG1-CG1 4.33Å; I136-V157 HydrophobicContact CG2-CG2 4.01Å; V157-Y159 HydrophobicContact CG1-CE2 4.04Å; V157-V174 WeakPolarHBondContact CA-O 3.39Å; V157-V174 HydrophobicContact CG2-CB 4.5Å; V157-R176 HydrophobicContact CG1-CG 3.88Å; V157-F184 HydrophobicContact CG1-CE1 4.49Å
158L94.8Very high91.1Very high17 Ų1784 Ų849%0.08949%0.493CS..EExtended strand (participates in β ladder)trans-111.7137.8176-65.3-177.3000110.5V156 E162 P164 I173 V174 E175 R176V156-L158 HydrophobicContact CG1-CD2 4.14Å; V156-L158 HydrophobicContact CG1-CG 4.44Å; L158-E162 HydrophobicContact CD2-CB 4.41Å; L158-P164 HydrophobicContact CD1-CB 4.23Å; L158-P164 HydrophobicContact CD1-CG 3.75Å; L158-I173 HydrophobicContact CB-CG2 4.3Å; L158-I173 HydrophobicContact CD1-CD1 4.38Å; L158-I173 HydrophobicContact CD1-CG1 4.49Å; L158-I173 HydrophobicContact CD1-CG2 3.54Å; L158-I173 HydrophobicContact CG-CG2 3.91Å; L158-V174 PolarHBondContact N-O 3.3Å; L158-E175 CarbonylContact O-C 3.59Å; L158-E175 WeakPolarHBondContact O-CA 3.47Å; L158-R176 PolarHBondContact O-N 2.93Å
159Y95.4Very high90.8Very high7 Ų778.4 Ų78.43%0.02748%0.479CS..EExtended strand (participates in β ladder)trans-100.7172.5174.8-73.2-85.9000111.3E132 V157 G161 E162 R176 R178 R180 F184E132-Y159 WeakPolarHBondContact OE1-CE1 3.4Å; E132-Y159 PolarHBondContact OE1-OH 2.86Å; V157-Y159 HydrophobicContact CG1-CE2 4.04Å; Y159-G161 PolarHBondContact O-N 2.89Å; Y159-E162 PolarHBondContact N-OE2 3.46Å; Y159-E162 VanDerWaalsContact N-OE2 3.07Å; Y159-E162 PolarHBondContact O-N 3.11Å; Y159-R176 HydrophobicContact CD1-CB 3.81Å; Y159-R176 HydrophobicContact CE1-CB 3.86Å; Y159-R176 HydrophobicContact CE1-CG 4.32Å; Y159-R178 WeakPolarHBondContact CB-O 3.4Å; Y159-R178 HydrophobicContact CD1-CB 4.32Å; Y159-R178 VanDerWaalsContact CD1-O 3.3Å; Y159-R178 WeakPolarHBondContact CD1-O 3.36Å; Y159-R180 HydrophobicContact CD2-CB 3.89Å; Y159-R180 HydrophobicContact CD2-CG 3.69Å; Y159-R180 HydrophobicContact CE2-CG 4.04Å; Y159-R180 HydrophobicContact CG-CB 3.85Å; Y159-R180 HydrophobicContact CG-CG 4.18Å; Y159-F184 AromaticContact CE2-CD1 3.55Å; Y159-F184 HydrophobicContact CE2-CD1 3.55Å; Y159-F184 AromaticContact CE2-CE1 3.72Å; Y159-F184 HydrophobicContact CE2-CE1 3.72Å; Y159-F184 AromaticContact CZ-CD1 3.86Å; Y159-F184 WeakPolarHBondContact OH-CD1 3.15Å
160E93.6Very high90.5Very high108 Ų10878 Ų7851%0.50549%0.491SS..THydrogen-bonded Turntrans-57.1125.9-179.9-71.1172.917100112.2E162 R176 P177 R178E160-E162 VanDerWaalsContact C-N 3.35Å; E160-R176 PolarHBondContact N-O 3.27Å; E160-P177 VanDerWaalsContact CD-C 3.46Å; E160-P177 WeakPolarHBondContact OE1-CA 3.26Å; E160-R178 VanDerWaalsContact CD-N 3.29Å; E160-R178 PolarHBondContact N-O 3.37Å; E160-R178 VanDerWaalsContact N-O 3.07Å; E160-R178 PolarHBondContact OE1-N 2.9Å
161G89Confident90.6Very high89 Ų8977.3 Ų77.392%0.91847%0.472SS*.THydrogen-bonded Turntrans84.52.917700000115Y159Y159-G161 PolarHBondContact O-N 2.89Å
162E90.1Very high90.6Very high50 Ų5077.3 Ų77.323%0.23447%0.466CS..PPolyproline II helixtrans-91.9132173.3-59.6-173.1139.700110.6L158 Y159 E160 R180 N186L158-E162 HydrophobicContact CD2-CB 4.41Å; Y159-E162 PolarHBondContact N-OE2 3.46Å; Y159-E162 VanDerWaalsContact N-OE2 3.07Å; Y159-E162 PolarHBondContact O-N 3.11Å; E160-E162 VanDerWaalsContact C-N 3.35Å; E162-R180 WeakPolarHBondContact OE1-CD 3.41Å; E162-R180 IonicContact OE1-CZ 3.53Å; E162-R180 IonicContact OE1-NE 2.7Å; E162-R180 IonicContact OE1-NH1 2.77Å; E162-R180 PolarHBondContact OE1-NH1 2.91Å; E162-R180 IonicContact OE2-CZ 3.9Å; E162-R180 IonicContact OE2-NH1 3.4Å; E162-R180 PolarHBondContact OE2-NH1 3.25Å; E162-N186 PolarHBondContact OE1-ND2 3.13Å
163T89.4Confident90.7Very high123 Ų12373.8 Ų73.876%0.75544%0.439SS*.PPolyproline II helixtrans-93.1144.8171.552.20000110.2S165T163-S165 PolarHBondContact O-N 2.93Å
164P88.1Confident90.7Very high73 Ų7370.4 Ų70.447%0.47442%0.419SS..PPolyproline II helixtrans-56.1136.9174.4-18.828.4000111.1L158 I173L158-P164 HydrophobicContact CD1-CB 4.23Å; L158-P164 HydrophobicContact CD1-CG 3.75Å; P164-I173 HydrophobicContact CB-CD1 4.2Å; P164-I173 HydrophobicContact CG-CD1 3.86Å
165S87.4Confident90.6Very high65 Ų6571 Ų7146%0.45542%0.422SS..PPolyproline II helixtrans-73.5157.2174.3-171.20000110.5T163 Q167 D168T163-S165 PolarHBondContact O-N 2.93Å; S165-Q167 PolarHBondContact O-N 3.17Å; S165-D168 WeakPolarHBondContact CB-OD2 3.44Å; S165-D168 PolarHBondContact N-OD2 3.46Å; S165-D168 VanDerWaalsContact N-OD2 3.17Å; S165-D168 WeakPolarHBondContact O-CB 3.49Å; S165-D168 PolarHBondContact O-N 2.89Å
166E84.6Confident90.6Very high195 Ų19569.2 Ų69.291%0.91141%0.407SS*.G310 helixtrans-57.9-30.3174-62.8-179176.600111.9D168 G169E166-D168 VanDerWaalsContact C-N 3.29Å; E166-D168 PolarHBondContact O-N 3.22Å; E166-G169 PolarHBondContact O-N 3.34Å
167Q83.6Confident90.5Very high164 Ų16472.5 Ų72.577%0.76643%0.429SS*.G310 helixtrans-74.2-16.9176.9-62-178.54.400113.8S165 G169S165-Q167 PolarHBondContact O-N 3.17Å; Q167-G169 PolarHBondContact O-N 3.06Å
168D86.1Confident90.4Very high33 Ų3377.2 Ų77.218%0.17644%0.444CS..G310 helixtrans-88.54.4-179.9-59.6-41000112.2V156 S165 E166 G170 K171V156-D168 HydrophobicContact CG2-CB 4.3Å; S165-D168 WeakPolarHBondContact CB-OD2 3.44Å; S165-D168 PolarHBondContact N-OD2 3.46Å; S165-D168 VanDerWaalsContact N-OD2 3.17Å; S165-D168 WeakPolarHBondContact O-CB 3.49Å; S165-D168 PolarHBondContact O-N 2.89Å; E166-D168 VanDerWaalsContact C-N 3.29Å; E166-D168 PolarHBondContact O-N 3.22Å; D168-G170 PolarHBondContact O-N 3.27Å; D168-G170 VanDerWaalsContact O-N 3.16Å; D168-K171 WeakPolarHBondContact O-CB 3.47Å; D168-K171 PolarHBondContact O-N 3.48Å
169G83.4Confident90.4Very high65 Ų6584.4 Ų84.467%0.6747%0.474SS*.THydrogen-bonded Turntrans-53.8118.5175.600000111.9E166 Q167E166-G169 PolarHBondContact O-N 3.34Å; Q167-G169 PolarHBondContact O-N 3.06Å
170G86.1Confident90.3Very high70 Ų7086.8 Ų86.872%0.72248%0.483SS*.THydrogen-bonded Turntrans88.10.6178.300000115.5D168D168-G170 PolarHBondContact O-N 3.27Å; D168-G170 VanDerWaalsContact O-N 3.16Å
171K93.3Very high90.4Very high67 Ų6782.5 Ų82.529%0.29147%0.465SS..SBendtrans-86.5153.9173.8-55.7-173.7-172.9-1640111.2E154 V156 D168 I173E154-K171 HydrophobicContact CB-CD 4.06Å; E154-K171 HydrophobicContact CB-CG 4.14Å; E154-K171 WeakPolarHBondContact OE2-CE 3.34Å; E154-K171 IonicContact OE2-NZ 2.81Å; E154-K171 PolarHBondContact OE2-NZ 3.16Å; V156-K171 HydrophobicContact CG2-CB 3.84Å; V156-K171 HydrophobicContact CG2-CD 3.5Å; V156-K171 VanDerWaalsContact CG2-CD 3.5Å; V156-K171 HydrophobicContact CG2-CG 4.3Å; D168-K171 WeakPolarHBondContact O-CB 3.47Å; D168-K171 PolarHBondContact O-N 3.48Å; K171-I173 PolarHBondContact O-N 3.29Å
172R92.5Very high90.5Very high48 Ų4883.4 Ų83.418%0.18146%0.464CS..EExtended strand (participates in β ladder)trans-73.9117.1173.6173.6172.172.7165.3-2.5109.8M143 E144 P151 V153 E154 T155 V156M143-R172 HydrophobicContact CE-CG 3.71Å; E144-R172 IonicContact OE1-CZ 3.91Å; E144-R172 IonicContact OE1-NH1 3.92Å; E144-R172 PolarHBondContact OE1-NH1 3.35Å; E144-R172 IonicContact OE1-NH2 2.88Å; E144-R172 PolarHBondContact OE1-NH2 3.31Å; P151-R172 VanDerWaalsContact CD-NH1 3.32Å; P151-R172 VanDerWaalsContact CG-NH1 3.29Å; V153-R172 HydrophobicContact CG2-CB 3.81Å; E154-R172 WeakPolarHBondContact O-CB 3.48Å; E154-R172 PolarHBondContact O-N 3.03Å; T155-R172 CarbonylContact C-O 3.56Å; T155-R172 VanDerWaalsContact CA-O 3.29Å; T155-R172 WeakPolarHBondContact CA-O 3.39Å; T155-R172 HydrophobicContact CG2-CB 4.28Å; T155-R172 HydrophobicContact CG2-CG 4.44Å; V156-R172 PolarHBondContact N-O 3.34Å
173I93.8Very high90.7Very high62 Ų6285.4 Ų85.432%0.31847%0.469SS..EExtended strand (participates in β ladder)trans-88.5127.7179.2-61.3170.3000109.5V156 L158 P164 K171 E175V156-I173 CarbonylContact O-C 3.55Å; V156-I173 WeakPolarHBondContact O-CA 3.49Å; L158-I173 HydrophobicContact CB-CG2 4.3Å; L158-I173 HydrophobicContact CD1-CD1 4.38Å; L158-I173 HydrophobicContact CD1-CG1 4.49Å; L158-I173 HydrophobicContact CD1-CG2 3.54Å; L158-I173 HydrophobicContact CG-CG2 3.91Å; P164-I173 HydrophobicContact CB-CD1 4.2Å; P164-I173 HydrophobicContact CG-CD1 3.86Å; K171-I173 PolarHBondContact O-N 3.29Å; I173-E175 HydrophobicContact CG2-CG 4.05Å
174V94.6Very high90.9Very high0 Ų082.8 Ų82.80%045%0.447CS..EExtended strand (participates in β ladder)trans-111.7107.2172.4-177.20000107.8I136 Q139 I140 M143 V156 V157 L158I136-V174 HydrophobicContact CG2-CG1 4.42Å; Q139-V174 HydrophobicContact CB-CG1 3.86Å; Q139-V174 HydrophobicContact CG-CG1 3.73Å; I140-V174 HydrophobicContact CD1-CG2 4.4Å; I140-V174 HydrophobicContact CG1-CG1 4.23Å; I140-V174 HydrophobicContact CG1-CG2 3.79Å; M143-V174 HydrophobicContact CE-CG2 3.92Å; M143-V174 HydrophobicContact SD-CG1 4.38Å; M143-V174 HydrophobicContact SD-CG2 4.19Å; V156-V174 PolarHBondContact O-N 3.47Å; V157-V174 WeakPolarHBondContact CA-O 3.39Å; V157-V174 HydrophobicContact CG2-CB 4.5Å; L158-V174 PolarHBondContact N-O 3.3Å
175E93.3Very high91Very high137 Ų13789.5 Ų89.564%0.6446%0.463SS*.EExtended strand (participates in β ladder)trans-82140.9-179.4-62.4-178.917700111.4L158 I173L158-E175 CarbonylContact O-C 3.59Å; L158-E175 WeakPolarHBondContact O-CA 3.47Å; I173-E175 HydrophobicContact CG2-CG 4.05Å
176R94.5Very high90.6Very high31 Ų3194.6 Ų94.612%0.11749%0.486CS..EExtended strand (participates in β ladder)trans-124.1121.3175.9-72-58.8-54.6151.36.7110.6I136 V157 L158 Y159 E160 R178I136-R176 HydrophobicContact CG1-CG 4.24Å; V157-R176 HydrophobicContact CG1-CG 3.88Å; L158-R176 PolarHBondContact O-N 2.93Å; Y159-R176 HydrophobicContact CD1-CB 3.81Å; Y159-R176 HydrophobicContact CE1-CB 3.86Å; Y159-R176 HydrophobicContact CE1-CG 4.32Å; E160-R176 PolarHBondContact N-O 3.27Å; R176-R178 PolarHBondContact O-N 3.4Å
177P92.4Very high90.9Very high94 Ų9489.6 Ų89.661%0.6146%0.464SS*.SBendtrans-78.266176.833.8-35.9000110.3E160E160-P177 VanDerWaalsContact CD-C 3.46Å; E160-P177 WeakPolarHBondContact OE1-CA 3.26Å
178R92.6Very high91.3Very high124 Ų12485.6 Ų85.647%0.46845%0.448SS..SBendtrans-154.6156.1175.9-165.4-172.3176.1157.59.8108.6E132 Y159 E160 R176E132-R178 IonicContact OE2-CZ 3.2Å; E132-R178 IonicContact OE2-NH1 3.87Å; E132-R178 PolarHBondContact OE2-NH1 3.18Å; Y159-R178 WeakPolarHBondContact CB-O 3.4Å; Y159-R178 HydrophobicContact CD1-CB 4.32Å; Y159-R178 VanDerWaalsContact CD1-O 3.3Å; Y159-R178 WeakPolarHBondContact CD1-O 3.36Å; E160-R178 VanDerWaalsContact CD-N 3.29Å; E160-R178 PolarHBondContact N-O 3.37Å; E160-R178 VanDerWaalsContact N-O 3.07Å; E160-R178 PolarHBondContact OE1-N 2.9Å; R176-R178 PolarHBondContact O-N 3.4Å
179K94.3Very high91.5Very high167 Ų16788.6 Ų88.673%0.72646%0.463SS*.PPolyproline II helixtrans-66.8142.3162.5-59.7-175.3-179.7-175.80111.5
180R94.1Very high92Very high57 Ų5789.9 Ų89.922%0.21545%0.451CS..PPolyproline II helixtrans-60.5129.4179.4-169.9157.1-164.7143.4-5.1112.1Y159 E162 F184 R185 N186Y159-R180 HydrophobicContact CD2-CB 3.89Å; Y159-R180 HydrophobicContact CD2-CG 3.69Å; Y159-R180 HydrophobicContact CE2-CG 4.04Å; Y159-R180 HydrophobicContact CG-CB 3.85Å; Y159-R180 HydrophobicContact CG-CG 4.18Å; E162-R180 WeakPolarHBondContact OE1-CD 3.41Å; E162-R180 IonicContact OE1-CZ 3.53Å; E162-R180 IonicContact OE1-NE 2.7Å; E162-R180 IonicContact OE1-NH1 2.77Å; E162-R180 PolarHBondContact OE1-NH1 2.91Å; E162-R180 IonicContact OE2-CZ 3.9Å; E162-R180 IonicContact OE2-NH1 3.4Å; E162-R180 PolarHBondContact OE2-NH1 3.25Å; R180-F184 PolarHBondContact NE-O 3.38Å; R180-R185 VanDerWaalsContact NH2-C 3.26Å; R180-R185 PolarHBondContact NH2-O 3.39Å; R180-N186 WeakPolarHBondContact CD-OD1 3.44Å; R180-N186 PolarHBondContact NE-OD1 3.09Å; R180-N186 PolarHBondContact NH1-ND2 3.45Å; R180-N186 PolarHBondContact NH1-OD1 3.03Å; R180-N186 VanDerWaalsContact NH1-OD1 3.08Å; R180-N186 PolarHBondContact NH2-OD1 2.69Å
181P94.4Very high92.4Very high18 Ų1891.2 Ų91.212%0.11743%0.434CS..PPolyproline II helixtrans-68.8137.1173.6-1831000111.8W183 F184P181-W183 HydrophobicContact CB-CD2 4.41Å; P181-W183 HydrophobicContact CB-CG 4.41Å; P181-W183 HydrophobicContact CB-CZ2 4.16Å; P181-W183 HydrophobicContact CG-CZ2 4.29Å; P181-W183 PolarHBondContact O-N 2.77Å; P181-F184 PolarHBondContact O-N 2.81Å
182A92.6Very high92.3Very high108 Ų10892.8 Ų92.889%0.89344%0.444SS*.THydrogen-bonded Turntrans-58-23.4-177.600000115.7
183W92.8Very high92.3Very high93 Ų9396 Ų9635%0.35246%0.463SS..THydrogen-bonded Turntrans-85-12.7178.557.8-86.7000113.1K128 I129 E132 P181K128-W183 VanDerWaalsContact NZ-NE1 3.19Å; I129-W183 HydrophobicContact CB-CH2 4.3Å; I129-W183 HydrophobicContact CD1-CZ3 4.42Å; I129-W183 HydrophobicContact CG1-CE3 4.22Å; I129-W183 HydrophobicContact CG1-CH2 3.8Å; I129-W183 HydrophobicContact CG1-CZ2 4.32Å; I129-W183 HydrophobicContact CG1-CZ3 3.75Å; I129-W183 HydrophobicContact CG2-CH2 4.34Å; I129-W183 HydrophobicContact CG2-CZ3 4.4Å; E132-W183 HydrophobicContact CB-CH2 4.27Å; E132-W183 HydrophobicContact CB-CZ2 4.24Å; E132-W183 HydrophobicContact CG-CH2 4.37Å; E132-W183 HydrophobicContact CG-CZ2 4.35Å; P181-W183 HydrophobicContact CB-CD2 4.41Å; P181-W183 HydrophobicContact CB-CG 4.41Å; P181-W183 HydrophobicContact CB-CZ2 4.16Å; P181-W183 HydrophobicContact CG-CZ2 4.29Å; P181-W183 PolarHBondContact O-N 2.77Å
184F93.6Very high92.2Very high67 Ų6798.6 Ų98.629%0.29447%0.474SS..SBendtrans-102.697.9-179.5-168.4-159.5000109.4I136 V157 Y159 R180 P181I136-F184 HydrophobicContact CD1-CE1 4.49Å; V157-F184 HydrophobicContact CG1-CE1 4.49Å; Y159-F184 AromaticContact CE2-CD1 3.55Å; Y159-F184 HydrophobicContact CE2-CD1 3.55Å; Y159-F184 AromaticContact CE2-CE1 3.72Å; Y159-F184 HydrophobicContact CE2-CE1 3.72Å; Y159-F184 AromaticContact CZ-CD1 3.86Å; Y159-F184 WeakPolarHBondContact OH-CD1 3.15Å; R180-F184 PolarHBondContact NE-O 3.38Å; P181-F184 PolarHBondContact O-N 2.81Å
185R90.2Very high92Very high214 Ų214106.8 Ų106.881%0.80851%0.513SS*.  trans-78.4156.2-176.1-62.9-173.3-179.7-149.90.2112.1R180R180-R185 VanDerWaalsContact NH2-C 3.26Å; R180-R185 PolarHBondContact NH2-O 3.39Å
186N79.4Confident91.9Very high172 Ų172104.1 Ų104.192%0.9250%0.502SS*.  trans-83.60174.9-56.633.6000110.1E162 R180E162-N186 PolarHBondContact OE1-ND2 3.13Å; R180-N186 WeakPolarHBondContact CD-OD1 3.44Å; R180-N186 PolarHBondContact NE-OD1 3.09Å; R180-N186 PolarHBondContact NH1-ND2 3.45Å; R180-N186 PolarHBondContact NH1-OD1 3.03Å; R180-N186 VanDerWaalsContact NH1-OD1 3.08Å; R180-N186 PolarHBondContact NH2-OD1 2.69Å

Retrieved 186 of 186 residues in 83.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).