A0A087XS23_POEFO Loading...

DNA-directed RNA polymerase III subunit RPC9

Accessory protein for the calcitonin gene-related peptide (CGRP) receptor. It modulates CGRP responsiveness in a variety of tissues. DNA-dependent RNA polymerase catalyzes the transcription of DNA into RNA using the four ribonucleoside triphosphates as substrates. Specific peripheric component of RNA polymerase III (Pol III) which synthesizes small non-coding RNAs including 5S rRNA, snRNAs, tRNAs and miRNAs from at least 500 distinct genomic loci. With POLR3H/RPC8 forms a mobile stalk that protrudes from Pol III core and functions primarily in transcription initiation. Pol III plays a key role in sensing and limiting infection by intracellular bacteria and DNA viruses. Acts as nuclear and cytosolic DNA sensor involved in innate immune response. Can sense non-self dsDNA that serves as template for transcription into dsRNA. The non-self RNA polymerase III transcripts, such as Epstein-Barr virus-encoded RNAs (EBERs) induce type I interferon and NF-kappa-B through the RIG-I pathway.

AlphaFold DB , UniProt , Accession A0A087XS23, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 148 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
1M81.1Confident90.8Very high255 Ų255136.1 Ų136.1100%1.25676%0.756SS**  0134.90-89.6-155.9-85.500107.4
2E91.2Very high90.9Very high183 Ų183125 Ų12586%0.85569%0.694SS**  trans-121.9137.1176.8-172.4-177.3170.600108.7
3V92.8Very high91.1Very high116 Ų116117.8 Ų117.870%0.70365%0.654SS**  trans-91.2115.5-176.8179.40000109A6V3-A6 HydrophobicContact CG1-CB 4.44Å
4K95Very high91.1Very high214 Ų214111.4 Ų111.493%0.9362%0.615SS**SBendtrans-80.8-38.8179-67-170.2176.4-175.80113.5
5N93.1Very high91.1Very high106 Ų106110.5 Ų110.557%0.56760%0.604SS**  trans-144.6117.9177.1-174.4-10.5000108.3N7N5-N7 PolarHBondContact OD1-N 3.29Å; N5-N7 PolarHBondContact OD1-O 3.3Å
6A90.6Very high91.2Very high84 Ų84106.4 Ų106.469%0.69458%0.584SS**SBendtrans-72.4-35-179.900000112.3V3V3-A6 HydrophobicContact CG1-CB 4.44Å
7N89.3Confident91.2Very high146 Ų146102.2 Ų102.278%0.78156%0.559SS**  trans-122.973.8-173-65-23.8000109.8N5N5-N7 PolarHBondContact OD1-N 3.29Å; N5-N7 PolarHBondContact OD1-O 3.3Å
8A91.8Very high91.2Very high86 Ų86101.9 Ų101.971%0.71155%0.551SS**  trans-76.8-35.9-176.900000113.2
9A91.5Very high91.3Very high81 Ų81101.8 Ų101.867%0.66955%0.55SS*.  trans-158.1158.2-17600000111.5
10M90.9Very high91.2Very high123 Ų12398 Ų9861%0.60653%0.529SS*.  trans-97.1134.3164.6-70177.7178.200108.3K80 A81 L84M10-K80 HydrophobicContact SD-CB 4.47Å; M10-A81 HydrophobicContact CE-CB 4.19Å; M10-A81 HydrophobicContact SD-CB 4.5Å; M10-L84 HydrophobicContact CB-CD2 3.86Å; M10-L84 HydrophobicContact CG-CD2 4.35Å; M10-L84 HydrophobicContact SD-CD2 4.33Å
11L92.1Very high91.1Very high103 Ų10395.5 Ų95.554%0.53952%0.517SS..  trans-118.7136.7179.7-65.6167.6000108.9V16L11-V16 HydrophobicContact CB-CG2 4.07Å
12S92.1Very high91.5Very high3 Ų387.1 Ų87.12%0.02148%0.477CS..  trans-75.4154.2173.561.90000111.6Y14 E15 V16S12-Y14 PolarHBondContact O-N 3.31Å; S12-E15 PolarHBondContact N-OE2 3.37Å; S12-E15 PolarHBondContact O-N 3.47Å; S12-E15 VanDerWaalsContact O-N 3.13Å; S12-E15 WeakPolarHBondContact OG-CB 3.45Å; S12-E15 VanDerWaalsContact OG-CD 3.3Å; S12-E15 WeakPolarHBondContact OG-CG 3.44Å; S12-E15 PolarHBondContact OG-N 3.49Å; S12-E15 VanDerWaalsContact OG-N 3.17Å; S12-E15 PolarHBondContact OG-OE2 2.92Å; S12-V16 WeakPolarHBondContact O-CG2 3.32Å; S12-V16 PolarHBondContact O-N 3.31Å; S12-V16 VanDerWaalsContact O-N 3.1Å
13N92.4Very high91.4Very high32 Ų3281.1 Ų81.117%0.17145%0.451CS..Hα-helixtrans-57-34.9174.1-75.2-4.7000111F17 L53 C58 N88N13-F17 WeakPolarHBondContact O-CB 3.37Å; N13-F17 PolarHBondContact O-N 3.48Å; N13-L53 HydrophobicContact CB-CD2 3.81Å; N13-C58 HydrophobicContact CB-CB 3.79Å; N13-N88 VanDerWaalsContact CB-OD1 3.31Å; N13-N88 WeakPolarHBondContact CB-OD1 3.45Å; N13-N88 VanDerWaalsContact CG-CG 3.44Å; N13-N88 PolarHBondContact N-OD1 3.11Å
14Y91.3Very high91Very high28 Ų2882 Ų8211%0.1145%0.445CS..Hα-helixtrans-63-48.5174.6169.7-103000112.8S12 V16 F17 K18 Q61 P63 V66S12-Y14 PolarHBondContact O-N 3.31Å; Y14-V16 VanDerWaalsContact C-N 3.31Å; Y14-V16 PolarHBondContact O-N 3.29Å; Y14-F17 PolarHBondContact O-N 3.38Å; Y14-K18 WeakPolarHBondContact O-CB 3.41Å; Y14-K18 PolarHBondContact O-N 3.09Å; Y14-Q61 HydrophobicContact CD2-CB 3.98Å; Y14-Q61 WeakPolarHBondContact CE2-O 3.45Å; Y14-Q61 HydrophobicContact CG-CB 4.37Å; Y14-P63 HydrophobicContact CE1-CB 4.24Å; Y14-P63 WeakPolarHBondContact OH-CD 3.42Å; Y14-V66 HydrophobicContact CD1-CG2 3.89Å; Y14-V66 HydrophobicContact CE1-CG2 4.42Å; Y14-V66 HydrophobicContact CG-CG2 4.26Å
15E91.1Very high90.5Very high97 Ų9777 Ų7745%0.45343%0.425SS..Hα-helixtrans-61.4-41.8178.7-74.4163.5134.400111.7S12 L19S12-E15 PolarHBondContact N-OE2 3.37Å; S12-E15 PolarHBondContact O-N 3.47Å; S12-E15 VanDerWaalsContact O-N 3.13Å; S12-E15 WeakPolarHBondContact OG-CB 3.45Å; S12-E15 VanDerWaalsContact OG-CD 3.3Å; S12-E15 WeakPolarHBondContact OG-CG 3.44Å; S12-E15 PolarHBondContact OG-N 3.49Å; S12-E15 VanDerWaalsContact OG-N 3.17Å; S12-E15 PolarHBondContact OG-OE2 2.92Å; E15-L19 VanDerWaalsContact O-CB 3.28Å; E15-L19 WeakPolarHBondContact O-CB 3.49Å; E15-L19 PolarHBondContact O-N 2.95Å
16V93Very high90Very high45 Ų4578.3 Ų78.327%0.27343%0.428SS..Hα-helixtrans-65.2-44175.7178.90000110.6L11 S12 Y14 L19 L20 L53L11-V16 HydrophobicContact CB-CG2 4.07Å; S12-V16 WeakPolarHBondContact O-CG2 3.32Å; S12-V16 PolarHBondContact O-N 3.31Å; S12-V16 VanDerWaalsContact O-N 3.1Å; Y14-V16 VanDerWaalsContact C-N 3.31Å; Y14-V16 PolarHBondContact O-N 3.29Å; V16-L19 PolarHBondContact O-N 3.33Å; V16-L20 HydrophobicContact CG1-CD1 3.9Å; V16-L20 HydrophobicContact CG1-CG 4.29Å; V16-L20 WeakPolarHBondContact O-CB 3.33Å; V16-L20 VanDerWaalsContact O-CG 3.26Å; V16-L20 WeakPolarHBondContact O-CG 3.29Å; V16-L20 PolarHBondContact O-N 3.18Å; V16-L53 HydrophobicContact CB-CD1 4.3Å; V16-L53 HydrophobicContact CG1-CD1 3.88Å
17F91.3Very high89.4Confident36 Ų3678.4 Ų78.416%0.15841%0.41CS..Hα-helixtrans-60.9-46.5178.6-178.4-107.5000112.1N13 Y14 L20 T21 L50 L53 S54N13-F17 WeakPolarHBondContact O-CB 3.37Å; N13-F17 PolarHBondContact O-N 3.48Å; Y14-F17 PolarHBondContact O-N 3.38Å; F17-L20 PolarHBondContact O-N 3.3Å; F17-T21 WeakPolarHBondContact O-CB 3.38Å; F17-T21 PolarHBondContact O-N 3.21Å; F17-T21 PolarHBondContact O-OG1 3Å; F17-L50 HydrophobicContact CD2-CD2 3.68Å; F17-L50 HydrophobicContact CE2-CD2 3.75Å; F17-L53 HydrophobicContact CB-CB 4.33Å; F17-L53 HydrophobicContact CB-CD1 4.08Å; F17-L53 HydrophobicContact CD2-CB 3.65Å; F17-L53 HydrophobicContact CD2-CD1 4.42Å; F17-L53 HydrophobicContact CE2-CB 4.45Å; F17-L53 HydrophobicContact CG-CB 4.39Å; F17-S54 WeakPolarHBondContact CE2-OG 3.46Å
18K91.1Very high88.5Confident97 Ų9781 Ų8142%0.42241%0.409SS..Hα-helixtrans-61.2-50.1176.4-176.1175.9-179.3175.70111.2Y14 L20 T21 D22Y14-K18 WeakPolarHBondContact O-CB 3.41Å; Y14-K18 PolarHBondContact O-N 3.09Å; K18-L20 VanDerWaalsContact C-N 3.33Å; K18-L20 PolarHBondContact O-N 3.28Å; K18-T21 WeakPolarHBondContact O-CB 3.46Å; K18-T21 PolarHBondContact O-N 3.44Å; K18-T21 VanDerWaalsContact O-N 3.11Å; K18-D22 VanDerWaalsContact O-CG 3.29Å; K18-D22 PolarHBondContact O-N 3.18Å
19L92.5Very high87.3Confident100 Ų10082.8 Ų82.852%0.52441%0.406SS..Hα-helixtrans-56.8-4617917765.7000112.1E15 V16 T21 D22 L23E15-L19 VanDerWaalsContact O-CB 3.28Å; E15-L19 WeakPolarHBondContact O-CB 3.49Å; E15-L19 PolarHBondContact O-N 2.95Å; V16-L19 PolarHBondContact O-N 3.33Å; L19-T21 VanDerWaalsContact C-N 3.31Å; L19-T21 PolarHBondContact O-N 3.37Å; L19-D22 PolarHBondContact O-N 3.12Å; L19-L23 HydrophobicContact CD1-CD1 4.31Å; L19-L23 HydrophobicContact CD1-CG 4.43Å; L19-L23 HydrophobicContact CG-CD1 4.13Å; L19-L23 WeakPolarHBondContact O-CB 3.43Å; L19-L23 VanDerWaalsContact O-CG 3.27Å; L19-L23 WeakPolarHBondContact O-CG 3.38Å; L19-L23 PolarHBondContact O-N 2.98Å
20L90.6Very high86Confident25 Ų2582.6 Ų82.613%0.13141%0.405CS..Hα-helixtrans-67.6-33.1179.5-69.9177.8000112.3V16 F17 K18 K24 M46 T49 L50 L53V16-L20 HydrophobicContact CG1-CD1 3.9Å; V16-L20 HydrophobicContact CG1-CG 4.29Å; V16-L20 WeakPolarHBondContact O-CB 3.33Å; V16-L20 VanDerWaalsContact O-CG 3.26Å; V16-L20 WeakPolarHBondContact O-CG 3.29Å; V16-L20 PolarHBondContact O-N 3.18Å; F17-L20 PolarHBondContact O-N 3.3Å; K18-L20 VanDerWaalsContact C-N 3.33Å; K18-L20 PolarHBondContact O-N 3.28Å; L20-K24 WeakPolarHBondContact O-CB 3.41Å; L20-K24 PolarHBondContact O-N 3.4Å; L20-M46 HydrophobicContact CD2-CG 4.12Å; L20-T49 HydrophobicContact CD1-CG2 3.52Å; L20-L50 HydrophobicContact CB-CD1 4.14Å; L20-L50 HydrophobicContact CB-CD2 3.56Å; L20-L50 HydrophobicContact CB-CG 3.74Å; L20-L50 HydrophobicContact CD1-CD2 4.39Å; L20-L50 HydrophobicContact CD1-CG 4.22Å; L20-L53 HydrophobicContact CD1-CD1 4.29Å
21T88.9Confident84.5Confident45 Ų4579.1 Ų79.128%0.27640%0.401SS..Hα-helixtrans-67.2-48.1175.2-58.60000110.8F17 K18 L19 L23 K24 E25F17-T21 WeakPolarHBondContact O-CB 3.38Å; F17-T21 PolarHBondContact O-N 3.21Å; F17-T21 PolarHBondContact O-OG1 3Å; K18-T21 WeakPolarHBondContact O-CB 3.46Å; K18-T21 PolarHBondContact O-N 3.44Å; K18-T21 VanDerWaalsContact O-N 3.11Å; L19-T21 VanDerWaalsContact C-N 3.31Å; L19-T21 PolarHBondContact O-N 3.37Å; T21-L23 VanDerWaalsContact C-N 3.34Å; T21-L23 PolarHBondContact O-N 3.32Å; T21-K24 WeakPolarHBondContact O-CB 3.49Å; T21-K24 PolarHBondContact O-N 3.17Å; T21-K24 VanDerWaalsContact O-N 3.12Å; T21-E25 PolarHBondContact O-N 2.99Å
22D89.8Confident83Confident79 Ų7984.7 Ų84.742%0.42242%0.421SS..Hα-helixtrans-60.2-43.4177.2-64.7-13000111.1K18 L19 K24 E25 Q26K18-D22 VanDerWaalsContact O-CG 3.29Å; K18-D22 PolarHBondContact O-N 3.18Å; L19-D22 PolarHBondContact O-N 3.12Å; D22-K24 VanDerWaalsContact C-N 3.31Å; D22-K24 PolarHBondContact O-N 2.96Å; D22-E25 PolarHBondContact O-N 3.5Å; D22-Q26 WeakPolarHBondContact O-CB 3.45Å; D22-Q26 PolarHBondContact O-N 3.07Å
23L87.8Confident81.4Confident58 Ų5889.2 Ų89.230%0.30445%0.452SS..Hα-helixtrans-63.2-35.7176.4-76.7173.4000112.9L19 T21 R27L19-L23 HydrophobicContact CD1-CD1 4.31Å; L19-L23 HydrophobicContact CD1-CG 4.43Å; L19-L23 HydrophobicContact CG-CD1 4.13Å; L19-L23 WeakPolarHBondContact O-CB 3.43Å; L19-L23 VanDerWaalsContact O-CG 3.27Å; L19-L23 WeakPolarHBondContact O-CG 3.38Å; L19-L23 PolarHBondContact O-N 2.98Å; T21-L23 VanDerWaalsContact C-N 3.34Å; T21-L23 PolarHBondContact O-N 3.32Å; L23-R27 WeakPolarHBondContact O-CB 3.5Å; L23-R27 WeakPolarHBondContact O-CG 3.32Å; L23-R27 PolarHBondContact O-N 2.98Å; L23-R27 VanDerWaalsContact O-N 3.17Å
24K85Confident79.7Confident134 Ų13496 Ų9658%0.58348%0.48SS*.Hα-helixtrans-67.6-42.1177.1-177.4-174.7176-172.10111.1L20 T21 D22 R28 L50L20-K24 WeakPolarHBondContact O-CB 3.41Å; L20-K24 PolarHBondContact O-N 3.4Å; T21-K24 WeakPolarHBondContact O-CB 3.49Å; T21-K24 PolarHBondContact O-N 3.17Å; T21-K24 VanDerWaalsContact O-N 3.12Å; D22-K24 VanDerWaalsContact C-N 3.31Å; D22-K24 PolarHBondContact O-N 2.96Å; K24-R28 PolarHBondContact O-N 3.31Å; K24-R28 VanDerWaalsContact O-N 3.08Å; K24-L50 HydrophobicContact CD-CD1 4.06Å
25E84.7Confident78.1Confident110 Ų110103.4 Ų103.451%0.51452%0.516SS..Hα-helixtrans-65.9-49.3176.5-70.9-169.3159.100111.7T21 D22 R27 R28 D29T21-E25 PolarHBondContact O-N 2.99Å; D22-E25 PolarHBondContact O-N 3.5Å; E25-R27 PolarHBondContact O-N 3.02Å; E25-R27 VanDerWaalsContact O-N 3.14Å; E25-R28 WeakPolarHBondContact O-CA 3.35Å; E25-R28 VanDerWaalsContact O-CB 3.27Å; E25-R28 WeakPolarHBondContact O-CB 3.36Å; E25-R28 PolarHBondContact O-N 3.32Å; E25-D29 PolarHBondContact O-N 3Å; E25-D29 VanDerWaalsContact O-N 3.14Å
26Q82.8Confident77.1Confident132 Ų132102 Ų10262%0.61752%0.516SS*.Hα-helixtrans-56-36.6178.4-169.1-177.910.300112.2D22 A30D22-Q26 WeakPolarHBondContact O-CB 3.45Å; D22-Q26 PolarHBondContact O-N 3.07Å; Q26-A30 WeakPolarHBondContact O-CB 3.11Å; Q26-A30 PolarHBondContact O-N 3.34Å; Q26-A30 VanDerWaalsContact O-N 3.13Å
27R76.8Confident75.8Confident87 Ų87104.6 Ų104.633%0.32853%0.532SS..Hα-helixtrans-76.9-27.4176.3-76-178.4178.5-145.5-8.6114L23 E25 D29 L42L23-R27 WeakPolarHBondContact O-CB 3.5Å; L23-R27 WeakPolarHBondContact O-CG 3.32Å; L23-R27 PolarHBondContact O-N 2.98Å; L23-R27 VanDerWaalsContact O-N 3.17Å; E25-R27 PolarHBondContact O-N 3.02Å; E25-R27 VanDerWaalsContact O-N 3.14Å; R27-D29 VanDerWaalsContact C-N 3.27Å; R27-L42 VanDerWaalsContact NH1-CD2 3.32Å
28R71.8Confident74.9Confident200 Ų200105 Ų10576%0.75555%0.546SS*.Hα-helixtrans-63.5-40.5172.9-162.9-176.289.4-176.18.5110.1K24 E25K24-R28 PolarHBondContact O-N 3.31Å; K24-R28 VanDerWaalsContact O-N 3.08Å; E25-R28 WeakPolarHBondContact O-CA 3.35Å; E25-R28 VanDerWaalsContact O-CB 3.27Å; E25-R28 WeakPolarHBondContact O-CB 3.36Å; E25-R28 PolarHBondContact O-N 3.32Å
29D65.8Low74.2Confident123 Ų123103.7 Ų103.766%0.65854%0.542SS*.Hα-helixtrans-81-27-177.2-63.2-23.1000113E25 R27 G31E25-D29 PolarHBondContact O-N 3Å; E25-D29 VanDerWaalsContact O-N 3.14Å; R27-D29 VanDerWaalsContact C-N 3.27Å; D29-G31 PolarHBondContact O-N 3.07Å
30A65Low73.6Confident78 Ų78104 Ų10465%0.64554%0.541SS*.THydrogen-bonded Turntrans-73.1-1.9-178.100000115.8Q26Q26-A30 WeakPolarHBondContact O-CB 3.11Å; Q26-A30 PolarHBondContact O-N 3.34Å; Q26-A30 VanDerWaalsContact O-N 3.13Å
31G58.1Low73.4Confident50 Ų50107.4 Ų107.452%0.51556%0.559SS.*  trans69.7147.7177.900000114.3D29 S33D29-G31 PolarHBondContact O-N 3.07Å; G31-S33 VanDerWaalsContact C-N 3.33Å; G31-S33 PolarHBondContact O-N 3.03Å
32K61.1Low73.2Confident219 Ų219108.5 Ų108.595%0.95256%0.563SS**SBendtrans-68.980.9-177.2-64.7177.4-177.21760111.4
33S58.2Low73Confident98 Ų98108.2 Ų108.269%0.68556%0.561SS**  trans-117.3118.3174.81540000110.1G31G31-S33 VanDerWaalsContact C-N 3.33Å; G31-S33 PolarHBondContact O-N 3.03Å
34K56.2Low73.1Confident176 Ų176108.7 Ų108.777%0.76557%0.567SS**  trans81.694.5178.4-66.2178.6175.9175.30117.1S36K34-S36 VanDerWaalsContact C-N 3.29Å; K34-S36 PolarHBondContact O-N 3.16Å
35H58Low73.4Confident183 Ų183107.1 Ų107.185%0.84756%0.563SS**  trans-66.684.2157.1-76.1-78.3000110
36S70.1Confident73.6Confident66 Ų66102.7 Ų102.746%0.46254%0.543SS..  trans-107.9144168.7168.60000109.3K34 G38 Q39 Q40K34-S36 VanDerWaalsContact C-N 3.29Å; K34-S36 PolarHBondContact O-N 3.16Å; S36-G38 PolarHBondContact O-N 3.37Å; S36-G38 PolarHBondContact OG-N 3.46Å; S36-Q39 WeakPolarHBondContact O-CA 3.18Å; S36-Q39 VanDerWaalsContact O-CB 3.29Å; S36-Q39 WeakPolarHBondContact O-CB 3.49Å; S36-Q39 PolarHBondContact O-N 2.9Å; S36-Q40 PolarHBondContact O-N 2.87Å
37V66.5Low73.9Confident100 Ų100103.4 Ų103.461%0.60654%0.541SS*.Hα-helixtrans-55.9-36174.6179.70000111.2Q39 Q40 N41V37-Q39 VanDerWaalsContact C-N 3.26Å; V37-Q39 PolarHBondContact O-N 2.95Å; V37-Q40 WeakPolarHBondContact O-CB 3.48Å; V37-Q40 PolarHBondContact O-N 3.26Å; V37-Q40 VanDerWaalsContact O-N 3.13Å; V37-N41 PolarHBondContact O-N 3.21Å; V37-N41 VanDerWaalsContact O-N 3.08Å
38G72.6Confident74.7Confident45 Ų45105 Ų10546%0.46455%0.552SS.*Hα-helixtrans-63.9-31.1175.500000113.5S36 L42S36-G38 PolarHBondContact O-N 3.37Å; S36-G38 PolarHBondContact OG-N 3.46Å; G38-L42 PolarHBondContact O-N 3Å
39Q76.8Confident75.7Confident70 Ų7097.8 Ų97.833%0.32753%0.531SS..Hα-helixtrans-73.4-32.8175.6-169.9673.600111.5S36 V37 N43S36-Q39 WeakPolarHBondContact O-CA 3.18Å; S36-Q39 VanDerWaalsContact O-CB 3.29Å; S36-Q39 WeakPolarHBondContact O-CB 3.49Å; S36-Q39 PolarHBondContact O-N 2.9Å; V37-Q39 VanDerWaalsContact C-N 3.26Å; V37-Q39 PolarHBondContact O-N 2.95Å; Q39-N43 WeakPolarHBondContact O-CB 3.41Å; Q39-N43 PolarHBondContact O-N 3.12Å; Q39-N43 PolarHBondContact O-ND2 3.32Å; Q39-N43 PolarHBondContact O-OD1 3.21Å
40Q79.8Confident76.9Confident106 Ų10692.8 Ų92.850%0.49550%0.504SS..Hα-helixtrans-67-49.7175.1-66.4176.9-30.400111.2S36 V37 L42 N43 T44S36-Q40 PolarHBondContact O-N 2.87Å; V37-Q40 WeakPolarHBondContact O-CB 3.48Å; V37-Q40 PolarHBondContact O-N 3.26Å; V37-Q40 VanDerWaalsContact O-N 3.13Å; Q40-L42 VanDerWaalsContact C-N 3.28Å; Q40-L42 PolarHBondContact O-N 2.98Å; Q40-N43 PolarHBondContact O-N 2.93Å; Q40-N43 VanDerWaalsContact O-N 3.1Å; Q40-T44 PolarHBondContact O-N 3.32Å; Q40-T44 PolarHBondContact O-OG1 3.21Å
41N86.6Confident78.1Confident97 Ų9794.4 Ų94.452%0.51950%0.496SS..Hα-helixtrans-56.9-43.9178.1-68.3-10.4000111.7V37 T44 I45V37-N41 PolarHBondContact O-N 3.21Å; V37-N41 VanDerWaalsContact O-N 3.08Å; N41-T44 PolarHBondContact O-N 3.47Å; N41-I45 WeakPolarHBondContact O-CG1 3.5Å; N41-I45 PolarHBondContact O-N 3.34Å
42L84.8Confident79.8Confident67 Ų6798.7 Ų98.735%0.35150%0.498SS..Hα-helixtrans-64.5-41.1177.5-178.355000112.2R27 G38 Q40 T44 I45 M46R27-L42 VanDerWaalsContact NH1-CD2 3.32Å; G38-L42 PolarHBondContact O-N 3Å; Q40-L42 VanDerWaalsContact C-N 3.28Å; Q40-L42 PolarHBondContact O-N 2.98Å; L42-T44 VanDerWaalsContact C-N 3.33Å; L42-T44 PolarHBondContact O-N 2.81Å; L42-I45 PolarHBondContact O-N 3.36Å; L42-M46 HydrophobicContact CD1-CG 4.08Å; L42-M46 HydrophobicContact CD1-SD 4.42Å; L42-M46 HydrophobicContact CG-CE 4.34Å; L42-M46 HydrophobicContact CG-CG 4.42Å; L42-M46 HydrophobicContact CG-SD 4.35Å; L42-M46 WeakPolarHBondContact O-CB 3.42Å; L42-M46 VanDerWaalsContact O-CG 3.25Å; L42-M46 WeakPolarHBondContact O-CG 3.47Å; L42-M46 PolarHBondContact O-N 2.73Å
43N84.8Confident81.1Confident73 Ų7388.5 Ų88.539%0.3945%0.454SS..Hα-helixtrans-63.4-39.5176.2-70.6-15.3000112.2Q39 Q40 M46 Y47Q39-N43 WeakPolarHBondContact O-CB 3.41Å; Q39-N43 PolarHBondContact O-N 3.12Å; Q39-N43 PolarHBondContact O-ND2 3.32Å; Q39-N43 PolarHBondContact O-OD1 3.21Å; Q40-N43 PolarHBondContact O-N 2.93Å; Q40-N43 VanDerWaalsContact O-N 3.1Å; N43-M46 VanDerWaalsContact OD1-CE 3.29Å; N43-M46 WeakPolarHBondContact OD1-CE 3.29Å; N43-Y47 VanDerWaalsContact O-CB 3.29Å; N43-Y47 WeakPolarHBondContact O-CB 3.27Å; N43-Y47 PolarHBondContact O-N 3.35Å
44T89.1Confident82.5Confident69 Ų6986.8 Ų86.842%0.42344%0.442SS..Hα-helixtrans-61.6-52175.4-57.60000110.8Q40 N41 L42 M46 Y47 E48Q40-T44 PolarHBondContact O-N 3.32Å; Q40-T44 PolarHBondContact O-OG1 3.21Å; N41-T44 PolarHBondContact O-N 3.47Å; L42-T44 VanDerWaalsContact C-N 3.33Å; L42-T44 PolarHBondContact O-N 2.81Å; T44-M46 PolarHBondContact O-N 2.81Å; T44-Y47 PolarHBondContact O-N 3.45Å; T44-E48 HydrophobicContact CG2-CG 4.37Å; T44-E48 WeakPolarHBondContact O-CG 3.27Å; T44-E48 PolarHBondContact O-N 3.11Å
45I91.6Very high83.9Confident100 Ų10086 Ų8651%0.51344%0.438SS..Hα-helixtrans-60.1-45.9179.5-65.2165.6000110.7N41 L42 Y47 E48 T49N41-I45 WeakPolarHBondContact O-CG1 3.5Å; N41-I45 PolarHBondContact O-N 3.34Å; L42-I45 PolarHBondContact O-N 3.36Å; I45-Y47 VanDerWaalsContact C-N 3.33Å; I45-Y47 PolarHBondContact O-N 3.46Å; I45-E48 PolarHBondContact O-N 3.32Å; I45-T49 VanDerWaalsContact O-CB 3.28Å; I45-T49 WeakPolarHBondContact O-CB 3.08Å; I45-T49 PolarHBondContact O-N 2.91Å; I45-T49 PolarHBondContact O-OG1 2.89Å
46M89.1Confident85.2Confident18 Ų1878.1 Ų78.19%0.08940%0.403CS..Hα-helixtrans-60.3-43.5177.5-72.6-171.3-51.900111.8L20 L42 N43 T44 L50L20-M46 HydrophobicContact CD2-CG 4.12Å; L42-M46 HydrophobicContact CD1-CG 4.08Å; L42-M46 HydrophobicContact CD1-SD 4.42Å; L42-M46 HydrophobicContact CG-CE 4.34Å; L42-M46 HydrophobicContact CG-CG 4.42Å; L42-M46 HydrophobicContact CG-SD 4.35Å; L42-M46 WeakPolarHBondContact O-CB 3.42Å; L42-M46 VanDerWaalsContact O-CG 3.25Å; L42-M46 WeakPolarHBondContact O-CG 3.47Å; L42-M46 PolarHBondContact O-N 2.73Å; N43-M46 VanDerWaalsContact OD1-CE 3.29Å; N43-M46 WeakPolarHBondContact OD1-CE 3.29Å; T44-M46 PolarHBondContact O-N 2.81Å; M46-L50 VanDerWaalsContact O-CB 3.24Å; M46-L50 WeakPolarHBondContact O-CB 3.38Å; M46-L50 WeakPolarHBondContact O-CG 3.24Å; M46-L50 PolarHBondContact O-N 2.99Å
47Y89.1Confident85.6Confident147 Ų14775.8 Ų75.858%0.57639%0.387SS*.Hα-helixtrans-67.1-47.1-179.4175.8-98.9000112N43 T44 I45 K51N43-Y47 VanDerWaalsContact O-CB 3.29Å; N43-Y47 WeakPolarHBondContact O-CB 3.27Å; N43-Y47 PolarHBondContact O-N 3.35Å; T44-Y47 PolarHBondContact O-N 3.45Å; I45-Y47 VanDerWaalsContact C-N 3.33Å; I45-Y47 PolarHBondContact O-N 3.46Å; Y47-K51 HydrophobicContact CE1-CD 4.06Å; Y47-K51 WeakPolarHBondContact O-CB 3.31Å; Y47-K51 PolarHBondContact O-N 2.94Å
48E93.3Very high86.3Confident119 Ų11971 Ų7156%0.55636%0.358SS*.Hα-helixtrans-64.6-44.9179.7-71.9178.7175.800111.6T44 I45 K51 Y52T44-E48 HydrophobicContact CG2-CG 4.37Å; T44-E48 WeakPolarHBondContact O-CG 3.27Å; T44-E48 PolarHBondContact O-N 3.11Å; I45-E48 PolarHBondContact O-N 3.32Å; E48-K51 PolarHBondContact O-N 3.15Å; E48-Y52 PolarHBondContact O-N 3.07Å
49T93.1Very high86.7Confident50 Ų5070.9 Ų70.931%0.30735%0.35SS..Hα-helixtrans-65.2-45.4177.9-56.90000111.5L20 I45 K51 Y52 L53L20-T49 HydrophobicContact CD1-CG2 3.52Å; I45-T49 VanDerWaalsContact O-CB 3.28Å; I45-T49 WeakPolarHBondContact O-CB 3.08Å; I45-T49 PolarHBondContact O-N 2.91Å; I45-T49 PolarHBondContact O-OG1 2.89Å; T49-K51 VanDerWaalsContact C-N 3.32Å; T49-K51 PolarHBondContact O-N 3.07Å; T49-Y52 PolarHBondContact O-N 3.1Å; T49-L53 HydrophobicContact CG2-CD1 3.8Å; T49-L53 HydrophobicContact CG2-CG 4.29Å; T49-L53 WeakPolarHBondContact O-CB 3.19Å; T49-L53 VanDerWaalsContact O-CG 3.3Å; T49-L53 WeakPolarHBondContact O-CG 3.08Å; T49-L53 PolarHBondContact O-N 3.25Å
50L91.2Very high86.8Confident17 Ų1772.9 Ų72.99%0.08935%0.354CS..Hα-helixtrans-60.9-42.8174.5-81.5172.3000111.4F17 L20 K24 M46 Y52 L53 S54F17-L50 HydrophobicContact CD2-CD2 3.68Å; F17-L50 HydrophobicContact CE2-CD2 3.75Å; L20-L50 HydrophobicContact CB-CD1 4.14Å; L20-L50 HydrophobicContact CB-CD2 3.56Å; L20-L50 HydrophobicContact CB-CG 3.74Å; L20-L50 HydrophobicContact CD1-CD2 4.39Å; L20-L50 HydrophobicContact CD1-CG 4.22Å; K24-L50 HydrophobicContact CD-CD1 4.06Å; M46-L50 VanDerWaalsContact O-CB 3.24Å; M46-L50 WeakPolarHBondContact O-CB 3.38Å; M46-L50 WeakPolarHBondContact O-CG 3.24Å; M46-L50 PolarHBondContact O-N 2.99Å; L50-Y52 VanDerWaalsContact C-N 3.29Å; L50-Y52 PolarHBondContact O-N 3.05Å; L50-L53 PolarHBondContact O-N 2.9Å; L50-S54 WeakPolarHBondContact O-CB 3.26Å; L50-S54 PolarHBondContact O-N 3.43Å; L50-S54 PolarHBondContact O-OG 2.89Å
51K91.3Very high86.9Confident112 Ų11268.3 Ų68.349%0.48733%0.333SS..Hα-helixtrans-61.9-37.6178.2-178.4178.5180-179.90112.1Y47 E48 T49Y47-K51 HydrophobicContact CE1-CD 4.06Å; Y47-K51 WeakPolarHBondContact O-CB 3.31Å; Y47-K51 PolarHBondContact O-N 2.94Å; E48-K51 PolarHBondContact O-N 3.15Å; T49-K51 VanDerWaalsContact C-N 3.32Å; T49-K51 PolarHBondContact O-N 3.07Å
52Y92.1Very high86.8Confident140 Ų14065.2 Ų65.255%0.54932%0.319SS..Hα-helixtrans-67.5-52.7173.7174.8-98.2000111E48 T49 L50 S54 K55 T56E48-Y52 PolarHBondContact O-N 3.07Å; T49-Y52 PolarHBondContact O-N 3.1Å; L50-Y52 VanDerWaalsContact C-N 3.29Å; L50-Y52 PolarHBondContact O-N 3.05Å; Y52-S54 VanDerWaalsContact C-N 3.29Å; Y52-S54 PolarHBondContact O-N 2.98Å; Y52-K55 WeakPolarHBondContact O-CB 3.32Å; Y52-K55 PolarHBondContact O-N 3.44Å; Y52-T56 HydrophobicContact CE1-CG2 4.08Å
53L89.9Confident86.9Confident5 Ų564.1 Ų64.13%0.02632%0.315CS..Hα-helixtrans-63.6-32.1-177.6-68.6173.1000112.8N13 V16 F17 L20 T49 L50 K55 T56N13-L53 HydrophobicContact CB-CD2 3.81Å; V16-L53 HydrophobicContact CB-CD1 4.3Å; V16-L53 HydrophobicContact CG1-CD1 3.88Å; F17-L53 HydrophobicContact CB-CB 4.33Å; F17-L53 HydrophobicContact CB-CD1 4.08Å; F17-L53 HydrophobicContact CD2-CB 3.65Å; F17-L53 HydrophobicContact CD2-CD1 4.42Å; F17-L53 HydrophobicContact CE2-CB 4.45Å; F17-L53 HydrophobicContact CG-CB 4.39Å; L20-L53 HydrophobicContact CD1-CD1 4.29Å; T49-L53 HydrophobicContact CG2-CD1 3.8Å; T49-L53 HydrophobicContact CG2-CG 4.29Å; T49-L53 WeakPolarHBondContact O-CB 3.19Å; T49-L53 VanDerWaalsContact O-CG 3.3Å; T49-L53 WeakPolarHBondContact O-CG 3.08Å; T49-L53 PolarHBondContact O-N 3.25Å; L50-L53 PolarHBondContact O-N 2.9Å; L53-K55 PolarHBondContact O-N 3.39Å; L53-T56 WeakPolarHBondContact CA-OG1 3.4Å; L53-T56 PolarHBondContact O-N 2.94Å; L53-T56 PolarHBondContact O-OG1 3.3Å
54S86.6Confident87.1Confident62 Ų6266.5 Ų66.543%0.43432%0.324SS..THydrogen-bonded Turntrans-63.3-22.4173.3-69.40000113.8F17 L50 Y52F17-S54 WeakPolarHBondContact CE2-OG 3.46Å; L50-S54 WeakPolarHBondContact O-CB 3.26Å; L50-S54 PolarHBondContact O-N 3.43Å; L50-S54 PolarHBondContact O-OG 2.89Å; Y52-S54 VanDerWaalsContact C-N 3.29Å; Y52-S54 PolarHBondContact O-N 2.98Å
55K85.6Confident87Confident159 Ų15965 Ų6569%0.69131%0.313SS*.THydrogen-bonded Turntrans-88.8-7.3175-63.2177176.1-168.30113.1Y52 L53Y52-K55 WeakPolarHBondContact O-CB 3.32Å; Y52-K55 PolarHBondContact O-N 3.44Å; L53-K55 PolarHBondContact O-N 3.39Å
56T84.8Confident86.8Confident19 Ų1961 Ų6112%0.11729%0.294CS..SBendtrans-97.1156.8178.961.40000109.9Y52 L53 C58 S59Y52-T56 HydrophobicContact CE1-CG2 4.08Å; L53-T56 WeakPolarHBondContact CA-OG1 3.4Å; L53-T56 PolarHBondContact O-N 2.94Å; L53-T56 PolarHBondContact O-OG1 3.3Å; T56-C58 PolarHBondContact O-N 3.1Å; T56-C58 PolarHBondContact OG1-SG 3.27Å; T56-S59 PolarHBondContact O-N 3.08Å; T56-S59 PolarHBondContact O-OG 3.14Å
57P79.4Confident86.8Confident17 Ų1767.1 Ų67.111%0.1132%0.32CS..G310 helixtrans-62.9-12.4-176.723.7-35.2000113.4S59 R60 R90P57-S59 PolarHBondContact O-N 3.45Å; P57-R60 PolarHBondContact O-N 3.09Å; P57-R90 HydrophobicContact CB-CB 4.39Å; P57-R90 HydrophobicContact CG-CB 4.09Å
58C82.1Confident86.8Confident0 Ų065.7 Ų65.70%032%0.318CS..G310 helixtrans-66.3-18178.3770000114.3N13 T56 R60 Q61N13-C58 HydrophobicContact CB-CB 3.79Å; T56-C58 PolarHBondContact O-N 3.1Å; T56-C58 PolarHBondContact OG1-SG 3.27Å; C58-R60 PolarHBondContact O-N 3.2Å; C58-Q61 PolarHBondContact O-N 2.97Å
59S79.6Confident86.5Confident42 Ų4260 Ų6029%0.29429%0.292SS..G310 helixtrans-67.3-25.1-178.761.30000113.6T56 P57T56-S59 PolarHBondContact O-N 3.08Å; T56-S59 PolarHBondContact O-OG 3.14Å; P57-S59 PolarHBondContact O-N 3.45Å
60R79Confident86.3Confident111 Ų11161.2 Ų61.242%0.41930%0.296SS..G310 helixtrans-101.9-6.6-177.3-54.7177.1-168.5-142.72.1112.9P57 C58 P125 G126 D127P57-R60 PolarHBondContact O-N 3.09Å; C58-R60 PolarHBondContact O-N 3.2Å; R60-P125 HydrophobicContact CB-CB 4.16Å; R60-P125 HydrophobicContact CB-CG 3.85Å; R60-P125 WeakPolarHBondContact O-CG 3.28Å; R60-G126 PolarHBondContact NH1-O 3.26Å; R60-D127 IonicContact CZ-OD1 3.4Å; R60-D127 IonicContact NE-OD1 2.78Å; R60-D127 PolarHBondContact NE-OD1 3.06Å; R60-D127 IonicContact NH2-OD1 3.72Å; R60-D127 PolarHBondContact NH2-OD1 3.4Å
61Q82.1Confident86.1Confident11 Ų1163.7 Ų63.75%0.05131%0.314CS..  trans-71.8152.4-180-67.3177.718.200110.8Y14 C58 L87 P125Y14-Q61 HydrophobicContact CD2-CB 3.98Å; Y14-Q61 WeakPolarHBondContact CE2-O 3.45Å; Y14-Q61 HydrophobicContact CG-CB 4.37Å; C58-Q61 PolarHBondContact O-N 2.97Å; Q61-L87 PolarHBondContact NE2-O 2.85Å; Q61-P125 HydrophobicContact CG-CG 4.36Å
62S85Confident85.8Confident31 Ų3159.6 Ų59.622%0.21730%0.3CS..  trans-119.4159.3173.993.10000109.7E64 I65 V66S62-E64 VanDerWaalsContact CB-OE2 3.27Å; S62-E64 WeakPolarHBondContact CB-OE2 3.06Å; S62-E64 PolarHBondContact O-N 2.69Å; S62-E64 PolarHBondContact OG-N 3.38Å; S62-E64 PolarHBondContact OG-OE2 3.02Å; S62-I65 PolarHBondContact O-N 3.07Å; S62-I65 VanDerWaalsContact O-N 3.17Å; S62-I65 WeakPolarHBondContact OG-CG1 3.41Å; S62-I65 PolarHBondContact OG-N 3.05Å; S62-V66 WeakPolarHBondContact O-CG2 3.5Å; S62-V66 PolarHBondContact O-N 2.93Å
63P87.1Confident85.4Confident44 Ų4453 Ų5329%0.28627%0.274SS..Hα-helixtrans-66.2-22.9-18026.6-27.5000112.5Y14 K67Y14-P63 HydrophobicContact CE1-CB 4.24Å; Y14-P63 WeakPolarHBondContact OH-CD 3.42Å; P63-K67 WeakPolarHBondContact O-CG 3.23Å; P63-K67 PolarHBondContact O-N 3.47Å
64E88.5Confident84.9Confident124 Ų12459.3 Ų59.358%0.57931%0.305SS*.Hα-helixtrans-69.2-48.4172-5873-150.500110.5S62 V66 K67 E68S62-E64 VanDerWaalsContact CB-OE2 3.27Å; S62-E64 WeakPolarHBondContact CB-OE2 3.06Å; S62-E64 PolarHBondContact O-N 2.69Å; S62-E64 PolarHBondContact OG-N 3.38Å; S62-E64 PolarHBondContact OG-OE2 3.02Å; E64-V66 VanDerWaalsContact C-N 3.32Å; E64-V66 PolarHBondContact O-N 3.36Å; E64-K67 WeakPolarHBondContact O-CB 3.16Å; E64-K67 PolarHBondContact O-N 3.22Å; E64-K67 VanDerWaalsContact O-N 3.09Å; E64-E68 PolarHBondContact O-N 3.3Å
65I86.6Confident84.5Confident36 Ų3663.9 Ų63.919%0.18532%0.32CS..Hα-helixtrans-59-43.2178.8-66169.2000111.1S62 K67 E68 F69 V123 L124 P125S62-I65 PolarHBondContact O-N 3.07Å; S62-I65 VanDerWaalsContact O-N 3.17Å; S62-I65 WeakPolarHBondContact OG-CG1 3.41Å; S62-I65 PolarHBondContact OG-N 3.05Å; I65-K67 VanDerWaalsContact C-N 3.3Å; I65-K67 PolarHBondContact O-N 3.04Å; I65-E68 PolarHBondContact O-N 3.42Å; I65-F69 VanDerWaalsContact O-CB 3.3Å; I65-F69 WeakPolarHBondContact O-CB 3.3Å; I65-F69 PolarHBondContact O-N 2.93Å; I65-V123 HydrophobicContact CG2-CG1 4.05Å; I65-V123 WeakPolarHBondContact CG2-O 3.32Å; I65-L124 HydrophobicContact CG2-CD2 3.82Å; I65-P125 HydrophobicContact CD1-CG 4.31Å
66V88Confident84.1Confident18 Ų1856.8 Ų56.811%0.10929%0.289CS..Hα-helixtrans-61.1-40.1177.5175.80000111.5Y14 S62 E64 L70 L87Y14-V66 HydrophobicContact CD1-CG2 3.89Å; Y14-V66 HydrophobicContact CE1-CG2 4.42Å; Y14-V66 HydrophobicContact CG-CG2 4.26Å; S62-V66 WeakPolarHBondContact O-CG2 3.5Å; S62-V66 PolarHBondContact O-N 2.93Å; E64-V66 VanDerWaalsContact C-N 3.32Å; E64-V66 PolarHBondContact O-N 3.36Å; V66-L70 HydrophobicContact CG1-CD1 4.2Å; V66-L70 WeakPolarHBondContact O-CB 3.43Å; V66-L70 VanDerWaalsContact O-CG 3.27Å; V66-L70 WeakPolarHBondContact O-CG 3.49Å; V66-L70 PolarHBondContact O-N 2.92Å; V66-L87 HydrophobicContact CG1-CD2 3.9Å; V66-L87 HydrophobicContact CG2-CD1 4.3Å
67K88.3Confident83.9Confident146 Ų14664.5 Ų64.564%0.63532%0.321SS*.Hα-helixtrans-69.7-41178.1-74174.6-177.1174.50112P63 E64 I65 L70 S71P63-K67 WeakPolarHBondContact O-CG 3.23Å; P63-K67 PolarHBondContact O-N 3.47Å; E64-K67 WeakPolarHBondContact O-CB 3.16Å; E64-K67 PolarHBondContact O-N 3.22Å; E64-K67 VanDerWaalsContact O-N 3.09Å; I65-K67 VanDerWaalsContact C-N 3.3Å; I65-K67 PolarHBondContact O-N 3.04Å; K67-L70 PolarHBondContact O-N 3.46Å; K67-S71 WeakPolarHBondContact O-CB 3.34Å; K67-S71 PolarHBondContact O-N 3.43Å; K67-S71 PolarHBondContact O-OG 3.38Å
68E88.8Confident84.2Confident117 Ų11764.4 Ų64.455%0.54732%0.319SS..Hα-helixtrans-61.7-47.9176.4-176.8167.5-163.600110.4E64 I65 L70 S71 S72 V123E64-E68 PolarHBondContact O-N 3.3Å; I65-E68 PolarHBondContact O-N 3.42Å; E68-L70 PolarHBondContact O-N 2.84Å; E68-S71 WeakPolarHBondContact O-CA 3.3Å; E68-S71 WeakPolarHBondContact O-CB 3.43Å; E68-S71 PolarHBondContact O-N 3.29Å; E68-S72 PolarHBondContact O-N 3.03Å; E68-S72 PolarHBondContact O-OG 2.99Å; E68-V123 HydrophobicContact CB-CG1 4.29Å; E68-V123 HydrophobicContact CG-CG1 4.13Å; E68-V123 HydrophobicContact CG-CG2 4.48Å
69F88.4Confident84.5Confident0 Ų067.5 Ų67.50%034%0.338CS..Hα-helixtrans-55.9-48174.3-179.3-96.6000112.3I65 S71 S72 M73 L86 L87 V120 V123 L124I65-F69 VanDerWaalsContact O-CB 3.3Å; I65-F69 WeakPolarHBondContact O-CB 3.3Å; I65-F69 PolarHBondContact O-N 2.93Å; F69-S71 PolarHBondContact O-N 3.49Å; F69-S72 PolarHBondContact O-N 3.4Å; F69-S72 PolarHBondContact O-OG 3.03Å; F69-M73 HydrophobicContact CD1-CG 4.17Å; F69-M73 HydrophobicContact CD2-CE 4.19Å; F69-M73 HydrophobicContact CD2-CG 4.33Å; F69-M73 HydrophobicContact CE1-CG 3.83Å; F69-M73 HydrophobicContact CE2-CE 3.37Å; F69-M73 HydrophobicContact CE2-CG 4.01Å; F69-M73 HydrophobicContact CE2-SD 4.45Å; F69-M73 HydrophobicContact CG-CG 4.4Å; F69-M73 HydrophobicContact CZ-CE 3.62Å; F69-M73 HydrophobicContact CZ-CG 3.74Å; F69-M73 HydrophobicContact CZ-SD 4.25Å; F69-M73 VanDerWaalsContact O-CB 3.23Å; F69-M73 WeakPolarHBondContact O-CB 3.26Å; F69-M73 WeakPolarHBondContact O-CG 3.21Å; F69-M73 PolarHBondContact O-N 3.35Å; F69-L86 HydrophobicContact CE1-CB 4.46Å; F69-L86 HydrophobicContact CZ-CB 3.82Å; F69-L87 HydrophobicContact CD1-CB 4.17Å; F69-L87 HydrophobicContact CD1-CD1 3.82Å; F69-L87 HydrophobicContact CE1-CB 3.82Å; F69-L87 HydrophobicContact CE1-CD1 4.27Å; F69-L87 HydrophobicContact CG-CD1 4.18Å; F69-V120 HydrophobicContact CE2-CG2 3.85Å; F69-V120 HydrophobicContact CZ-CG2 4.44Å; F69-V123 HydrophobicContact CB-CG1 3.92Å; F69-L124 HydrophobicContact CB-CD2 4.27Å; F69-L124 HydrophobicContact CD2-CD1 4.1Å; F69-L124 HydrophobicContact CD2-CD2 3.98Å; F69-L124 HydrophobicContact CD2-CG 3.93Å; F69-L124 HydrophobicContact CE2-CD1 3.96Å; F69-L124 HydrophobicContact CE2-CG 4.25Å; F69-L124 HydrophobicContact CG-CD2 4.19Å
70L87.4Confident84.9Confident75 Ų7573.9 Ų73.939%0.39336%0.361SS..Hα-helixtrans-64.5-29.4178.4-72.2173.6000112.6V66 K67 E68 M74V66-L70 HydrophobicContact CG1-CD1 4.2Å; V66-L70 WeakPolarHBondContact O-CB 3.43Å; V66-L70 VanDerWaalsContact O-CG 3.27Å; V66-L70 WeakPolarHBondContact O-CG 3.49Å; V66-L70 PolarHBondContact O-N 2.92Å; K67-L70 PolarHBondContact O-N 3.46Å; E68-L70 PolarHBondContact O-N 2.84Å; L70-M74 WeakPolarHBondContact O-CG 3.47Å; L70-M74 PolarHBondContact O-N 2.9Å
71S87.7Confident85.4Confident68 Ų6870.6 Ų70.648%0.47636%0.357SS..Hα-helixtrans-76.5-44.4179.7-57.30000111.9K67 E68 F69 M73 M74K67-S71 WeakPolarHBondContact O-CB 3.34Å; K67-S71 PolarHBondContact O-N 3.43Å; K67-S71 PolarHBondContact O-OG 3.38Å; E68-S71 WeakPolarHBondContact O-CA 3.3Å; E68-S71 WeakPolarHBondContact O-CB 3.43Å; E68-S71 PolarHBondContact O-N 3.29Å; F69-S71 PolarHBondContact O-N 3.49Å; S71-M73 VanDerWaalsContact C-N 3.29Å; S71-M73 PolarHBondContact O-N 3.39Å; S71-M74 WeakPolarHBondContact O-CB 3.4Å; S71-M74 PolarHBondContact O-N 3.27Å
72S85.1Confident85.7Confident27 Ų2770.7 Ų70.719%0.18936%0.358CS..Hα-helixtrans-62.1-41.4173.955.50000110.8E68 F69 M74 H75E68-S72 PolarHBondContact O-N 3.03Å; E68-S72 PolarHBondContact O-OG 2.99Å; F69-S72 PolarHBondContact O-N 3.4Å; F69-S72 PolarHBondContact O-OG 3.03Å; S72-M74 PolarHBondContact O-N 3.11Å; S72-M74 VanDerWaalsContact O-N 3.11Å; S72-H75 PolarHBondContact O-ND1 2.95Å
73M83.1Confident85.9Confident0 Ų071 Ų710%036%0.355CS..THydrogen-bonded Turntrans-70.7-1.4177.6-65.6-66.6169.300115.1F69 S71 H75 L78 K83 L86 L116 V120F69-M73 HydrophobicContact CD1-CG 4.17Å; F69-M73 HydrophobicContact CD2-CE 4.19Å; F69-M73 HydrophobicContact CD2-CG 4.33Å; F69-M73 HydrophobicContact CE1-CG 3.83Å; F69-M73 HydrophobicContact CE2-CE 3.37Å; F69-M73 HydrophobicContact CE2-CG 4.01Å; F69-M73 HydrophobicContact CE2-SD 4.45Å; F69-M73 HydrophobicContact CG-CG 4.4Å; F69-M73 HydrophobicContact CZ-CE 3.62Å; F69-M73 HydrophobicContact CZ-CG 3.74Å; F69-M73 HydrophobicContact CZ-SD 4.25Å; F69-M73 VanDerWaalsContact O-CB 3.23Å; F69-M73 WeakPolarHBondContact O-CB 3.26Å; F69-M73 WeakPolarHBondContact O-CG 3.21Å; F69-M73 PolarHBondContact O-N 3.35Å; S71-M73 VanDerWaalsContact C-N 3.29Å; S71-M73 PolarHBondContact O-N 3.39Å; M73-H75 VanDerWaalsContact C-N 3.31Å; M73-L78 HydrophobicContact SD-CD1 4.17Å; M73-K83 HydrophobicContact CB-CD 4.4Å; M73-K83 HydrophobicContact CB-CG 4.47Å; M73-K83 WeakPolarHBondContact O-CE 3.36Å; M73-K83 PolarHBondContact O-NZ 3.21Å; M73-L86 HydrophobicContact SD-CD1 4.47Å; M73-L116 HydrophobicContact CE-CD1 3.46Å; M73-L116 VanDerWaalsContact CE-CD1 3.46Å; M73-L116 HydrophobicContact CE-CG 3.97Å; M73-L116 HydrophobicContact SD-CD1 3.24Å; M73-L116 WeakPolarHBondContact SD-CD1 3.45Å; M73-L116 HydrophobicContact SD-CG 4.31Å; M73-V120 HydrophobicContact CE-CG2 3.54Å
74M80.7Confident86.1Confident139 Ų13970.7 Ų70.769%0.68535%0.351SS*.THydrogen-bonded Turntrans-70.5-29.1176.1-68.6-167.266.600112.9L70 S71 S72L70-M74 WeakPolarHBondContact O-CG 3.47Å; L70-M74 PolarHBondContact O-N 2.9Å; S71-M74 WeakPolarHBondContact O-CB 3.4Å; S71-M74 PolarHBondContact O-N 3.27Å; S72-M74 PolarHBondContact O-N 3.11Å; S72-M74 VanDerWaalsContact O-N 3.11Å
75H77.3Confident86.2Confident158 Ų15868.8 Ų68.873%0.73134%0.342SS*.SBendtrans-73.9-31.1-176.4-52.988.3000111.7S72 M73S72-H75 PolarHBondContact O-ND1 2.95Å; M73-H75 VanDerWaalsContact C-N 3.31Å
76H77.9Confident86.3Confident9 Ų967.1 Ų67.14%0.04233%0.333CS..SBendtrans-78.8135.4173.7-54.1-78.4000110.4L78 L116H76-L78 HydrophobicContact CB-CD1 3.97Å; H76-L78 HydrophobicContact CB-CG 3.91Å; H76-L78 PolarHBondContact O-N 3.3Å; H76-L116 HydrophobicContact CB-CD1 4.45Å
77K81Confident86.3Confident181 Ų18166.5 Ų66.579%0.78733%0.329SS*.  trans-7556.4177.5-69.3-176.9-1801730111.8R107K77-R107 PolarHBondContact O-NH2 2.92Å
78L85.3Confident86.3Confident16 Ų1660.3 Ų60.38%0.08430%0.303CS..  trans-95.9144.1179.2-62172.8000111.5M73 H76 E82 K83 L86 V101 L108 L116M73-L78 HydrophobicContact SD-CD1 4.17Å; H76-L78 HydrophobicContact CB-CD1 3.97Å; H76-L78 HydrophobicContact CB-CG 3.91Å; H76-L78 PolarHBondContact O-N 3.3Å; L78-E82 WeakPolarHBondContact CA-OE2 3.35Å; L78-E82 HydrophobicContact CB-CB 4.27Å; L78-E82 HydrophobicContact CD2-CB 4.4Å; L78-E82 WeakPolarHBondContact CD2-OE2 3.37Å; L78-K83 HydrophobicContact CB-CD 4.47Å; L78-K83 HydrophobicContact CB-CG 3.85Å; L78-K83 HydrophobicContact CD1-CG 4.44Å; L78-K83 VanDerWaalsContact O-CE 3.31Å; L78-K83 WeakPolarHBondContact O-CE 3.41Å; L78-L86 HydrophobicContact CD1-CD1 3.58Å; L78-V101 HydrophobicContact CD2-CG1 3.91Å; L78-V101 HydrophobicContact CD2-CG2 3.86Å; L78-L108 HydrophobicContact CD2-CD1 4.23Å; L78-L116 HydrophobicContact CD1-CD1 4.12Å; L78-L116 HydrophobicContact CD1-CD2 4.47Å
79T88.5Confident86.2Confident64 Ų6460.2 Ų60.239%0.39330%0.303SS..  trans-72.2164.6173.274.40000110.9A81 E82 K83T79-A81 VanDerWaalsContact C-N 3.25Å; T79-A81 PolarHBondContact O-N 2.87Å; T79-E82 PolarHBondContact N-OE2 3.36Å; T79-E82 PolarHBondContact O-N 3.32Å; T79-E82 VanDerWaalsContact OG1-CD 3.24Å; T79-E82 VanDerWaalsContact OG1-CG 3.26Å; T79-E82 WeakPolarHBondContact OG1-CG 3.31Å; T79-E82 PolarHBondContact OG1-N 2.89Å; T79-E82 PolarHBondContact OG1-OE2 3.44Å; T79-K83 WeakPolarHBondContact O-CG 3.37Å; T79-K83 PolarHBondContact O-N 2.91Å
80K87.4Confident86.1Confident176 Ų17661.3 Ų61.377%0.76531%0.307SS*.Hα-helixtrans-62.5-34.6177.7-67.4-176.4-179.31790112.4M10 L84M10-K80 HydrophobicContact SD-CB 4.47Å; K80-L84 WeakPolarHBondContact O-CB 3.31Å; K80-L84 PolarHBondContact O-N 3.27Å; K80-L84 VanDerWaalsContact O-N 3.1Å
81A88.4Confident86Confident42 Ų4257.9 Ų57.935%0.34729%0.289SS..Hα-helixtrans-70.4-43.117900000111.4M10 T79 L84 Q85M10-A81 HydrophobicContact CE-CB 4.19Å; M10-A81 HydrophobicContact SD-CB 4.5Å; T79-A81 VanDerWaalsContact C-N 3.25Å; T79-A81 PolarHBondContact O-N 2.87Å; A81-L84 WeakPolarHBondContact O-CB 3.19Å; A81-L84 PolarHBondContact O-N 2.99Å; A81-Q85 WeakPolarHBondContact O-CG 3.19Å; A81-Q85 PolarHBondContact O-N 2.82Å
82E89.8Confident85.8Confident13 Ų1357.7 Ų57.76%0.06128%0.28CS..Hα-helixtrans-59.9-49.9175.4-70.8160.8-170.200110.7L78 T79 L84 Q85 L86 V101 R107L78-E82 WeakPolarHBondContact CA-OE2 3.35Å; L78-E82 HydrophobicContact CB-CB 4.27Å; L78-E82 HydrophobicContact CD2-CB 4.4Å; L78-E82 WeakPolarHBondContact CD2-OE2 3.37Å; T79-E82 PolarHBondContact N-OE2 3.36Å; T79-E82 PolarHBondContact O-N 3.32Å; T79-E82 VanDerWaalsContact OG1-CD 3.24Å; T79-E82 VanDerWaalsContact OG1-CG 3.26Å; T79-E82 WeakPolarHBondContact OG1-CG 3.31Å; T79-E82 PolarHBondContact OG1-N 2.89Å; T79-E82 PolarHBondContact OG1-OE2 3.44Å; E82-L84 PolarHBondContact O-N 3.38Å; E82-Q85 PolarHBondContact O-N 3.47Å; E82-Q85 VanDerWaalsContact O-N 3.11Å; E82-L86 VanDerWaalsContact O-CG 3.32Å; E82-L86 WeakPolarHBondContact O-CG 3.43Å; E82-L86 PolarHBondContact O-N 2.78Å; E82-V101 HydrophobicContact CB-CG2 4.36Å; E82-V101 HydrophobicContact CG-CG1 4.5Å; E82-V101 HydrophobicContact CG-CG2 4.24Å; E82-R107 IonicContact OE1-CZ 2.73Å; E82-R107 IonicContact OE1-NH1 2.96Å; E82-R107 PolarHBondContact OE1-NH1 2.9Å; E82-R107 IonicContact OE1-NH2 3.78Å; E82-R107 PolarHBondContact OE1-NH2 3.48Å; E82-R107 IonicContact OE2-CZ 3.21Å; E82-R107 IonicContact OE2-NH1 3.56Å; E82-R107 IonicContact OE2-NH2 3.35Å; E82-R107 PolarHBondContact OE2-NH2 3.11Å
83K89.6Confident85.7Confident37 Ų3759.5 Ų59.516%0.16129%0.291CS..Hα-helixtrans-56.9-39.1176.3-69.1179.1-175-168.10112.4M73 L78 T79 L87M73-K83 HydrophobicContact CB-CD 4.4Å; M73-K83 HydrophobicContact CB-CG 4.47Å; M73-K83 WeakPolarHBondContact O-CE 3.36Å; M73-K83 PolarHBondContact O-NZ 3.21Å; L78-K83 HydrophobicContact CB-CD 4.47Å; L78-K83 HydrophobicContact CB-CG 3.85Å; L78-K83 HydrophobicContact CD1-CG 4.44Å; L78-K83 VanDerWaalsContact O-CE 3.31Å; L78-K83 WeakPolarHBondContact O-CE 3.41Å; T79-K83 WeakPolarHBondContact O-CG 3.37Å; T79-K83 PolarHBondContact O-N 2.91Å; K83-L87 WeakPolarHBondContact O-CB 3.27Å; K83-L87 PolarHBondContact O-N 2.73Å
84L90.7Very high85.8Confident39 Ų3961.5 Ų61.520%0.20431%0.307CS..Hα-helixtrans-68-41.8177.9-17370.3000112M10 K80 A81 E82 L87 N88M10-L84 HydrophobicContact CB-CD2 3.86Å; M10-L84 HydrophobicContact CG-CD2 4.35Å; M10-L84 HydrophobicContact SD-CD2 4.33Å; K80-L84 WeakPolarHBondContact O-CB 3.31Å; K80-L84 PolarHBondContact O-N 3.27Å; K80-L84 VanDerWaalsContact O-N 3.1Å; A81-L84 WeakPolarHBondContact O-CB 3.19Å; A81-L84 PolarHBondContact O-N 2.99Å; E82-L84 PolarHBondContact O-N 3.38Å; L84-L87 PolarHBondContact O-N 3.23Å; L84-N88 WeakPolarHBondContact O-CB 3.18Å; L84-N88 PolarHBondContact O-N 2.89Å; L84-N88 PolarHBondContact O-ND2 3.24Å
85Q89.9Confident86.1Confident84 Ų8459.1 Ų59.139%0.39330%0.3SS..Hα-helixtrans-63.2-47176.3-76.5-177.2-42.300110.7A81 E82 L87 N88 H89 M100A81-Q85 WeakPolarHBondContact O-CG 3.19Å; A81-Q85 PolarHBondContact O-N 2.82Å; E82-Q85 PolarHBondContact O-N 3.47Å; E82-Q85 VanDerWaalsContact O-N 3.11Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; Q85-L87 PolarHBondContact O-N 2.96Å; Q85-N88 PolarHBondContact O-N 3.4Å; Q85-N88 VanDerWaalsContact O-N 3.1Å; Q85-H89 PolarHBondContact O-CD2 3.1Å; Q85-H89 PolarHBondContact O-N 2.77Å; Q85-M100 HydrophobicContact CB-CE 3.55Å; Q85-M100 WeakPolarHBondContact O-CE 3.4Å; Q85-M100 PolarHBondContact OE1-O 3.21Å; Q85-M100 VanDerWaalsContact OE1-O 3.08Å
86L88.7Confident86.5Confident0 Ų055.7 Ų55.70%028%0.284CS..Hα-helixtrans-57.2-45.1176.7-64.1174000111.3F69 M73 L78 E82 N88 R90 P91 I97 M100 L116F69-L86 HydrophobicContact CE1-CB 4.46Å; F69-L86 HydrophobicContact CZ-CB 3.82Å; M73-L86 HydrophobicContact SD-CD1 4.47Å; L78-L86 HydrophobicContact CD1-CD1 3.58Å; E82-L86 VanDerWaalsContact O-CG 3.32Å; E82-L86 WeakPolarHBondContact O-CG 3.43Å; E82-L86 PolarHBondContact O-N 2.78Å; L86-N88 VanDerWaalsContact C-N 3.3Å; L86-N88 PolarHBondContact O-N 3.11Å; L86-R90 WeakPolarHBondContact O-CA 3.14Å; L86-R90 PolarHBondContact O-N 3.05Å; L86-P91 HydrophobicContact CD2-CG 3.53Å; L86-I97 HydrophobicContact CD2-CG1 4.39Å; L86-M100 HydrophobicContact CD2-CE 4.08Å; L86-M100 HydrophobicContact CD2-SD 4.29Å; L86-L116 HydrophobicContact CD1-CD2 4.05Å
87L88.7Confident86.9Confident5 Ų555.2 Ų55.23%0.02628%0.282CS..Hα-helixtrans-61.6-37.3176.9-179.463.9000113Q61 V66 F69 K83 L84 Q85 L124Q61-L87 PolarHBondContact NE2-O 2.85Å; V66-L87 HydrophobicContact CG1-CD2 3.9Å; V66-L87 HydrophobicContact CG2-CD1 4.3Å; F69-L87 HydrophobicContact CD1-CB 4.17Å; F69-L87 HydrophobicContact CD1-CD1 3.82Å; F69-L87 HydrophobicContact CE1-CB 3.82Å; F69-L87 HydrophobicContact CE1-CD1 4.27Å; F69-L87 HydrophobicContact CG-CD1 4.18Å; K83-L87 WeakPolarHBondContact O-CB 3.27Å; K83-L87 PolarHBondContact O-N 2.73Å; L84-L87 PolarHBondContact O-N 3.23Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; Q85-L87 PolarHBondContact O-N 2.96Å; L87-L124 HydrophobicContact CD1-CD2 3.91Å
88N88.7Confident87Confident16 Ų1650.5 Ų50.59%0.08626%0.263CS..Hα-helixtrans-80.7-33.3-175.3-77-16.4000113.5N13 L84 Q85 L86N13-N88 VanDerWaalsContact CB-OD1 3.31Å; N13-N88 WeakPolarHBondContact CB-OD1 3.45Å; N13-N88 VanDerWaalsContact CG-CG 3.44Å; N13-N88 PolarHBondContact N-OD1 3.11Å; L84-N88 WeakPolarHBondContact O-CB 3.18Å; L84-N88 PolarHBondContact O-N 2.89Å; L84-N88 PolarHBondContact O-ND2 3.24Å; Q85-N88 PolarHBondContact O-N 3.4Å; Q85-N88 VanDerWaalsContact O-N 3.1Å; L86-N88 VanDerWaalsContact C-N 3.3Å; L86-N88 PolarHBondContact O-N 3.11Å
89H85.4Confident87.1Confident115 Ų11556.7 Ų56.753%0.53230%0.296SS..Hα-helixtrans-107.3-20.2-172.2-69.8-75.9000114.3Q85 M100Q85-H89 PolarHBondContact O-CD2 3.1Å; Q85-H89 PolarHBondContact O-N 2.77Å; H89-M100 HydrophobicContact CB-CE 3.73Å; H89-M100 HydrophobicContact CB-SD 4.45Å
90R86.8Confident87Confident23 Ų2355 Ų559%0.08728%0.283CS..  trans48.472-178.3-172.2-176.2-175.5-106.92.1111.4P57 L86 V120 A121 L124 G126P57-R90 HydrophobicContact CB-CB 4.39Å; P57-R90 HydrophobicContact CG-CB 4.09Å; L86-R90 WeakPolarHBondContact O-CA 3.14Å; L86-R90 PolarHBondContact O-N 3.05Å; R90-V120 HydrophobicContact CB-CG1 4.39Å; R90-V120 HydrophobicContact CG-CG1 3.69Å; R90-A121 PolarHBondContact NH2-O 3.02Å; R90-A121 VanDerWaalsContact NH2-O 3.07Å; R90-L124 HydrophobicContact CB-CD1 4.11Å; R90-L124 HydrophobicContact CG-CB 4.05Å; R90-L124 HydrophobicContact CG-CD1 4.07Å; R90-L124 PolarHBondContact NE-O 3.29Å; R90-L124 PolarHBondContact NH2-O 3.36Å; R90-G126 VanDerWaalsContact NH1-CA 3.26Å
91P85.7Confident86.9Confident3 Ų346.6 Ų46.62%0.01925%0.247CC..  trans-63.2142.9-178.828-36.2000111.5L86 E96 I97 M100 V120L86-P91 HydrophobicContact CD2-CG 3.53Å; P91-E96 WeakPolarHBondContact CA-OE2 3.49Å; P91-E96 HydrophobicContact CB-CB 3.73Å; P91-I97 HydrophobicContact CB-CG1 4Å; P91-I97 HydrophobicContact CG-CG1 3.87Å; P91-M100 HydrophobicContact CB-SD 4.13Å; P91-M100 HydrophobicContact CG-SD 4.26Å; P91-V120 HydrophobicContact CG-CG1 4.5Å
92Q82.1Confident86.6Confident64 Ų6452.1 Ų52.130%0.29927%0.266SS..  trans-110.3-16.1178.9-62.3-172.6-5.500112.5E96 I117Q92-E96 PolarHBondContact N-OE2 3.09Å; Q92-I117 WeakPolarHBondContact O-CG2 3.44Å
93T84.9Confident86.2Confident66 Ų6658 Ų5841%0.40529%0.293SS..SBendtrans-126.5153.8-175.766.90000111.5V95 E96 I97T93-V95 PolarHBondContact O-N 2.8Å; T93-E96 PolarHBondContact O-N 3.07Å; T93-E96 WeakPolarHBondContact OG1-CG 3.27Å; T93-E96 PolarHBondContact OG1-N 3.17Å; T93-I97 PolarHBondContact O-N 2.89Å
94A84.3Confident85.6Confident41 Ų4156.6 Ų56.634%0.33929%0.288SS..Hα-helixtrans-60.5-34.1175.800000112.1E96 I97 Q98 I113 I117A94-E96 VanDerWaalsContact C-N 3.33Å; A94-E96 PolarHBondContact O-N 3.39Å; A94-I97 PolarHBondContact O-N 2.66Å; A94-Q98 WeakPolarHBondContact O-CG 3.48Å; A94-Q98 PolarHBondContact O-N 3.37Å; A94-I113 HydrophobicContact CB-CG2 3.89Å; A94-I117 HydrophobicContact CB-CD1 4.16Å
95V86.3Confident84.8Confident90 Ų9062 Ų6255%0.54531%0.312SS..Hα-helixtrans-62.2-41177.7-177.90000111.2T93 I97 Q98 L99T93-V95 PolarHBondContact O-N 2.8Å; V95-I97 VanDerWaalsContact C-N 3.33Å; V95-I97 PolarHBondContact O-N 3.29Å; V95-Q98 PolarHBondContact O-N 3.25Å; V95-L99 HydrophobicContact CG1-CD1 4.48Å; V95-L99 WeakPolarHBondContact O-CG 3.19Å; V95-L99 PolarHBondContact O-N 3.4Å; V95-L99 VanDerWaalsContact O-N 3.12Å
96E85.9Confident84.3Confident85 Ų8566 Ų6640%0.39733%0.33SS..Hα-helixtrans-64.3-39.3176.1-72.7173.7168.700111.8P91 Q92 T93 A94 L99 M100P91-E96 WeakPolarHBondContact CA-OE2 3.49Å; P91-E96 HydrophobicContact CB-CB 3.73Å; Q92-E96 PolarHBondContact N-OE2 3.09Å; T93-E96 PolarHBondContact O-N 3.07Å; T93-E96 WeakPolarHBondContact OG1-CG 3.27Å; T93-E96 PolarHBondContact OG1-N 3.17Å; A94-E96 VanDerWaalsContact C-N 3.33Å; A94-E96 PolarHBondContact O-N 3.39Å; E96-L99 PolarHBondContact O-N 3Å; E96-M100 WeakPolarHBondContact O-CG 3.38Å; E96-M100 PolarHBondContact O-N 2.74Å; E96-M100 VanDerWaalsContact O-N 3.1Å
97I85.9Confident83.8Confident0 Ų069.9 Ų69.90%035%0.345CS..Hα-helixtrans-64.2-41.9176.3-68.1164.7000111L86 P91 T93 A94 V95 L99 M100 V101 I113 L116 I117L86-I97 HydrophobicContact CD2-CG1 4.39Å; P91-I97 HydrophobicContact CB-CG1 4Å; P91-I97 HydrophobicContact CG-CG1 3.87Å; T93-I97 PolarHBondContact O-N 2.89Å; A94-I97 PolarHBondContact O-N 2.66Å; V95-I97 VanDerWaalsContact C-N 3.33Å; V95-I97 PolarHBondContact O-N 3.29Å; I97-L99 PolarHBondContact O-N 2.93Å; I97-M100 PolarHBondContact O-N 3.02Å; I97-M100 VanDerWaalsContact O-N 3.07Å; I97-V101 HydrophobicContact CG2-CG2 4.12Å; I97-V101 WeakPolarHBondContact O-CB 3.43Å; I97-V101 PolarHBondContact O-N 3.37Å; I97-I113 HydrophobicContact CD1-CG2 4Å; I97-L116 HydrophobicContact CD1-CB 4.42Å; I97-L116 HydrophobicContact CD1-CD2 3.92Å; I97-L116 HydrophobicContact CG1-CD2 4.31Å; I97-L116 HydrophobicContact CG2-CD2 4.05Å; I97-I117 HydrophobicContact CD1-CD1 3.91Å; I97-I117 HydrophobicContact CD1-CG1 3.23Å
98Q84.5Confident83.4Confident81 Ų8170.2 Ų70.238%0.37935%0.347SS..Hα-helixtrans-60.6-32.8175.6-70.3172.9-10.400112.6A94 V95 S104A94-Q98 WeakPolarHBondContact O-CG 3.48Å; A94-Q98 PolarHBondContact O-N 3.37Å; V95-Q98 PolarHBondContact O-N 3.25Å; Q98-S104 WeakPolarHBondContact CG-OG 3.32Å
99L86.6Confident83.2Confident147 Ų14772 Ų7277%0.7736%0.361SS*.Hα-helixtrans-77-23.1176-66.7172.8000113.2V95 E96 I97V95-L99 HydrophobicContact CG1-CD1 4.48Å; V95-L99 WeakPolarHBondContact O-CG 3.19Å; V95-L99 PolarHBondContact O-N 3.4Å; V95-L99 VanDerWaalsContact O-N 3.12Å; E96-L99 PolarHBondContact O-N 3Å; I97-L99 PolarHBondContact O-N 2.93Å
100M86.9Confident83Confident27 Ų2774.4 Ų74.413%0.13337%0.372CS..Hα-helixtrans-97.9-28.6-176.8-65.6169.278.900113Q85 L86 H89 P91 E96 I97Q85-M100 HydrophobicContact CB-CE 3.55Å; Q85-M100 WeakPolarHBondContact O-CE 3.4Å; Q85-M100 PolarHBondContact OE1-O 3.21Å; Q85-M100 VanDerWaalsContact OE1-O 3.08Å; L86-M100 HydrophobicContact CD2-CE 4.08Å; L86-M100 HydrophobicContact CD2-SD 4.29Å; H89-M100 HydrophobicContact CB-CE 3.73Å; H89-M100 HydrophobicContact CB-SD 4.45Å; P91-M100 HydrophobicContact CB-SD 4.13Å; P91-M100 HydrophobicContact CG-SD 4.26Å; E96-M100 WeakPolarHBondContact O-CG 3.38Å; E96-M100 PolarHBondContact O-N 2.74Å; E96-M100 VanDerWaalsContact O-N 3.1Å; I97-M100 PolarHBondContact O-N 3.02Å; I97-M100 VanDerWaalsContact O-N 3.07Å
101V85.1Confident82.9Confident1 Ų180.8 Ų80.81%0.00640%0.403CS..SBendtrans-112.2113.5-178.4-1790000109.1L78 E82 I97 S104 L108L78-V101 HydrophobicContact CD2-CG1 3.91Å; L78-V101 HydrophobicContact CD2-CG2 3.86Å; E82-V101 HydrophobicContact CB-CG2 4.36Å; E82-V101 HydrophobicContact CG-CG1 4.5Å; E82-V101 HydrophobicContact CG-CG2 4.24Å; I97-V101 HydrophobicContact CG2-CG2 4.12Å; I97-V101 WeakPolarHBondContact O-CB 3.43Å; I97-V101 PolarHBondContact O-N 3.37Å; V101-S104 WeakPolarHBondContact O-CB 3.45Å; V101-S104 PolarHBondContact O-N 3.18Å; V101-L108 HydrophobicContact CG1-CD1 4.35Å
102E83.1Confident82.8Confident158 Ų15884 Ų8474%0.73842%0.418SS*.THydrogen-bonded Turntrans-65136.2176.4-66.9-179.1178.400111S104 R107E102-S104 PolarHBondContact O-N 2.89Å; E102-R107 PolarHBondContact O-NH1 3.41Å; E102-R107 VanDerWaalsContact O-NH1 3.14Å
103E80.5Confident83Confident137 Ų13781.6 Ų81.664%0.6441%0.407SS*.THydrogen-bonded Turntrans54.637179.9-58.9173171.400112.3E105 E106 R107E103-E105 PolarHBondContact O-N 3.41Å; E103-E106 PolarHBondContact O-N 2.97Å; E103-E106 VanDerWaalsContact O-N 3.11Å; E103-R107 WeakPolarHBondContact O-CG 3.24Å; E103-R107 PolarHBondContact O-N 3.49Å; E103-R107 VanDerWaalsContact O-N 3.09Å
104S77.1Confident83Confident6 Ų685.2 Ų85.24%0.04242%0.419CS..Hα-helixtrans-57.2-35.1-176.862.30000113.1Q98 V101 E102 E106 R107 L108Q98-S104 WeakPolarHBondContact CG-OG 3.32Å; V101-S104 WeakPolarHBondContact O-CB 3.45Å; V101-S104 PolarHBondContact O-N 3.18Å; E102-S104 PolarHBondContact O-N 2.89Å; S104-E106 VanDerWaalsContact C-N 3.33Å; S104-E106 PolarHBondContact O-N 2.95Å; S104-R107 PolarHBondContact O-N 3.41Å; S104-L108 WeakPolarHBondContact O-CB 3.29Å; S104-L108 PolarHBondContact O-N 2.95Å
105E73.9Confident83.1Confident152 Ų15288.3 Ų88.371%0.7143%0.426SS*.Hα-helixtrans-68.5-27.7179.9-60.6-176.4170.200113.4E103E103-E105 PolarHBondContact O-N 3.41Å
106E78.7Confident83.1Confident168 Ų16884 Ų8479%0.78540%0.401SS*.Hα-helixtrans-88.6-27.1175.9-65.2-169.2-17700112E103 S104E103-E106 PolarHBondContact O-N 2.97Å; E103-E106 VanDerWaalsContact O-N 3.11Å; S104-E106 VanDerWaalsContact C-N 3.33Å; S104-E106 PolarHBondContact O-N 2.95Å
107R79.6Confident83.1Confident83 Ų8381.4 Ų81.431%0.31339%0.389SS..Hα-helixtrans-95.4-26.1-172.7-70.6173.360.7-164.1-4.7114.3K77 E82 E102 E103 S104K77-R107 PolarHBondContact O-NH2 2.92Å; E82-R107 IonicContact OE1-CZ 2.73Å; E82-R107 IonicContact OE1-NH1 2.96Å; E82-R107 PolarHBondContact OE1-NH1 2.9Å; E82-R107 IonicContact OE1-NH2 3.78Å; E82-R107 PolarHBondContact OE1-NH2 3.48Å; E82-R107 IonicContact OE2-CZ 3.21Å; E82-R107 IonicContact OE2-NH1 3.56Å; E82-R107 IonicContact OE2-NH2 3.35Å; E82-R107 PolarHBondContact OE2-NH2 3.11Å; E102-R107 PolarHBondContact O-NH1 3.41Å; E102-R107 VanDerWaalsContact O-NH1 3.14Å; E103-R107 WeakPolarHBondContact O-CG 3.24Å; E103-R107 PolarHBondContact O-N 3.49Å; E103-R107 VanDerWaalsContact O-N 3.09Å; S104-R107 PolarHBondContact O-N 3.41Å
108L79.8Confident83.1Confident12 Ų1286.5 Ų86.56%0.06341%0.413CS..SBendtrans-132.2138.8-174.5-62.3163000109.4L78 V101 S104 Q112 I113L78-L108 HydrophobicContact CD2-CD1 4.23Å; V101-L108 HydrophobicContact CG1-CD1 4.35Å; S104-L108 WeakPolarHBondContact O-CB 3.29Å; S104-L108 PolarHBondContact O-N 2.95Å; L108-Q112 HydrophobicContact CB-CB 4.44Å; L108-Q112 HydrophobicContact CD2-CB 4.34Å; L108-I113 HydrophobicContact CB-CD1 4.43Å; L108-I113 HydrophobicContact CB-CG1 4Å; L108-I113 HydrophobicContact CD1-CG1 4.49Å
109S84.1Confident83.2Confident54 Ų5484.6 Ų84.638%0.37841%0.405SS..  trans-75.7159.8168.961.80000111.1E111 Q112 I113S109-E111 VanDerWaalsContact C-N 3.25Å; S109-E111 PolarHBondContact O-N 2.95Å; S109-Q112 WeakPolarHBondContact O-CB 3.28Å; S109-Q112 PolarHBondContact O-N 2.99Å; S109-Q112 VanDerWaalsContact OG-CG 3.32Å; S109-Q112 WeakPolarHBondContact OG-CG 3.38Å; S109-Q112 PolarHBondContact OG-N 3.06Å; S109-I113 WeakPolarHBondContact O-CG1 3.4Å; S109-I113 PolarHBondContact O-N 3.34Å
110E81.8Confident83.1Confident165 Ų16577.6 Ų77.677%0.77137%0.369SS*.Hα-helixtrans-53.5-43.7173.7-72.6177.1171.700111.7Q112 I113 E114E110-Q112 VanDerWaalsContact C-N 3.29Å; E110-Q112 PolarHBondContact O-N 3.46Å; E110-I113 WeakPolarHBondContact O-CB 3.42Å; E110-I113 PolarHBondContact O-N 2.79Å; E110-I113 VanDerWaalsContact O-N 3.07Å; E110-E114 PolarHBondContact O-N 3.1Å
111E84.4Confident83Confident156 Ų15678.4 Ų78.473%0.72938%0.379SS*.Hα-helixtrans-58.9-38.9175.6-64179.7174.400112.5S109 I113 E114 E115S109-E111 VanDerWaalsContact C-N 3.25Å; S109-E111 PolarHBondContact O-N 2.95Å; E111-I113 VanDerWaalsContact C-N 3.33Å; E111-E114 PolarHBondContact O-N 3.41Å; E111-E115 WeakPolarHBondContact O-CB 3.41Å; E111-E115 PolarHBondContact O-N 3.46Å
112Q84.3Confident82.9Confident72 Ų7283.8 Ų83.834%0.33641%0.408SS..Hα-helixtrans-71.4-30.7177.3-74.9179.5-37.200112.3L108 S109 E110 L116L108-Q112 HydrophobicContact CB-CB 4.44Å; L108-Q112 HydrophobicContact CD2-CB 4.34Å; S109-Q112 WeakPolarHBondContact O-CB 3.28Å; S109-Q112 PolarHBondContact O-N 2.99Å; S109-Q112 VanDerWaalsContact OG-CG 3.32Å; S109-Q112 WeakPolarHBondContact OG-CG 3.38Å; S109-Q112 PolarHBondContact OG-N 3.06Å; E110-Q112 VanDerWaalsContact C-N 3.29Å; E110-Q112 PolarHBondContact O-N 3.46Å; Q112-L116 VanDerWaalsContact O-CB 3.29Å; Q112-L116 WeakPolarHBondContact O-CB 3.47Å; Q112-L116 PolarHBondContact O-N 3.41Å
113I84.8Confident83Confident12 Ų1277.3 Ų77.36%0.06238%0.38CS..Hα-helixtrans-69.8-45.5175.5-65.8168.9000109.4A94 I97 L108 S109 E110 E111 L116 I117A94-I113 HydrophobicContact CB-CG2 3.89Å; I97-I113 HydrophobicContact CD1-CG2 4Å; L108-I113 HydrophobicContact CB-CD1 4.43Å; L108-I113 HydrophobicContact CB-CG1 4Å; L108-I113 HydrophobicContact CD1-CG1 4.49Å; S109-I113 WeakPolarHBondContact O-CG1 3.4Å; S109-I113 PolarHBondContact O-N 3.34Å; E110-I113 WeakPolarHBondContact O-CB 3.42Å; E110-I113 PolarHBondContact O-N 2.79Å; E110-I113 VanDerWaalsContact O-N 3.07Å; E111-I113 VanDerWaalsContact C-N 3.33Å; I113-L116 VanDerWaalsContact O-CB 3.29Å; I113-L116 WeakPolarHBondContact O-CB 3.26Å; I113-L116 PolarHBondContact O-N 3.21Å; I113-I117 HydrophobicContact CG2-CD1 4.21Å; I113-I117 WeakPolarHBondContact O-CG1 3.49Å; I113-I117 PolarHBondContact O-N 3.4Å
114E85.2Confident83.1Confident142 Ų14270.9 Ų70.966%0.66435%0.349SS*.Hα-helixtrans-61.4-45174.6-75.6-178.9172.400111.9E110 E111 L116 I117 Q118E110-E114 PolarHBondContact O-N 3.1Å; E111-E114 PolarHBondContact O-N 3.41Å; E114-L116 VanDerWaalsContact C-N 3.25Å; E114-L116 PolarHBondContact O-N 3.13Å; E114-I117 PolarHBondContact O-N 2.79Å; E114-Q118 WeakPolarHBondContact O-CB 3.36Å; E114-Q118 PolarHBondContact O-N 2.87Å
115E86.6Confident83Confident106 Ų10672.4 Ų72.450%0.49536%0.359SS..Hα-helixtrans-59.4-38.6174.5-168.3-171.8178.900111.3E111 Q118 N119E111-E115 WeakPolarHBondContact O-CB 3.41Å; E111-E115 PolarHBondContact O-N 3.46Å; E115-Q118 PolarHBondContact O-N 3.17Å; E115-N119 VanDerWaalsContact O-CB 3.27Å; E115-N119 WeakPolarHBondContact O-CB 3.46Å; E115-N119 VanDerWaalsContact O-CG 3.22Å; E115-N119 PolarHBondContact O-N 2.96Å; E115-N119 PolarHBondContact O-ND2 2.91Å; E115-N119 VanDerWaalsContact O-ND2 3.15Å
116L86.4Confident82.5Confident0 Ų066.1 Ų66.10%034%0.335CS..Hα-helixtrans-62.9-46.9176.6-16277000111.5M73 H76 L78 L86 I97 Q112 I113 E114 Q118 N119 V120M73-L116 HydrophobicContact CE-CD1 3.46Å; M73-L116 VanDerWaalsContact CE-CD1 3.46Å; M73-L116 HydrophobicContact CE-CG 3.97Å; M73-L116 HydrophobicContact SD-CD1 3.24Å; M73-L116 WeakPolarHBondContact SD-CD1 3.45Å; M73-L116 HydrophobicContact SD-CG 4.31Å; H76-L116 HydrophobicContact CB-CD1 4.45Å; L78-L116 HydrophobicContact CD1-CD1 4.12Å; L78-L116 HydrophobicContact CD1-CD2 4.47Å; L86-L116 HydrophobicContact CD1-CD2 4.05Å; I97-L116 HydrophobicContact CD1-CB 4.42Å; I97-L116 HydrophobicContact CD1-CD2 3.92Å; I97-L116 HydrophobicContact CG1-CD2 4.31Å; I97-L116 HydrophobicContact CG2-CD2 4.05Å; Q112-L116 VanDerWaalsContact O-CB 3.29Å; Q112-L116 WeakPolarHBondContact O-CB 3.47Å; Q112-L116 PolarHBondContact O-N 3.41Å; I113-L116 VanDerWaalsContact O-CB 3.29Å; I113-L116 WeakPolarHBondContact O-CB 3.26Å; I113-L116 PolarHBondContact O-N 3.21Å; E114-L116 VanDerWaalsContact C-N 3.25Å; E114-L116 PolarHBondContact O-N 3.13Å; L116-Q118 VanDerWaalsContact C-N 3.34Å; L116-N119 PolarHBondContact O-N 3.48Å; L116-V120 WeakPolarHBondContact O-CB 3.46Å; L116-V120 WeakPolarHBondContact O-CG2 3.25Å; L116-V120 PolarHBondContact O-N 3.32Å
117I86.1Confident81.7Confident31 Ų3159 Ų5916%0.15930%0.303CS..Hα-helixtrans-61.1-46.8178.6-64.6165.9000109.7Q92 A94 I97 I113 E114 V120 A121Q92-I117 WeakPolarHBondContact O-CG2 3.44Å; A94-I117 HydrophobicContact CB-CD1 4.16Å; I97-I117 HydrophobicContact CD1-CD1 3.91Å; I97-I117 HydrophobicContact CD1-CG1 3.23Å; I113-I117 HydrophobicContact CG2-CD1 4.21Å; I113-I117 WeakPolarHBondContact O-CG1 3.49Å; I113-I117 PolarHBondContact O-N 3.4Å; E114-I117 PolarHBondContact O-N 2.79Å; I117-V120 WeakPolarHBondContact O-CB 3.21Å; I117-V120 PolarHBondContact O-N 3.07Å; I117-A121 WeakPolarHBondContact O-CB 3.41Å; I117-A121 PolarHBondContact O-N 2.97Å
118Q85.5Confident80.5Confident106 Ų10658.5 Ų58.550%0.49531%0.31SS..Hα-helixtrans-62.5-47.1180-170.25948.400111.3E114 E115 L116 V120 A121 D122E114-Q118 WeakPolarHBondContact O-CB 3.36Å; E114-Q118 PolarHBondContact O-N 2.87Å; E115-Q118 PolarHBondContact O-N 3.17Å; L116-Q118 VanDerWaalsContact C-N 3.34Å; Q118-V120 VanDerWaalsContact C-N 3.32Å; Q118-V120 PolarHBondContact O-N 2.79Å; Q118-A121 PolarHBondContact O-N 3.21Å; Q118-A121 VanDerWaalsContact O-N 3.16Å; Q118-D122 VanDerWaalsContact NE2-CG 3.28Å; Q118-D122 PolarHBondContact NE2-OD1 3.08Å; Q118-D122 PolarHBondContact NE2-OD2 3.1Å; Q118-D122 WeakPolarHBondContact O-CB 3.29Å; Q118-D122 VanDerWaalsContact O-CG 3.27Å; Q118-D122 PolarHBondContact O-N 3.33Å
119N85.9Confident79.1Confident42 Ų4265.4 Ų65.423%0.22534%0.342CS..Hα-helixtrans-60.5-40176-78-33.8000112.4E115 L116 V123E115-N119 VanDerWaalsContact O-CB 3.27Å; E115-N119 WeakPolarHBondContact O-CB 3.46Å; E115-N119 VanDerWaalsContact O-CG 3.22Å; E115-N119 PolarHBondContact O-N 2.96Å; E115-N119 PolarHBondContact O-ND2 2.91Å; E115-N119 VanDerWaalsContact O-ND2 3.15Å; L116-N119 PolarHBondContact O-N 3.48Å; N119-V123 VanDerWaalsContact O-CB 3.31Å; N119-V123 WeakPolarHBondContact O-CB 3.43Å; N119-V123 VanDerWaalsContact O-CG2 3.26Å; N119-V123 WeakPolarHBondContact O-CG2 3.27Å; N119-V123 PolarHBondContact O-N 3.43Å; N119-V123 VanDerWaalsContact O-N 3.07Å
120V85.9Confident77.6Confident0 Ų067.8 Ų67.80%035%0.347CS..Hα-helixtrans-63.4-45.3175168.80000110.4F69 M73 R90 P91 L116 I117 Q118 L124F69-V120 HydrophobicContact CE2-CG2 3.85Å; F69-V120 HydrophobicContact CZ-CG2 4.44Å; M73-V120 HydrophobicContact CE-CG2 3.54Å; R90-V120 HydrophobicContact CB-CG1 4.39Å; R90-V120 HydrophobicContact CG-CG1 3.69Å; P91-V120 HydrophobicContact CG-CG1 4.5Å; L116-V120 WeakPolarHBondContact O-CB 3.46Å; L116-V120 WeakPolarHBondContact O-CG2 3.25Å; L116-V120 PolarHBondContact O-N 3.32Å; I117-V120 WeakPolarHBondContact O-CB 3.21Å; I117-V120 PolarHBondContact O-N 3.07Å; Q118-V120 VanDerWaalsContact C-N 3.32Å; Q118-V120 PolarHBondContact O-N 2.79Å; V120-L124 HydrophobicContact CG1-CD1 4.12Å; V120-L124 VanDerWaalsContact O-CB 3.27Å; V120-L124 WeakPolarHBondContact O-CB 3.4Å; V120-L124 PolarHBondContact O-N 3.25Å
121A83.8Confident76.1Confident43 Ų4365.7 Ų65.736%0.35534%0.337SS..Hα-helixtrans-65.9-41.1-178.200000112.3R90 I117 Q118R90-A121 PolarHBondContact NH2-O 3.02Å; R90-A121 VanDerWaalsContact NH2-O 3.07Å; I117-A121 WeakPolarHBondContact O-CB 3.41Å; I117-A121 PolarHBondContact O-N 2.97Å; Q118-A121 PolarHBondContact O-N 3.21Å; Q118-A121 VanDerWaalsContact O-N 3.16Å
122D83.6Confident74.2Confident114 Ų11464.1 Ų64.161%0.6133%0.334SS*.Hα-helixtrans-74.5-40.9-177.7-70.4-25.3000112.7Q118Q118-D122 VanDerWaalsContact NE2-CG 3.28Å; Q118-D122 PolarHBondContact NE2-OD1 3.08Å; Q118-D122 PolarHBondContact NE2-OD2 3.1Å; Q118-D122 WeakPolarHBondContact O-CB 3.29Å; Q118-D122 VanDerWaalsContact O-CG 3.27Å; Q118-D122 PolarHBondContact O-N 3.33Å
123V84.4Confident72.6Confident23 Ų2365.4 Ų65.414%0.13935%0.346CS..Hα-helixtrans-83.6-42.7-176.4177.70000111.6I65 E68 F69 N119I65-V123 HydrophobicContact CG2-CG1 4.05Å; I65-V123 WeakPolarHBondContact CG2-O 3.32Å; E68-V123 HydrophobicContact CB-CG1 4.29Å; E68-V123 HydrophobicContact CG-CG1 4.13Å; E68-V123 HydrophobicContact CG-CG2 4.48Å; F69-V123 HydrophobicContact CB-CG1 3.92Å; N119-V123 VanDerWaalsContact O-CB 3.31Å; N119-V123 WeakPolarHBondContact O-CB 3.43Å; N119-V123 VanDerWaalsContact O-CG2 3.26Å; N119-V123 WeakPolarHBondContact O-CG2 3.27Å; N119-V123 PolarHBondContact O-N 3.43Å; N119-V123 VanDerWaalsContact O-N 3.07Å
124L82.6Confident70.8Confident1 Ų167 Ų671%0.00536%0.361CS..SBendtrans-88.7126.9-176.4-59.2-176.8000110.8I65 F69 L87 R90 V120 G126I65-L124 HydrophobicContact CG2-CD2 3.82Å; F69-L124 HydrophobicContact CB-CD2 4.27Å; F69-L124 HydrophobicContact CD2-CD1 4.1Å; F69-L124 HydrophobicContact CD2-CD2 3.98Å; F69-L124 HydrophobicContact CD2-CG 3.93Å; F69-L124 HydrophobicContact CE2-CD1 3.96Å; F69-L124 HydrophobicContact CE2-CG 4.25Å; F69-L124 HydrophobicContact CG-CD2 4.19Å; L87-L124 HydrophobicContact CD1-CD2 3.91Å; R90-L124 HydrophobicContact CB-CD1 4.11Å; R90-L124 HydrophobicContact CG-CB 4.05Å; R90-L124 HydrophobicContact CG-CD1 4.07Å; R90-L124 PolarHBondContact NE-O 3.29Å; R90-L124 PolarHBondContact NH2-O 3.36Å; V120-L124 HydrophobicContact CG1-CD1 4.12Å; V120-L124 VanDerWaalsContact O-CB 3.27Å; V120-L124 WeakPolarHBondContact O-CB 3.4Å; V120-L124 PolarHBondContact O-N 3.25Å; L124-G126 PolarHBondContact O-N 3.43Å
125P75.1Confident69Low39 Ų3963.1 Ų63.125%0.25335%0.354SS..PPolyproline II helixtrans-62.3129.7-179.323.7-30.9000110.3R60 Q61 I65R60-P125 HydrophobicContact CB-CB 4.16Å; R60-P125 HydrophobicContact CB-CG 3.85Å; R60-P125 WeakPolarHBondContact O-CG 3.28Å; Q61-P125 HydrophobicContact CG-CG 4.36Å; I65-P125 HydrophobicContact CD1-CG 4.31Å
126G62.9Low67Low20 Ų2060.5 Ų60.521%0.20635%0.351CS..PPolyproline II helixtrans-77.1156.2-178.400000114.7R60 R90 L124R60-G126 PolarHBondContact NH1-O 3.26Å; R90-G126 VanDerWaalsContact NH1-CA 3.26Å; L124-G126 PolarHBondContact O-N 3.43Å
127D61.9Low65.2Low18 Ų1863.1 Ų63.110%0.09637%0.372CS..PPolyproline II helixtrans-85.1116.5162.4-92.8-64.7000108.5R60 E129 Q130 E131R60-D127 IonicContact CZ-OD1 3.4Å; R60-D127 IonicContact NE-OD1 2.78Å; R60-D127 PolarHBondContact NE-OD1 3.06Å; R60-D127 IonicContact NH2-OD1 3.72Å; R60-D127 PolarHBondContact NH2-OD1 3.4Å; D127-E129 PolarHBondContact O-N 3.12Å; D127-E129 VanDerWaalsContact O-N 3.12Å; D127-Q130 HydrophobicContact CB-CB 4.31Å; D127-Q130 PolarHBondContact O-N 3.17Å; D127-E131 PolarHBondContact O-N 3.14Å
128P54.4Low63.3Low73 Ų7367.7 Ų67.747%0.47440%0.397SS..Hα-helixtrans-64.2-17.3-179.325.3-33.5000112.6
129E52.1Low61.7Low157 Ų15765.4 Ų65.473%0.73440%0.396SS*.Hα-helixtrans-78.6-27.3172.9-78.8173.9130.100112.7D127 V133D127-E129 PolarHBondContact O-N 3.12Å; D127-E129 VanDerWaalsContact O-N 3.12Å; E129-V133 WeakPolarHBondContact O-CG2 3.27Å
130Q52Low59.9Low103 Ų10371.2 Ų71.248%0.48142%0.421SS..Hα-helixtrans-83.6-33.1177.2-107.3126.514.800112.6D127 N132 V133 A134D127-Q130 HydrophobicContact CB-CB 4.31Å; D127-Q130 PolarHBondContact O-N 3.17Å; Q130-N132 PolarHBondContact O-N 2.92Å; Q130-V133 PolarHBondContact O-N 3.08Å; Q130-A134 PolarHBondContact O-N 3.14Å
131E50.3Low58.2Low121 Ų12179.3 Ų79.357%0.56546%0.461SS*.Hα-helixtrans-58.4-35171.7-76.5177.313000111.8D127 A135D127-E131 PolarHBondContact O-N 3.14Å; E131-A135 WeakPolarHBondContact O-CB 3.44Å; E131-A135 PolarHBondContact O-N 2.96Å; E131-A135 VanDerWaalsContact O-N 3.09Å
132N44.4Very low56.4Low124 Ų12483.7 Ų83.766%0.66348%0.479SS*.Hα-helixtrans-76.3-26-179.9-141.313000113.1Q130 A136Q130-N132 PolarHBondContact O-N 2.92Å; N132-A136 WeakPolarHBondContact O-CB 3.29Å; N132-A136 PolarHBondContact O-N 3.31Å
133V49.6Very low54.7Low98 Ų9886.7 Ų86.759%0.59449%0.489SS*.Hα-helixtrans-84.3-37.8177-179.70000110.9E129 Q130 A136 A137E129-V133 WeakPolarHBondContact O-CG2 3.27Å; Q130-V133 PolarHBondContact O-N 3.08Å; V133-A136 PolarHBondContact O-N 2.98Å; V133-A137 WeakPolarHBondContact O-CB 3.48Å; V133-A137 PolarHBondContact O-N 3.13Å
134A48.6Very low52.8Low45 Ų4588.8 Ų88.837%0.37252%0.515SS..Hα-helixtrans-63.5-43.2172.700000111.3Q130 A136 A137 D138Q130-A134 PolarHBondContact O-N 3.14Å; A134-A136 VanDerWaalsContact C-N 3.29Å; A134-A136 PolarHBondContact O-N 3.22Å; A134-A137 PolarHBondContact O-N 2.95Å; A134-D138 WeakPolarHBondContact O-CB 3.46Å; A134-D138 PolarHBondContact O-N 3.25Å
135A47.2Very low50.9Low61 Ų6192 Ų9250%0.50455%0.549SS..Hα-helixtrans-63.3-32.5174.300000113.4E131 A139E131-A135 WeakPolarHBondContact O-CB 3.44Å; E131-A135 PolarHBondContact O-N 2.96Å; E131-A135 VanDerWaalsContact O-N 3.09Å; A135-A139 WeakPolarHBondContact O-CB 3.36Å; A135-A139 PolarHBondContact O-N 3.32Å
136A44.6Very low49.3Very low52 Ų5298.6 Ų98.643%0.4358%0.577SS.*Hα-helixtrans-75.8-37.117600000112.6N132 V133 A134 A139 E140N132-A136 WeakPolarHBondContact O-CB 3.29Å; N132-A136 PolarHBondContact O-N 3.31Å; V133-A136 PolarHBondContact O-N 2.98Å; A134-A136 VanDerWaalsContact C-N 3.29Å; A134-A136 PolarHBondContact O-N 3.22Å; A136-A139 PolarHBondContact O-N 3.4Å; A136-E140 PolarHBondContact O-N 2.99Å; A136-E140 VanDerWaalsContact O-N 3.11Å
137A49Very low48.2Very low54 Ų54106.6 Ų106.645%0.44661%0.609SS.*Hα-helixtrans-71.2-34.7177.700000112.7V133 A134 E140 M141V133-A137 WeakPolarHBondContact O-CB 3.48Å; V133-A137 PolarHBondContact O-N 3.13Å; A134-A137 PolarHBondContact O-N 2.95Å; A137-E140 PolarHBondContact O-N 2.81Å; A137-M141 PolarHBondContact O-N 3.18Å
138D45.5Very low47Very low128 Ų128115.5 Ų115.568%0.68467%0.672SS**Hα-helixtrans-67.4-39.3174.3-154.2-95.4000111.1A134 M141 D142A134-D138 WeakPolarHBondContact O-CB 3.46Å; A134-D138 PolarHBondContact O-N 3.25Å; D138-M141 PolarHBondContact O-N 3.13Å; D138-D142 PolarHBondContact O-N 3.33Å
139A50.8Low46.7Very low57 Ų57117.6 Ų117.647%0.47168%0.682SS.*Hα-helixtrans-67.4-34.1174.800000113.7A135 A136A135-A139 WeakPolarHBondContact O-CB 3.36Å; A135-A139 PolarHBondContact O-N 3.32Å; A136-A139 PolarHBondContact O-N 3.4Å
140E48.2Very low46.4Very low164 Ų164115.5 Ų115.577%0.76668%0.679SS**Hα-helixtrans-76.7-18176.9-73.5-162.1153.200113.7A136 A137A136-E140 PolarHBondContact O-N 2.99Å; A136-E140 VanDerWaalsContact O-N 3.11Å; A137-E140 PolarHBondContact O-N 2.81Å
141M51.5Low46.1Very low170 Ų170116.2 Ų116.284%0.83769%0.69SS**Hα-helixtrans-82.5-24.5173.7-80.7-167.917800113.6A137 D138A137-M141 PolarHBondContact O-N 3.18Å; D138-M141 PolarHBondContact O-N 3.13Å
142D46.4Very low45.8Very low135 Ų135115.9 Ų115.972%0.72270%0.697SS**Hα-helixtrans-78.2-33.9178.4-166.858.7000112.5D138 G144D138-D142 PolarHBondContact O-N 3.33Å; D142-G144 VanDerWaalsContact C-N 3.28Å; D142-G144 PolarHBondContact O-N 2.97Å
143E46.3Very low45.9Very low177 Ų177115.4 Ų115.483%0.82770%0.7SS**THydrogen-bonded Turntrans-76.8-7.5-179.5-69-159.4132.900114.6
144G44.3Very low45.6Very low67 Ų67116.6 Ų116.669%0.69171%0.707SS**THydrogen-bonded Turntrans-87.7-8-178.900000115.8D142D142-G144 VanDerWaalsContact C-N 3.28Å; D142-G144 PolarHBondContact O-N 2.97Å
145G42.7Very low45.4Very low69 Ų69121.7 Ų121.771%0.71173%0.731SS**SBendtrans-91.4-13.7-171.900000116.4
146E43Very low45.3Very low178 Ų178126.4 Ų126.483%0.83275%0.748SS**SBendtrans-116.558.8-174.9-78-174.29500112.6
147Q39.1Very low45.4Very low188 Ų188132.6 Ų132.688%0.87977%0.774SS**  trans-170.383.9155.1-108.6160.267.300111.7
148S37.6Very low45Very low204 Ų204139.7 Ų139.7100%1.42780%0.804SS**  trans-176.70141.2-79.40000111.6

Retrieved 148 of 148 residues in 171.5 ms (Link to these results)