Q542W5_MOUSE Loading...

Small ribosomal subunit protein mS40

AlphaFold DB , UniProt , Accession Q542W5, Species MOUSE (Mus musculus, Mouse), Gene Mrps18b, Length 162 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
1M35.3Very low46.2Very low250 Ų250147.5 Ų147.5100%1.23280%0.795SS**  097.10-68.2-178.217900107.8
2A37.1Very low46.5Very low100 Ų100148 Ų14883%0.82680%0.796SS**  trans-97117.7-176.500000108.9
3A38.8Very low46.9Very low90 Ų90140.2 Ų140.274%0.74476%0.756SS**  trans-73.6126.3179.800000111L5A3-L5 PolarHBondContact O-N 3.01Å
4P51.4Low47.1Very low122 Ų122137.6 Ų137.679%0.79275%0.75SS**  trans-94.287.9177.235-27.7000109.5
5L51.1Low47.3Very low162 Ų162136.5 Ų136.585%0.84875%0.75SS**  trans-138.152.3173.3-74.7177.3000112A3A3-L5 PolarHBondContact O-N 3.01Å
6R51.4Low47.5Very low172 Ų172135.6 Ų135.665%0.64974%0.743SS**  trans-138.57.1179.5-61.1-171-178.9-142.50.2116
7H50.4Low47.7Very low167 Ų167129.8 Ų129.877%0.77371%0.711SS**SBendtrans-88.4-12.8-175.7-154.2-61.8000114.2
8T46.1Very low48.1Very low140 Ų140134.4 Ų134.486%0.85972%0.716SS**THydrogen-bonded Turntrans-96.41-172-20.30000115.1
9L49.8Very low48.3Very low110 Ų110133.4 Ų133.458%0.57672%0.72SS**THydrogen-bonded Turntrans-102.37.2178.4-78.6172.6000114.7
10L49.8Very low48.3Very low112 Ų112130.5 Ų130.559%0.58671%0.71SS**THydrogen-bonded Turntrans-94.58.5-174.2-71.3173.8000115.6T46L10-T46 WeakPolarHBondContact CD2-O 3.5Å
11K47.3Very low48.7Very low198 Ų198131.5 Ų131.586%0.86171%0.705SS**THydrogen-bonded Turntrans-111.63.2-179.8-72-169.5177.4178.50116.3
12L50Low49.9Very low153 Ų153119.9 Ų119.980%0.80165%0.648SS**SBendtrans-123.724.3-172.6-91.4165.1000116.2
13V51.3Low51.3Low47 Ų47115.5 Ų115.529%0.28561%0.612SS.*  trans-126.429.4178.3-150.50000116.5L28V13-L28 HydrophobicContact CG1-CD1 4.24Å; V13-L28 HydrophobicContact CG1-CD2 4.15Å; V13-L28 HydrophobicContact CG2-CD1 4.03Å
14P50.3Low53.2Low103 Ų103117.2 Ų117.267%0.66961%0.605SS**SBendtrans-86-23.5164.7-13.830.5000114.8
15T49.4Very low54.8Low121 Ų121115 Ų11574%0.74259%0.586SS**SBendtrans-102.9-4.2-162.832.90000117.1
16L50.9Low56.5Low122 Ų122108.8 Ų108.864%0.63956%0.555SS**  trans-122.937.2-174.2-75.8169.7000114.9V22L16-V22 VanDerWaalsContact O-CG2 3.26Å; L16-V22 WeakPolarHBondContact O-CG2 3.43Å
17L51.5Low58.3Low38 Ų38109 Ų10920%0.19956%0.561CS.*  trans-107.652.2172.4-116.978.5000113.3V22 K55L17-V22 HydrophobicContact CB-CG2 4.33Å; L17-V22 HydrophobicContact CD1-CB 4.45Å; L17-V22 HydrophobicContact CD1-CG1 3.87Å; L17-V22 HydrophobicContact CD1-CG2 3.65Å; L17-V22 HydrophobicContact CG-CG1 4.44Å; L17-V22 HydrophobicContact CG-CG2 3.68Å; L17-K55 HydrophobicContact CD2-CB 3.57Å; L17-K55 HydrophobicContact CD2-CD 3.75Å; L17-K55 HydrophobicContact CD2-CG 4.35Å
18R53.8Low60.1Low212 Ų212103 Ų10380%0.853%0.534SS*.  trans-80125.9157.2-92.2-173.9-177.9-159.2-0.9108.4S20 Y21R18-S20 PolarHBondContact O-N 3.46Å; R18-Y21 PolarHBondContact O-N 3.04Å; R18-Y21 VanDerWaalsContact O-N 3.1Å
19S51.2Low62.2Low115 Ų11596.4 Ų96.480%0.80449%0.493SS*.THydrogen-bonded Turntrans-52.1-25.5-163.7-151.90000116.6
20S49.8Very low64.2Low75 Ų7595.8 Ų95.852%0.52449%0.487SS..THydrogen-bonded Turntrans-88-25.5-178.453.30000114.7R18R18-S20 PolarHBondContact O-N 3.46Å
21Y55.4Low66.2Low152 Ų15294.7 Ų94.760%0.59648%0.48SS*.THydrogen-bonded Turntrans-94.3-18.6-171.3-92.5-90.9000114.2R18 Q24 N25R18-Y21 PolarHBondContact O-N 3.04Å; R18-Y21 VanDerWaalsContact O-N 3.1Å; Y21-Q24 PolarHBondContact O-N 3.11Å; Y21-N25 PolarHBondContact O-ND2 3Å
22V60.4Low68.4Low7 Ų786.3 Ų86.34%0.04244%0.443CS..G310 helixtrans-74-38.9-169.7-178.20000112.2L16 L17 Q24 N25 L29 A59L16-V22 VanDerWaalsContact O-CG2 3.26Å; L16-V22 WeakPolarHBondContact O-CG2 3.43Å; L17-V22 HydrophobicContact CB-CG2 4.33Å; L17-V22 HydrophobicContact CD1-CB 4.45Å; L17-V22 HydrophobicContact CD1-CG1 3.87Å; L17-V22 HydrophobicContact CD1-CG2 3.65Å; L17-V22 HydrophobicContact CG-CG1 4.44Å; L17-V22 HydrophobicContact CG-CG2 3.68Å; V22-Q24 PolarHBondContact O-N 3.33Å; V22-N25 PolarHBondContact O-N 3.4Å; V22-N25 VanDerWaalsContact O-N 3.07Å; V22-L29 HydrophobicContact CG1-CD2 4.05Å; V22-A59 HydrophobicContact CB-CB 4.15Å; V22-A59 HydrophobicContact CG1-CB 3.67Å
23A68.2Low70.4Confident8 Ų880.1 Ų80.17%0.06641%0.411CS..G310 helixtrans-64.9-22178.700000113K62A23-K62 HydrophobicContact CB-CB 4.28Å; A23-K62 HydrophobicContact CB-CD 4.14Å; A23-K62 HydrophobicContact CB-CG 4.16Å
24Q77Confident72.4Confident125 Ų12579.1 Ų79.158%0.58441%0.406SS*.G310 helixtrans-80.7-18.8176.3-64.3177.18.400112.5Y21 V22 V26Y21-Q24 PolarHBondContact O-N 3.11Å; V22-Q24 PolarHBondContact O-N 3.33Å; Q24-V26 VanDerWaalsContact C-N 3.33Å; Q24-V26 PolarHBondContact O-N 3.27Å; Q24-V26 VanDerWaalsContact O-N 3.09Å
25N85.2Confident74.3Confident76 Ų7679 Ų7941%0.40641%0.414SS..  trans-88.568.5-177.7-75.4-75.5000111.3Y21 V22 K27 L28 L29Y21-N25 PolarHBondContact O-ND2 3Å; V22-N25 PolarHBondContact O-N 3.4Å; V22-N25 VanDerWaalsContact O-N 3.07Å; N25-K27 VanDerWaalsContact C-N 3.3Å; N25-K27 PolarHBondContact O-N 3.45Å; N25-L28 HydrophobicContact CB-CB 4.18Å; N25-L28 WeakPolarHBondContact O-CB 3.49Å; N25-L28 PolarHBondContact O-N 3.48Å; N25-L29 PolarHBondContact O-N 2.83Å
26V86.4Confident76.2Confident31 Ų3181.9 Ų81.919%0.18842%0.419CS..Hα-helixtrans-54.2-44-176.9-175.80000112Q24 L28 L29 E30 L68 L69Q24-V26 VanDerWaalsContact C-N 3.33Å; Q24-V26 PolarHBondContact O-N 3.27Å; Q24-V26 VanDerWaalsContact O-N 3.09Å; V26-L28 VanDerWaalsContact C-N 3.25Å; V26-L28 PolarHBondContact O-N 3.05Å; V26-L29 PolarHBondContact O-N 3.48Å; V26-E30 HydrophobicContact CG1-CG 4.16Å; V26-E30 WeakPolarHBondContact O-CG 3.14Å; V26-E30 PolarHBondContact O-N 3.07Å; V26-L68 WeakPolarHBondContact CG1-O 3.32Å; V26-L68 HydrophobicContact CG2-CB 3.82Å; V26-L68 WeakPolarHBondContact CG2-O 3.33Å; V26-L69 HydrophobicContact CG1-CD1 3.72Å
27K89.3Confident78Confident178 Ų17880.2 Ų80.277%0.77441%0.414SS*.Hα-helixtrans-58.6-32.6178.8-64.6-172176.3-1790114.1N25N25-K27 VanDerWaalsContact C-N 3.3Å; N25-K27 PolarHBondContact O-N 3.45Å
28L89.7Confident79.9Confident40 Ų4079.7 Ų79.721%0.20942%0.418CS..Hα-helixtrans-76-44.3176.3178.767.1000110.1V13 N25 V26 E30 Q31 F32V13-L28 HydrophobicContact CG1-CD1 4.24Å; V13-L28 HydrophobicContact CG1-CD2 4.15Å; V13-L28 HydrophobicContact CG2-CD1 4.03Å; N25-L28 HydrophobicContact CB-CB 4.18Å; N25-L28 WeakPolarHBondContact O-CB 3.49Å; N25-L28 PolarHBondContact O-N 3.48Å; V26-L28 VanDerWaalsContact C-N 3.25Å; V26-L28 PolarHBondContact O-N 3.05Å; L28-E30 PolarHBondContact O-N 2.96Å; L28-Q31 WeakPolarHBondContact O-CB 3.44Å; L28-Q31 PolarHBondContact O-N 3.36Å; L28-F32 HydrophobicContact CD1-CE2 4.17Å; L28-F32 HydrophobicContact CG-CE2 4.45Å; L28-F32 VanDerWaalsContact O-CD2 3.28Å; L28-F32 WeakPolarHBondContact O-CD2 3.28Å
29L90.6Very high81.8Confident1 Ų175 Ų751%0.00541%0.407CS..Hα-helixtrans-65.5-37.9-177.5-65.3-177.6000112.6V22 N25 V26 Q31 F32 A59 I60 A63V22-L29 HydrophobicContact CG1-CD2 4.05Å; N25-L29 PolarHBondContact O-N 2.83Å; V26-L29 PolarHBondContact O-N 3.48Å; L29-Q31 PolarHBondContact O-N 3.24Å; L29-F32 PolarHBondContact O-N 3.07Å; L29-F32 VanDerWaalsContact O-N 3.11Å; L29-A59 HydrophobicContact CD2-CB 4.21Å; L29-I60 HydrophobicContact CB-CG1 4.15Å; L29-I60 HydrophobicContact CD1-CG1 4.46Å; L29-I60 HydrophobicContact CD2-CG1 3.94Å; L29-I60 HydrophobicContact CG-CG1 4.41Å; L29-A63 HydrophobicContact CD1-CB 3.84Å
30E91.1Very high83.8Confident97 Ų9771.6 Ų71.645%0.45338%0.38SS..Hα-helixtrans-56.2-33.2176.7-77.4174.2171.800112.9V26 L28 F32 V33 L69V26-E30 HydrophobicContact CG1-CG 4.16Å; V26-E30 WeakPolarHBondContact O-CG 3.14Å; V26-E30 PolarHBondContact O-N 3.07Å; L28-E30 PolarHBondContact O-N 2.96Å; E30-F32 PolarHBondContact O-N 3.48Å; E30-V33 PolarHBondContact O-N 2.82Å; E30-V33 VanDerWaalsContact O-N 3.16Å; E30-V33 VanDerWaalsContact O-O 3.13Å; E30-L69 HydrophobicContact CG-CD1 3.53Å
31Q91.3Very high85.9Confident90 Ų9069.8 Ų69.842%0.42136%0.362SS..THydrogen-bonded Turntrans-65.3-24.4-179.5-62.5177.6-12.900113.2L28 L29L28-Q31 WeakPolarHBondContact O-CB 3.44Å; L28-Q31 PolarHBondContact O-N 3.36Å; L29-Q31 PolarHBondContact O-N 3.24Å
32F92.9Very high87.7Confident22 Ų2268 Ų6810%0.09636%0.359CS..THydrogen-bonded Turntrans-95.94.5-179.3-63.6-91.8000112.9L28 L29 E30 F41 T46 V48 L56 I60L28-F32 HydrophobicContact CD1-CE2 4.17Å; L28-F32 HydrophobicContact CG-CE2 4.45Å; L28-F32 VanDerWaalsContact O-CD2 3.28Å; L28-F32 WeakPolarHBondContact O-CD2 3.28Å; L29-F32 PolarHBondContact O-N 3.07Å; L29-F32 VanDerWaalsContact O-N 3.11Å; E30-F32 PolarHBondContact O-N 3.48Å; F32-F41 WeakPolarHBondContact O-CD2 3.47Å; F32-F41 PolarHBondContact O-N 2.82Å; F32-T46 HydrophobicContact CD1-CG2 3.78Å; F32-T46 HydrophobicContact CE1-CG2 4.36Å; F32-V48 HydrophobicContact CE1-CG1 3.91Å; F32-L56 HydrophobicContact CB-CD1 4Å; F32-L56 HydrophobicContact CB-CD2 3.89Å; F32-L56 HydrophobicContact CB-CG 4.48Å; F32-L56 HydrophobicContact CD1-CD1 3.64Å; F32-L56 HydrophobicContact CD2-CD1 3.56Å; F32-L56 HydrophobicContact CE1-CD1 3.93Å; F32-L56 HydrophobicContact CE2-CD1 3.85Å; F32-L56 HydrophobicContact CG-CD1 3.45Å; F32-L56 VanDerWaalsContact CG-CD1 3.45Å; F32-L56 HydrophobicContact CG-CD2 4.25Å; F32-L56 HydrophobicContact CG-CG 4.42Å; F32-L56 HydrophobicContact CZ-CD1 4.02Å; F32-I60 HydrophobicContact CB-CD1 4.48Å
33V93.4Very high89.2Confident22 Ų2268 Ų6813%0.13336%0.359CS..BIsolated β-bridgetrans-116.8141.3177.9-176.80000109.7E30 A35 I40 I60E30-V33 PolarHBondContact O-N 2.82Å; E30-V33 VanDerWaalsContact O-N 3.16Å; E30-V33 VanDerWaalsContact O-O 3.13Å; V33-A35 PolarHBondContact O-N 3.44Å; V33-I40 HydrophobicContact CG2-CG1 4.34Å; V33-I60 HydrophobicContact CG2-CD1 3.78Å; V33-I60 HydrophobicContact CG2-CG2 4.39Å
34C92.3Very high90.3Very high27 Ų2772.6 Ų72.618%0.18239%0.389CS..  trans-72.6124.2172.7-178.50000110.9H36 T37 G38 I39 F41C34-H36 PolarHBondContact O-N 2.95Å; C34-T37 VanDerWaalsContact CB-OG1 3.25Å; C34-T37 WeakPolarHBondContact CB-OG1 3.36Å; C34-T37 PolarHBondContact O-N 3.21Å; C34-T37 PolarHBondContact SG-OG1 3.41Å; C34-T37 VanDerWaalsContact SG-OG1 3.37Å; C34-G38 WeakPolarHBondContact O-CA 3.23Å; C34-G38 PolarHBondContact O-N 2.94Å; C34-I39 PolarHBondContact N-O 3.06Å; C34-F41 HydrophobicContact CB-CE1 4.07Å; C34-F41 HydrophobicContact CB-CZ 3.91Å
35A90.1Very high91Very high101 Ų10172.3 Ų72.384%0.83538%0.383SS*.THydrogen-bonded Turntrans-62.5-23.4-179.800000114.3V33V33-A35 PolarHBondContact O-N 3.44Å
36H89.1Confident91.2Very high180 Ų18069.4 Ų69.483%0.83337%0.368SS*.THydrogen-bonded Turntrans-96-31.7-177.5-57.8-66.9000113.6C34C34-H36 PolarHBondContact O-N 2.95Å
37T90Very high91.4Very high88 Ų8871 Ų7154%0.5439%0.392SS..THydrogen-bonded Turntrans-111.1-15.6-174.957.80000113.5C34 I39C34-T37 VanDerWaalsContact CB-OG1 3.25Å; C34-T37 WeakPolarHBondContact CB-OG1 3.36Å; C34-T37 PolarHBondContact O-N 3.21Å; C34-T37 PolarHBondContact SG-OG1 3.41Å; C34-T37 VanDerWaalsContact SG-OG1 3.37Å; T37-I39 PolarHBondContact O-N 3.48Å
38G90.8Very high91.3Very high27 Ų2764.2 Ų64.228%0.27837%0.365SS..  trans67.89.3-174.800000114.2C34 R64C34-G38 WeakPolarHBondContact O-CA 3.23Å; C34-G38 PolarHBondContact O-N 2.94Å; G38-R64 PolarHBondContact O-NH2 3.48Å
39I93.4Very high91.4Very high114 Ų11466 Ų6659%0.58538%0.38SS*.PPolyproline II helixtrans-84.4137.7179.7-58.5171.2000109.5C34 T37C34-I39 PolarHBondContact N-O 3.06Å; T37-I39 PolarHBondContact O-N 3.48Å
40I94.1Very high91.4Very high43 Ų4371.9 Ų71.922%0.22141%0.409CS..BIsolated β-bridgetrans-73.8131175.8-54.2171.3000108.8V33 L56 T57 I60V33-I40 HydrophobicContact CG2-CG1 4.34Å; I40-L56 HydrophobicContact CG2-CD2 4.12Å; I40-T57 HydrophobicContact CD1-CG2 4.03Å; I40-I60 HydrophobicContact CD1-CB 4.21Å; I40-I60 HydrophobicContact CD1-CD1 4.04Å; I40-I60 HydrophobicContact CD1-CG2 3.81Å; I40-I60 HydrophobicContact CG1-CD1 4.02Å; I40-I60 HydrophobicContact CG1-CG2 4.17Å; I40-I60 HydrophobicContact CG2-CD1 4.02Å
41F94.4Very high91.5Very high36 Ų3674.4 Ų74.416%0.15842%0.418CS..PPolyproline II helixtrans-66140.6177-67-59.3000111.9F32 C34 Y45 T46 H53F32-F41 WeakPolarHBondContact O-CD2 3.47Å; F32-F41 PolarHBondContact O-N 2.82Å; C34-F41 HydrophobicContact CB-CE1 4.07Å; C34-F41 HydrophobicContact CB-CZ 3.91Å; F41-Y45 HydrophobicContact CB-CD1 3.6Å; F41-Y45 HydrophobicContact CB-CE1 4.17Å; F41-Y45 HydrophobicContact CB-CG 4.43Å; F41-Y45 AromaticContact CD1-CD1 3.49Å; F41-Y45 HydrophobicContact CD1-CD1 3.49Å; F41-Y45 VanDerWaalsContact CD1-CD1 3.49Å; F41-Y45 AromaticContact CD1-CE1 3.26Å; F41-Y45 HydrophobicContact CD1-CE1 3.26Å; F41-Y45 HydrophobicContact CD1-CG 4.33Å; F41-Y45 AromaticContact CD1-CZ 3.99Å; F41-Y45 HydrophobicContact CD2-CD1 4.18Å; F41-Y45 AromaticContact CD2-CE1 3.93Å; F41-Y45 HydrophobicContact CD2-CE1 3.93Å; F41-Y45 HydrophobicContact CE1-CD1 4.2Å; F41-Y45 AromaticContact CE1-CE1 3.49Å; F41-Y45 HydrophobicContact CE1-CE1 3.49Å; F41-Y45 VanDerWaalsContact CE1-CE1 3.49Å; F41-Y45 AromaticContact CE1-CZ 3.91Å; F41-Y45 HydrophobicContact CE2-CE1 4.14Å; F41-Y45 AromaticContact CG-CD1 3.49Å; F41-Y45 HydrophobicContact CG-CD1 3.49Å; F41-Y45 VanDerWaalsContact CG-CD1 3.49Å; F41-Y45 AromaticContact CG-CE1 3.52Å; F41-Y45 HydrophobicContact CG-CE1 3.52Å; F41-Y45 AromaticContact CZ-CE1 3.94Å; F41-Y45 HydrophobicContact CZ-CE1 3.94Å; F41-T46 HydrophobicContact CB-CG2 3.43Å; F41-T46 VanDerWaalsContact CB-CG2 3.43Å; F41-T46 HydrophobicContact CD2-CG2 4.48Å; F41-T46 HydrophobicContact CG-CG2 4.34Å; F41-H53 PolarHBondContact O-CE1 3.23Å
42H92.4Very high91.3Very high116 Ų11673 Ų7354%0.53741%0.411SS..PPolyproline II helixtrans-67.3154.8177.755.3-84.8000112.2Y45 T46H42-Y45 PolarHBondContact CD2-N 2.64Å; H42-Y45 WeakPolarHBondContact NE2-CB 3.41Å; H42-Y45 WeakPolarHBondContact O-CB 3.42Å; H42-Y45 PolarHBondContact O-N 3.41Å; H42-T46 PolarHBondContact O-N 3.14Å; H42-T46 PolarHBondContact O-OG1 3.36Å; H42-T46 VanDerWaalsContact O-OG1 3.08Å
43A91.3Very high91.2Very high5 Ų573.7 Ų73.74%0.04142%0.415CS..Hα-helixtrans-56.2-44.3-176.600000114.6Y45 T46 G47 M50 H53A43-Y45 VanDerWaalsContact C-N 3.27Å; A43-Y45 PolarHBondContact O-N 3.03Å; A43-T46 WeakPolarHBondContact CA-OG1 3.47Å; A43-T46 PolarHBondContact O-N 2.88Å; A43-T46 PolarHBondContact O-OG1 3.39Å; A43-T46 VanDerWaalsContact O-OG1 3.07Å; A43-G47 PolarHBondContact O-N 3.13Å; A43-M50 HydrophobicContact CB-CE 3.29Å; A43-M50 HydrophobicContact CB-SD 3.67Å; A43-H53 HydrophobicContact CB-CB 3.99Å
44P91.5Very high91.1Very high106 Ų10679.3 Ų79.369%0.68844%0.438SS*.Hα-helixtrans-59.3-32.9174.3-25.831.8000114.6
45Y91Very high91.1Very high118 Ų11882 Ų8246%0.46345%0.446SS..Hα-helixtrans-72.6-32.7178.5-176.5-92.4000112.8F41 H42 A43F41-Y45 HydrophobicContact CB-CD1 3.6Å; F41-Y45 HydrophobicContact CB-CE1 4.17Å; F41-Y45 HydrophobicContact CB-CG 4.43Å; F41-Y45 AromaticContact CD1-CD1 3.49Å; F41-Y45 HydrophobicContact CD1-CD1 3.49Å; F41-Y45 VanDerWaalsContact CD1-CD1 3.49Å; F41-Y45 AromaticContact CD1-CE1 3.26Å; F41-Y45 HydrophobicContact CD1-CE1 3.26Å; F41-Y45 HydrophobicContact CD1-CG 4.33Å; F41-Y45 AromaticContact CD1-CZ 3.99Å; F41-Y45 HydrophobicContact CD2-CD1 4.18Å; F41-Y45 AromaticContact CD2-CE1 3.93Å; F41-Y45 HydrophobicContact CD2-CE1 3.93Å; F41-Y45 HydrophobicContact CE1-CD1 4.2Å; F41-Y45 AromaticContact CE1-CE1 3.49Å; F41-Y45 HydrophobicContact CE1-CE1 3.49Å; F41-Y45 VanDerWaalsContact CE1-CE1 3.49Å; F41-Y45 AromaticContact CE1-CZ 3.91Å; F41-Y45 HydrophobicContact CE2-CE1 4.14Å; F41-Y45 AromaticContact CG-CD1 3.49Å; F41-Y45 HydrophobicContact CG-CD1 3.49Å; F41-Y45 VanDerWaalsContact CG-CD1 3.49Å; F41-Y45 AromaticContact CG-CE1 3.52Å; F41-Y45 HydrophobicContact CG-CE1 3.52Å; F41-Y45 AromaticContact CZ-CE1 3.94Å; F41-Y45 HydrophobicContact CZ-CE1 3.94Å; H42-Y45 PolarHBondContact CD2-N 2.64Å; H42-Y45 WeakPolarHBondContact NE2-CB 3.41Å; H42-Y45 WeakPolarHBondContact O-CB 3.42Å; H42-Y45 PolarHBondContact O-N 3.41Å; A43-Y45 VanDerWaalsContact C-N 3.27Å; A43-Y45 PolarHBondContact O-N 3.03Å
46T90Very high91.2Very high15 Ų1577.8 Ų77.89%0.09241%0.41CS..Hα-helixtrans-94.3-17.1-176.448.70000113L10 F32 F41 H42 A43 V48L10-T46 WeakPolarHBondContact CD2-O 3.5Å; F32-T46 HydrophobicContact CD1-CG2 3.78Å; F32-T46 HydrophobicContact CE1-CG2 4.36Å; F41-T46 HydrophobicContact CB-CG2 3.43Å; F41-T46 VanDerWaalsContact CB-CG2 3.43Å; F41-T46 HydrophobicContact CD2-CG2 4.48Å; F41-T46 HydrophobicContact CG-CG2 4.34Å; H42-T46 PolarHBondContact O-N 3.14Å; H42-T46 PolarHBondContact O-OG1 3.36Å; H42-T46 VanDerWaalsContact O-OG1 3.08Å; A43-T46 WeakPolarHBondContact CA-OG1 3.47Å; A43-T46 PolarHBondContact O-N 2.88Å; A43-T46 PolarHBondContact O-OG1 3.39Å; A43-T46 VanDerWaalsContact O-OG1 3.07Å; T46-V48 PolarHBondContact O-N 3.43Å; T46-V48 WeakPolarHBondContact OG1-CG2 3.25Å
47G90Very high91.4Very high66 Ų6671.8 Ų71.868%0.6839%0.386SS*.THydrogen-bonded Turntrans73.310.3-177.500000114.4A43A43-G47 PolarHBondContact O-N 3.13Å
48V89.1Confident91.5Very high35 Ų3573 Ų7321%0.21239%0.385CS..  trans-85.4143.9177.2-62.70000111.5F32 T46 H53F32-V48 HydrophobicContact CE1-CG1 3.91Å; T46-V48 PolarHBondContact O-N 3.43Å; T46-V48 WeakPolarHBondContact OG1-CG2 3.25Å; V48-H53 HydrophobicContact CG2-CB 3.81Å
49C90Very high91.6Very high77 Ų7772.2 Ų72.252%0.5238%0.376SS..  trans-67.9153.6175.177.10000111.2K51 Q52 H53C49-K51 PolarHBondContact O-N 3.11Å; C49-K51 VanDerWaalsContact O-N 3.13Å; C49-Q52 PolarHBondContact O-N 3.48Å; C49-Q52 VanDerWaalsContact SG-CG 3.57Å; C49-H53 PolarHBondContact O-N 3.46Å
50M92.3Very high91.6Very high124 Ų12466.8 Ų66.861%0.61135%0.349SS*.Hα-helixtrans-56.7-35.4-174.4-64.1-59.2147.100113.7A43 Q52 H53 K54A43-M50 HydrophobicContact CB-CE 3.29Å; A43-M50 HydrophobicContact CB-SD 3.67Å; M50-Q52 PolarHBondContact O-N 3.08Å; M50-H53 PolarHBondContact O-N 2.97Å; M50-K54 WeakPolarHBondContact O-CB 3.34Å; M50-K54 PolarHBondContact O-N 3.45Å
51K91.4Very high91.6Very high151 Ų15169 Ų6966%0.65736%0.358SS*.Hα-helixtrans-61.6-42.9176.7-174.6177.9-178.1177.20111.9C49 K55C49-K51 PolarHBondContact O-N 3.11Å; C49-K51 VanDerWaalsContact O-N 3.13Å; K51-K55 PolarHBondContact O-N 3.02Å
52Q87.2Confident91.5Very high59 Ų5972.3 Ų72.328%0.27637%0.372SS..Hα-helixtrans-77.1-37.2177.7-60-62.315.300111.2C49 M50 K54 K55 L56C49-Q52 PolarHBondContact O-N 3.48Å; C49-Q52 VanDerWaalsContact SG-CG 3.57Å; M50-Q52 PolarHBondContact O-N 3.08Å; Q52-K54 VanDerWaalsContact C-N 3.32Å; Q52-K54 PolarHBondContact O-N 3.16Å; Q52-K55 PolarHBondContact O-N 3.13Å; Q52-L56 VanDerWaalsContact O-CB 3.28Å; Q52-L56 WeakPolarHBondContact O-CB 3.31Å; Q52-L56 PolarHBondContact O-N 3.02Å
53H90.8Very high91.6Very high37 Ų3766.8 Ų66.817%0.17135%0.347CS..Hα-helixtrans-57-45.4173.9-170.864.1000111.6F41 A43 V48 C49 M50 K55 L56 T57F41-H53 PolarHBondContact O-CE1 3.23Å; A43-H53 HydrophobicContact CB-CB 3.99Å; V48-H53 HydrophobicContact CG2-CB 3.81Å; C49-H53 PolarHBondContact O-N 3.46Å; M50-H53 PolarHBondContact O-N 2.97Å; H53-K55 PolarHBondContact O-N 3.01Å; H53-L56 WeakPolarHBondContact O-CB 3.47Å; H53-L56 PolarHBondContact O-N 3.16Å; H53-T57 PolarHBondContact O-N 3.38Å; H53-T57 PolarHBondContact O-OG1 3.06Å; H53-T57 VanDerWaalsContact O-OG1 3.06Å
54K93.1Very high91.7Very high140 Ų14068.7 Ų68.761%0.60935%0.353SS*.Hα-helixtrans-58.5-45.6175.4-174.5175.6-177.4176.30112.5M50 Q52 L56 T57 Q58M50-K54 WeakPolarHBondContact O-CB 3.34Å; M50-K54 PolarHBondContact O-N 3.45Å; Q52-K54 VanDerWaalsContact C-N 3.32Å; Q52-K54 PolarHBondContact O-N 3.16Å; K54-L56 VanDerWaalsContact C-N 3.32Å; K54-T57 PolarHBondContact O-N 3.03Å; K54-Q58 WeakPolarHBondContact O-CG 3.45Å; K54-Q58 PolarHBondContact O-N 3.39Å; K54-Q58 VanDerWaalsContact O-N 3.11Å
55K91Very high91.8Very high83 Ų8370 Ų7036%0.36135%0.35SS..Hα-helixtrans-65.1-37.5177.1-72.5-179.4176.2-173.70112L17 K51 Q52 H53 Q58 A59L17-K55 HydrophobicContact CD2-CB 3.57Å; L17-K55 HydrophobicContact CD2-CD 3.75Å; L17-K55 HydrophobicContact CD2-CG 4.35Å; K51-K55 PolarHBondContact O-N 3.02Å; Q52-K55 PolarHBondContact O-N 3.13Å; H53-K55 PolarHBondContact O-N 3.01Å; K55-Q58 PolarHBondContact O-N 3.29Å; K55-A59 WeakPolarHBondContact O-CB 3.35Å; K55-A59 PolarHBondContact O-N 3.19Å
56L91.6Very high91.8Very high13 Ų1368.2 Ų68.27%0.06835%0.354CS..Hα-helixtrans-65.9-46177.5-178.8144000111.2F32 I40 Q52 H53 K54 Q58 A59 I60F32-L56 HydrophobicContact CB-CD1 4Å; F32-L56 HydrophobicContact CB-CD2 3.89Å; F32-L56 HydrophobicContact CB-CG 4.48Å; F32-L56 HydrophobicContact CD1-CD1 3.64Å; F32-L56 HydrophobicContact CD2-CD1 3.56Å; F32-L56 HydrophobicContact CE1-CD1 3.93Å; F32-L56 HydrophobicContact CE2-CD1 3.85Å; F32-L56 HydrophobicContact CG-CD1 3.45Å; F32-L56 VanDerWaalsContact CG-CD1 3.45Å; F32-L56 HydrophobicContact CG-CD2 4.25Å; F32-L56 HydrophobicContact CG-CG 4.42Å; F32-L56 HydrophobicContact CZ-CD1 4.02Å; I40-L56 HydrophobicContact CG2-CD2 4.12Å; Q52-L56 VanDerWaalsContact O-CB 3.28Å; Q52-L56 WeakPolarHBondContact O-CB 3.31Å; Q52-L56 PolarHBondContact O-N 3.02Å; H53-L56 WeakPolarHBondContact O-CB 3.47Å; H53-L56 PolarHBondContact O-N 3.16Å; K54-L56 VanDerWaalsContact C-N 3.32Å; L56-Q58 VanDerWaalsContact C-N 3.32Å; L56-Q58 PolarHBondContact O-N 3.24Å; L56-A59 PolarHBondContact O-N 3.15Å; L56-A59 VanDerWaalsContact O-N 3.17Å; L56-I60 HydrophobicContact CD2-CD1 3.41Å; L56-I60 VanDerWaalsContact CD2-CD1 3.41Å; L56-I60 HydrophobicContact CD2-CG1 4.29Å; L56-I60 HydrophobicContact CG-CD1 4.15Å; L56-I60 WeakPolarHBondContact O-CG1 3.34Å; L56-I60 PolarHBondContact O-N 3.44Å
57T93.6Very high91.9Very high54 Ų5470.7 Ų70.733%0.33138%0.382SS..Hα-helixtrans-58.4-44.2174.3-53.90000111.4I40 H53 K54 I60 Q61I40-T57 HydrophobicContact CD1-CG2 4.03Å; H53-T57 PolarHBondContact O-N 3.38Å; H53-T57 PolarHBondContact O-OG1 3.06Å; H53-T57 VanDerWaalsContact O-OG1 3.06Å; K54-T57 PolarHBondContact O-N 3.03Å; T57-I60 PolarHBondContact O-N 3.3Å; T57-Q61 WeakPolarHBondContact O-CB 3.4Å; T57-Q61 PolarHBondContact O-N 3.08Å
58Q93.6Very high92Very high114 Ų11471.7 Ų71.753%0.53337%0.371SS..Hα-helixtrans-62.7-41.6175.4-71.9174.8-15.100112.3K54 K55 L56 Q61 K62K54-Q58 WeakPolarHBondContact O-CG 3.45Å; K54-Q58 PolarHBondContact O-N 3.39Å; K54-Q58 VanDerWaalsContact O-N 3.11Å; K55-Q58 PolarHBondContact O-N 3.29Å; L56-Q58 VanDerWaalsContact C-N 3.32Å; L56-Q58 PolarHBondContact O-N 3.24Å; Q58-Q61 PolarHBondContact O-N 3.12Å; Q58-K62 VanDerWaalsContact O-CB 3.31Å; Q58-K62 WeakPolarHBondContact O-CB 3.38Å; Q58-K62 PolarHBondContact O-N 3.15Å
59A92.4Very high92.2Very high11 Ų1170.3 Ų70.39%0.09136%0.363CS..Hα-helixtrans-68.5-39.5178.500000112.6V22 L29 K55 L56 K62 A63V22-A59 HydrophobicContact CB-CB 4.15Å; V22-A59 HydrophobicContact CG1-CB 3.67Å; L29-A59 HydrophobicContact CD2-CB 4.21Å; K55-A59 WeakPolarHBondContact O-CB 3.35Å; K55-A59 PolarHBondContact O-N 3.19Å; L56-A59 PolarHBondContact O-N 3.15Å; L56-A59 VanDerWaalsContact O-N 3.17Å; A59-K62 PolarHBondContact O-N 3.47Å; A59-A63 VanDerWaalsContact O-CB 3.3Å; A59-A63 WeakPolarHBondContact O-CB 3.42Å; A59-A63 PolarHBondContact O-N 3.19Å
60I92.6Very high92.2Very high0 Ų071.7 Ų71.70%037%0.373CS..Hα-helixtrans-61.8-47.5173.2-71.2175.6000110.1L29 F32 V33 I40 L56 T57 A63 R64 L69L29-I60 HydrophobicContact CB-CG1 4.15Å; L29-I60 HydrophobicContact CD1-CG1 4.46Å; L29-I60 HydrophobicContact CD2-CG1 3.94Å; L29-I60 HydrophobicContact CG-CG1 4.41Å; F32-I60 HydrophobicContact CB-CD1 4.48Å; V33-I60 HydrophobicContact CG2-CD1 3.78Å; V33-I60 HydrophobicContact CG2-CG2 4.39Å; I40-I60 HydrophobicContact CD1-CB 4.21Å; I40-I60 HydrophobicContact CD1-CD1 4.04Å; I40-I60 HydrophobicContact CD1-CG2 3.81Å; I40-I60 HydrophobicContact CG1-CD1 4.02Å; I40-I60 HydrophobicContact CG1-CG2 4.17Å; I40-I60 HydrophobicContact CG2-CD1 4.02Å; L56-I60 HydrophobicContact CD2-CD1 3.41Å; L56-I60 VanDerWaalsContact CD2-CD1 3.41Å; L56-I60 HydrophobicContact CD2-CG1 4.29Å; L56-I60 HydrophobicContact CG-CD1 4.15Å; L56-I60 WeakPolarHBondContact O-CG1 3.34Å; L56-I60 PolarHBondContact O-N 3.44Å; T57-I60 PolarHBondContact O-N 3.3Å; I60-A63 PolarHBondContact O-N 2.77Å; I60-R64 WeakPolarHBondContact O-CG 3.38Å; I60-R64 PolarHBondContact O-N 3.35Å; I60-L69 HydrophobicContact CG2-CD2 3.77Å
61Q93.9Very high92.3Very high88 Ų8871.3 Ų71.341%0.41137%0.365SS..Hα-helixtrans-61.1-46.9179.1-176.55826.200111.2T57 Q58 A63 R64 E65T57-Q61 WeakPolarHBondContact O-CB 3.4Å; T57-Q61 PolarHBondContact O-N 3.08Å; Q58-Q61 PolarHBondContact O-N 3.12Å; Q61-A63 VanDerWaalsContact C-N 3.34Å; Q61-A63 PolarHBondContact O-N 2.94Å; Q61-R64 WeakPolarHBondContact O-CB 3.39Å; Q61-R64 PolarHBondContact O-N 3.31Å; Q61-R64 VanDerWaalsContact O-N 3.16Å; Q61-E65 WeakPolarHBondContact CG-OE1 3.37Å; Q61-E65 PolarHBondContact NE2-OE1 3.36Å; Q61-E65 WeakPolarHBondContact O-CG 3.28Å; Q61-E65 PolarHBondContact O-N 2.9Å
62K93.2Very high92.4Very high107 Ų10773.2 Ų73.247%0.46537%0.37SS..Hα-helixtrans-60.9-40.2174.8-174.2172.7-177.9173.90112.6A23 Q58 A59 R64 E65 C66A23-K62 HydrophobicContact CB-CB 4.28Å; A23-K62 HydrophobicContact CB-CD 4.14Å; A23-K62 HydrophobicContact CB-CG 4.16Å; Q58-K62 VanDerWaalsContact O-CB 3.31Å; Q58-K62 WeakPolarHBondContact O-CB 3.38Å; Q58-K62 PolarHBondContact O-N 3.15Å; A59-K62 PolarHBondContact O-N 3.47Å; K62-R64 VanDerWaalsContact C-N 3.31Å; K62-R64 PolarHBondContact O-N 2.88Å; K62-E65 PolarHBondContact O-N 3.49Å; K62-C66 WeakPolarHBondContact O-CB 3.44Å; K62-C66 PolarHBondContact O-N 3.15Å; K62-C66 PolarHBondContact O-SG 2.92Å
63A93Very high92.7Very high0 Ų074.7 Ų74.70%038%0.383CS..Hα-helixtrans-65.1-34.5176.600000112.2L29 A59 I60 Q61 G67 L68 L69L29-A63 HydrophobicContact CD1-CB 3.84Å; A59-A63 VanDerWaalsContact O-CB 3.3Å; A59-A63 WeakPolarHBondContact O-CB 3.42Å; A59-A63 PolarHBondContact O-N 3.19Å; I60-A63 PolarHBondContact O-N 2.77Å; Q61-A63 VanDerWaalsContact C-N 3.34Å; Q61-A63 PolarHBondContact O-N 2.94Å; A63-G67 PolarHBondContact O-N 2.85Å; A63-L68 HydrophobicContact CB-CB 4.33Å; A63-L68 PolarHBondContact O-N 3.37Å; A63-L69 HydrophobicContact CB-CB 3.84Å; A63-L69 PolarHBondContact O-N 3.49Å; A63-L69 VanDerWaalsContact O-N 3.14Å
64R94.2Very high92.8Very high44 Ų4476.3 Ų76.317%0.16640%0.397CS..Hα-helixtrans-68.3-44.7172.7-70.7176.6178.9-175-3.6112.1G38 I60 Q61 K62 C66 G67 L69 Y71G38-R64 PolarHBondContact O-NH2 3.48Å; I60-R64 WeakPolarHBondContact O-CG 3.38Å; I60-R64 PolarHBondContact O-N 3.35Å; Q61-R64 WeakPolarHBondContact O-CB 3.39Å; Q61-R64 PolarHBondContact O-N 3.31Å; Q61-R64 VanDerWaalsContact O-N 3.16Å; K62-R64 VanDerWaalsContact C-N 3.31Å; K62-R64 PolarHBondContact O-N 2.88Å; R64-C66 VanDerWaalsContact C-N 3.3Å; R64-C66 PolarHBondContact O-N 2.98Å; R64-G67 PolarHBondContact O-N 3.13Å; R64-L69 HydrophobicContact CG-CB 4.32Å; R64-L69 HydrophobicContact CG-CD2 4.22Å; R64-Y71 HydrophobicContact CB-CD1 3.84Å; R64-Y71 HydrophobicContact CB-CE1 3.76Å; R64-Y71 HydrophobicContact CG-CD1 3.65Å; R64-Y71 HydrophobicContact CG-CE1 4.11Å; R64-Y71 HydrophobicContact CG-CG 4.15Å
65E93.3Very high92.9Very high135 Ų13579 Ų7963%0.63141%0.411SS*.Hα-helixtrans-62.6-37.4177.2-72.4165.9-16900112.1Q61 K62 G67Q61-E65 WeakPolarHBondContact CG-OE1 3.37Å; Q61-E65 PolarHBondContact NE2-OE1 3.36Å; Q61-E65 WeakPolarHBondContact O-CG 3.28Å; Q61-E65 PolarHBondContact O-N 2.9Å; K62-E65 PolarHBondContact O-N 3.49Å; E65-G67 VanDerWaalsContact C-N 3.26Å; E65-G67 PolarHBondContact O-N 2.9Å
66C92.2Very high93.2Very high80 Ų8080.7 Ų80.754%0.54143%0.429SS..THydrogen-bonded Turntrans-810.8174.9-62.30000113.9K62 R64 L68K62-C66 WeakPolarHBondContact O-CB 3.44Å; K62-C66 PolarHBondContact O-N 3.15Å; K62-C66 PolarHBondContact O-SG 2.92Å; R64-C66 VanDerWaalsContact C-N 3.3Å; R64-C66 PolarHBondContact O-N 2.98Å; C66-L68 HydrophobicContact CB-CD1 4.21Å; C66-L68 HydrophobicContact CB-CG 4.14Å; C66-L68 PolarHBondContact O-N 3.41Å
67G92Very high93.3Very high66 Ų6687.7 Ų87.768%0.6846%0.461SS*.THydrogen-bonded Turntrans68.614.4-178.200000115.3A63 R64 E65A63-G67 PolarHBondContact O-N 2.85Å; R64-G67 PolarHBondContact O-N 3.13Å; E65-G67 VanDerWaalsContact C-N 3.26Å; E65-G67 PolarHBondContact O-N 2.9Å
68L92Very high93.4Very high87 Ų8789 Ų8946%0.45547%0.47SS..  trans-81.2-30.6179.1-65.3174.3000112.6V26 A63 C66V26-L68 WeakPolarHBondContact CG1-O 3.32Å; V26-L68 HydrophobicContact CG2-CB 3.82Å; V26-L68 WeakPolarHBondContact CG2-O 3.33Å; A63-L68 HydrophobicContact CB-CB 4.33Å; A63-L68 PolarHBondContact O-N 3.37Å; C66-L68 HydrophobicContact CB-CD1 4.21Å; C66-L68 HydrophobicContact CB-CG 4.14Å; C66-L68 PolarHBondContact O-N 3.41Å
69L92.1Very high93.4Very high7 Ų794.8 Ų94.84%0.03749%0.487CS..SBendtrans-114.4121179.6-173.172.3000109.7V26 E30 I60 A63 R64V26-L69 HydrophobicContact CG1-CD1 3.72Å; E30-L69 HydrophobicContact CG-CD1 3.53Å; I60-L69 HydrophobicContact CG2-CD2 3.77Å; A63-L69 HydrophobicContact CB-CB 3.84Å; A63-L69 PolarHBondContact O-N 3.49Å; A63-L69 VanDerWaalsContact O-N 3.14Å; R64-L69 HydrophobicContact CG-CB 4.32Å; R64-L69 HydrophobicContact CG-CD2 4.22Å
70S91.4Very high93.5Very high106 Ų10698.7 Ų98.774%0.74151%0.507SS*.  trans-69.8143.2177.8610000111.4
71Y93.4Very high93.5Very high115 Ų115103.3 Ų103.345%0.45154%0.544SS..  trans-153.3161.8173.870.9-74.7000109.5R64 V73R64-Y71 HydrophobicContact CB-CD1 3.84Å; R64-Y71 HydrophobicContact CB-CE1 3.76Å; R64-Y71 HydrophobicContact CG-CD1 3.65Å; R64-Y71 HydrophobicContact CG-CE1 4.11Å; R64-Y71 HydrophobicContact CG-CG 4.15Å; Y71-V73 HydrophobicContact CD2-CG2 4.04Å; Y71-V73 HydrophobicContact CE1-CG2 4.06Å; Y71-V73 HydrophobicContact CE2-CG2 3.46Å; Y71-V73 VanDerWaalsContact CE2-CG2 3.46Å; Y71-V73 VanDerWaalsContact CZ-CG2 3.46Å; Y71-V73 PolarHBondContact O-N 3.39Å
72Y93.2Very high93.5Very high192 Ų192105.9 Ų105.975%0.75356%0.561SS**  trans-72120.3176.4177.3-101.5000110.3P74Y72-P74 HydrophobicContact CE1-CB 3.91Å
73V93Very high93.6Very high90 Ų90108.3 Ų108.355%0.54557%0.572SS.*  trans-109.3115.9170.4-178.30000107Y71Y71-V73 HydrophobicContact CD2-CG2 4.04Å; Y71-V73 HydrophobicContact CE1-CG2 4.06Å; Y71-V73 HydrophobicContact CE2-CG2 3.46Å; Y71-V73 VanDerWaalsContact CE2-CG2 3.46Å; Y71-V73 VanDerWaalsContact CZ-CG2 3.46Å; Y71-V73 PolarHBondContact O-N 3.39Å
74P94.1Very high93.6Very high71 Ų71110.9 Ų110.946%0.46160%0.598SS.*  trans-65.7146.5177.727.3-33000110.1Y72 V76Y72-P74 HydrophobicContact CE1-CB 3.91Å; P74-V76 HydrophobicContact CG-CG2 4.39Å; P74-V76 PolarHBondContact O-N 3.25Å
75Q95.3Very high93.6Very high195 Ų195113.9 Ų113.991%0.91162%0.622SS**  trans-70.8127.9163.3-67.3-176.1-7.900107.7
76V96Very high93.7Very high120 Ų120113.9 Ų113.973%0.72763%0.631SS**  trans-117.3136.7179.5-175.80000107.3P74P74-V76 HydrophobicContact CG-CG2 4.39Å; P74-V76 PolarHBondContact O-N 3.25Å
77E95.3Very high93.9Very high160 Ų160116.3 Ų116.375%0.74863%0.634SS**  trans-60.4146.2177.1-64.4-54.8138.100111
78P95.2Very high94.1Very high80 Ų80115 Ų11552%0.51962%0.621SS.*  trans-53.6146.2171.8-23.733.8000111.4D80 F83P78-D80 VanDerWaalsContact C-N 3.32Å; P78-D80 PolarHBondContact O-N 3.29Å; P78-F83 HydrophobicContact CB-CE1 4.38Å; P78-F83 HydrophobicContact CB-CZ 3.85Å; P78-F83 HydrophobicContact CG-CZ 4.28Å
79R94.3Very high94.2Very high236 Ų236114.8 Ų114.889%0.89163%0.631SS**SBendtrans-59-45.4178.4173.6-173.5-101.7-95.41.2111.7
80D93.9Very high94.4Very high94 Ų94119.3 Ų119.350%0.50366%0.659SS.*  trans-115.1141.6-172.9-55.9-63.3000109.6P78P78-D80 VanDerWaalsContact C-N 3.32Å; P78-D80 PolarHBondContact O-N 3.29Å
81A93.3Very high94.6Very high96 Ų96116.7 Ų116.779%0.79364%0.641SS**SBendtrans-77.2-33179.800000112.5
82D93.7Very high94.7Very high143 Ų143117.7 Ų117.777%0.76566%0.658SS**  trans-112.4133.6-179.1-62.8-39.4000110.4
83F94.5Very high94.8Very high157 Ų157113.4 Ų113.469%0.68965%0.652SS**  trans-10318.4178.7-56-77.3000112.7P78 T85P78-F83 HydrophobicContact CB-CE1 4.38Å; P78-F83 HydrophobicContact CB-CZ 3.85Å; P78-F83 HydrophobicContact CG-CZ 4.28Å; F83-T85 PolarHBondContact O-N 2.87Å
84G94Very high94.9Very high54 Ų54114.5 Ų114.556%0.55766%0.661SS**  trans-72.4113.1-178.300000112V86G84-V86 PolarHBondContact O-N 3.07Å
85T94.4Very high95Very high107 Ų107114.5 Ų114.566%0.65666%0.661SS**THydrogen-bonded Turntrans-90.131.7177.561.30000112.9F83F83-T85 PolarHBondContact O-N 2.87Å
86V93.9Very high95.1Very high135 Ų135106.2 Ų106.282%0.81863%0.626SS**THydrogen-bonded Turntrans-86.2-17.5-176.1-630000112.9G84G84-V86 PolarHBondContact O-N 3.07Å
87H95.9Very high95.1Very high132 Ų132105.4 Ų105.461%0.61162%0.623SS**SBendtrans-67.2139.7-178.5-173.8-94.7000111.5A89 V90 S91H87-A89 WeakPolarHBondContact ND1-CB 3.31Å; H87-A89 PolarHBondContact ND1-N 3.21Å; H87-A89 VanDerWaalsContact ND1-N 3.13Å; H87-A89 PolarHBondContact O-N 3.08Å; H87-V90 HydrophobicContact CB-CG2 4.43Å; H87-V90 VanDerWaalsContact O-CG2 3.31Å; H87-V90 WeakPolarHBondContact O-CG2 3.39Å; H87-V90 PolarHBondContact O-N 3.21Å; H87-S91 PolarHBondContact O-N 3.17Å; H87-S91 VanDerWaalsContact O-N 3.08Å; H87-S91 PolarHBondContact O-OG 3.07Å; H87-S91 VanDerWaalsContact O-OG 3.12Å
88G96.2Very high95.1Very high39 Ų3999.7 Ų99.740%0.40260%0.599SS.*THydrogen-bonded Turntrans-56.1-22.8-177.100000115.6S91 T93G88-S91 WeakPolarHBondContact CA-OG 3.32Å; G88-T93 PolarHBondContact O-OG1 3.44Å
89A94.9Very high95Very high81 Ų81101.4 Ų101.467%0.66960%0.603SS**THydrogen-bonded Turntrans-74.2-25.3178.100000114.2H87H87-A89 WeakPolarHBondContact ND1-CB 3.31Å; H87-A89 PolarHBondContact ND1-N 3.21Å; H87-A89 VanDerWaalsContact ND1-N 3.13Å; H87-A89 PolarHBondContact O-N 3.08Å
90V96.3Very high95.1Very high102 Ų10296.2 Ų96.262%0.61859%0.593SS**THydrogen-bonded Turntrans-109.2-15.5178.9-63.80000112.3H87H87-V90 HydrophobicContact CB-CG2 4.43Å; H87-V90 VanDerWaalsContact O-CG2 3.31Å; H87-V90 WeakPolarHBondContact O-CG2 3.39Å; H87-V90 PolarHBondContact O-N 3.21Å
91S95.6Very high95.1Very high52 Ų5295.4 Ų95.436%0.36459%0.594SS.*SBendtrans-93.8172173660000111.7H87 G88 T93H87-S91 PolarHBondContact O-N 3.17Å; H87-S91 VanDerWaalsContact O-N 3.08Å; H87-S91 PolarHBondContact O-OG 3.07Å; H87-S91 VanDerWaalsContact O-OG 3.12Å; G88-S91 WeakPolarHBondContact CA-OG 3.32Å; S91-T93 PolarHBondContact O-N 2.83Å; S91-T93 VanDerWaalsContact O-N 3.15Å
92V95.4Very high95.1Very high136 Ų13694 Ų9482%0.82459%0.59SS**  trans-68.8114.1179-179.10000109
93T96.1Very high95.1Very high102 Ų10292.9 Ų92.963%0.62658%0.58SS**PPolyproline II helixtrans-75125.3171.6-60.20000109G88 S91G88-T93 PolarHBondContact O-OG1 3.44Å; S91-T93 PolarHBondContact O-N 2.83Å; S91-T93 VanDerWaalsContact O-N 3.15Å
94P95.6Very high95.2Very high113 Ų11387.6 Ų87.673%0.73456%0.561SS**PPolyproline II helixtrans-55.6133.4177.6-26.334.9000111.6
95P96.3Very high95.2Very high71 Ų7192.1 Ų92.146%0.46156%0.562SS.*PPolyproline II helixtrans-69.5139.4-17728.9-34.9000110.8L99 L100P95-L99 HydrophobicContact CB-CD2 3.77Å; P95-L100 HydrophobicContact CB-CD2 4.06Å; P95-L100 HydrophobicContact CB-CG 4.29Å; P95-L100 HydrophobicContact CG-CD1 4.5Å; P95-L100 HydrophobicContact CG-CD2 3.79Å; P95-L100 HydrophobicContact CG-CG 4.23Å
96A95.9Very high95.3Very high20 Ų2092.1 Ų92.117%0.16555%0.55CS.*PPolyproline II helixtrans-68.1153.4172.100000110.9T98 L99 L100 W105A96-T98 PolarHBondContact O-N 3.11Å; A96-L99 WeakPolarHBondContact O-CB 3.44Å; A96-L99 PolarHBondContact O-N 3.06Å; A96-L100 PolarHBondContact O-N 3.45Å; A96-W105 HydrophobicContact CB-CE3 4.14Å; A96-W105 HydrophobicContact CB-CH2 3.43Å; A96-W105 VanDerWaalsContact CB-CH2 3.43Å; A96-W105 HydrophobicContact CB-CZ2 4.42Å; A96-W105 HydrophobicContact CB-CZ3 3.25Å
97P95.9Very high95.4Very high104 Ų10490.3 Ų90.368%0.67554%0.541SS*.Hα-helixtrans-56-37.4178.4-26.234.8000113.8L99 L100 S101P97-L99 VanDerWaalsContact C-N 3.31Å; P97-L99 PolarHBondContact O-N 2.96Å; P97-L100 WeakPolarHBondContact O-CB 3.25Å; P97-L100 PolarHBondContact O-N 2.89Å; P97-L100 VanDerWaalsContact O-N 3.16Å; P97-S101 PolarHBondContact O-N 3.42Å; P97-S101 PolarHBondContact O-OG 3.19Å
98T95.1Very high95.3Very high40 Ų4092.3 Ų92.325%0.24554%0.544CS..Hα-helixtrans-62.6-37.1176.644.70000112.3A96 L100 S101 G102 E103A96-T98 PolarHBondContact O-N 3.11Å; T98-L100 VanDerWaalsContact C-N 3.34Å; T98-S101 WeakPolarHBondContact CA-OG 3.41Å; T98-S101 PolarHBondContact O-N 3.48Å; T98-S101 PolarHBondContact O-OG 3.4Å; T98-S101 VanDerWaalsContact O-OG 3.06Å; T98-G102 PolarHBondContact O-N 2.89Å; T98-G102 VanDerWaalsContact O-N 3.08Å; T98-E103 PolarHBondContact O-N 2.85Å
99L94.4Very high95.2Very high115 Ų11597 Ų9760%0.60255%0.55SS*.Hα-helixtrans-68.8-33.9175-170.7142.7000111.9P95 A96 P97P95-L99 HydrophobicContact CB-CD2 3.77Å; A96-L99 WeakPolarHBondContact O-CB 3.44Å; A96-L99 PolarHBondContact O-N 3.06Å; P97-L99 VanDerWaalsContact C-N 3.31Å; P97-L99 PolarHBondContact O-N 2.96Å
100L95.3Very high95.2Very high128 Ų12895.5 Ų95.567%0.6754%0.535SS*.Hα-helixtrans-71-33.1175.1-64.2176000112.7P95 A96 P97 T98P95-L100 HydrophobicContact CB-CD2 4.06Å; P95-L100 HydrophobicContact CB-CG 4.29Å; P95-L100 HydrophobicContact CG-CD1 4.5Å; P95-L100 HydrophobicContact CG-CD2 3.79Å; P95-L100 HydrophobicContact CG-CG 4.23Å; A96-L100 PolarHBondContact O-N 3.45Å; P97-L100 WeakPolarHBondContact O-CB 3.25Å; P97-L100 PolarHBondContact O-N 2.89Å; P97-L100 VanDerWaalsContact O-N 3.16Å; T98-L100 VanDerWaalsContact C-N 3.34Å
101S93.7Very high95.1Very high76 Ų7696.7 Ų96.753%0.53153%0.528SS..Hα-helixtrans-84.3-9.5177.563.90000113.7P97 T98 E103P97-S101 PolarHBondContact O-N 3.42Å; P97-S101 PolarHBondContact O-OG 3.19Å; T98-S101 WeakPolarHBondContact CA-OG 3.41Å; T98-S101 PolarHBondContact O-N 3.48Å; T98-S101 PolarHBondContact O-OG 3.4Å; T98-S101 VanDerWaalsContact O-OG 3.06Å; S101-E103 PolarHBondContact O-N 3.41Å; S101-E103 WeakPolarHBondContact OG-CG 3.41Å
102G94.1Very high95Very high68 Ų68100 Ų10070%0.70154%0.538SS*.THydrogen-bonded Turntrans74.611.7-17400000114T98T98-G102 PolarHBondContact O-N 2.89Å; T98-G102 VanDerWaalsContact O-N 3.08Å
103E94.7Very high94.9Very high118 Ų11898.2 Ų98.255%0.55152%0.52SS*.  trans-85.5151.3-179.8-69.8-64.4140.100110.6T98 S101T98-E103 PolarHBondContact O-N 2.85Å; S101-E103 PolarHBondContact O-N 3.41Å; S101-E103 WeakPolarHBondContact OG-CG 3.41Å
104P95.8Very high94.9Very high47 Ų4796 Ų9631%0.30551%0.508SS..  trans-57.1151.3171.1-22.434.2000111.3Y106 Y109P104-Y106 PolarHBondContact O-N 2.94Å; P104-Y106 VanDerWaalsContact O-N 3.11Å; P104-Y109 HydrophobicContact CB-CD2 3.9Å; P104-Y109 HydrophobicContact CB-CG 4.33Å
105W94.6Very high95Very high148 Ų14894.8 Ų94.856%0.56150%0.5SS*.SBendtrans-57.4-32.8-177.5-168.8-84.3000113.1A96 Y109A96-W105 HydrophobicContact CB-CE3 4.14Å; A96-W105 HydrophobicContact CB-CH2 3.43Å; A96-W105 VanDerWaalsContact CB-CH2 3.43Å; A96-W105 HydrophobicContact CB-CZ2 4.42Å; A96-W105 HydrophobicContact CB-CZ3 3.25Å; W105-Y109 HydrophobicContact CB-CE2 4.31Å
106Y96.1Very high94.9Very high108 Ų10896.4 Ų96.442%0.42450%0.501SS..SBendtrans-126.6142.1174.7-62-65.4000111.3P104 W108 Y109P104-Y106 PolarHBondContact O-N 2.94Å; P104-Y106 VanDerWaalsContact O-N 3.11Å; Y106-W108 VanDerWaalsContact CB-NE1 3.29Å; Y106-W108 AromaticContact CD2-CZ2 3.93Å; Y106-W108 HydrophobicContact CD2-CZ2 3.93Å; Y106-W108 HydrophobicContact CG-CZ2 4.32Å; Y106-W108 AromaticContact CG-NE1 3.62Å; Y106-W108 PolarHBondContact O-N 3.17Å; Y106-W108 VanDerWaalsContact O-N 3.14Å; Y106-Y109 HydrophobicContact CD2-CE1 4.47Å; Y106-Y109 HydrophobicContact CD2-CE2 4.07Å; Y106-Y109 AromaticContact CD2-CZ 3.89Å; Y106-Y109 WeakPolarHBondContact O-CB 3.3Å; Y106-Y109 PolarHBondContact O-N 2.91Å; Y106-Y109 VanDerWaalsContact O-N 3.13Å
107P94.9Very high95Very high96 Ų96105.4 Ų105.462%0.62353%0.531SS*.G310 helixtrans-60.9-26.6-178.4-25.234.2000114.7Y109 S110 Q112P107-Y109 VanDerWaalsContact C-N 3.26Å; P107-Y109 PolarHBondContact O-N 3.46Å; P107-S110 PolarHBondContact O-N 3.43Å; P107-Q112 PolarHBondContact O-NE2 3.47Å
108W94.6Very high95Very high175 Ų175104.4 Ų104.466%0.66352%0.518SS*.G310 helixtrans-80.4-3.3-17859.1-98000113.7Y106Y106-W108 VanDerWaalsContact CB-NE1 3.29Å; Y106-W108 AromaticContact CD2-CZ2 3.93Å; Y106-W108 HydrophobicContact CD2-CZ2 3.93Å; Y106-W108 HydrophobicContact CG-CZ2 4.32Å; Y106-W108 AromaticContact CG-NE1 3.62Å; Y106-W108 PolarHBondContact O-N 3.17Å; Y106-W108 VanDerWaalsContact O-N 3.14Å
109Y95Very high95Very high136 Ų136103.8 Ų103.853%0.53351%0.512SS..G310 helixtrans-72.2-31.5166.9-72-17.9000112.1P104 W105 Y106 P107P104-Y109 HydrophobicContact CB-CD2 3.9Å; P104-Y109 HydrophobicContact CB-CG 4.33Å; W105-Y109 HydrophobicContact CB-CE2 4.31Å; Y106-Y109 HydrophobicContact CD2-CE1 4.47Å; Y106-Y109 HydrophobicContact CD2-CE2 4.07Å; Y106-Y109 AromaticContact CD2-CZ 3.89Å; Y106-Y109 WeakPolarHBondContact O-CB 3.3Å; Y106-Y109 PolarHBondContact O-N 2.91Å; Y106-Y109 VanDerWaalsContact O-N 3.13Å; P107-Y109 VanDerWaalsContact C-N 3.26Å; P107-Y109 PolarHBondContact O-N 3.46Å
110S93.6Very high95Very high50 Ų50101 Ų10135%0.3550%0.503SS..SBendtrans-75.2142.2173.8-570000110.3P107 Q112P107-S110 PolarHBondContact O-N 3.43Å; S110-Q112 PolarHBondContact O-N 3.16Å
111W93.9Very high95.1Very high127 Ų127102.2 Ų102.248%0.48150%0.498SS..  trans-62.3128.8171.2174.7-95.7000110.3P136 P137W111-P136 HydrophobicContact CG-CB 4.16Å; W111-P137 HydrophobicContact CB-CG 4.2Å
112Q93.9Very high95.1Very high121 Ų121103 Ų10357%0.56550%0.496SS*.  trans-126.5122.5175.9-60.6-178.524.100108.7P107 S110 P114P107-Q112 PolarHBondContact O-NE2 3.47Å; S110-Q112 PolarHBondContact O-N 3.16Å; Q112-P114 VanDerWaalsContact O-CD 3.23Å; Q112-P114 WeakPolarHBondContact O-CD 3.47Å
113Q94.8Very high95.2Very high99 Ų99104 Ų10446%0.46348%0.479SS..PPolyproline II helixtrans-69.2119.4177-172.168.423.400109.7E133Q113-E133 PolarHBondContact NE2-OE1 2.9Å
114P95.4Very high95.2Very high57 Ų57106.8 Ų106.837%0.3748%0.484SS..PPolyproline II helixtrans-67156.7176.9-20.234.1000112.1Q112 L119Q112-P114 VanDerWaalsContact O-CD 3.23Å; Q112-P114 WeakPolarHBondContact O-CD 3.47Å; P114-L119 HydrophobicContact CB-CD2 4.13Å; P114-L119 HydrophobicContact CB-CG 4.37Å; P114-L119 HydrophobicContact CG-CD2 4.27Å
115P96.4Very high95.3Very high87 Ų87110.2 Ų110.257%0.56550%0.5SS*.PPolyproline II helixtrans-66.1142.9177.827.3-34.3000111.8R117 E118 L119P115-R117 PolarHBondContact O-N 3.16Å; P115-E118 HydrophobicContact CG-CB 4.27Å; P115-E118 HydrophobicContact CG-CG 3.9Å; P115-E118 PolarHBondContact O-N 2.98Å; P115-L119 PolarHBondContact O-N 3.23Å
116E95.7Very high95.3Very high104 Ų104109.4 Ų109.449%0.48650%0.497SS..Hα-helixtrans-57.7-29.6-174.4-174.252.5-141.800113.8E118 L119 S120 R123E116-E118 PolarHBondContact O-N 3.41Å; E116-L119 PolarHBondContact O-N 2.86Å; E116-S120 VanDerWaalsContact O-CB 3.28Å; E116-S120 WeakPolarHBondContact O-CB 3.28Å; E116-S120 PolarHBondContact O-N 3.37Å; E116-S120 PolarHBondContact O-OG 3.26Å; E116-S120 PolarHBondContact OE1-OG 3.5Å; E116-R123 IonicContact OE1-CZ 3.64Å; E116-R123 IonicContact OE1-NH1 2.64Å; E116-R123 PolarHBondContact OE1-NH1 3.03Å; E116-R123 IonicContact OE1-NH2 3.74Å; E116-R123 IonicContact OE2-NH1 3.99Å; E116-R123 IonicContact OE2-NH2 3.84Å
117R97.1Very high95.2Very high210 Ų210111 Ų11179%0.79251%0.508SS*.Hα-helixtrans-61-42.5175-178.3-178.5174.6-178.5-1.5112.3P115 R121P115-R117 PolarHBondContact O-N 3.16Å; R117-R121 PolarHBondContact O-N 2.96Å; R117-R121 VanDerWaalsContact O-N 3.07Å
118E96Very high95.1Very high83 Ų83110.2 Ų110.239%0.38852%0.519SS..Hα-helixtrans-75-38.2179.3-65.2-58144.700110.5P115 E116 S120 R121 L122P115-E118 HydrophobicContact CG-CB 4.27Å; P115-E118 HydrophobicContact CG-CG 3.9Å; P115-E118 PolarHBondContact O-N 2.98Å; E116-E118 PolarHBondContact O-N 3.41Å; E118-S120 PolarHBondContact O-N 2.93Å; E118-R121 WeakPolarHBondContact O-CB 3.48Å; E118-R121 PolarHBondContact O-N 3.2Å; E118-R121 IonicContact OE2-NH1 3.74Å; E118-L122 PolarHBondContact O-N 3.45Å
119L94.6Very high95Very high26 Ų26108.7 Ų108.714%0.13652%0.523CS..Hα-helixtrans-58.4-48.3171.8-63.2178.9000110.9P114 P115 E116 R121 L122 R123P114-L119 HydrophobicContact CB-CD2 4.13Å; P114-L119 HydrophobicContact CB-CG 4.37Å; P114-L119 HydrophobicContact CG-CD2 4.27Å; P115-L119 PolarHBondContact O-N 3.23Å; E116-L119 PolarHBondContact O-N 2.86Å; L119-R121 VanDerWaalsContact C-N 3.32Å; L119-R121 PolarHBondContact O-N 3.06Å; L119-L122 WeakPolarHBondContact O-CB 3.36Å; L119-L122 PolarHBondContact O-N 3.14Å; L119-R123 WeakPolarHBondContact O-CG 3.4Å; L119-R123 PolarHBondContact O-N 3.43Å
120S94.9Very high94.9Very high57 Ų57106.8 Ų106.840%0.39952%0.522SS..Hα-helixtrans-58.1-42176.1-69.80000112.7E116 E118 L122 R123 R124E116-S120 VanDerWaalsContact O-CB 3.28Å; E116-S120 WeakPolarHBondContact O-CB 3.28Å; E116-S120 PolarHBondContact O-N 3.37Å; E116-S120 PolarHBondContact O-OG 3.26Å; E116-S120 PolarHBondContact OE1-OG 3.5Å; E118-S120 PolarHBondContact O-N 2.93Å; S120-L122 VanDerWaalsContact C-N 3.32Å; S120-L122 PolarHBondContact O-N 2.82Å; S120-R123 PolarHBondContact O-N 3.28Å; S120-R124 PolarHBondContact O-N 3.39Å
121R96.3Very high94.9Very high153 Ų153112.3 Ų112.358%0.57755%0.546SS*.Hα-helixtrans-61-42.2174.9-178.1-174.8177.1179.60.7111.3R117 E118 L119 R124 L125R117-R121 PolarHBondContact O-N 2.96Å; R117-R121 VanDerWaalsContact O-N 3.07Å; E118-R121 WeakPolarHBondContact O-CB 3.48Å; E118-R121 PolarHBondContact O-N 3.2Å; E118-R121 IonicContact OE2-NH1 3.74Å; L119-R121 VanDerWaalsContact C-N 3.32Å; L119-R121 PolarHBondContact O-N 3.06Å; R121-R124 PolarHBondContact O-N 2.96Å; R121-L125 PolarHBondContact O-N 3.07Å
122L95.6Very high94.6Very high94 Ų94115.1 Ų115.149%0.49257%0.565SS.*Hα-helixtrans-68.9-44.4178.7-13472.6000112.1E118 L119 S120 R124 L125 Y126E118-L122 PolarHBondContact O-N 3.45Å; L119-L122 WeakPolarHBondContact O-CB 3.36Å; L119-L122 PolarHBondContact O-N 3.14Å; S120-L122 VanDerWaalsContact C-N 3.32Å; S120-L122 PolarHBondContact O-N 2.82Å; L122-R124 PolarHBondContact O-N 3.27Å; L122-L125 PolarHBondContact O-N 3.23Å; L122-Y126 HydrophobicContact CD1-CE2 4.3Å; L122-Y126 HydrophobicContact CG-CD2 4.07Å; L122-Y126 HydrophobicContact CG-CE2 4.08Å; L122-Y126 WeakPolarHBondContact O-CD2 3.32Å; L122-Y126 PolarHBondContact O-N 3.4Å
123R94.9Very high94.3Very high89 Ų89114 Ų11434%0.33656%0.56SS.*Hα-helixtrans-58.2-35.7174.9-66.4-169.9-163.9111.22111.5E116 L119 S120 Q127 L130 E133E116-R123 IonicContact OE1-CZ 3.64Å; E116-R123 IonicContact OE1-NH1 2.64Å; E116-R123 PolarHBondContact OE1-NH1 3.03Å; E116-R123 IonicContact OE1-NH2 3.74Å; E116-R123 IonicContact OE2-NH1 3.99Å; E116-R123 IonicContact OE2-NH2 3.84Å; L119-R123 WeakPolarHBondContact O-CG 3.4Å; L119-R123 PolarHBondContact O-N 3.43Å; S120-R123 PolarHBondContact O-N 3.28Å; R123-Q127 WeakPolarHBondContact O-CG 3.26Å; R123-Q127 PolarHBondContact O-N 3.23Å; R123-L130 HydrophobicContact CB-CD2 4.29Å; R123-L130 HydrophobicContact CG-CD2 3.72Å; R123-E133 IonicContact CZ-OE2 3.85Å; R123-E133 IonicContact NH2-OE2 2.82Å; R123-E133 PolarHBondContact NH2-OE2 3.13Å
124R95.9Very high93.8Very high175 Ų175113.8 Ų113.866%0.6657%0.569SS**Hα-helixtrans-71.5-37.6173.3-172.2176.667.7-173.91.5113.1S120 R121 L122 Q127S120-R124 PolarHBondContact O-N 3.39Å; R121-R124 PolarHBondContact O-N 2.96Å; L122-R124 PolarHBondContact O-N 3.27Å; R124-Q127 WeakPolarHBondContact O-CG 3.48Å
125L96.4Very high93.4Very high120 Ų120113.4 Ų113.463%0.62858%0.575SS**Hα-helixtrans-69.3-37.1-178.8-17662000112.2R121 L122R121-L125 PolarHBondContact O-N 3.07Å; L122-L125 PolarHBondContact O-N 3.23Å
126Y95.4Very high93.2Very high130 Ų130113.7 Ų113.751%0.5158%0.577SS.*THydrogen-bonded Turntrans-109.631.3-175.2-64.9-76.1000113.1L122 G128 N129 L130L122-Y126 HydrophobicContact CD1-CE2 4.3Å; L122-Y126 HydrophobicContact CG-CD2 4.07Å; L122-Y126 HydrophobicContact CG-CE2 4.08Å; L122-Y126 WeakPolarHBondContact O-CD2 3.32Å; L122-Y126 PolarHBondContact O-N 3.4Å; Y126-G128 PolarHBondContact O-N 3.11Å; Y126-N129 PolarHBondContact O-N 3.22Å; Y126-N129 VanDerWaalsContact O-N 3.11Å; Y126-L130 HydrophobicContact CG-CD1 4.42Å
127Q93.3Very high93Very high141 Ų141112.5 Ų112.566%0.65958%0.579SS**THydrogen-bonded Turntrans-53.5131.8177.4-72.2174.4-1100111R123 R124 N129R123-Q127 WeakPolarHBondContact O-CG 3.26Å; R123-Q127 PolarHBondContact O-N 3.23Å; R124-Q127 WeakPolarHBondContact O-CG 3.48Å; Q127-N129 VanDerWaalsContact C-N 3.32Å; Q127-N129 PolarHBondContact O-N 3.33Å
128G92.6Very high92.7Very high81 Ų81107.1 Ų107.184%0.83557%0.571SS**THydrogen-bonded Turntrans84.3-7.9-18000000115.8Y126Y126-G128 PolarHBondContact O-N 3.11Å
129N94.1Very high92.2Very high143 Ų143113.2 Ų113.277%0.76560%0.599SS**SBendtrans-131.933.2178.9-62.2-77.9000112.6Y126 Q127Y126-N129 PolarHBondContact O-N 3.22Å; Y126-N129 VanDerWaalsContact O-N 3.11Å; Q127-N129 VanDerWaalsContact C-N 3.32Å; Q127-N129 PolarHBondContact O-N 3.33Å
130L93Very high91.9Very high95 Ų95116.2 Ų116.250%0.49762%0.623SS.*PPolyproline II helixtrans-100.4139.6-179-130.878.2000111.7R123 Y126R123-L130 HydrophobicContact CB-CD2 4.29Å; R123-L130 HydrophobicContact CG-CD2 3.72Å; Y126-L130 HydrophobicContact CG-CD1 4.42Å
131L92.4Very high91.5Very high166 Ų166121.5 Ų121.587%0.86964%0.643SS**PPolyproline II helixtrans-90.9171.3169-63.7176.4000110.8
132E88.8Confident91Very high187 Ų187119.2 Ų119.287%0.87465%0.648SS**PPolyproline II helixtrans-62.5137173.5-167.2175.3142.500111.1S134E132-S134 PolarHBondContact O-N 3.5Å
133E86.7Confident90.3Very high98 Ų98123.1 Ų123.146%0.45866%0.663SS.*PPolyproline II helixtrans-70.1124.7179.2-170.7178.7139.300109.8Q113 R123Q113-E133 PolarHBondContact NE2-OE1 2.9Å; R123-E133 IonicContact CZ-OE2 3.85Å; R123-E133 IonicContact NH2-OE2 2.82Å; R123-E133 PolarHBondContact NH2-OE2 3.13Å
134S84.2Confident89.1Confident94 Ų94126.4 Ų126.466%0.65769%0.685SS**PPolyproline II helixtrans-87.5133.8174.6-58.90000110E132E132-S134 PolarHBondContact O-N 3.5Å
135G86.4Confident88Confident48 Ų48124 Ų12450%0.49569%0.692SS.*  trans-72.3-173173.600000113.2
136P92.4Very high86.1Confident94 Ų94124.1 Ų124.161%0.6170%0.697SS**PPolyproline II helixtrans-54.8137.9174.822.7-32.4000110.7W111W111-P136 HydrophobicContact CG-CB 4.16Å
137P92Very high83.9Confident79 Ų79123.8 Ų123.851%0.51371%0.709SS.*PPolyproline II helixtrans-62.7152.8174.328.2-33.6000110.1W111 E139W111-P137 HydrophobicContact CB-CG 4.2Å; P137-E139 PolarHBondContact O-N 3.07Å
138P90.9Very high82Confident97 Ų97122.3 Ų122.363%0.6371%0.712SS**PPolyproline II helixtrans-59.9138.8176.127.4-34.9000110.5S140P138-S140 PolarHBondContact O-N 3.18Å
139E86.1Confident79.9Confident210 Ų210124.3 Ų124.398%0.98171%0.71SS**SBendtrans-63.7-28.5-177-66.5-176.5164.900113P137P137-E139 PolarHBondContact O-N 3.07Å
140S87.4Confident77.4Confident90 Ų90122.1 Ų122.163%0.62971%0.712SS**SBendtrans-123.2152174.959.20000110.5P138P138-S140 PolarHBondContact O-N 3.18Å
141M87.7Confident74.9Confident168 Ų168126.7 Ų126.783%0.82873%0.73SS**PPolyproline II helixtrans-62129.2171.5-71.9-62.4-64.200108.9E143M141-E143 PolarHBondContact O-N 3.2Å; M141-E143 VanDerWaalsContact O-N 3.15Å
142P85.3Confident72.3Confident104 Ų104123.9 Ų123.968%0.67573%0.725SS**PPolyproline II helixtrans-62.2121178.423.4-31.3000109.5
143E81Confident69.9Low176 Ų176120.6 Ų120.682%0.82272%0.722SS**PPolyproline II helixtrans-81.6126.6176.2-161.7171.7170.100109M141M141-E143 PolarHBondContact O-N 3.2Å; M141-E143 VanDerWaalsContact O-N 3.15Å
144M70.1Confident67.6Low158 Ų158123.5 Ų123.578%0.77874%0.74SS**PPolyproline II helixtrans-70.6138.8174-70.6-71.9-76.200108.8T146M144-T146 PolarHBondContact O-N 3.38Å
145P71.1Confident65.3Low125 Ų125127.8 Ų127.881%0.81275%0.749SS**  trans-58.6108.6176.6-20.531.2000110.1T147P145-T147 PolarHBondContact O-N 3.2Å
146T56.7Low63.1Low122 Ų122134.1 Ų134.175%0.74877%0.766SS**  trans-79.9109.6166.9-59.40000106.5M144M144-T146 PolarHBondContact O-N 3.38Å
147T49.5Very low60.6Low124 Ų124135.8 Ų135.876%0.76178%0.777SS**  trans-45.8126173-5.30000109.9P145P145-T147 PolarHBondContact O-N 3.2Å
148P54.3Low57.9Low110 Ų110135.4 Ų135.471%0.71479%0.787SS**  trans-63.6141.5174.425.4-31.7000109.4A150P148-A150 PolarHBondContact O-N 2.76Å
149P47.4Very low55.6Low123 Ų123136.7 Ų136.780%0.79980%0.798SS**  trans-58.2130.4167.2-15.728.7000108.3E151P149-E151 PolarHBondContact O-N 3.1Å
150A43.1Very low53.6Low96 Ų96135.9 Ų135.979%0.79379%0.794SS**  trans-42.9126177.100000111P148 S152P148-A150 PolarHBondContact O-N 2.76Å; A150-S152 PolarHBondContact O-N 3.05Å
151E39.2Very low51.4Low191 Ų191137.5 Ų137.589%0.89381%0.806SS**  trans-50.7111.3172.4-68.5172.2109.500109.1P149 S153P149-E151 PolarHBondContact O-N 3.1Å; E151-S153 PolarHBondContact O-N 3.4Å; E151-S153 VanDerWaalsContact O-N 3.13Å
152S37.6Very low48.9Very low108 Ų108138.1 Ų138.176%0.75584%0.837SS**  trans-66.6109.4167.255.40000107.8A150 I154A150-S152 PolarHBondContact O-N 3.05Å; S152-I154 PolarHBondContact O-N 3.27Å
153S39.1Very low47.1Very low117 Ų117139.8 Ų139.882%0.81885%0.846SS**  trans-50.6118.9172.1-55.80000110.7E151 E155E151-S153 PolarHBondContact O-N 3.4Å; E151-S153 VanDerWaalsContact O-N 3.13Å; S153-E155 PolarHBondContact O-N 3.09Å
154I39Very low45.3Very low160 Ų160137.9 Ų137.982%0.82185%0.847SS**  trans-80.5103.7164-65.5171.6000106.2S152S152-I154 PolarHBondContact O-N 3.27Å
155E35.9Very low43.9Very low184 Ų184136.8 Ų136.886%0.8685%0.851SS**PPolyproline II helixtrans-75.5121167.8-125.2176.4102.100108.8S153S153-E155 PolarHBondContact O-N 3.09Å
156Q40.4Very low42.3Very low181 Ų181137.5 Ų137.585%0.84685%0.853SS**PPolyproline II helixtrans-78.3131.7166.7-70-156.7-5900109.9
157P39.6Very low41.5Very low129 Ų129138.4 Ų138.484%0.83886%0.859SS**PPolyproline II helixtrans-80.2123.7164.729.7-29.1000110.1
158G35.5Very low40.9Very low70 Ų70139.4 Ų139.472%0.72287%0.866SS**PPolyproline II helixtrans-68.3149.217700000113.8
159S42Very low40Very low124 Ų124141.5 Ų141.587%0.86788%0.877SS**PPolyproline II helixtrans-52132.5171.4-51.50000112.8
160Q44.8Very low39.4Very low193 Ų193142.9 Ų142.990%0.90288%0.883SS**  trans-121.5122.2158.5-82-174.6-19.200109.3
161S40.6Very low39.1Very low125 Ų125146.8 Ų146.887%0.87489%0.89SS**  trans-72.5141.2171.9-61.20000111.8
162A35.5Very low39.1Very low180 Ų180142.8 Ų142.8100%1.48889%0.89SS**  trans-151.90143.200000108

Retrieved 162 of 162 residues in 121 ms (Link to these results)