A0A077ZB78_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZB78, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 175 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
1M30.6Very low48.1Very low240 Ų240137.9 Ų137.9100%1.18279%0.786SS**  098.60-60.7-173.6-168.200107
2L41.5Very low49.2Very low176 Ų176135.3 Ų135.392%0.92178%0.778SS**  trans-123121.6176.2-91.7154.2000106.1G4L2-G4 PolarHBondContact O-N 3.42Å
3F49.7Very low50.3Low196 Ų196134.8 Ų134.886%0.8677%0.771SS**  trans-54.4118.2-171.7-74.5-95.7000110.8F5F3-F5 PolarHBondContact O-N 3.25Å
4G40.3Very low51.6Low76 Ų76129.1 Ų129.178%0.78474%0.741SS**  trans-66.1112165.300000108.3L2 G6L2-G4 PolarHBondContact O-N 3.42Å; G4-G6 VanDerWaalsContact C-N 3.3Å; G4-G6 PolarHBondContact O-N 3.31Å
5F51.5Low53Low154 Ų154128.1 Ų128.168%0.67573%0.732SS**  trans-67.299.3164.2-85.3-80.6000107F3 E7 F18F3-F5 PolarHBondContact O-N 3.25Å; F5-E7 PolarHBondContact O-N 3.09Å; F5-F18 HydrophobicContact CD1-CD1 4.41Å; F5-F18 AromaticContact CD1-CE1 3.92Å; F5-F18 HydrophobicContact CD1-CE1 3.92Å; F5-F18 HydrophobicContact CD1-CZ 4.25Å; F5-F18 AromaticContact CE1-CD1 3.92Å; F5-F18 HydrophobicContact CE1-CD1 3.92Å; F5-F18 AromaticContact CE1-CE1 3.19Å; F5-F18 HydrophobicContact CE1-CE1 3.19Å; F5-F18 AromaticContact CE1-CZ 3.73Å; F5-F18 HydrophobicContact CE1-CZ 3.73Å; F5-F18 HydrophobicContact CZ-CD1 4.19Å; F5-F18 AromaticContact CZ-CE1 3.69Å; F5-F18 HydrophobicContact CZ-CE1 3.69Å
6G46.6Very low54.3Low67 Ų67127.8 Ų127.869%0.69173%0.726SS**  trans-51.7126.2174.700000110.3G4 A8G4-G6 VanDerWaalsContact C-N 3.3Å; G4-G6 PolarHBondContact O-N 3.31Å; G6-A8 VanDerWaalsContact C-N 3.26Å; G6-A8 PolarHBondContact O-N 3.47Å
7E47.5Very low55.6Low208 Ų208128.4 Ų128.497%0.97272%0.719SS**  trans-52.486.6162.9-165.6177.8160.200109F5F5-E7 PolarHBondContact O-N 3.09Å
8A54.1Low56.8Low82 Ų82126.2 Ų126.268%0.67870%0.701SS**  trans-131.2106.6175.400000106.5G6 G10G6-A8 VanDerWaalsContact C-N 3.26Å; G6-A8 PolarHBondContact O-N 3.47Å; A8-G10 VanDerWaalsContact C-N 3.27Å; A8-G10 WeakPolarHBondContact O-CA 3.11Å; A8-G10 PolarHBondContact O-N 3.23Å
9E52.7Low58.1Low211 Ų211123.5 Ų123.599%0.98669%0.691SS**  trans-17.880.2172.8-61.4-169.2150.800113.8
10G53.7Low59.3Low45 Ų45121.2 Ų121.246%0.46468%0.68SS.*  trans-93.2123.7-174.700000108.2A8 T14A8-G10 VanDerWaalsContact C-N 3.27Å; A8-G10 WeakPolarHBondContact O-CA 3.11Å; A8-G10 PolarHBondContact O-N 3.23Å; G10-T14 WeakPolarHBondContact CA-OG1 3.29Å
11S60.9Low60.6Low62 Ų62117.9 Ų117.943%0.43467%0.665SS.*  trans-44.2145.2170.365.10000110.7N13 T14S11-N13 PolarHBondContact O-N 2.73Å; S11-T14 PolarHBondContact O-N 3.21Å; S11-T14 PolarHBondContact O-OG1 2.78Å
12P61.8Low63.3Low106 Ų106111.4 Ų111.469%0.68863%0.634SS**Hα-helixtrans-55.7-19.5-17521.3-33.9000113.9L16P12-L16 PolarHBondContact O-N 3.45Å
13N63.3Low65.4Low129 Ų129108.6 Ų108.669%0.6962%0.615SS**Hα-helixtrans-69.1-38174.1-59.9-46.7000113.1S11 F17S11-N13 PolarHBondContact O-N 2.73Å; N13-F17 WeakPolarHBondContact O-CB 3.41Å; N13-F17 PolarHBondContact O-N 2.93Å; N13-F17 VanDerWaalsContact O-N 3.09Å
14T68Low67.3Low56 Ų56103 Ų10334%0.34460%0.596SS.*Hα-helixtrans-70.9-4117852.50000110.3G10 S11 L16 F17 F18G10-T14 WeakPolarHBondContact CA-OG1 3.29Å; S11-T14 PolarHBondContact O-N 3.21Å; S11-T14 PolarHBondContact O-OG1 2.78Å; T14-L16 VanDerWaalsContact C-N 3.34Å; T14-L16 PolarHBondContact O-N 3.32Å; T14-F17 PolarHBondContact O-N 3.08Å; T14-F18 WeakPolarHBondContact O-CB 3.46Å; T14-F18 WeakPolarHBondContact O-CD2 3.42Å; T14-F18 PolarHBondContact O-N 3.48Å
15D72.5Confident69.5Low114 Ų114103 Ų10361%0.6158%0.582SS**Hα-helixtrans-59.8-44.3177-169.414.7000111.5F17 F18 S19D15-F17 PolarHBondContact O-N 3.15Å; D15-F18 PolarHBondContact O-N 3.45Å; D15-S19 VanDerWaalsContact O-CB 3.31Å; D15-S19 WeakPolarHBondContact O-CB 3.39Å; D15-S19 PolarHBondContact O-N 3.48Å
16L74.9Confident71.2Confident122 Ų12299.4 Ų99.464%0.63958%0.575SS**Hα-helixtrans-64.3-41.5176.5-154.7116.4000112.2P12 T14 S19 V20P12-L16 PolarHBondContact O-N 3.45Å; T14-L16 VanDerWaalsContact C-N 3.34Å; T14-L16 PolarHBondContact O-N 3.32Å; L16-S19 PolarHBondContact O-N 3.2Å; L16-V20 VanDerWaalsContact O-CG2 3.27Å; L16-V20 WeakPolarHBondContact O-CG2 3.46Å; L16-V20 PolarHBondContact O-N 3.26Å
17F75.5Confident72.8Confident139 Ų13999.2 Ų99.261%0.6156%0.559SS**Hα-helixtrans-64.8-43.4177.1-170.3-96.3000111.7N13 T14 D15 V20 C21N13-F17 WeakPolarHBondContact O-CB 3.41Å; N13-F17 PolarHBondContact O-N 2.93Å; N13-F17 VanDerWaalsContact O-N 3.09Å; T14-F17 PolarHBondContact O-N 3.08Å; D15-F17 PolarHBondContact O-N 3.15Å; F17-V20 PolarHBondContact O-N 3.16Å; F17-C21 WeakPolarHBondContact O-CB 3.4Å; F17-C21 PolarHBondContact O-N 3.47Å
18F78Confident74.7Confident89 Ų8993.7 Ų93.739%0.3954%0.539SS..Hα-helixtrans-63.2-43.8174.9-83.8-67.7000111.8F5 T14 D15 V20 C21 L22F5-F18 HydrophobicContact CD1-CD1 4.41Å; F5-F18 AromaticContact CD1-CE1 3.92Å; F5-F18 HydrophobicContact CD1-CE1 3.92Å; F5-F18 HydrophobicContact CD1-CZ 4.25Å; F5-F18 AromaticContact CE1-CD1 3.92Å; F5-F18 HydrophobicContact CE1-CD1 3.92Å; F5-F18 AromaticContact CE1-CE1 3.19Å; F5-F18 HydrophobicContact CE1-CE1 3.19Å; F5-F18 AromaticContact CE1-CZ 3.73Å; F5-F18 HydrophobicContact CE1-CZ 3.73Å; F5-F18 HydrophobicContact CZ-CD1 4.19Å; F5-F18 AromaticContact CZ-CE1 3.69Å; F5-F18 HydrophobicContact CZ-CE1 3.69Å; T14-F18 WeakPolarHBondContact O-CB 3.46Å; T14-F18 WeakPolarHBondContact O-CD2 3.42Å; T14-F18 PolarHBondContact O-N 3.48Å; D15-F18 PolarHBondContact O-N 3.45Å; F18-V20 PolarHBondContact O-N 3.42Å; F18-C21 PolarHBondContact O-N 3.16Å; F18-L22 WeakPolarHBondContact O-CB 3.48Å; F18-L22 VanDerWaalsContact O-CG 3.25Å; F18-L22 WeakPolarHBondContact O-CG 3.39Å; F18-L22 PolarHBondContact O-N 3.09Å
19S80.9Confident76.3Confident74 Ų7494.5 Ų94.552%0.51754%0.535SS..Hα-helixtrans-60-46.8176.8-173.70000111.9D15 L16 L22 F23D15-S19 VanDerWaalsContact O-CB 3.31Å; D15-S19 WeakPolarHBondContact O-CB 3.39Å; D15-S19 PolarHBondContact O-N 3.48Å; L16-S19 PolarHBondContact O-N 3.2Å; S19-L22 PolarHBondContact O-N 3.47Å; S19-F23 WeakPolarHBondContact O-CB 3.07Å; S19-F23 PolarHBondContact O-N 3.17Å
20V83Confident77.8Confident78 Ų7889.4 Ų89.447%0.47351%0.514SS..Hα-helixtrans-65-43.8176.8174.30000111L16 F17 F18 F23 V24L16-V20 VanDerWaalsContact O-CG2 3.27Å; L16-V20 WeakPolarHBondContact O-CG2 3.46Å; L16-V20 PolarHBondContact O-N 3.26Å; F17-V20 PolarHBondContact O-N 3.16Å; F18-V20 PolarHBondContact O-N 3.42Å; V20-F23 PolarHBondContact O-N 2.74Å; V20-V24 HydrophobicContact CG1-CG2 4.35Å; V20-V24 WeakPolarHBondContact O-CG2 3.4Å; V20-V24 PolarHBondContact O-N 3.5Å
21C86.5Confident79.2Confident52 Ų5293 Ų9335%0.35152%0.522SS..Hα-helixtrans-61.7-44.1176.3-85.30000112.5F17 F18 F23 V24 T25F17-C21 WeakPolarHBondContact O-CB 3.4Å; F17-C21 PolarHBondContact O-N 3.47Å; F18-C21 PolarHBondContact O-N 3.16Å; C21-F23 VanDerWaalsContact C-N 3.32Å; C21-F23 PolarHBondContact O-N 3Å; C21-V24 PolarHBondContact O-N 2.9Å; C21-T25 WeakPolarHBondContact O-CB 3.42Å; C21-T25 VanDerWaalsContact O-CG2 3.29Å; C21-T25 WeakPolarHBondContact O-CG2 3.43Å; C21-T25 PolarHBondContact O-N 3.43Å; C21-T25 PolarHBondContact O-OG1 3.21Å
22L86.3Confident80.2Confident104 Ų10497.1 Ų97.155%0.54553%0.532SS..Hα-helixtrans-63.6-39.1176-72.1175.1000111.4F18 S19 T25 S26F18-L22 WeakPolarHBondContact O-CB 3.48Å; F18-L22 VanDerWaalsContact O-CG 3.25Å; F18-L22 WeakPolarHBondContact O-CG 3.39Å; F18-L22 PolarHBondContact O-N 3.09Å; S19-L22 PolarHBondContact O-N 3.47Å; L22-T25 WeakPolarHBondContact CA-OG1 3.46Å; L22-T25 PolarHBondContact O-OG1 2.92Å; L22-T25 VanDerWaalsContact O-OG1 3.11Å; L22-S26 WeakPolarHBondContact O-CB 3.48Å; L22-S26 PolarHBondContact O-N 3.35Å
23F86.7Confident81.2Confident116 Ų11694.4 Ų94.451%0.50952%0.519SS..Hα-helixtrans-65-49176.2-172.6-101000111.7S19 V20 C21 S26 N27S19-F23 WeakPolarHBondContact O-CB 3.07Å; S19-F23 PolarHBondContact O-N 3.17Å; V20-F23 PolarHBondContact O-N 2.74Å; C21-F23 VanDerWaalsContact C-N 3.32Å; C21-F23 PolarHBondContact O-N 3Å; F23-S26 PolarHBondContact O-N 3.47Å; F23-N27 VanDerWaalsContact CE1-ND2 3.33Å; F23-N27 WeakPolarHBondContact CE1-ND2 3.39Å; F23-N27 WeakPolarHBondContact CZ-ND2 3.28Å; F23-N27 PolarHBondContact O-N 3.42Å; F23-N27 PolarHBondContact O-ND2 3.09Å
24V88.1Confident82Confident78 Ų7893.8 Ų93.847%0.47352%0.515SS..Hα-helixtrans-62-48179.41730000110.8V20 C21 S26 N27 V28V20-V24 HydrophobicContact CG1-CG2 4.35Å; V20-V24 WeakPolarHBondContact O-CG2 3.4Å; V20-V24 PolarHBondContact O-N 3.5Å; C21-V24 PolarHBondContact O-N 2.9Å; V24-S26 PolarHBondContact O-N 2.75Å; V24-N27 PolarHBondContact O-N 2.91Å; V24-V28 HydrophobicContact CG1-CG2 4.47Å; V24-V28 VanDerWaalsContact O-CG2 3.32Å; V24-V28 WeakPolarHBondContact O-CG2 3.33Å; V24-V28 PolarHBondContact O-N 2.86Å
25T86.9Confident82.4Confident78 Ų7899.7 Ų99.748%0.47954%0.536SS..Hα-helixtrans-63.5-40.7179.351.70000112.3C21 L22 N27 V28 V29C21-T25 WeakPolarHBondContact O-CB 3.42Å; C21-T25 VanDerWaalsContact O-CG2 3.29Å; C21-T25 WeakPolarHBondContact O-CG2 3.43Å; C21-T25 PolarHBondContact O-N 3.43Å; C21-T25 PolarHBondContact O-OG1 3.21Å; L22-T25 WeakPolarHBondContact CA-OG1 3.46Å; L22-T25 PolarHBondContact O-OG1 2.92Å; L22-T25 VanDerWaalsContact O-OG1 3.11Å; T25-N27 PolarHBondContact O-N 3.31Å; T25-V28 PolarHBondContact O-N 3Å; T25-V29 VanDerWaalsContact O-CG2 3.28Å; T25-V29 WeakPolarHBondContact O-CG2 3.44Å; T25-V29 PolarHBondContact O-N 3.5Å
26S87.7Confident82.7Confident77 Ų7797.4 Ų97.454%0.53853%0.533SS..Hα-helixtrans-60.7-43.8175.3-179.50000112.5L22 F23 V24 V29 L30L22-S26 WeakPolarHBondContact O-CB 3.48Å; L22-S26 PolarHBondContact O-N 3.35Å; F23-S26 PolarHBondContact O-N 3.47Å; V24-S26 PolarHBondContact O-N 2.75Å; S26-V29 PolarHBondContact O-N 2.88Å; S26-L30 PolarHBondContact O-N 3.35Å
27N79Confident82.7Confident64 Ų6496.7 Ų96.734%0.34254%0.537SS..Hα-helixtrans-66.7-40.3178.1-79.1-83.4000112.3F23 V24 T25 V29 L30 L31F23-N27 VanDerWaalsContact CE1-ND2 3.33Å; F23-N27 WeakPolarHBondContact CE1-ND2 3.39Å; F23-N27 WeakPolarHBondContact CZ-ND2 3.28Å; F23-N27 PolarHBondContact O-N 3.42Å; F23-N27 PolarHBondContact O-ND2 3.09Å; V24-N27 PolarHBondContact O-N 2.91Å; T25-N27 PolarHBondContact O-N 3.31Å; N27-V29 VanDerWaalsContact C-N 3.35Å; N27-V29 PolarHBondContact O-N 3.3Å; N27-L30 PolarHBondContact O-N 3.12Å; N27-L31 WeakPolarHBondContact O-CG 3.46Å; N27-L31 PolarHBondContact O-N 3.13Å
28V87.5Confident82Confident91 Ų9193.4 Ų93.455%0.55254%0.543SS*.Hα-helixtrans-62.9-42.5176.4172.60000111V24 T25 L31 F32V24-V28 HydrophobicContact CG1-CG2 4.47Å; V24-V28 VanDerWaalsContact O-CG2 3.32Å; V24-V28 WeakPolarHBondContact O-CG2 3.33Å; V24-V28 PolarHBondContact O-N 2.86Å; T25-V28 PolarHBondContact O-N 3Å; V28-L31 PolarHBondContact O-N 3.15Å; V28-F32 WeakPolarHBondContact O-CB 3.37Å; V28-F32 PolarHBondContact O-N 3.4Å
29V88.2Confident80.8Confident100 Ų10092.9 Ų92.961%0.60656%0.562SS**Hα-helixtrans-64.5-40.6176.4172.50000111.4T25 S26 N27 F32 A33T25-V29 VanDerWaalsContact O-CG2 3.28Å; T25-V29 WeakPolarHBondContact O-CG2 3.44Å; T25-V29 PolarHBondContact O-N 3.5Å; S26-V29 PolarHBondContact O-N 2.88Å; N27-V29 VanDerWaalsContact C-N 3.35Å; N27-V29 PolarHBondContact O-N 3.3Å; V29-F32 PolarHBondContact O-N 3.17Å; V29-A33 WeakPolarHBondContact O-CB 3.4Å; V29-A33 PolarHBondContact O-N 3.38Å
30L85.6Confident79.2Confident103 Ų10392.2 Ų92.254%0.53957%0.567SS.*Hα-helixtrans-63.3-45.3177.5-174.967.5000111.9S26 N27 F32 A33 L34S26-L30 PolarHBondContact O-N 3.35Å; N27-L30 PolarHBondContact O-N 3.12Å; L30-F32 VanDerWaalsContact C-N 3.33Å; L30-F32 PolarHBondContact O-N 3.49Å; L30-A33 PolarHBondContact O-N 3.38Å; L30-L34 WeakPolarHBondContact O-CG 3.37Å; L30-L34 PolarHBondContact O-N 3Å
31L82.6Confident77.7Confident120 Ų12097.5 Ų97.563%0.62858%0.584SS**Hα-helixtrans-62.2-42176.8-72.4171.6000111.6N27 V28 L34 F35N27-L31 WeakPolarHBondContact O-CG 3.46Å; N27-L31 PolarHBondContact O-N 3.13Å; V28-L31 PolarHBondContact O-N 3.15Å; L31-L34 PolarHBondContact O-N 3.48Å; L31-F35 WeakPolarHBondContact O-CB 3.33Å; L31-F35 PolarHBondContact O-N 3.05Å
32F81.8Confident75.7Confident149 Ų149104.4 Ų104.465%0.65461%0.611SS**Hα-helixtrans-65.6-39.8176.4-168.7-97.3000112V28 V29 L30 F35 A36V28-F32 WeakPolarHBondContact O-CB 3.37Å; V28-F32 PolarHBondContact O-N 3.4Å; V29-F32 PolarHBondContact O-N 3.17Å; L30-F32 VanDerWaalsContact C-N 3.33Å; L30-F32 PolarHBondContact O-N 3.49Å; F32-F35 PolarHBondContact O-N 3.35Å; F32-A36 VanDerWaalsContact O-CB 3.28Å; F32-A36 WeakPolarHBondContact O-CB 3.28Å; F32-A36 PolarHBondContact O-N 3.11Å
33A82.2Confident73.6Confident50 Ų50108.3 Ų108.341%0.41362%0.623SS.*Hα-helixtrans-64.4-41.4176.900000112.2V29 L30 A36 C37V29-A33 WeakPolarHBondContact O-CB 3.4Å; V29-A33 PolarHBondContact O-N 3.38Å; L30-A33 PolarHBondContact O-N 3.38Å; A33-A36 PolarHBondContact O-N 2.78Å; A33-C37 WeakPolarHBondContact O-CB 3.15Å; A33-C37 PolarHBondContact O-N 3.28Å
34L79.3Confident71.8Confident116 Ų116108.3 Ų108.361%0.60764%0.635SS**Hα-helixtrans-63.8-42.8175.2-69.8172.6000111.6L30 L31 G38L30-L34 WeakPolarHBondContact O-CG 3.37Å; L30-L34 PolarHBondContact O-N 3Å; L31-L34 PolarHBondContact O-N 3.48Å; L34-G38 PolarHBondContact O-N 2.99Å; L34-G38 VanDerWaalsContact O-N 3.11Å
35F77.5Confident70.1Confident180 Ų180111.7 Ų111.779%0.78966%0.655SS**Hα-helixtrans-66.8-40.7178.2-167.1-97.3000112.3L31 F32L31-F35 WeakPolarHBondContact O-CB 3.33Å; L31-F35 PolarHBondContact O-N 3.05Å; F32-F35 PolarHBondContact O-N 3.35Å
36A78.8Confident67.8Low66 Ų66117.2 Ų117.255%0.54567%0.673SS.*Hα-helixtrans-74.2-33.1178.600000113.2F32 A33F32-A36 VanDerWaalsContact O-CB 3.28Å; F32-A36 WeakPolarHBondContact O-CB 3.28Å; F32-A36 PolarHBondContact O-N 3.11Å; A33-A36 PolarHBondContact O-N 2.78Å
37C73.6Confident65.7Low107 Ų107118.8 Ų118.872%0.72368%0.684SS**Hα-helixtrans-81.8-24-178.2-165.50000113A33 G39A33-C37 WeakPolarHBondContact O-CB 3.15Å; A33-C37 PolarHBondContact O-N 3.28Å; C37-G39 PolarHBondContact O-N 3.44Å
38G62.7Low63.9Low70 Ų70121.3 Ų121.372%0.72270%0.704SS**THydrogen-bonded Turntrans-72.4-0.7-178.500000116.5L34 G40L34-G38 PolarHBondContact O-N 2.99Å; L34-G38 VanDerWaalsContact O-N 3.11Å; G38-G40 PolarHBondContact O-N 2.86Å
39G52.8Low61.5Low78 Ų78121.1 Ų121.180%0.80471%0.712SS**THydrogen-bonded Turntrans-86.68.7-177.200000116.2C37C37-G39 PolarHBondContact O-N 3.44Å
40G47.4Very low58.9Low59 Ų59125 Ų12561%0.60872%0.723SS**SBendtrans-128.986.5-166.100000116.2G38G38-G40 PolarHBondContact O-N 2.86Å
41K50.1Low56.4Low190 Ų190128.7 Ų128.783%0.82674%0.738SS**  trans6297.7154.4-55.7-140.5-178.8-167.90119.9
42E45.5Very low53.9Low197 Ų197131.6 Ų131.692%0.92175%0.748SS**  trans-136.394141.6-64.9-162.6157.500107.3
43K42Very low51.4Low185 Ų185130 Ų13080%0.80475%0.75SS**  54.9142.685.5-77-160.8-176.2-176.30116.2
44P48.1Very low49.3Very low116 Ų116137 Ų13775%0.75377%0.772SS**  trans-111.5144-133.437.3-27.4000114.5
45V53.3Low47.1Very low150 Ų150136.8 Ų136.891%0.90978%0.78SS**  trans-92124.7172.5176.60000110.3
46K38.7Very low45.8Very low193 Ų193133.8 Ų133.884%0.83978%0.778SS**  trans-58.6125.6174.8-67.3168.6172178.10111.2
47S42.3Very low43.8Very low111 Ų111135.3 Ų135.378%0.77679%0.791SS**  66.1131.593.9-155.30000114.4
48P42.7Very low41.7Very low117 Ų117138.8 Ų138.876%0.7680%0.797SS**  -146.6155.35738.4-17.4000119.6
49A35.6Very low40.8Very low87 Ų87141.4 Ų141.472%0.71980%0.801SS**  trans56.3136.8140.600000119.7
50E33.9Very low40.2Very low181 Ų181143.8 Ų143.885%0.84680%0.802SS**  cis-175.2168.6-3.5-139.1174132.300105.4
51Q32.7Very low39.8Very low180 Ų180146.6 Ų146.684%0.84181%0.813SS**  trans84.594.3175.8-60.5-177.7-3100116.7
52Q30Very low39.7Very low181 Ų181143.1 Ų143.185%0.84681%0.81SS**  60.7103.586.2-83.6-170.6-1.800115.2
53T31.3Very low39.5Very low115 Ų115138.8 Ų138.871%0.70681%0.808SS**  trans108.2112.2133.7-39.40000117.5
54K36Very low39.3Very low199 Ų199135.8 Ų135.887%0.86580%0.804SS**  trans75.395.7157.9-75.9176.8-179.2-176.20118.7
55S35Very low39.2Very low111 Ų111140.5 Ų140.578%0.77681%0.807SS**  trans-66.5175.9157.8-148.30000112.2
56P49.3Very low38.9Very low116 Ų116142.1 Ų142.175%0.75380%0.802SS**  -138.6143.2-73.740.9-25000111.9
57A36.8Very low38.5Very low99 Ų99139.5 Ų139.582%0.81880%0.796SS**SBendtrans-157.2112.9156.600000102.8
58E29.3Very low37.8Very low179 Ų179138.1 Ų138.184%0.83679%0.787SS**  cis177.8125.243.8176.9179.1173.200103.9
59P44.2Very low37.4Very low126 Ų126140.9 Ų140.982%0.81879%0.787SS**  trans-89.6133177.729.3-29.6000113
60P39.5Very low37.7Very low127 Ų127140.3 Ų140.383%0.82578%0.782SS**  trans-79.8157.1168.931.8-33.9000114.1
61S39.4Very low38.1Very low118 Ų118138 Ų13883%0.82577%0.769SS**  trans-80.7177.6175.1-76.60000114
62P48.2Very low38.4Very low118 Ų118134 Ų13477%0.76676%0.757SS**  cis-137158.6-35.136.2-17.3000115.9
63A41.9Very low38.5Very low106 Ų106130.5 Ų130.588%0.87675%0.749SS**  trans-145.2115.6161.400000111.5
64V37.8Very low38.5Very low122 Ų122130.1 Ų130.174%0.73975%0.746SS**  trans-129.9118.6-177.8-155.50000107.1
65R45.4Very low38.2Very low214 Ų214126.2 Ų126.281%0.80874%0.739SS**  44.1127.683.3-98.9-165.3-178.8178.30.9111
66K46.5Very low38.2Very low184 Ų184127 Ų12780%0.874%0.74SS**SBend47.999.155.1-52.4178.4175.7-177.20110.7
67L31.1Very low37.1Very low138 Ų138126.4 Ų126.472%0.72373%0.734SS**SBendcis-157.854.32-125.1152.6000108.3K69L67-K69 HydrophobicContact CD2-CD 4.08Å; L67-K69 HydrophobicContact CD2-CG 4.34Å
68S28.1Very low37.3Very low83 Ų83126.9 Ų126.958%0.5874%0.738SS**  trans-125.185.7144.662.60000104
69K34.4Very low37.3Very low174 Ų174124.3 Ų124.376%0.75773%0.734SS**  31.47875.3-71-164.2-179.6-177.10112L67L67-K69 HydrophobicContact CD2-CD 4.08Å; L67-K69 HydrophobicContact CD2-CG 4.34Å
70A41.1Very low36.9Very low75 Ų75122.5 Ų122.562%0.6273%0.73SS**  69.788.8121.100000116.1
71K42.2Very low36.8Very low132 Ų132121.6 Ų121.657%0.57473%0.727SS**  -126.384.5115.1-153.4161.9-177-178.30105.8T73 S127K71-T73 VanDerWaalsContact C-N 3.33Å; K71-S127 WeakPolarHBondContact CB-OG 3.32Å
72T39.3Very low36.3Very low97 Ų97123 Ų12360%0.59573%0.731SS**  31.379.776.2-56.10000108.1
73T33Very low35.9Very low108 Ų108121.8 Ų121.866%0.66373%0.731SS**  88.398.7108.7-59.70000108.5K71K71-T73 VanDerWaalsContact C-N 3.33Å
74T31.2Very low35.7Very low106 Ų106123.9 Ų123.965%0.6573%0.727SS**  77.2107.4120-38.90000114
75T29.6Very low35.5Very low117 Ų117123.9 Ų123.972%0.71873%0.727SS**  25.6107.3111.6-36.40000114.3
76T34.2Very low35.2Very low129 Ų129123 Ų12379%0.79173%0.729SS**  -164.997.7128.1-1.20000107.8
77T27.1Very low34.7Very low102 Ų102120 Ų12063%0.62673%0.732SS**  59.584.6107.6-29.70000112.1T79T77-T79 PolarHBondContact O-N 3.47Å; T77-T79 VanDerWaalsContact O-N 3.14Å
78A39.3Very low35.3Very low109 Ų109119.2 Ų119.290%0.90174%0.735SS**  trans-76.889.3149.500000106.8A80A78-A80 PolarHBondContact O-N 3.18Å
79T29.4Very low35.7Very low125 Ų125120.2 Ų120.277%0.76774%0.742SS**  trans-60.1113.4166.9-46.40000109T77T77-T79 PolarHBondContact O-N 3.47Å; T77-T79 VanDerWaalsContact O-N 3.14Å
80A37.1Very low36.1Very low88 Ų88118 Ų11873%0.72775%0.748SS**  trans175122.2152.100000107.2A78A78-A80 PolarHBondContact O-N 3.18Å
81S36.2Very low35.9Very low109 Ų109120.2 Ų120.276%0.76275%0.754SS**  cis-157.5144.313.1-79.80000108.7A83S81-A83 PolarHBondContact O-N 2.86Å
82T30.5Very low35.8Very low147 Ų147118.7 Ų118.790%0.90277%0.767SS**  trans-48.3117154.311.90000110.5
83A38Very low36.1Very low93 Ų93118.3 Ų118.377%0.76977%0.773SS**  trans-159.8108.5152.700000111.2S81S81-A83 PolarHBondContact O-N 2.86Å
84N38.6Very low36.9Very low150 Ų150118.8 Ų118.880%0.80278%0.781SS**  trans58.4100.2154.9-89.7-0.6000121.3K86N84-K86 PolarHBondContact O-N 3.15Å
85T33.4Very low37.6Very low121 Ų121122.1 Ų122.174%0.74279%0.789SS**  20.894.5113.358.70000117.6
86K40Very low38.8Very low195 Ų195122.2 Ų122.285%0.84879%0.789SS**  162.8116.4117.6-102.9179.7173.8175.10106.4N84 P88N84-K86 PolarHBondContact O-N 3.15Å; K86-P88 WeakPolarHBondContact O-CD 3.27Å
87S35.8Very low40Very low123 Ų123124.1 Ų124.186%0.8679%0.787SS**PPolyproline II helixtrans-56.6118.6164.9-53.70000110
88P42.5Very low41.3Very low120 Ų120127.7 Ų127.778%0.77979%0.794SS**PPolyproline II helixtrans-82.9139.1144.913.95.7000107.9K86K86-P88 WeakPolarHBondContact O-CD 3.27Å
89S37.3Very low42.3Very low104 Ų104131.7 Ų131.773%0.72779%0.786SS**PPolyproline II helixtrans-50.1135.6-174.458.10000113.9T91S89-T91 PolarHBondContact O-N 3.29Å
90S41.6Very low43.6Very low128 Ų128131.7 Ų131.790%0.89578%0.781SS**SBendtrans-7449-179.161.50000114.5
91T38.3Very low44.6Very low121 Ų121136 Ų13674%0.74279%0.786SS**  trans-125.3115.9171.3-45.90000108.1S89S89-T91 PolarHBondContact O-N 3.29Å
92A40.4Very low45.4Very low101 Ų101139.3 Ų139.384%0.83579%0.789SS**SBendtrans91.884.4177.800000116.2
93A45.4Very low46.6Very low88 Ų88136.4 Ų136.473%0.72778%0.775SS**  trans-165.256.2135.800000109.1E95A93-E95 PolarHBondContact O-N 3.27Å
94S49.3Very low47Very low118 Ų118141.1 Ų141.183%0.82578%0.778SS**  trans-76.261.2153.5176.10000106.8V96S94-V96 VanDerWaalsContact C-N 3.34Å; S94-V96 PolarHBondContact O-N 3.4Å
95E45.9Very low47.8Very low177 Ų177140.3 Ų140.383%0.82777%0.773SS**  trans-64.3104.7165.6-96.1-175.9152.700105.9A93 F97A93-E95 PolarHBondContact O-N 3.27Å; E95-F97 PolarHBondContact O-N 3.2Å
96V54.7Low48.6Very low119 Ų119142 Ų14272%0.72177%0.772SS**  trans-50110165.8175.60000106.1S94 K98S94-V96 VanDerWaalsContact C-N 3.34Å; S94-V96 PolarHBondContact O-N 3.4Å; V96-K98 VanDerWaalsContact C-N 3.31Å; V96-K98 PolarHBondContact O-N 3.06Å
97F58.7Low49.1Very low168 Ų168139 Ų13974%0.73777%0.772SS**  trans-5896.4175.1176.8-109.8000108.2E95 W99E95-F97 PolarHBondContact O-N 3.2Å; F97-W99 AromaticContact CE1-CE3 3.47Å; F97-W99 HydrophobicContact CE1-CE3 3.47Å; F97-W99 VanDerWaalsContact CE1-CE3 3.47Å; F97-W99 HydrophobicContact CE1-CZ3 4.03Å; F97-W99 AromaticContact CZ-CE3 3.65Å; F97-W99 HydrophobicContact CZ-CE3 3.65Å; F97-W99 AromaticContact CZ-CZ3 3.99Å; F97-W99 HydrophobicContact CZ-CZ3 3.99Å; F97-W99 PolarHBondContact O-N 3.3Å
98K56.1Low49.8Very low177 Ų177136.5 Ų136.577%0.7777%0.766SS**  trans-77.5107.9170-85.8-175.8166-174.40106.6V96 D100V96-K98 VanDerWaalsContact C-N 3.31Å; V96-K98 PolarHBondContact O-N 3.06Å; K98-D100 PolarHBondContact O-N 3.41Å
99W58.7Low49.7Very low194 Ų194135.5 Ų135.574%0.73576%0.761SS**  trans-65.1101.3166.8-172.3-92.2000107.8F97 E101F97-W99 AromaticContact CE1-CE3 3.47Å; F97-W99 HydrophobicContact CE1-CE3 3.47Å; F97-W99 VanDerWaalsContact CE1-CE3 3.47Å; F97-W99 HydrophobicContact CE1-CZ3 4.03Å; F97-W99 AromaticContact CZ-CE3 3.65Å; F97-W99 HydrophobicContact CZ-CE3 3.65Å; F97-W99 AromaticContact CZ-CZ3 3.99Å; F97-W99 HydrophobicContact CZ-CZ3 3.99Å; F97-W99 PolarHBondContact O-N 3.3Å; W99-E101 PolarHBondContact O-N 3.37Å
100D56.7Low50.5Low124 Ų124138.3 Ų138.366%0.66376%0.762SS**  trans-71.595.6171.9-91.1-25.9000108.5K98 E102 S103K98-D100 PolarHBondContact O-N 3.41Å; D100-E102 PolarHBondContact O-N 3.4Å; D100-E102 VanDerWaalsContact O-N 3.17Å; D100-S103 WeakPolarHBondContact O-CB 3.29Å; D100-S103 PolarHBondContact O-N 3.09Å; D100-S103 VanDerWaalsContact O-N 3.08Å
101E59.5Low51.1Low178 Ų178138 Ų13883%0.83276%0.755SS**THydrogen-bonded Turntrans-58.5-22.6173.6-79.9-165.1150.300112.7W99 S103W99-E101 PolarHBondContact O-N 3.37Å; E101-S103 VanDerWaalsContact C-N 3.32Å
102E51.3Low51.6Low179 Ų179138 Ų13884%0.83676%0.755SS**THydrogen-bonded Turntrans-89.15.8178.8-70.3-174151.300113.8D100 K104D100-E102 PolarHBondContact O-N 3.4Å; D100-E102 VanDerWaalsContact O-N 3.17Å; E102-K104 PolarHBondContact O-N 3.08Å
103S55.7Low51.9Low87 Ų87139.9 Ų139.961%0.60875%0.75SS**  trans-67.683169.2-156.30000108.6D100 E101 I105D100-S103 WeakPolarHBondContact O-CB 3.29Å; D100-S103 PolarHBondContact O-N 3.09Å; D100-S103 VanDerWaalsContact O-N 3.08Å; E101-S103 VanDerWaalsContact C-N 3.32Å; S103-I105 PolarHBondContact O-N 3.12Å
104K48.1Very low52.1Low191 Ų191140.1 Ų140.183%0.8374%0.743SS**  trans-5893.3162.7-74.4-176.4178.9-174.20105.8E102 E106E102-K104 PolarHBondContact O-N 3.08Å; K104-E106 VanDerWaalsContact C-N 3.3Å; K104-E106 PolarHBondContact O-N 3.32Å
105I55.5Low52.2Low134 Ų134141.9 Ų141.969%0.68774%0.736SS**  trans-57.1104166.5-36169.7000104S103S103-I105 PolarHBondContact O-N 3.12Å
106E49.9Very low52.5Low157 Ų157141.5 Ų141.573%0.73473%0.732SS**  trans-57.7127.8176.6-72.7-159.5161.100107.4K104 G108 C109K104-E106 VanDerWaalsContact C-N 3.3Å; K104-E106 PolarHBondContact O-N 3.32Å; E106-G108 PolarHBondContact O-N 3.25Å; E106-C109 PolarHBondContact O-N 3.38Å
107P49.2Very low52.5Low131 Ų131137.7 Ų137.785%0.85171%0.713SS**THydrogen-bonded Turntrans-6499.8-179.324.4-31.7000108.5
108G51.1Low52Low70 Ų70138.8 Ų138.872%0.72271%0.712SS**THydrogen-bonded Turntrans156.3-23.2-173.900000114.1E106E106-G108 PolarHBondContact O-N 3.25Å
109C39.6Very low51.9Low99 Ų99136.2 Ų136.267%0.66970%0.703SS**  trans-101.928.5174.5-81.80000113.1E106 T111E106-C109 PolarHBondContact O-N 3.38Å; C109-T111 PolarHBondContact O-N 3.38Å
110E55.4Low51.7Low163 Ų163131.8 Ų131.876%0.76270%0.697SS**  trans-62.891.4161.1-68.4-177.4-155.800107.1T112E110-T112 VanDerWaalsContact C-N 3.34Å; E110-T112 PolarHBondContact O-N 3.32Å
111T54.2Low51.4Low121 Ų121131.9 Ų131.974%0.74269%0.694SS**  trans-54.1107.8170.148.20000105.4C109 L113C109-T111 PolarHBondContact O-N 3.38Å; T111-L113 PolarHBondContact O-N 2.9Å
112T49.1Very low51Low122 Ų122126.6 Ų126.675%0.74868%0.676SS**  trans-62.493.1178.8-46.90000105.4E110 T114E110-T112 VanDerWaalsContact C-N 3.34Å; E110-T112 PolarHBondContact O-N 3.32Å; T112-T114 HydrophobicContact CG2-CG2 4.31Å; T112-T114 PolarHBondContact O-N 3.47Å
113L46.7Very low51.1Low140 Ų140120.2 Ų120.273%0.73365%0.654SS**  trans-6483.5165.4-99.7159.5000104.7T111 K115 A117T111-L113 PolarHBondContact O-N 2.9Å; L113-K115 PolarHBondContact O-N 2.78Å; L113-A117 HydrophobicContact CD2-CB 3.4Å
114T48.8Very low50.9Low93 Ų93123.6 Ų123.657%0.57165%0.654SS**  trans-50.5131.4178.251.80000107.2T112 K116 A117T112-T114 HydrophobicContact CG2-CG2 4.31Å; T112-T114 PolarHBondContact O-N 3.47Å; T114-K116 PolarHBondContact O-N 3.37Å; T114-A117 PolarHBondContact O-N 3.48Å
115K51Low51.1Low156 Ų156119.3 Ų119.368%0.67864%0.64SS**THydrogen-bonded Turntrans-36.6-25.4-175.6-172.3179.2174.2-1750116.1L113 A117 W118 E119L113-K115 PolarHBondContact O-N 2.78Å; K115-A117 VanDerWaalsContact C-N 3.34Å; K115-A117 PolarHBondContact O-N 2.76Å; K115-W118 PolarHBondContact O-N 3.4Å; K115-E119 PolarHBondContact O-N 3.06Å
116K52.7Low50.9Low169 Ų169116.8 Ų116.874%0.73564%0.639SS**Hα-helixtrans-58.7-36.2172.2-74.9-165.3172.4-173.90114.4T114 W118 T120T114-K116 PolarHBondContact O-N 3.37Å; K116-W118 VanDerWaalsContact C-N 3.31Å; K116-W118 PolarHBondContact O-N 3.02Å; K116-T120 PolarHBondContact O-OG1 3.45Å
117A54.3Low50.9Low39 Ų39112 Ų11232%0.32262%0.622SS.*Hα-helixtrans-65.5-37.1177.500000111.6L113 T114 K115 T120 E121L113-A117 HydrophobicContact CD2-CB 3.4Å; T114-A117 PolarHBondContact O-N 3.48Å; K115-A117 VanDerWaalsContact C-N 3.34Å; K115-A117 PolarHBondContact O-N 2.76Å; A117-T120 WeakPolarHBondContact O-CB 3.39Å; A117-T120 PolarHBondContact O-N 2.98Å; A117-T120 VanDerWaalsContact O-N 3.15Å; A117-E121 PolarHBondContact O-N 3.3Å
118W49.3Very low51.1Low190 Ų190110.1 Ų110.172%0.7261%0.609SS**Hα-helixtrans-74.3-33.6-176.7-162.728.2000113.7K115 K116 T120 E121 S122K115-W118 PolarHBondContact O-N 3.4Å; K116-W118 VanDerWaalsContact C-N 3.31Å; K116-W118 PolarHBondContact O-N 3.02Å; W118-T120 PolarHBondContact O-N 3.4Å; W118-E121 PolarHBondContact O-N 2.99Å; W118-S122 PolarHBondContact O-N 3.3Å; W118-S122 PolarHBondContact O-OG 3.37Å; W118-S122 VanDerWaalsContact O-OG 3.06Å
119E53.3Low50.9Low123 Ų123107.9 Ų107.958%0.57558%0.583SS**Hα-helixtrans-64.3-23.7170.5-71.8179.6-175.600112K115 S122K115-E119 PolarHBondContact O-N 3.06Å; E119-S122 PolarHBondContact O-OG 3.5Å
120T55.1Low51.1Low101 Ų101107.8 Ų107.862%0.6258%0.576SS**Hα-helixtrans-80.1-34.5177.5-36.10000111.9K116 A117 W118K116-T120 PolarHBondContact O-OG1 3.45Å; A117-T120 WeakPolarHBondContact O-CB 3.39Å; A117-T120 PolarHBondContact O-N 2.98Å; A117-T120 VanDerWaalsContact O-N 3.15Å; W118-T120 PolarHBondContact O-N 3.4Å
121E49.8Very low51.1Low127 Ų127104 Ų10459%0.59357%0.566SS**Hα-helixtrans-76.2-37.5-179-160.5173.2-166.600112.8A117 W118 A123 Y124 I125A117-E121 PolarHBondContact O-N 3.3Å; W118-E121 PolarHBondContact O-N 2.99Å; E121-A123 VanDerWaalsContact C-N 3.32Å; E121-A123 PolarHBondContact O-N 3Å; E121-Y124 WeakPolarHBondContact O-CB 3.28Å; E121-Y124 PolarHBondContact O-N 3.01Å; E121-Y124 VanDerWaalsContact O-N 3.09Å; E121-I125 PolarHBondContact O-N 3.27Å
122S51.7Low51.1Low67 Ų67103 Ų10347%0.46956%0.56SS.*Hα-helixtrans-64.1-34.3175.347.90000113.1W118 E119 Y124 A126W118-S122 PolarHBondContact O-N 3.3Å; W118-S122 PolarHBondContact O-OG 3.37Å; W118-S122 VanDerWaalsContact O-OG 3.06Å; E119-S122 PolarHBondContact O-OG 3.5Å; S122-Y124 VanDerWaalsContact C-N 3.27Å; S122-Y124 PolarHBondContact O-N 3.14Å; S122-A126 PolarHBondContact O-N 2.88Å
123A51.7Low51.4Low44 Ų44101.6 Ų101.636%0.36455%0.547SS..Hα-helixtrans-73.3-13.5174.400000114E121E121-A123 VanDerWaalsContact C-N 3.32Å; E121-A123 PolarHBondContact O-N 3Å
124Y52Low51.6Low158 Ų15897.4 Ų97.462%0.6253%0.532SS*.Hα-helixtrans-81.5-45.3174.1-172.8-103000111.1E121 S122 A126 S127 T128E121-Y124 WeakPolarHBondContact O-CB 3.28Å; E121-Y124 PolarHBondContact O-N 3.01Å; E121-Y124 VanDerWaalsContact O-N 3.09Å; S122-Y124 VanDerWaalsContact C-N 3.27Å; S122-Y124 PolarHBondContact O-N 3.14Å; Y124-A126 VanDerWaalsContact C-N 3.35Å; Y124-A126 PolarHBondContact O-N 2.7Å; Y124-S127 PolarHBondContact O-N 2.87Å; Y124-S127 VanDerWaalsContact O-N 3.16Å; Y124-T128 PolarHBondContact O-N 2.87Å; Y124-T128 PolarHBondContact O-OG1 3.33Å
125I53Low51.8Low101 Ų10196.3 Ų96.352%0.51853%0.529SS..Hα-helixtrans-65.3-38-179.4-58.8172000111.5E121 S127 T128 A129E121-I125 PolarHBondContact O-N 3.27Å; I125-S127 PolarHBondContact O-N 3.29Å; I125-T128 PolarHBondContact O-N 3.46Å; I125-A129 PolarHBondContact O-N 3.44Å
126A51.3Low51.8Low82 Ų8291.7 Ų91.768%0.67852%0.52SS*.Hα-helixtrans-66.5-21177.700000113.7S122 Y124S122-A126 PolarHBondContact O-N 2.88Å; Y124-A126 VanDerWaalsContact C-N 3.35Å; Y124-A126 PolarHBondContact O-N 2.7Å
127S49Very low51.5Low55 Ų5587.9 Ų87.939%0.38551%0.507SS..Hα-helixtrans-92.3-21.7-178.4-175.30000114K71 Y124 I125K71-S127 WeakPolarHBondContact CB-OG 3.32Å; Y124-S127 PolarHBondContact O-N 2.87Å; Y124-S127 VanDerWaalsContact O-N 3.16Å; I125-S127 PolarHBondContact O-N 3.29Å
128T54Low51.3Low93 Ų9392.7 Ų92.757%0.57152%0.522SS*.Hα-helixtrans-106.5-3.3-179.643.40000113.4Y124 I125 D130Y124-T128 PolarHBondContact O-N 2.87Å; Y124-T128 PolarHBondContact O-OG1 3.33Å; I125-T128 PolarHBondContact O-N 3.46Å; T128-D130 PolarHBondContact O-N 3.4Å; T128-D130 VanDerWaalsContact O-N 3.09Å
129A47.5Very low51.4Low22 Ų2287.8 Ų87.818%0.18251%0.513CS..  trans-66.5109.1171.900000110.4I125 I133I125-A129 PolarHBondContact O-N 3.44Å; A129-I133 HydrophobicContact CB-CB 4.16Å; A129-I133 HydrophobicContact CB-CG2 4.16Å
130D43.9Very low51.2Low97 Ų9784.6 Ų84.652%0.51951%0.509SS..  trans-38.6132.4159.1-157.2-28.5000108.8T128 T132 I133 A134T128-D130 PolarHBondContact O-N 3.4Å; T128-D130 VanDerWaalsContact O-N 3.09Å; D130-T132 VanDerWaalsContact CG-OG1 3.24Å; D130-T132 PolarHBondContact O-N 2.96Å; D130-T132 PolarHBondContact OD1-OG1 3.44Å; D130-I133 HydrophobicContact CB-CD1 4.11Å; D130-I133 HydrophobicContact CB-CG1 4.25Å; D130-I133 WeakPolarHBondContact O-CA 3.31Å; D130-I133 WeakPolarHBondContact O-CB 3.25Å; D130-I133 PolarHBondContact O-N 3.49Å; D130-A134 PolarHBondContact O-N 2.9Å
131P54.1Low51Low85 Ų8583.1 Ų83.155%0.55250%0.499SS*.Hα-helixtrans-52.6-22.9-177.916.6-32.8000114.5A134 S135P131-A134 PolarHBondContact O-N 3.49Å; P131-S135 PolarHBondContact O-N 2.74Å
132T54.9Low51.1Low100 Ų10081.8 Ų81.861%0.61350%0.5SS*.Hα-helixtrans-62.6-36.416935.10000113.2D130 A136D130-T132 VanDerWaalsContact CG-OG1 3.24Å; D130-T132 PolarHBondContact O-N 2.96Å; D130-T132 PolarHBondContact OD1-OG1 3.44Å; T132-A136 PolarHBondContact O-N 2.88Å
133I54.3Low51.2Low92 Ų9281.4 Ų81.447%0.47250%0.495SS..Hα-helixtrans-77.1-37.7175.9-57.9171.6000110.8A129 D130 S135 A136 L137A129-I133 HydrophobicContact CB-CB 4.16Å; A129-I133 HydrophobicContact CB-CG2 4.16Å; D130-I133 HydrophobicContact CB-CD1 4.11Å; D130-I133 HydrophobicContact CB-CG1 4.25Å; D130-I133 WeakPolarHBondContact O-CA 3.31Å; D130-I133 WeakPolarHBondContact O-CB 3.25Å; D130-I133 PolarHBondContact O-N 3.49Å; I133-S135 VanDerWaalsContact C-N 3.34Å; I133-S135 PolarHBondContact O-N 2.93Å; I133-A136 WeakPolarHBondContact O-CB 3.38Å; I133-A136 PolarHBondContact O-N 3.41Å; I133-A136 VanDerWaalsContact O-N 3.17Å; I133-L137 HydrophobicContact CG2-CD1 4.42Å; I133-L137 PolarHBondContact O-N 3.44Å
134A52.6Low51.1Low51 Ų5181.9 Ų81.942%0.42150%0.499SS..Hα-helixtrans-61.2-41.3178.800000112.3D130 P131 L137 E138D130-A134 PolarHBondContact O-N 2.9Å; P131-A134 PolarHBondContact O-N 3.49Å; A134-L137 PolarHBondContact O-N 3.28Å; A134-E138 PolarHBondContact O-N 2.93Å; A134-E138 VanDerWaalsContact O-N 3.09Å
135S53.2Low51.2Low71 Ų7178.9 Ų78.950%0.49750%0.497SS..Hα-helixtrans-67-37174.7-176.30000112.4P131 I133 L137 E138 T139P131-S135 PolarHBondContact O-N 2.74Å; I133-S135 VanDerWaalsContact C-N 3.34Å; I133-S135 PolarHBondContact O-N 2.93Å; S135-L137 VanDerWaalsContact C-N 3.32Å; S135-L137 PolarHBondContact O-N 3.32Å; S135-E138 PolarHBondContact O-N 3.42Å; S135-T139 PolarHBondContact O-N 2.83Å; S135-T139 PolarHBondContact O-OG1 3.28Å
136A50.3Low51.1Low59 Ų5976.8 Ų76.849%0.48850%0.495SS..Hα-helixtrans-64.6-37.3174.100000112.1T132 I133 T139 A140T132-A136 PolarHBondContact O-N 2.88Å; I133-A136 WeakPolarHBondContact O-CB 3.38Å; I133-A136 PolarHBondContact O-N 3.41Å; I133-A136 VanDerWaalsContact O-N 3.17Å; A136-T139 PolarHBondContact O-N 3.11Å; A136-A140 WeakPolarHBondContact O-CB 3.44Å; A136-A140 PolarHBondContact O-N 3.26Å
137L46.1Very low51.1Low88 Ų8878 Ų7846%0.46149%0.489SS..Hα-helixtrans-69.7-37.8178.3-120.5149.7000112.7I133 A134 S135 T139 A140 T141I133-L137 HydrophobicContact CG2-CD1 4.42Å; I133-L137 PolarHBondContact O-N 3.44Å; A134-L137 PolarHBondContact O-N 3.28Å; S135-L137 VanDerWaalsContact C-N 3.32Å; S135-L137 PolarHBondContact O-N 3.32Å; L137-T139 VanDerWaalsContact C-N 3.27Å; L137-T139 PolarHBondContact O-N 2.83Å; L137-A140 PolarHBondContact O-N 2.7Å; L137-T141 HydrophobicContact CD2-CG2 4.36Å; L137-T141 WeakPolarHBondContact O-CB 3.46Å; L137-T141 PolarHBondContact O-N 2.82Å; L137-T141 PolarHBondContact O-OG1 2.83Å
138E51Low51.2Low140 Ų14079.6 Ų79.665%0.65450%0.501SS*.Hα-helixtrans-62.9-37.6172.9-160170.3-165.700110.9A134 S135 T141 V142A134-E138 PolarHBondContact O-N 2.93Å; A134-E138 VanDerWaalsContact O-N 3.09Å; S135-E138 PolarHBondContact O-N 3.42Å; E138-T141 WeakPolarHBondContact CA-OG1 3.39Å; E138-T141 PolarHBondContact O-OG1 3.46Å; E138-T141 VanDerWaalsContact O-OG1 3.08Å; E138-V142 VanDerWaalsContact O-CG2 3.29Å; E138-V142 WeakPolarHBondContact O-CG2 3.09Å; E138-V142 PolarHBondContact O-N 2.93Å; E138-V142 VanDerWaalsContact O-N 3.15Å
139T51.2Low51.1Low87 Ų8779.8 Ų79.853%0.53450%0.501SS..Hα-helixtrans-72.2-38.5177.6-390000111.5S135 A136 L137 T143S135-T139 PolarHBondContact O-N 2.83Å; S135-T139 PolarHBondContact O-OG1 3.28Å; A136-T139 PolarHBondContact O-N 3.11Å; L137-T139 VanDerWaalsContact C-N 3.27Å; L137-T139 PolarHBondContact O-N 2.83Å; T139-T143 PolarHBondContact O-N 3.45Å; T139-T143 VanDerWaalsContact O-N 3.15Å; T139-T143 PolarHBondContact O-OG1 3.21Å
140A47.6Very low51.2Low57 Ų5783.4 Ų83.447%0.47152%0.517SS..Hα-helixtrans-68.6-38.3176.300000112.8A136 L137 T143 A144A136-A140 WeakPolarHBondContact O-CB 3.44Å; A136-A140 PolarHBondContact O-N 3.26Å; L137-A140 PolarHBondContact O-N 2.7Å; A140-T143 PolarHBondContact O-N 3.21Å; A140-A144 WeakPolarHBondContact O-CB 3.32Å; A140-A144 PolarHBondContact O-N 3.09Å
141T52.5Low51.4Low70 Ų7080.9 Ų80.943%0.42951%0.514SS..Hα-helixtrans-70.7-37.717841.90000112.6L137 E138 T143 T145L137-T141 HydrophobicContact CD2-CG2 4.36Å; L137-T141 WeakPolarHBondContact O-CB 3.46Å; L137-T141 PolarHBondContact O-N 2.82Å; L137-T141 PolarHBondContact O-OG1 2.83Å; E138-T141 WeakPolarHBondContact CA-OG1 3.39Å; E138-T141 PolarHBondContact O-OG1 3.46Å; E138-T141 VanDerWaalsContact O-OG1 3.08Å; T141-T143 VanDerWaalsContact C-N 3.32Å; T141-T143 PolarHBondContact O-N 3.34Å; T141-T145 WeakPolarHBondContact O-CB 3.4Å; T141-T145 PolarHBondContact O-N 3.43Å; T141-T145 PolarHBondContact O-OG1 3.39Å
142V52.2Low51.1Low99 Ų9980.8 Ų80.860%0.652%0.515SS*.Hα-helixtrans-62.5-41.8171.21740000110.7E138 T145 A146E138-V142 VanDerWaalsContact O-CG2 3.29Å; E138-V142 WeakPolarHBondContact O-CG2 3.09Å; E138-V142 PolarHBondContact O-N 2.93Å; E138-V142 VanDerWaalsContact O-N 3.15Å; V142-T145 PolarHBondContact O-N 3.22Å; V142-A146 PolarHBondContact O-N 2.69Å
143T53.3Low50.9Low59 Ų5980.2 Ų80.236%0.36251%0.512SS..Hα-helixtrans-67.7-43179.3-52.20000112.3T139 A140 T141 T145 A146 L147T139-T143 PolarHBondContact O-N 3.45Å; T139-T143 VanDerWaalsContact O-N 3.15Å; T139-T143 PolarHBondContact O-OG1 3.21Å; A140-T143 PolarHBondContact O-N 3.21Å; T141-T143 VanDerWaalsContact C-N 3.32Å; T141-T143 PolarHBondContact O-N 3.34Å; T143-T145 VanDerWaalsContact C-N 3.34Å; T143-T145 PolarHBondContact O-N 3.23Å; T143-A146 PolarHBondContact O-N 2.83Å; T143-L147 HydrophobicContact CG2-CD1 4.33Å; T143-L147 PolarHBondContact O-N 2.82Å; T143-L147 VanDerWaalsContact O-N 3.12Å
144A49.9Very low50.5Low54 Ų5483.7 Ų83.745%0.44652%0.52SS..Hα-helixtrans-66.2-34.5176.500000112.8A140 S148A140-A144 WeakPolarHBondContact O-CB 3.32Å; A140-A144 PolarHBondContact O-N 3.09Å; A144-S148 PolarHBondContact O-N 3.19Å; A144-S148 VanDerWaalsContact O-N 3.12Å; A144-S148 PolarHBondContact O-OG 2.69Å; A144-S148 VanDerWaalsContact O-OG 3.08Å
145T52.3Low50.4Low94 Ų9489.6 Ų89.658%0.57754%0.537SS*.Hα-helixtrans-68.9-43.6175.5-53.40000110.8T141 V142 T143 L147 S148 T149T141-T145 WeakPolarHBondContact O-CB 3.4Å; T141-T145 PolarHBondContact O-N 3.43Å; T141-T145 PolarHBondContact O-OG1 3.39Å; V142-T145 PolarHBondContact O-N 3.22Å; T143-T145 VanDerWaalsContact C-N 3.34Å; T143-T145 PolarHBondContact O-N 3.23Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 2.83Å; T145-S148 WeakPolarHBondContact O-CB 3.43Å; T145-S148 PolarHBondContact O-N 3.29Å; T145-S148 VanDerWaalsContact O-N 3.13Å; T145-T149 PolarHBondContact O-N 2.87Å; T145-T149 VanDerWaalsContact O-N 3.17Å; T145-T149 PolarHBondContact O-OG1 2.79Å
146A52Low49.8Very low58 Ų5891 Ų9148%0.47955%0.547SS..Hα-helixtrans-58.5-42.617600000112.2V142 T143 S148 T149 L150V142-A146 PolarHBondContact O-N 2.69Å; T143-A146 PolarHBondContact O-N 2.83Å; A146-S148 PolarHBondContact O-N 3.36Å; A146-T149 WeakPolarHBondContact CA-OG1 3.15Å; A146-T149 PolarHBondContact O-N 3.31Å; A146-T149 PolarHBondContact O-OG1 2.99Å; A146-L150 PolarHBondContact O-N 2.96Å; A146-L150 VanDerWaalsContact O-N 3.09Å
147L50.3Low49.5Very low106 Ų10693.5 Ų93.556%0.55556%0.555SS**Hα-helixtrans-64-36.5175.4-81.1157.1000113T143 T145 T149 L150 G151T143-L147 HydrophobicContact CG2-CD1 4.33Å; T143-L147 PolarHBondContact O-N 2.82Å; T143-L147 VanDerWaalsContact O-N 3.12Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 2.83Å; L147-T149 VanDerWaalsContact C-N 3.35Å; L147-T149 PolarHBondContact O-N 2.97Å; L147-L150 PolarHBondContact O-N 3Å; L147-G151 PolarHBondContact O-N 3.33Å
148S51.8Low49.6Very low90 Ų9093.3 Ų93.363%0.62957%0.567SS**Hα-helixtrans-65.1-38.3176-63.40000112A144 T145 A146 S152A144-S148 PolarHBondContact O-N 3.19Å; A144-S148 VanDerWaalsContact O-N 3.12Å; A144-S148 PolarHBondContact O-OG 2.69Å; A144-S148 VanDerWaalsContact O-OG 3.08Å; T145-S148 WeakPolarHBondContact O-CB 3.43Å; T145-S148 PolarHBondContact O-N 3.29Å; T145-S148 VanDerWaalsContact O-N 3.13Å; A146-S148 PolarHBondContact O-N 3.36Å; S148-S152 PolarHBondContact O-N 3.11Å
149T52.2Low49.4Very low96 Ų9695.7 Ų95.759%0.58958%0.575SS**Hα-helixtrans-65.9-41.8172.8130000112.6T145 A146 L147 S152T145-T149 PolarHBondContact O-N 2.87Å; T145-T149 VanDerWaalsContact O-N 3.17Å; T145-T149 PolarHBondContact O-OG1 2.79Å; A146-T149 WeakPolarHBondContact CA-OG1 3.15Å; A146-T149 PolarHBondContact O-N 3.31Å; A146-T149 PolarHBondContact O-OG1 2.99Å; L147-T149 VanDerWaalsContact C-N 3.35Å; L147-T149 PolarHBondContact O-N 2.97Å; T149-S152 PolarHBondContact O-N 2.91Å
150L50.5Low48.9Very low99 Ų9997.6 Ų97.652%0.51859%0.586SS.*Hα-helixtrans-70.1-37.4-180-159.474.2000112.1A146 L147 S152 T153 Y154A146-L150 PolarHBondContact O-N 2.96Å; A146-L150 VanDerWaalsContact O-N 3.09Å; L147-L150 PolarHBondContact O-N 3Å; L150-S152 VanDerWaalsContact C-N 3.26Å; L150-S152 PolarHBondContact O-N 3.31Å; L150-T153 PolarHBondContact O-N 2.8Å; L150-T153 PolarHBondContact O-OG1 3.05Å; L150-Y154 HydrophobicContact CG-CE2 4.17Å; L150-Y154 VanDerWaalsContact O-CD2 3.28Å; L150-Y154 WeakPolarHBondContact O-CD2 3.41Å
151G46.9Very low48.5Very low44 Ų44104.1 Ų104.145%0.45461%0.607SS.*Hα-helixtrans-63.9-28.1176.200000113.9L147L147-G151 PolarHBondContact O-N 3.33Å
152S48.8Very low47.8Very low82 Ų82112.6 Ų112.657%0.57363%0.631SS**Hα-helixtrans-72.2-35.5177.8-163.40000112.5S148 T149 L150 Y154 K155S148-S152 PolarHBondContact O-N 3.11Å; T149-S152 PolarHBondContact O-N 2.91Å; L150-S152 VanDerWaalsContact C-N 3.26Å; L150-S152 PolarHBondContact O-N 3.31Å; S152-Y154 VanDerWaalsContact C-N 3.32Å; S152-Y154 PolarHBondContact O-N 2.84Å; S152-K155 PolarHBondContact O-N 2.87Å
153T49.8Very low47.3Very low88 Ų88116.7 Ų116.754%0.5464%0.641SS.*Hα-helixtrans-67.1-30178.740.70000113.3L150 S156L150-T153 PolarHBondContact O-N 2.8Å; L150-T153 PolarHBondContact O-OG1 3.05Å; T153-S156 PolarHBondContact O-N 2.8Å
154Y45.9Very low47Very low166 Ų166120.1 Ų120.165%0.65166%0.664SS**Hα-helixtrans-75.6-22.3176.3-74.4-79.6000113.8L150 S152 S156L150-Y154 HydrophobicContact CG-CE2 4.17Å; L150-Y154 VanDerWaalsContact O-CD2 3.28Å; L150-Y154 WeakPolarHBondContact O-CD2 3.41Å; S152-Y154 VanDerWaalsContact C-N 3.32Å; S152-Y154 PolarHBondContact O-N 2.84Å; Y154-S156 VanDerWaalsContact C-N 3.26Å; Y154-S156 PolarHBondContact O-N 3.08Å
155K50.2Low46.8Very low175 Ų175122.9 Ų122.976%0.76168%0.68SS**Hα-helixtrans-70.6-21.9175.1-100.6-174.7178.9178.60113.1S152S152-K155 PolarHBondContact O-N 2.87Å
156S41.1Very low46.3Very low101 Ų101125 Ų12571%0.70669%0.687SS**THydrogen-bonded Turntrans-80.9-21.3-176.3-164.40000114.2T153 Y154T153-S156 PolarHBondContact O-N 2.8Å; Y154-S156 VanDerWaalsContact C-N 3.26Å; Y154-S156 PolarHBondContact O-N 3.08Å
157T44.7Very low46.2Very low110 Ų110127.6 Ų127.668%0.67570%0.699SS**THydrogen-bonded Turntrans-103.6-13.7-17842.20000114.3K159T157-K159 PolarHBondContact O-N 3.17Å
158A46.6Very low46.1Very low84 Ų84131.2 Ų131.269%0.69471%0.713SS**THydrogen-bonded Turntrans-72.5-6177.600000114.7
159K47.8Very low46.3Very low191 Ų191134 Ų13483%0.8372%0.719SS**THydrogen-bonded Turntrans-87.25.9-178.6-85.6-171.3177.8-178.40115.6T157T157-K159 PolarHBondContact O-N 3.17Å
160T41.4Very low46.5Very low126 Ų126135 Ų13577%0.77373%0.729SS**  trans-135.856.5179.2-45.20000113.4
161Q38.5Very low47Very low194 Ų194136.7 Ų136.791%0.90774%0.744SS**  trans-133.286.6148.6-79.7-144.216.400109.7K163Q161-K163 PolarHBondContact O-N 3.05Å
162R38.3Very low47.3Very low248 Ų248144 Ų14494%0.93676%0.763SS**  trans-71.1115.2167.3-84.3-174.8171.6-179.8-1.4109.1
163K41Very low47.5Very low186 Ų186145 Ų14581%0.80978%0.776SS**  trans49.1103.5139.7-144.7-179.2-168.4-170.10117.1Q161 S165Q161-K163 PolarHBondContact O-N 3.05Å; K163-S165 PolarHBondContact O-N 3.49Å; K163-S165 VanDerWaalsContact O-N 3.11Å
164P46.1Very low47.9Very low131 Ų131150.8 Ų150.885%0.85179%0.794SS**  trans-62.6115.4160.424.1-29.4000109.4
165S45.7Very low48.4Very low111 Ų111156.1 Ų156.178%0.77682%0.82SS**  trans-67.5127.7169169.50000109.6K163K163-S165 PolarHBondContact O-N 3.49Å; K163-S165 VanDerWaalsContact O-N 3.11Å
166I43.2Very low48.4Very low140 Ų140155.2 Ų155.272%0.71882%0.823SS**  trans-52.1131174.8-62.3155.1000111.2Q168I166-Q168 HydrophobicContact CG2-CG 4.41Å; I166-Q168 PolarHBondContact O-N 2.69Å
167P50.1Low48.7Very low112 Ų112158 Ų15873%0.72783%0.829SS**  trans-81.8108.2157.628.2-26.8000109.8I169P167-I169 PolarHBondContact O-N 3.3Å
168Q47.7Very low49Very low181 Ų181160.7 Ų160.785%0.84684%0.838SS**  trans-70.8112.5164.2-74.9-152.2-44.200108.8I166 S170I166-Q168 HydrophobicContact CG2-CG 4.41Å; I166-Q168 PolarHBondContact O-N 2.69Å; Q168-S170 PolarHBondContact O-N 3.4Å
169I56.6Low49.1Very low150 Ų150165.2 Ų165.277%0.76985%0.846SS**  trans-84.7100.4171.5-60.9172.5000107.7P167 V171P167-I169 PolarHBondContact O-N 3.3Å; I169-V171 HydrophobicContact CG2-CG2 4.37Å; I169-V171 PolarHBondContact O-N 3.33Å
170S55Low49.2Very low115 Ų115163.6 Ų163.680%0.80485%0.847SS**  trans-71112.6163.4-82.70000109.6Q168 K172Q168-S170 PolarHBondContact O-N 3.4Å; S170-K172 PolarHBondContact O-N 3.43Å
171V60.9Low49.7Very low135 Ų135166.1 Ų166.182%0.81885%0.852SS**  trans-82.7112.9167.7-170.70000108.3I169I169-V171 HydrophobicContact CG2-CG2 4.37Å; I169-V171 PolarHBondContact O-N 3.33Å
172K54.4Low50.5Low198 Ų198164.1 Ų164.186%0.86185%0.849SS**PPolyproline II helixtrans-69.3126179.1-128.2174.3-177175.20110S170S170-K172 PolarHBondContact O-N 3.43Å
173A51.5Low51.4Low102 Ų102157.6 Ų157.684%0.84384%0.842SS**PPolyproline II helixtrans-59.6132.1167.300000110.3
174K59.1Low52.3Low210 Ų210155.3 Ų155.391%0.91385%0.845SS**PPolyproline II helixtrans-101.5125172.7-154.6174.2-177.3-176.50108.3
175K57.5Low52.9Low278 Ų278157.5 Ų157.5100%1.20984%0.844SS**  trans-25.40177.8-130.3176.6-177.3-176.80117.4

Retrieved 175 of 175 residues in 101.8 ms (Link to these results)