A0A5K4FBV2_SCHMA Loading...

Detected protein of confused Function

AlphaFold DB , UniProt , Accession A0A5K4FBV2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 155 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 low42.3Very low240 Ų240142 Ų142100%1.18272%0.72SS**  01100-77.3174174.100108.3K3M1-K3 PolarHBondContact O-N 2.89Å
2A35.5Very low43.3Very low100 Ų100134.1 Ų134.183%0.82670%0.701SS**  trans-67.5121.2176.200000109.1K4A2-K4 PolarHBondContact O-N 3.32Å; A2-K4 VanDerWaalsContact O-N 3.09Å
3K35.4Very low44.5Very low173 Ų173134.9 Ų134.975%0.75272%0.722SS**  trans-56.5113.3168.8-91-179172.1-178.90107.5M1 P5M1-K3 PolarHBondContact O-N 2.89Å; K3-P5 WeakPolarHBondContact O-CD 3.28Å
4K40.9Very low45.8Very low189 Ų189131.5 Ų131.582%0.82270%0.698SS**  trans-58.3120.8170.9-78.8-175.5177179.90108.1A2 G6A2-K4 PolarHBondContact O-N 3.32Å; A2-K4 VanDerWaalsContact O-N 3.09Å; K4-G6 PolarHBondContact O-N 3.43Å
5P39.4Very low46.4Very low126 Ų126135.2 Ų135.282%0.81870%0.7SS**THydrogen-bonded Turntrans-77.127.1-177.931.5-34.3000113.3K3K3-P5 WeakPolarHBondContact O-CD 3.28Å
6G42.4Very low47.2Very low47 Ų47130.3 Ų130.349%0.48568%0.675SS.*THydrogen-bonded Turntrans-90.2-23.4-165.800000116.9K4K4-G6 PolarHBondContact O-N 3.43Å
7N45.1Very low47.9Very low84 Ų84131.5 Ų131.545%0.44967%0.674SS.*SBendtrans-113-14.7-166.8-83.36.4000115.9M9 F11N7-M9 VanDerWaalsContact C-N 3.3Å; N7-M9 PolarHBondContact O-N 3.1Å; N7-F11 VanDerWaalsContact O-CD2 3.31Å; N7-F11 WeakPolarHBondContact O-CD2 3.36Å
8Y46Very low48.8Very low167 Ų167127.3 Ų127.366%0.65565%0.654SS**G310 helixtrans-75.7-16.7-177.9-67.5-76.5000114.1Y10Y8-Y10 PolarHBondContact O-N 3.17Å
9M47.3Very low49.7Very low153 Ų153133.1 Ų133.175%0.75467%0.666SS**G310 helixtrans-71.1-14.3-179.8-98.8-175175.400114N7 F14N7-M9 VanDerWaalsContact C-N 3.3Å; N7-M9 PolarHBondContact O-N 3.1Å; M9-F14 WeakPolarHBondContact O-CZ 3.33Å
10Y51Low50.4Low129 Ų129134.9 Ų134.951%0.50667%0.67SS.*G310 helixtrans-118.98.2-177.9-61.3-75.8000113.9Y8 G12 F14 I21 L24Y8-Y10 PolarHBondContact O-N 3.17Å; Y10-G12 VanDerWaalsContact C-N 3.33Å; Y10-G12 PolarHBondContact O-N 3.36Å; Y10-G12 VanDerWaalsContact O-N 3.12Å; Y10-F14 HydrophobicContact CD1-CE2 4.29Å; Y10-F14 HydrophobicContact CD1-CZ 4.48Å; Y10-F14 WeakPolarHBondContact O-CE2 3.31Å; Y10-I21 HydrophobicContact CE1-CG2 4.42Å; Y10-L24 HydrophobicContact CD1-CD1 4.1Å; Y10-L24 HydrophobicContact CE1-CD1 3.53Å
11F47.1Very low51Low154 Ų154129 Ų12968%0.67564%0.64SS**SBendtrans-82.481.6166.9-87.7-83.9000109.1N7N7-F11 VanDerWaalsContact O-CD2 3.31Å; N7-F11 WeakPolarHBondContact O-CD2 3.36Å
12G54.6Low52.3Low47 Ų47120.7 Ų120.749%0.48561%0.606SS.*SBendtrans-177.8159.7176.600000112.7Y10 F14Y10-G12 VanDerWaalsContact C-N 3.33Å; Y10-G12 PolarHBondContact O-N 3.36Å; Y10-G12 VanDerWaalsContact O-N 3.12Å; G12-F14 WeakPolarHBondContact O-CD2 3.44Å; G12-F14 WeakPolarHBondContact O-CE2 3.49Å; G12-F14 PolarHBondContact O-N 2.96Å
13C59Low53.7Low145 Ų145121.4 Ų121.498%0.9860%0.6SS**  trans-73.1110.6165.7-83.90000108.6
14F61.9Low55Low87 Ų87115.4 Ų115.438%0.38258%0.576SS.*  trans-92.9138.9172.3-61.1-80.3000109.8M9 Y10 G12 L16 I21M9-F14 WeakPolarHBondContact O-CZ 3.33Å; Y10-F14 HydrophobicContact CD1-CE2 4.29Å; Y10-F14 HydrophobicContact CD1-CZ 4.48Å; Y10-F14 WeakPolarHBondContact O-CE2 3.31Å; G12-F14 WeakPolarHBondContact O-CD2 3.44Å; G12-F14 WeakPolarHBondContact O-CE2 3.49Å; G12-F14 PolarHBondContact O-N 2.96Å; F14-L16 PolarHBondContact O-N 3.44Å; F14-I21 HydrophobicContact CB-CD1 4.09Å; F14-I21 HydrophobicContact CB-CG2 4.24Å; F14-I21 HydrophobicContact CG-CG2 4.29Å
15Y55.3Low56Low187 Ų187111.1 Ų111.173%0.73356%0.555SS**  trans-65.1129.9170.8-118.6-90.7000108.6F17 D18 I21Y15-F17 PolarHBondContact O-N 3.14Å; Y15-D18 VanDerWaalsContact O-CB 3.26Å; Y15-D18 WeakPolarHBondContact O-CB 3.46Å; Y15-D18 PolarHBondContact O-N 3.01Å; Y15-I21 WeakPolarHBondContact O-CD1 3.49Å
16L59.3Low57.2Low56 Ų56109.7 Ų109.729%0.29355%0.546SS..THydrogen-bonded Turntrans-48-33.8179.8-148.681.3000113.4F14 W25 F29F14-L16 PolarHBondContact O-N 3.44Å; L16-W25 PolarHBondContact O-NE1 3.23Å; L16-F29 HydrophobicContact CD1-CE1 3.53Å; L16-F29 HydrophobicContact CD1-CZ 3.3Å; L16-F29 HydrophobicContact CD2-CE1 3.6Å; L16-F29 HydrophobicContact CD2-CZ 3.84Å; L16-F29 HydrophobicContact CG-CE1 3.56Å; L16-F29 HydrophobicContact CG-CE2 4.4Å; L16-F29 HydrophobicContact CG-CZ 3.26Å
17F59Low58.2Low151 Ų151113.1 Ų113.166%0.66255%0.551SS**THydrogen-bonded Turntrans-97.38.4-177.5-57.3-67000114.2Y15 R19 W25Y15-F17 PolarHBondContact O-N 3.14Å; F17-R19 PolarHBondContact O-N 2.77Å; F17-W25 HydrophobicContact CD1-CZ2 4.34Å
18D63.4Low59Low57 Ų57112.6 Ų112.631%0.30555%0.548SS..  trans-66.9121.9174.3-169.8-12.4000109Y15 K20 I21Y15-D18 VanDerWaalsContact O-CB 3.26Å; Y15-D18 WeakPolarHBondContact O-CB 3.46Å; Y15-D18 PolarHBondContact O-N 3.01Å; D18-K20 PolarHBondContact O-N 2.86Å; D18-K20 PolarHBondContact OD1-N 3.47Å; D18-I21 HydrophobicContact CB-CG1 4.15Å; D18-I21 WeakPolarHBondContact O-CG1 3.37Å; D18-I21 PolarHBondContact O-N 2.91Å; D18-I21 VanDerWaalsContact O-N 3.09Å
19R66.3Low59.8Low236 Ų236106 Ų10689%0.89152%0.523SS*.G310 helixtrans-56.3-25.2-178.9-86.3-176172.6179.6-1.9112.3F17 I21 S22F17-R19 PolarHBondContact O-N 2.77Å; R19-I21 VanDerWaalsContact C-N 3.27Å; R19-I21 PolarHBondContact O-N 2.93Å; R19-S22 WeakPolarHBondContact O-CB 3.45Å; R19-S22 PolarHBondContact O-N 3.48Å
20K64.2Low60.9Low170 Ų170102.8 Ų102.874%0.73950%0.502SS*.G310 helixtrans-68.3-21.6-179.3-67.8-176.9-179.7179.40114.3D18D18-K20 PolarHBondContact O-N 2.86Å; D18-K20 PolarHBondContact OD1-N 3.47Å
21I63.6Low62.4Low11 Ų11103.3 Ų103.36%0.05651%0.514CS..G310 helixtrans-102.76.7178.253.6164.7000112.9Y10 F14 Y15 D18 R19 T23 L24 W25Y10-I21 HydrophobicContact CE1-CG2 4.42Å; F14-I21 HydrophobicContact CB-CD1 4.09Å; F14-I21 HydrophobicContact CB-CG2 4.24Å; F14-I21 HydrophobicContact CG-CG2 4.29Å; Y15-I21 WeakPolarHBondContact O-CD1 3.49Å; D18-I21 HydrophobicContact CB-CG1 4.15Å; D18-I21 WeakPolarHBondContact O-CG1 3.37Å; D18-I21 PolarHBondContact O-N 2.91Å; D18-I21 VanDerWaalsContact O-N 3.09Å; R19-I21 VanDerWaalsContact C-N 3.27Å; R19-I21 PolarHBondContact O-N 2.93Å; I21-T23 PolarHBondContact O-N 3.14Å; I21-L24 HydrophobicContact CB-CD1 4.35Å; I21-L24 HydrophobicContact CG2-CD1 4.07Å; I21-L24 WeakPolarHBondContact O-CA 3.39Å; I21-L24 WeakPolarHBondContact O-CB 3.33Å; I21-L24 PolarHBondContact O-N 3.41Å; I21-W25 PolarHBondContact O-N 3.34Å
22S61.4Low64.1Low65 Ų6598.5 Ų98.546%0.45549%0.491SS..G310 helixtrans-57.5-32.3178.7173.60000112.9R19 L24 W25R19-S22 WeakPolarHBondContact O-CB 3.45Å; R19-S22 PolarHBondContact O-N 3.48Å; S22-L24 VanDerWaalsContact C-N 3.28Å; S22-L24 PolarHBondContact O-N 3Å; S22-W25 VanDerWaalsContact O-CB 3.24Å; S22-W25 WeakPolarHBondContact O-CB 3.43Å; S22-W25 PolarHBondContact O-N 3.41Å
23T65.8Low65.4Low116 Ų11698.8 Ų98.871%0.71248%0.479SS*.G310 helixtrans-69.6-24.9174.123.40000113.5I21I21-T23 PolarHBondContact O-N 3.14Å
24L62.8Low66.7Low46 Ų4696 Ų9624%0.24145%0.454CS..G310 helixtrans-85.1-11.7174.1-75.4148.7000112.1Y10 I21 S22 I27 I28Y10-L24 HydrophobicContact CD1-CD1 4.1Å; Y10-L24 HydrophobicContact CE1-CD1 3.53Å; I21-L24 HydrophobicContact CB-CD1 4.35Å; I21-L24 HydrophobicContact CG2-CD1 4.07Å; I21-L24 WeakPolarHBondContact O-CA 3.39Å; I21-L24 WeakPolarHBondContact O-CB 3.33Å; I21-L24 PolarHBondContact O-N 3.41Å; S22-L24 VanDerWaalsContact C-N 3.28Å; S22-L24 PolarHBondContact O-N 3Å; L24-I27 HydrophobicContact CD2-CD1 4.44Å; L24-I27 CarbonylContact O-C 3.57Å; L24-I27 WeakPolarHBondContact O-CA 3.24Å; L24-I27 WeakPolarHBondContact O-CB 3.5Å; L24-I27 PolarHBondContact O-N 3.17Å; L24-I28 HydrophobicContact CB-CD1 3.64Å; L24-I28 HydrophobicContact CB-CG1 4.19Å; L24-I28 WeakPolarHBondContact O-CG1 3.44Å; L24-I28 PolarHBondContact O-N 2.95Å
25W60.9Low67.9Low100 Ų10093.5 Ų93.538%0.37945%0.449SS..Hα-helixtrans-52.8-46.9-178.7-83.120.5000115L16 F17 I21 S22 I27 I28 F29L16-W25 PolarHBondContact O-NE1 3.23Å; F17-W25 HydrophobicContact CD1-CZ2 4.34Å; I21-W25 PolarHBondContact O-N 3.34Å; S22-W25 VanDerWaalsContact O-CB 3.24Å; S22-W25 WeakPolarHBondContact O-CB 3.43Å; S22-W25 PolarHBondContact O-N 3.41Å; W25-I27 PolarHBondContact O-N 2.92Å; W25-I28 PolarHBondContact O-N 3.42Å; W25-F29 HydrophobicContact CB-CD2 3.61Å; W25-F29 HydrophobicContact CB-CE2 4.11Å; W25-F29 AromaticContact CD1-CD2 3.68Å; W25-F29 AromaticContact CD1-CE2 3.23Å; W25-F29 AromaticContact CD2-CD2 3.9Å; W25-F29 HydrophobicContact CD2-CD2 3.9Å; W25-F29 AromaticContact CD2-CE2 3.97Å; W25-F29 HydrophobicContact CD2-CE2 3.97Å; W25-F29 AromaticContact CE2-CE2 3.89Å; W25-F29 AromaticContact CG-CD2 3.46Å; W25-F29 HydrophobicContact CG-CD2 3.46Å; W25-F29 VanDerWaalsContact CG-CD2 3.46Å; W25-F29 AromaticContact CG-CE2 3.53Å; W25-F29 HydrophobicContact CG-CE2 3.53Å; W25-F29 AromaticContact NE1-CE2 3.41Å; W25-F29 WeakPolarHBondContact O-CA 3.4Å; W25-F29 WeakPolarHBondContact O-CB 3.36Å; W25-F29 WeakPolarHBondContact O-CD2 3.28Å; W25-F29 PolarHBondContact O-N 3.46Å
26P64Low69.5Low96 Ų9685.3 Ų85.362%0.62342%0.419SS*.Hα-helixtrans-66.9-1817823.5-32.4000113.5
27I64.3Low70.9Confident118 Ų11886.8 Ų86.861%0.60542%0.424SS*.Hα-helixtrans-86.9-38.6176.3-57.3173.4000110.1L24 W25L24-I27 HydrophobicContact CD2-CD1 4.44Å; L24-I27 CarbonylContact O-C 3.57Å; L24-I27 WeakPolarHBondContact O-CA 3.24Å; L24-I27 WeakPolarHBondContact O-CB 3.5Å; L24-I27 PolarHBondContact O-N 3.17Å; W25-I27 PolarHBondContact O-N 2.92Å
28I61.4Low72.5Confident74 Ų7482.5 Ų82.538%0.37942%0.417SS..Hα-helixtrans-88.6-44.8-176.2-62.3174.7000112.2L24 W25 R30L24-I28 HydrophobicContact CB-CD1 3.64Å; L24-I28 HydrophobicContact CB-CG1 4.19Å; L24-I28 WeakPolarHBondContact O-CG1 3.44Å; L24-I28 PolarHBondContact O-N 2.95Å; W25-I28 PolarHBondContact O-N 3.42Å; I28-R30 VanDerWaalsContact C-N 3.34Å; I28-R30 PolarHBondContact O-N 2.94Å
29F62.7Low73.9Confident28 Ų2883.4 Ų83.412%0.12342%0.418CS..SBendtrans-92.656.4176.6-55.9-73.5000111.5L16 W25 F33 I34L16-F29 HydrophobicContact CD1-CE1 3.53Å; L16-F29 HydrophobicContact CD1-CZ 3.3Å; L16-F29 HydrophobicContact CD2-CE1 3.6Å; L16-F29 HydrophobicContact CD2-CZ 3.84Å; L16-F29 HydrophobicContact CG-CE1 3.56Å; L16-F29 HydrophobicContact CG-CE2 4.4Å; L16-F29 HydrophobicContact CG-CZ 3.26Å; W25-F29 HydrophobicContact CB-CD2 3.61Å; W25-F29 HydrophobicContact CB-CE2 4.11Å; W25-F29 AromaticContact CD1-CD2 3.68Å; W25-F29 AromaticContact CD1-CE2 3.23Å; W25-F29 AromaticContact CD2-CD2 3.9Å; W25-F29 HydrophobicContact CD2-CD2 3.9Å; W25-F29 AromaticContact CD2-CE2 3.97Å; W25-F29 HydrophobicContact CD2-CE2 3.97Å; W25-F29 AromaticContact CE2-CE2 3.89Å; W25-F29 AromaticContact CG-CD2 3.46Å; W25-F29 HydrophobicContact CG-CD2 3.46Å; W25-F29 VanDerWaalsContact CG-CD2 3.46Å; W25-F29 AromaticContact CG-CE2 3.53Å; W25-F29 HydrophobicContact CG-CE2 3.53Å; W25-F29 AromaticContact NE1-CE2 3.41Å; W25-F29 WeakPolarHBondContact O-CA 3.4Å; W25-F29 WeakPolarHBondContact O-CB 3.36Å; W25-F29 WeakPolarHBondContact O-CD2 3.28Å; W25-F29 PolarHBondContact O-N 3.46Å; F29-F33 AromaticContact CD1-CD1 3.71Å; F29-F33 HydrophobicContact CD1-CD1 3.71Å; F29-F33 AromaticContact CD1-CE1 3.89Å; F29-F33 HydrophobicContact CD1-CE1 3.89Å; F29-F33 HydrophobicContact CE1-CD1 4.06Å; F29-F33 AromaticContact CE1-CE1 3.75Å; F29-F33 HydrophobicContact CE1-CE1 3.75Å; F29-I34 HydrophobicContact CB-CD1 4.23Å; F29-I34 HydrophobicContact CB-CG1 4.12Å
30R71.8Confident75Confident86 Ų8676.9 Ų76.933%0.32540%0.396SS..  trans-59.3154165.3-85175.7158.2-162.32.9110.1I28 W32 F33 I34 E98 I101I28-R30 VanDerWaalsContact C-N 3.34Å; I28-R30 PolarHBondContact O-N 2.94Å; R30-W32 VanDerWaalsContact CB-CD1 3.49Å; R30-W32 HydrophobicContact CB-CG 4.3Å; R30-W32 PolarHBondContact O-N 2.96Å; R30-F33 WeakPolarHBondContact O-CA 3.36Å; R30-F33 WeakPolarHBondContact O-CB 3.48Å; R30-F33 PolarHBondContact O-N 3.42Å; R30-I34 PolarHBondContact O-N 3.49Å; R30-E98 WeakPolarHBondContact CD-OE1 3.41Å; R30-E98 IonicContact CZ-OE1 3.46Å; R30-E98 IonicContact CZ-OE2 3.36Å; R30-E98 IonicContact NE-OE1 3.73Å; R30-E98 PolarHBondContact NE-OE1 3.31Å; R30-E98 IonicContact NH1-OE1 2.64Å; R30-E98 PolarHBondContact NH1-OE1 3.32Å; R30-E98 IonicContact NH1-OE2 2.64Å; R30-E98 PolarHBondContact NH1-OE2 2.93Å; R30-I101 VanDerWaalsContact NH1-CD1 3.34Å
31D81.9Confident76.4Confident139 Ų13972.7 Ų72.774%0.74339%0.385SS*.Hα-helixtrans-51.8-35.6-175.7-60.2-29.8000112.7F33 I34 A35D31-F33 VanDerWaalsContact C-N 3.34Å; D31-F33 PolarHBondContact O-N 3.41Å; D31-I34 PolarHBondContact O-N 2.98Å; D31-A35 WeakPolarHBondContact O-CB 3.31Å; D31-A35 PolarHBondContact O-N 3.43Å
32W82.4Confident77.9Confident53 Ų5375 Ų7520%0.20140%0.401CS..Hα-helixtrans-64-36.1176.570.2-105.5000112.8R30 C36 T90 M91 E98R30-W32 VanDerWaalsContact CB-CD1 3.49Å; R30-W32 HydrophobicContact CB-CG 4.3Å; R30-W32 PolarHBondContact O-N 2.96Å; W32-C36 WeakPolarHBondContact O-CB 3.45Å; W32-C36 PolarHBondContact O-N 2.94Å; W32-T90 HydrophobicContact CB-CG2 4.06Å; W32-T90 VanDerWaalsContact O-CG2 3.31Å; W32-T90 WeakPolarHBondContact O-CG2 3.4Å; W32-M91 HydrophobicContact CH2-CE 4.37Å; W32-M91 HydrophobicContact CH2-SD 4.37Å; W32-M91 HydrophobicContact CZ3-CE 4.25Å; W32-M91 HydrophobicContact CZ3-SD 3.67Å; W32-E98 HydrophobicContact CZ2-CG 4.08Å; W32-E98 PolarHBondContact NE1-OE1 3.34Å
33F83Confident79.4Confident54 Ų5472.3 Ų72.324%0.23738%0.383CS..Hα-helixtrans-71.9-41.7178.7-173.1-91.8000110.7F29 R30 D31 C36 Q37F29-F33 AromaticContact CD1-CD1 3.71Å; F29-F33 HydrophobicContact CD1-CD1 3.71Å; F29-F33 AromaticContact CD1-CE1 3.89Å; F29-F33 HydrophobicContact CD1-CE1 3.89Å; F29-F33 HydrophobicContact CE1-CD1 4.06Å; F29-F33 AromaticContact CE1-CE1 3.75Å; F29-F33 HydrophobicContact CE1-CE1 3.75Å; R30-F33 WeakPolarHBondContact O-CA 3.36Å; R30-F33 WeakPolarHBondContact O-CB 3.48Å; R30-F33 PolarHBondContact O-N 3.42Å; D31-F33 VanDerWaalsContact C-N 3.34Å; D31-F33 PolarHBondContact O-N 3.41Å; F33-C36 PolarHBondContact O-N 3.47Å; F33-Q37 WeakPolarHBondContact O-CB 3.33Å; F33-Q37 PolarHBondContact O-N 3.47Å
34I84.5Confident80.6Confident87 Ų8773.1 Ų73.145%0.44638%0.376SS..Hα-helixtrans-61.9-46.1175.1-59.5172.8000110.2F29 R30 D31 C36 Q37 A38F29-I34 HydrophobicContact CB-CD1 4.23Å; F29-I34 HydrophobicContact CB-CG1 4.12Å; R30-I34 PolarHBondContact O-N 3.49Å; D31-I34 PolarHBondContact O-N 2.98Å; I34-C36 PolarHBondContact O-N 2.67Å; I34-Q37 PolarHBondContact O-N 3.23Å; I34-A38 PolarHBondContact O-N 2.94Å
35A87.6Confident82.2Confident34 Ų3473.7 Ų73.728%0.28139%0.388SS..Hα-helixtrans-59.7-47.4176.200000111.3D31 Q37 A38 F39 T90D31-A35 WeakPolarHBondContact O-CB 3.31Å; D31-A35 PolarHBondContact O-N 3.43Å; A35-Q37 VanDerWaalsContact C-N 3.3Å; A35-Q37 PolarHBondContact O-N 2.99Å; A35-A38 PolarHBondContact O-N 3.04Å; A35-F39 WeakPolarHBondContact O-CD2 3.35Å; A35-F39 PolarHBondContact O-N 3.2Å; A35-T90 HydrophobicContact CB-CG2 4.34Å
36C89.2Confident83.8Confident15 Ų1569.5 Ų69.510%0.10137%0.374CS..Hα-helixtrans-56.7-44175.8-174.90000111.7W32 F33 I34 A38 F39 F40 S87 T90W32-C36 WeakPolarHBondContact O-CB 3.45Å; W32-C36 PolarHBondContact O-N 2.94Å; F33-C36 PolarHBondContact O-N 3.47Å; I34-C36 PolarHBondContact O-N 2.67Å; C36-A38 PolarHBondContact O-N 3.03Å; C36-F39 PolarHBondContact O-N 3.41Å; C36-F40 WeakPolarHBondContact O-CB 3.36Å; C36-F40 PolarHBondContact O-N 2.87Å; C36-S87 PolarHBondContact SG-O 3.48Å; C36-T90 HydrophobicContact CB-CG2 4.49Å
37Q89.4Confident85.1Confident87 Ų8768.1 Ų68.141%0.40736%0.359SS..Hα-helixtrans-65.1-40.1179-171.6170.12.600112.1F33 I34 A35 F40 T41F33-Q37 WeakPolarHBondContact O-CB 3.33Å; F33-Q37 PolarHBondContact O-N 3.47Å; I34-Q37 PolarHBondContact O-N 3.23Å; A35-Q37 VanDerWaalsContact C-N 3.3Å; A35-Q37 PolarHBondContact O-N 2.99Å; Q37-F40 PolarHBondContact O-N 2.8Å; Q37-T41 WeakPolarHBondContact O-CB 3.49Å; Q37-T41 PolarHBondContact O-N 3.3Å; Q37-T41 PolarHBondContact O-OG1 3.18Å
38A91.5Very high86.6Confident61 Ų6166.1 Ų66.150%0.50435%0.352SS..Hα-helixtrans-63.4-47.1176.800000111.8I34 A35 C36 T41 C42I34-A38 PolarHBondContact O-N 2.94Å; A35-A38 PolarHBondContact O-N 3.04Å; C36-A38 PolarHBondContact O-N 3.03Å; A38-T41 PolarHBondContact O-N 3.5Å; A38-C42 PolarHBondContact O-N 3.23Å
39F93.2Very high88.1Confident75 Ų7566.5 Ų66.533%0.32936%0.355SS..Hα-helixtrans-66.3-38.4177.8-78.1-70.5000112.3A35 C36 T41 C42 S43 S83 V86 S87A35-F39 WeakPolarHBondContact O-CD2 3.35Å; A35-F39 PolarHBondContact O-N 3.2Å; C36-F39 PolarHBondContact O-N 3.41Å; F39-T41 VanDerWaalsContact C-N 3.32Å; F39-T41 PolarHBondContact O-N 3.12Å; F39-C42 WeakPolarHBondContact O-CB 3.32Å; F39-C42 PolarHBondContact O-N 3.44Å; F39-S43 PolarHBondContact O-N 3.47Å; F39-S83 WeakPolarHBondContact O-CB 3.36Å; F39-V86 HydrophobicContact CD1-CB 4.15Å; F39-V86 HydrophobicContact CD1-CG1 3.98Å; F39-V86 HydrophobicContact CD2-CB 4.44Å; F39-V86 HydrophobicContact CD2-CG1 3.55Å; F39-V86 HydrophobicContact CE1-CB 4.37Å; F39-V86 HydrophobicContact CE1-CG1 3.95Å; F39-V86 HydrophobicContact CE2-CG1 3.55Å; F39-V86 HydrophobicContact CG-CB 4.21Å; F39-V86 HydrophobicContact CG-CG1 3.8Å; F39-V86 HydrophobicContact CZ-CG1 3.76Å; F39-S87 VanDerWaalsContact C-OG 3.28Å; F39-S87 WeakPolarHBondContact CB-OG 3.31Å
40F90.5Very high89.5Confident99 Ų9965.2 Ų65.243%0.43435%0.349SS..Hα-helixtrans-67.7-35.5176.7-156.2-91.4000111.7C36 Q37 S43 F44 S87 A125C36-F40 WeakPolarHBondContact O-CB 3.36Å; C36-F40 PolarHBondContact O-N 2.87Å; Q37-F40 PolarHBondContact O-N 2.8Å; F40-S43 WeakPolarHBondContact O-CB 3.36Å; F40-S43 PolarHBondContact O-N 3.49Å; F40-F44 WeakPolarHBondContact O-CB 3.43Å; F40-F44 PolarHBondContact O-N 3Å; F40-S87 PolarHBondContact N-OG 2.95Å; F40-S87 VanDerWaalsContact N-OG 3.1Å; F40-A125 HydrophobicContact CE2-CB 4.09Å
41T93.1Very high90.5Very high83 Ų8365.2 Ų65.251%0.50935%0.353SS..Hα-helixtrans-65.2-41.1173.6-550000111.4Q37 A38 F39 F44 A45Q37-T41 WeakPolarHBondContact O-CB 3.49Å; Q37-T41 PolarHBondContact O-N 3.3Å; Q37-T41 PolarHBondContact O-OG1 3.18Å; A38-T41 PolarHBondContact O-N 3.5Å; F39-T41 VanDerWaalsContact C-N 3.32Å; F39-T41 PolarHBondContact O-N 3.12Å; T41-F44 PolarHBondContact O-N 2.94Å; T41-A45 WeakPolarHBondContact O-CB 3.44Å; T41-A45 PolarHBondContact O-N 2.91Å
42C93.7Very high90.9Very high58 Ų5861.1 Ų61.139%0.39234%0.335SS..Hα-helixtrans-61.8-45.4174.1-172.50000111.5A38 F39 A45 S46A38-C42 PolarHBondContact O-N 3.23Å; F39-C42 WeakPolarHBondContact O-CB 3.32Å; F39-C42 PolarHBondContact O-N 3.44Å; C42-A45 PolarHBondContact O-N 3.3Å; C42-S46 WeakPolarHBondContact O-CB 3.44Å; C42-S46 PolarHBondContact O-N 3.43Å; C42-S46 PolarHBondContact O-OG 3.01Å
43S93.4Very high91.3Very high9 Ų959.5 Ų59.56%0.06333%0.331CS..Hα-helixtrans-54.5-54.6173154.90000110.8F39 F40 A45 S46 H47 N80 T84F39-S43 PolarHBondContact O-N 3.47Å; F40-S43 WeakPolarHBondContact O-CB 3.36Å; F40-S43 PolarHBondContact O-N 3.49Å; S43-A45 PolarHBondContact O-N 2.91Å; S43-S46 PolarHBondContact O-N 2.89Å; S43-S46 PolarHBondContact O-OG 2.93Å; S43-H47 WeakPolarHBondContact O-CB 3.33Å; S43-H47 PolarHBondContact O-N 3.24Å; S43-N80 WeakPolarHBondContact CA-OD1 3.45Å; S43-N80 WeakPolarHBondContact CB-OD1 3.41Å; S43-N80 PolarHBondContact O-OD1 3.38Å; S43-N80 PolarHBondContact OG-OD1 2.93Å; S43-T84 WeakPolarHBondContact CB-OG1 3.48Å; S43-T84 PolarHBondContact OG-OG1 3.36Å
44F92.4Very high91.6Very high133 Ų13360 Ų6058%0.58334%0.335SS*.Hα-helixtrans-57.8-46.6179.9-177.4-105.4000112.5F40 T41 S46 H47 V48F40-F44 WeakPolarHBondContact O-CB 3.43Å; F40-F44 PolarHBondContact O-N 3Å; T41-F44 PolarHBondContact O-N 2.94Å; F44-S46 PolarHBondContact O-N 3.29Å; F44-H47 PolarHBondContact O-N 3.41Å; F44-V48 HydrophobicContact CD1-CG2 4.25Å; F44-V48 HydrophobicContact CD2-CG2 4.47Å; F44-V48 HydrophobicContact CE1-CG2 3.85Å; F44-V48 HydrophobicContact CE2-CG2 4.08Å; F44-V48 HydrophobicContact CZ-CG2 3.75Å; F44-V48 WeakPolarHBondContact O-CG2 3.23Å; F44-V48 PolarHBondContact O-N 2.88Å
45A95.2Very high91.8Very high58 Ų5860.6 Ų60.648%0.47934%0.339SS..Hα-helixtrans-60.6-43.9178.200000112.1T41 C42 S43 H47 V48 L49T41-A45 WeakPolarHBondContact O-CB 3.44Å; T41-A45 PolarHBondContact O-N 2.91Å; C42-A45 PolarHBondContact O-N 3.3Å; S43-A45 PolarHBondContact O-N 2.91Å; A45-H47 VanDerWaalsContact C-N 3.34Å; A45-H47 PolarHBondContact O-N 2.84Å; A45-V48 PolarHBondContact O-N 3.43Å; A45-L49 WeakPolarHBondContact O-CB 3.36Å; A45-L49 PolarHBondContact O-N 3.24Å
46S93.7Very high91.9Very high12 Ų1261 Ų618%0.08434%0.338CS..Hα-helixtrans-65.9-35.9177.6670000112.7C42 S43 F44 L49 A50 N80C42-S46 WeakPolarHBondContact O-CB 3.44Å; C42-S46 PolarHBondContact O-N 3.43Å; C42-S46 PolarHBondContact O-OG 3.01Å; S43-S46 PolarHBondContact O-N 2.89Å; S43-S46 PolarHBondContact O-OG 2.93Å; F44-S46 PolarHBondContact O-N 3.29Å; S46-L49 PolarHBondContact O-N 2.95Å; S46-A50 PolarHBondContact O-N 3.01Å; S46-N80 WeakPolarHBondContact OG-CA 3.28Å; S46-N80 VanDerWaalsContact OG-CB 3.23Å; S46-N80 WeakPolarHBondContact OG-CB 3.26Å; S46-N80 PolarHBondContact OG-N 3.46Å
47H92.7Very high91.6Very high68 Ų6863.1 Ų63.132%0.31535%0.346SS..Hα-helixtrans-69-45.1176.6-167.466.1000111.8S43 F44 A45 L49 A50 E51S43-H47 WeakPolarHBondContact O-CB 3.33Å; S43-H47 PolarHBondContact O-N 3.24Å; F44-H47 PolarHBondContact O-N 3.41Å; A45-H47 VanDerWaalsContact C-N 3.34Å; A45-H47 PolarHBondContact O-N 2.84Å; H47-L49 PolarHBondContact O-N 3.17Å; H47-A50 WeakPolarHBondContact O-CB 3.44Å; H47-A50 PolarHBondContact O-N 2.92Å; H47-A50 VanDerWaalsContact O-N 3.17Å; H47-E51 PolarHBondContact O-N 3Å
48V94.9Very high91.5Very high75 Ų7564.4 Ų64.446%0.45536%0.36SS..Hα-helixtrans-58.3-40.1173.5170.50000111F44 A45 E51 S52F44-V48 HydrophobicContact CD1-CG2 4.25Å; F44-V48 HydrophobicContact CD2-CG2 4.47Å; F44-V48 HydrophobicContact CE1-CG2 3.85Å; F44-V48 HydrophobicContact CE2-CG2 4.08Å; F44-V48 HydrophobicContact CZ-CG2 3.75Å; F44-V48 WeakPolarHBondContact O-CG2 3.23Å; F44-V48 PolarHBondContact O-N 2.88Å; A45-V48 PolarHBondContact O-N 3.43Å; V48-E51 PolarHBondContact O-N 3.18Å; V48-S52 WeakPolarHBondContact O-CB 3.2Å; V48-S52 PolarHBondContact O-N 2.69Å
49L94Very high91.3Very high83 Ų8367.2 Ų67.244%0.43537%0.366SS..Hα-helixtrans-65.8-43.1177.2-161.5129.4000111.6A45 S46 H47 E51 S52 V53 T76A45-L49 WeakPolarHBondContact O-CB 3.36Å; A45-L49 PolarHBondContact O-N 3.24Å; S46-L49 PolarHBondContact O-N 2.95Å; H47-L49 PolarHBondContact O-N 3.17Å; L49-E51 PolarHBondContact O-N 3.47Å; L49-S52 WeakPolarHBondContact CA-OG 3.31Å; L49-S52 PolarHBondContact O-N 3.31Å; L49-S52 PolarHBondContact O-OG 3.47Å; L49-V53 HydrophobicContact CD2-CG2 4.44Å; L49-V53 WeakPolarHBondContact O-CG2 3.48Å; L49-V53 PolarHBondContact O-N 3.34Å; L49-T76 HydrophobicContact CD2-CG2 3.37Å
50A92.1Very high90.7Very high1 Ų166.6 Ų66.61%0.00838%0.38CS..Hα-helixtrans-58.8-47.4175.500000112S46 H47 S52 V53 I54 L77S46-A50 PolarHBondContact O-N 3.01Å; H47-A50 WeakPolarHBondContact O-CB 3.44Å; H47-A50 PolarHBondContact O-N 2.92Å; H47-A50 VanDerWaalsContact O-N 3.17Å; A50-S52 VanDerWaalsContact C-N 3.33Å; A50-S52 PolarHBondContact O-N 2.92Å; A50-V53 PolarHBondContact O-N 2.98Å; A50-I54 WeakPolarHBondContact O-CG1 3.39Å; A50-I54 PolarHBondContact O-N 3.19Å; A50-L77 HydrophobicContact CB-CD2 4.21Å; A50-L77 HydrophobicContact CB-CG 4.24Å
51E91.4Very high90Very high85 Ų8567.8 Ų67.840%0.39739%0.391SS..Hα-helixtrans-60.9-40.5176.2-71.9-62.8153.200111.9H47 V48 L49 V53 I54 L55H47-E51 PolarHBondContact O-N 3Å; V48-E51 PolarHBondContact O-N 3.18Å; L49-E51 PolarHBondContact O-N 3.47Å; E51-V53 VanDerWaalsContact C-N 3.32Å; E51-V53 PolarHBondContact O-N 2.9Å; E51-I54 PolarHBondContact O-N 3.27Å; E51-L55 WeakPolarHBondContact O-CB 3.22Å; E51-L55 WeakPolarHBondContact O-CG 3.48Å; E51-L55 PolarHBondContact O-N 3.32Å
52S92.1Very high88.9Confident53 Ų5366.9 Ų66.937%0.37139%0.385SS..Hα-helixtrans-63.4-37176.676.50000112.8V48 L49 A50 T56V48-S52 WeakPolarHBondContact O-CB 3.2Å; V48-S52 PolarHBondContact O-N 2.69Å; L49-S52 WeakPolarHBondContact CA-OG 3.31Å; L49-S52 PolarHBondContact O-N 3.31Å; L49-S52 PolarHBondContact O-OG 3.47Å; A50-S52 VanDerWaalsContact C-N 3.33Å; A50-S52 PolarHBondContact O-N 2.92Å; S52-T56 WeakPolarHBondContact O-CB 3.49Å; S52-T56 VanDerWaalsContact O-CG2 3.31Å; S52-T56 WeakPolarHBondContact O-CG2 3.48Å; S52-T56 PolarHBondContact O-N 2.91Å; S52-T56 PolarHBondContact O-OG1 3.35Å
53V89.7Confident87.2Confident19 Ų1969.9 Ų69.912%0.11541%0.407CS..Hα-helixtrans-67.8-42175.3176.20000110.2L49 A50 E51 T56 Q57 A69 I73L49-V53 HydrophobicContact CD2-CG2 4.44Å; L49-V53 WeakPolarHBondContact O-CG2 3.48Å; L49-V53 PolarHBondContact O-N 3.34Å; A50-V53 PolarHBondContact O-N 2.98Å; E51-V53 VanDerWaalsContact C-N 3.32Å; E51-V53 PolarHBondContact O-N 2.9Å; V53-T56 WeakPolarHBondContact CA-OG1 3.47Å; V53-T56 PolarHBondContact O-N 3.48Å; V53-T56 PolarHBondContact O-OG1 3.5Å; V53-Q57 WeakPolarHBondContact O-CG 3.37Å; V53-Q57 PolarHBondContact O-N 3.36Å; V53-Q57 VanDerWaalsContact O-N 3.14Å; V53-A69 HydrophobicContact CG1-CB 4.19Å; V53-I73 HydrophobicContact CB-CG1 4.1Å; V53-I73 HydrophobicContact CG1-CD1 4.01Å; V53-I73 HydrophobicContact CG1-CG1 3.78Å
54I89Confident85.5Confident64 Ų6472.8 Ų72.833%0.32842%0.421SS..Hα-helixtrans-62.1-49176.4-66.1166.5000110.6A50 E51 T56 Q57 V58 I73A50-I54 WeakPolarHBondContact O-CG1 3.39Å; A50-I54 PolarHBondContact O-N 3.19Å; E51-I54 PolarHBondContact O-N 3.27Å; I54-T56 PolarHBondContact O-N 2.77Å; I54-Q57 PolarHBondContact O-N 2.92Å; I54-Q57 VanDerWaalsContact O-N 3.17Å; I54-V58 HydrophobicContact CG2-CG2 4.26Å; I54-V58 WeakPolarHBondContact O-CG2 3.39Å; I54-V58 PolarHBondContact O-N 3.38Å; I54-I73 HydrophobicContact CD1-CD1 4.42Å; I54-I73 HydrophobicContact CG1-CD1 3.58Å; I54-I73 HydrophobicContact CG1-CG1 4.18Å
55L90.1Very high84.2Confident100 Ų10073.8 Ų73.852%0.52443%0.425SS..Hα-helixtrans-61-42-179.8-74.1172.6000112.3E51 Q57 V58 L59E51-L55 WeakPolarHBondContact O-CB 3.22Å; E51-L55 WeakPolarHBondContact O-CG 3.48Å; E51-L55 PolarHBondContact O-N 3.32Å; L55-Q57 VanDerWaalsContact C-N 3.29Å; L55-Q57 PolarHBondContact O-N 3.25Å; L55-V58 PolarHBondContact O-N 3.3Å; L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 VanDerWaalsContact O-CG 3.28Å; L55-L59 WeakPolarHBondContact O-CG 3.33Å; L55-L59 PolarHBondContact O-N 2.91Å
56T88.7Confident83.2Confident42 Ų4273.2 Ų73.226%0.25843%0.425SS..Hα-helixtrans-65.6-32.4177.549.80000112.8S52 V53 I54 G60 L61S52-T56 WeakPolarHBondContact O-CB 3.49Å; S52-T56 VanDerWaalsContact O-CG2 3.31Å; S52-T56 WeakPolarHBondContact O-CG2 3.48Å; S52-T56 PolarHBondContact O-N 2.91Å; S52-T56 PolarHBondContact O-OG1 3.35Å; V53-T56 WeakPolarHBondContact CA-OG1 3.47Å; V53-T56 PolarHBondContact O-N 3.48Å; V53-T56 PolarHBondContact O-OG1 3.5Å; I54-T56 PolarHBondContact O-N 2.77Å; T56-G60 PolarHBondContact O-N 2.71Å; T56-L61 PolarHBondContact O-N 3.46Å; T56-L61 VanDerWaalsContact O-N 3.1Å
57Q84.2Confident82.4Confident61 Ų6175.3 Ų75.329%0.28544%0.439SS..Hα-helixtrans-71-45.9172.3-68.1-53.9-62.500112.2V53 I54 L55 L59 G60 V62 A69V53-Q57 WeakPolarHBondContact O-CG 3.37Å; V53-Q57 PolarHBondContact O-N 3.36Å; V53-Q57 VanDerWaalsContact O-N 3.14Å; I54-Q57 PolarHBondContact O-N 2.92Å; I54-Q57 VanDerWaalsContact O-N 3.17Å; L55-Q57 VanDerWaalsContact C-N 3.29Å; L55-Q57 PolarHBondContact O-N 3.25Å; Q57-L59 VanDerWaalsContact C-N 3.32Å; Q57-L59 PolarHBondContact O-N 2.85Å; Q57-G60 PolarHBondContact O-N 2.7Å; Q57-G60 VanDerWaalsContact O-N 3.14Å; Q57-V62 PolarHBondContact NE2-O 3.42Å; Q57-A69 HydrophobicContact CG-CB 3.83Å
58V85.7Confident81.9Confident114 Ų11480.4 Ų80.469%0.69146%0.456SS*.Hα-helixtrans-63.1-38.9-179.8171.60000111.6I54 L55 G60I54-V58 HydrophobicContact CG2-CG2 4.26Å; I54-V58 WeakPolarHBondContact O-CG2 3.39Å; I54-V58 PolarHBondContact O-N 3.38Å; L55-V58 PolarHBondContact O-N 3.3Å; V58-G60 VanDerWaalsContact C-N 3.27Å; V58-G60 PolarHBondContact O-N 2.9Å
59L87Confident81.5Confident119 Ų11977 Ų7762%0.62344%0.436SS*.THydrogen-bonded Turntrans-80.9-3.9178.8-64.2173.7000113.5L55 Q57 L61L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 VanDerWaalsContact O-CG 3.28Å; L55-L59 WeakPolarHBondContact O-CG 3.33Å; L55-L59 PolarHBondContact O-N 2.91Å; Q57-L59 VanDerWaalsContact C-N 3.32Å; Q57-L59 PolarHBondContact O-N 2.85Å; L59-L61 HydrophobicContact CB-CD1 3.88Å; L59-L61 HydrophobicContact CB-CG 3.84Å; L59-L61 HydrophobicContact CD1-CD1 3.86Å; L59-L61 PolarHBondContact O-N 3.37Å
60G80.7Confident81.1Confident62 Ų6274.3 Ų74.364%0.63942%0.422SS*.THydrogen-bonded Turntrans63.218.5-177.600000114.2T56 Q57 V58 V62T56-G60 PolarHBondContact O-N 2.71Å; Q57-G60 PolarHBondContact O-N 2.7Å; Q57-G60 VanDerWaalsContact O-N 3.14Å; V58-G60 VanDerWaalsContact C-N 3.27Å; V58-G60 PolarHBondContact O-N 2.9Å; G60-V62 VanDerWaalsContact C-N 3.29Å; G60-V62 PolarHBondContact O-N 3.13Å
61L77.7Confident80.8Confident125 Ų12577.9 Ų77.965%0.65444%0.441SS*.SBendtrans-69.6-28.8-176.5-72.8168.3000112.2T56 L59T56-L61 PolarHBondContact O-N 3.46Å; T56-L61 VanDerWaalsContact O-N 3.1Å; L59-L61 HydrophobicContact CB-CD1 3.88Å; L59-L61 HydrophobicContact CB-CG 3.84Å; L59-L61 HydrophobicContact CD1-CD1 3.86Å; L59-L61 PolarHBondContact O-N 3.37Å
62V68.9Low80.7Confident63 Ų6376.1 Ų76.138%0.38244%0.438SS..  trans-137.8113.3-177.4-168.50000110Q57 G60 I64Q57-V62 PolarHBondContact NE2-O 3.42Å; G60-V62 VanDerWaalsContact C-N 3.29Å; G60-V62 PolarHBondContact O-N 3.13Å; V62-I64 HydrophobicContact CB-CD1 4.37Å; V62-I64 HydrophobicContact CG1-CD1 3.65Å; V62-I64 HydrophobicContact CG1-CG1 3.63Å; V62-I64 PolarHBondContact O-N 3.5Å
63S58.4Low80.7Confident122 Ų12274.4 Ų74.485%0.85342%0.424SS*.  trans-77.355.8173.577.20000111.6F65S63-F65 PolarHBondContact O-N 3.49Å
64I57.7Low80.7Confident69 Ų6975.1 Ų75.135%0.35443%0.426SS..  trans-66125.7163.9-71.6152.9000106V62 G66 R68 A69V62-I64 HydrophobicContact CB-CD1 4.37Å; V62-I64 HydrophobicContact CG1-CD1 3.65Å; V62-I64 HydrophobicContact CG1-CG1 3.63Å; V62-I64 PolarHBondContact O-N 3.5Å; I64-G66 PolarHBondContact O-N 2.98Å; I64-R68 HydrophobicContact CG2-CB 3.56Å; I64-A69 HydrophobicContact CB-CB 4.48Å; I64-A69 HydrophobicContact CG2-CB 4Å
65F64.4Low80.9Confident155 Ų15576 Ų7668%0.6844%0.435SS*.  trans-43.4119.3171.2-74.2-85.1000108.7S63 S67 R68 A69S63-F65 PolarHBondContact O-N 3.49Å; F65-S67 PolarHBondContact O-N 2.89Å; F65-R68 PolarHBondContact O-N 3.26Å; F65-A69 PolarHBondContact O-N 2.84Å
66G74.3Confident81.1Confident46 Ų4672.1 Ų72.147%0.47442%0.415SS..Hα-helixtrans-50.4-30.1-166.100000114.1I64 R68 A69 V70I64-G66 PolarHBondContact O-N 2.98Å; G66-R68 PolarHBondContact O-N 2.89Å; G66-A69 PolarHBondContact O-N 2.95Å; G66-V70 VanDerWaalsContact O-CG2 3.24Å; G66-V70 WeakPolarHBondContact O-CG2 3.19Å; G66-V70 PolarHBondContact O-N 3.14Å
67S78.1Confident81.3Confident55 Ų5570.6 Ų70.639%0.38541%0.406SS..Hα-helixtrans-60.4-40.2173.455.80000114.5F65 L71F65-S67 PolarHBondContact O-N 2.89Å; S67-L71 WeakPolarHBondContact O-CB 3.4Å; S67-L71 PolarHBondContact O-N 3.45Å
68R82.2Confident81.7Confident176 Ų17670.4 Ų70.466%0.66441%0.411SS*.Hα-helixtrans-71.5-37.3176.8-70.4-175.9179.8-1780.6111.9I64 F65 G66 L71 C72I64-R68 HydrophobicContact CG2-CB 3.56Å; F65-R68 PolarHBondContact O-N 3.26Å; G66-R68 PolarHBondContact O-N 2.89Å; R68-L71 PolarHBondContact O-N 3.37Å; R68-C72 WeakPolarHBondContact O-CB 3.47Å; R68-C72 PolarHBondContact O-N 2.93Å
69A85Confident82.2Confident4 Ų467.9 Ų67.93%0.03340%0.395CS..Hα-helixtrans-64.4-44.717500000110.7V53 Q57 I64 F65 G66 L71 C72 I73V53-A69 HydrophobicContact CG1-CB 4.19Å; Q57-A69 HydrophobicContact CG-CB 3.83Å; I64-A69 HydrophobicContact CB-CB 4.48Å; I64-A69 HydrophobicContact CG2-CB 4Å; F65-A69 PolarHBondContact O-N 2.84Å; G66-A69 PolarHBondContact O-N 2.95Å; A69-L71 PolarHBondContact O-N 3.44Å; A69-C72 WeakPolarHBondContact O-CB 3.33Å; A69-C72 PolarHBondContact O-N 3.33Å; A69-I73 WeakPolarHBondContact O-CG1 3.4Å; A69-I73 PolarHBondContact O-N 2.61Å
70V85.9Confident82.5Confident25 Ų2562.5 Ų62.515%0.15237%0.367CS..Hα-helixtrans-60.2-45.6174.5172.10000111.4G66 C72 I73 M74 L139 V143G66-V70 VanDerWaalsContact O-CG2 3.24Å; G66-V70 WeakPolarHBondContact O-CG2 3.19Å; G66-V70 PolarHBondContact O-N 3.14Å; V70-C72 VanDerWaalsContact C-N 3.32Å; V70-C72 PolarHBondContact O-N 2.88Å; V70-I73 PolarHBondContact O-N 3.5Å; V70-M74 HydrophobicContact CG1-CG 4.38Å; V70-M74 HydrophobicContact CG1-SD 4.09Å; V70-M74 WeakPolarHBondContact O-CG 3.36Å; V70-M74 PolarHBondContact O-N 3.47Å; V70-L139 HydrophobicContact CG1-CD2 4.4Å; V70-V143 HydrophobicContact CB-CG1 4.42Å; V70-V143 HydrophobicContact CG1-CB 4.3Å; V70-V143 HydrophobicContact CG1-CG1 3.85Å; V70-V143 HydrophobicContact CG2-CG1 3.84Å
71L87Confident83.2Confident77 Ų7760.3 Ų60.340%0.40334%0.342SS..Hα-helixtrans-58.2-45.5175.7-173.386000111.3S67 R68 A69 I73 M74 V75 Y144S67-L71 WeakPolarHBondContact O-CB 3.4Å; S67-L71 PolarHBondContact O-N 3.45Å; R68-L71 PolarHBondContact O-N 3.37Å; A69-L71 PolarHBondContact O-N 3.44Å; L71-I73 PolarHBondContact O-N 3.27Å; L71-M74 PolarHBondContact O-N 3.05Å; L71-V75 WeakPolarHBondContact O-CG2 3.39Å; L71-V75 PolarHBondContact O-N 3.48Å; L71-Y144 HydrophobicContact CB-CE2 4.2Å; L71-Y144 HydrophobicContact CD1-CD2 4.46Å; L71-Y144 HydrophobicContact CD1-CE2 3.64Å
72C89.2Confident84Confident48 Ų4860.6 Ų60.632%0.32434%0.338SS..Hα-helixtrans-58.9-49178-174.30000111R68 A69 V70 M74 V75 T76R68-C72 WeakPolarHBondContact O-CB 3.47Å; R68-C72 PolarHBondContact O-N 2.93Å; A69-C72 WeakPolarHBondContact O-CB 3.33Å; A69-C72 PolarHBondContact O-N 3.33Å; V70-C72 VanDerWaalsContact C-N 3.32Å; V70-C72 PolarHBondContact O-N 2.88Å; C72-M74 PolarHBondContact O-N 2.91Å; C72-V75 PolarHBondContact O-N 3.1Å; C72-T76 WeakPolarHBondContact O-CG2 3.31Å; C72-T76 PolarHBondContact O-N 3.01Å; C72-T76 PolarHBondContact O-OG1 3.2Å
73I90.5Very high85.2Confident17 Ų1757.8 Ų57.89%0.08732%0.321CS..Hα-helixtrans-57.3-48.2176.7-67.6162.3000110.7V53 I54 A69 V70 L71 V75 T76 L77 L139V53-I73 HydrophobicContact CB-CG1 4.1Å; V53-I73 HydrophobicContact CG1-CD1 4.01Å; V53-I73 HydrophobicContact CG1-CG1 3.78Å; I54-I73 HydrophobicContact CD1-CD1 4.42Å; I54-I73 HydrophobicContact CG1-CD1 3.58Å; I54-I73 HydrophobicContact CG1-CG1 4.18Å; A69-I73 WeakPolarHBondContact O-CG1 3.4Å; A69-I73 PolarHBondContact O-N 2.61Å; V70-I73 PolarHBondContact O-N 3.5Å; L71-I73 PolarHBondContact O-N 3.27Å; I73-V75 PolarHBondContact O-N 2.96Å; I73-T76 VanDerWaalsContact CA-OG1 3.31Å; I73-T76 WeakPolarHBondContact CA-OG1 3.04Å; I73-T76 PolarHBondContact O-N 3.5Å; I73-T76 PolarHBondContact O-OG1 3.36Å; I73-L77 HydrophobicContact CG2-CD1 3.64Å; I73-L77 HydrophobicContact CG2-CG 4.19Å; I73-L77 WeakPolarHBondContact O-CB 3.05Å; I73-L77 WeakPolarHBondContact O-CG 3.44Å; I73-L77 PolarHBondContact O-N 3.24Å; I73-L139 HydrophobicContact CG2-CD1 3.75Å
74M90.8Very high86.9Confident33 Ų3352 Ų5216%0.16328%0.281CS..Hα-helixtrans-58.1-46.2178.6-74.5178.264.600112.1V70 L71 C72 S78 L139 Y144V70-M74 HydrophobicContact CG1-CG 4.38Å; V70-M74 HydrophobicContact CG1-SD 4.09Å; V70-M74 WeakPolarHBondContact O-CG 3.36Å; V70-M74 PolarHBondContact O-N 3.47Å; L71-M74 PolarHBondContact O-N 3.05Å; C72-M74 PolarHBondContact O-N 2.91Å; M74-S78 WeakPolarHBondContact O-CB 3.41Å; M74-S78 PolarHBondContact O-N 2.96Å; M74-S78 PolarHBondContact O-OG 3.47Å; M74-L139 HydrophobicContact CG-CB 3.72Å; M74-L139 HydrophobicContact CG-CD1 4.18Å; M74-L139 HydrophobicContact SD-CB 4.08Å; M74-Y144 HydrophobicContact SD-CD2 4.43Å; M74-Y144 HydrophobicContact SD-CG 4.48Å
75V92.3Very high88.7Confident84 Ų8452.6 Ų52.651%0.50929%0.285SS..Hα-helixtrans-63.3-48178.1172.30000110.5L71 C72 I73 L77 S78 V79L71-V75 WeakPolarHBondContact O-CG2 3.39Å; L71-V75 PolarHBondContact O-N 3.48Å; C72-V75 PolarHBondContact O-N 3.1Å; I73-V75 PolarHBondContact O-N 2.96Å; V75-L77 PolarHBondContact O-N 2.91Å; V75-S78 WeakPolarHBondContact O-CB 3.26Å; V75-S78 PolarHBondContact O-N 3.1Å; V75-V79 WeakPolarHBondContact O-CG2 3.32Å; V75-V79 PolarHBondContact O-N 3.45Å
76T93.7Very high90.1Very high17 Ų1746.8 Ų46.810%0.10426%0.261CS..Hα-helixtrans-64.8-40.8-178.847.50000112.7L49 C72 I73 S78 V79 N80L49-T76 HydrophobicContact CD2-CG2 3.37Å; C72-T76 WeakPolarHBondContact O-CG2 3.31Å; C72-T76 PolarHBondContact O-N 3.01Å; C72-T76 PolarHBondContact O-OG1 3.2Å; I73-T76 VanDerWaalsContact CA-OG1 3.31Å; I73-T76 WeakPolarHBondContact CA-OG1 3.04Å; I73-T76 PolarHBondContact O-N 3.5Å; I73-T76 PolarHBondContact O-OG1 3.36Å; T76-S78 VanDerWaalsContact C-N 3.33Å; T76-S78 PolarHBondContact O-N 3.45Å; T76-V79 PolarHBondContact O-N 2.87Å; T76-N80 PolarHBondContact O-N 2.92Å
77L93.4Very high91Very high11 Ų1144.7 Ų44.76%0.05824%0.24CC..Hα-helixtrans-68.5-32.5174.6-73.3174.8000111.9A50 I73 V75 N80 C81 T135 V136 L139A50-L77 HydrophobicContact CB-CD2 4.21Å; A50-L77 HydrophobicContact CB-CG 4.24Å; I73-L77 HydrophobicContact CG2-CD1 3.64Å; I73-L77 HydrophobicContact CG2-CG 4.19Å; I73-L77 WeakPolarHBondContact O-CB 3.05Å; I73-L77 WeakPolarHBondContact O-CG 3.44Å; I73-L77 PolarHBondContact O-N 3.24Å; V75-L77 PolarHBondContact O-N 2.91Å; L77-N80 WeakPolarHBondContact O-CB 3.49Å; L77-N80 PolarHBondContact O-N 2.9Å; L77-C81 WeakPolarHBondContact O-CB 3.11Å; L77-C81 PolarHBondContact O-N 2.91Å; L77-C81 PolarHBondContact O-SG 2.73Å; L77-T135 HydrophobicContact CD1-CG2 3.74Å; L77-V136 HydrophobicContact CB-CG2 3.4Å; L77-V136 HydrophobicContact CD1-CG2 4.23Å; L77-V136 HydrophobicContact CG-CG2 4.47Å; L77-L139 HydrophobicContact CD1-CD1 4.41Å
78S93.5Very high91.7Very high56 Ų5642.9 Ų42.939%0.39223%0.225SC..Hα-helixtrans-65-42.9173.8-58.30000111.4M74 V75 T76 N80 C81 F82M74-S78 WeakPolarHBondContact O-CB 3.41Å; M74-S78 PolarHBondContact O-N 2.96Å; M74-S78 PolarHBondContact O-OG 3.47Å; V75-S78 WeakPolarHBondContact O-CB 3.26Å; V75-S78 PolarHBondContact O-N 3.1Å; T76-S78 VanDerWaalsContact C-N 3.33Å; T76-S78 PolarHBondContact O-N 3.45Å; S78-N80 VanDerWaalsContact C-N 3.32Å; S78-C81 PolarHBondContact O-N 3.36Å; S78-F82 WeakPolarHBondContact O-CB 3.24Å; S78-F82 PolarHBondContact O-N 3.01Å
79V94.7Very high92.2Very high61 Ų6139 Ų3937%0.3722%0.217SC..Hα-helixtrans-62.9-40.5173.41750000110.9V75 T76 F82 S83V75-V79 WeakPolarHBondContact O-CG2 3.32Å; V75-V79 PolarHBondContact O-N 3.45Å; T76-V79 PolarHBondContact O-N 2.87Å; V79-F82 PolarHBondContact O-N 3.37Å; V79-S83 VanDerWaalsContact O-CB 3.31Å; V79-S83 WeakPolarHBondContact O-CB 3.47Å; V79-S83 PolarHBondContact O-N 2.97Å; V79-S83 PolarHBondContact O-OG 3.28Å
80N94.5Very high92.4Very high6 Ų640.3 Ų40.33%0.03223%0.225CC..Hα-helixtrans-58.6-52.2174.1-17739.7000111.4S43 S46 T76 L77 S78 F82 S83 T84 S132S43-N80 WeakPolarHBondContact CA-OD1 3.45Å; S43-N80 WeakPolarHBondContact CB-OD1 3.41Å; S43-N80 PolarHBondContact O-OD1 3.38Å; S43-N80 PolarHBondContact OG-OD1 2.93Å; S46-N80 WeakPolarHBondContact OG-CA 3.28Å; S46-N80 VanDerWaalsContact OG-CB 3.23Å; S46-N80 WeakPolarHBondContact OG-CB 3.26Å; S46-N80 PolarHBondContact OG-N 3.46Å; T76-N80 PolarHBondContact O-N 2.92Å; L77-N80 WeakPolarHBondContact O-CB 3.49Å; L77-N80 PolarHBondContact O-N 2.9Å; S78-N80 VanDerWaalsContact C-N 3.32Å; N80-F82 PolarHBondContact O-N 3.21Å; N80-S83 PolarHBondContact O-N 2.9Å; N80-T84 VanDerWaalsContact O-CB 3.31Å; N80-T84 WeakPolarHBondContact O-CB 3.28Å; N80-T84 PolarHBondContact O-N 3.35Å; N80-T84 PolarHBondContact O-OG1 3.37Å; N80-T84 PolarHBondContact OD1-OG1 3.32Å; N80-S132 PolarHBondContact ND2-OG 2.71Å
81C94.3Very high92.6Very high16 Ų1641 Ų4111%0.10823%0.227CC..Hα-helixtrans-59.7-47.1179.8-70.90000111.4L77 S78 T84 L85 L129 S132L77-C81 WeakPolarHBondContact O-CB 3.11Å; L77-C81 PolarHBondContact O-N 2.91Å; L77-C81 PolarHBondContact O-SG 2.73Å; S78-C81 PolarHBondContact O-N 3.36Å; C81-T84 PolarHBondContact O-N 3Å; C81-L85 VanDerWaalsContact O-CB 3.26Å; C81-L85 WeakPolarHBondContact O-CB 3.37Å; C81-L85 PolarHBondContact O-N 3.09Å; C81-L129 HydrophobicContact CB-CD1 3.76Å; C81-L129 WeakPolarHBondContact O-CD1 3.38Å; C81-S132 WeakPolarHBondContact SG-CB 3.4Å
82F95.5Very high92.6Very high131 Ų13138.3 Ų38.358%0.57522%0.218SC*.Hα-helixtrans-60.5-49.5178.5179.9-99.6000111.6S78 V79 N80 T84 L85 V86S78-F82 WeakPolarHBondContact O-CB 3.24Å; S78-F82 PolarHBondContact O-N 3.01Å; V79-F82 PolarHBondContact O-N 3.37Å; N80-F82 PolarHBondContact O-N 3.21Å; F82-T84 PolarHBondContact O-N 3.26Å; F82-L85 PolarHBondContact O-N 3.02Å; F82-V86 HydrophobicContact CD1-CG2 4.42Å; F82-V86 HydrophobicContact CE1-CG2 4.02Å; F82-V86 HydrophobicContact CE2-CG2 4.28Å; F82-V86 HydrophobicContact CZ-CG2 3.94Å; F82-V86 WeakPolarHBondContact O-CG2 3.43Å; F82-V86 PolarHBondContact O-N 3.35Å
83S94.6Very high92.5Very high4 Ų440 Ų403%0.02823%0.226CC..Hα-helixtrans-66.5-38.2-178-52.70000112F39 V79 N80 S87F39-S83 WeakPolarHBondContact O-CB 3.36Å; V79-S83 VanDerWaalsContact O-CB 3.31Å; V79-S83 WeakPolarHBondContact O-CB 3.47Å; V79-S83 PolarHBondContact O-N 2.97Å; V79-S83 PolarHBondContact O-OG 3.28Å; N80-S83 PolarHBondContact O-N 2.9Å; S83-S87 WeakPolarHBondContact O-CB 3.33Å; S83-S87 PolarHBondContact O-N 3.39Å; S83-S87 PolarHBondContact O-OG 3Å
84T93.4Very high92.2Very high1 Ų139.3 Ų39.31%0.00622%0.223CC..Hα-helixtrans-65.9-42.9175.5-52.90000110.9S43 N80 C81 F82 S87 L88 L129S43-T84 WeakPolarHBondContact CB-OG1 3.48Å; S43-T84 PolarHBondContact OG-OG1 3.36Å; N80-T84 VanDerWaalsContact O-CB 3.31Å; N80-T84 WeakPolarHBondContact O-CB 3.28Å; N80-T84 PolarHBondContact O-N 3.35Å; N80-T84 PolarHBondContact O-OG1 3.37Å; N80-T84 PolarHBondContact OD1-OG1 3.32Å; C81-T84 PolarHBondContact O-N 3Å; F82-T84 PolarHBondContact O-N 3.26Å; T84-S87 WeakPolarHBondContact O-CB 3.36Å; T84-S87 PolarHBondContact O-N 3.45Å; T84-L88 HydrophobicContact CG2-CD1 4.16Å; T84-L88 HydrophobicContact CG2-CG 4.48Å; T84-L88 WeakPolarHBondContact O-CG 3.35Å; T84-L88 PolarHBondContact O-N 3.35Å; T84-L129 HydrophobicContact CG2-CB 4.13Å; T84-L129 HydrophobicContact CG2-CD1 4.45Å
85L94.8Very high91.7Very high82 Ų8238.5 Ų38.543%0.42922%0.22SC..Hα-helixtrans-61.9-47.1177.6-17966.4000111.3C81 F82 S87 L88 I89 L129C81-L85 VanDerWaalsContact O-CB 3.26Å; C81-L85 WeakPolarHBondContact O-CB 3.37Å; C81-L85 PolarHBondContact O-N 3.09Å; F82-L85 PolarHBondContact O-N 3.02Å; L85-S87 VanDerWaalsContact C-N 3.32Å; L85-S87 PolarHBondContact O-N 3.36Å; L85-L88 PolarHBondContact O-N 3.39Å; L85-I89 HydrophobicContact CD1-CD1 4.2Å; L85-I89 HydrophobicContact CG-CD1 4.01Å; L85-I89 WeakPolarHBondContact O-CG1 3.4Å; L85-I89 PolarHBondContact O-N 3.45Å; L85-L129 HydrophobicContact CB-CD2 4.18Å; L85-L129 HydrophobicContact CD1-CD2 4.01Å
86V94.7Very high91.2Very high32 Ų3237.7 Ų37.719%0.19421%0.212CC..Hα-helixtrans-59.6-46175.7175.70000110.2F39 F82 L88 I89 T90F39-V86 HydrophobicContact CD1-CB 4.15Å; F39-V86 HydrophobicContact CD1-CG1 3.98Å; F39-V86 HydrophobicContact CD2-CB 4.44Å; F39-V86 HydrophobicContact CD2-CG1 3.55Å; F39-V86 HydrophobicContact CE1-CB 4.37Å; F39-V86 HydrophobicContact CE1-CG1 3.95Å; F39-V86 HydrophobicContact CE2-CG1 3.55Å; F39-V86 HydrophobicContact CG-CB 4.21Å; F39-V86 HydrophobicContact CG-CG1 3.8Å; F39-V86 HydrophobicContact CZ-CG1 3.76Å; F82-V86 HydrophobicContact CD1-CG2 4.42Å; F82-V86 HydrophobicContact CE1-CG2 4.02Å; F82-V86 HydrophobicContact CE2-CG2 4.28Å; F82-V86 HydrophobicContact CZ-CG2 3.94Å; F82-V86 WeakPolarHBondContact O-CG2 3.43Å; F82-V86 PolarHBondContact O-N 3.35Å; V86-L88 PolarHBondContact O-N 3.06Å; V86-I89 PolarHBondContact O-N 3.27Å; V86-T90 WeakPolarHBondContact O-CB 3.43Å; V86-T90 PolarHBondContact O-N 2.97Å; V86-T90 PolarHBondContact O-OG1 2.91Å
87S92.9Very high90.6Very high3 Ų339.7 Ų39.72%0.02123%0.225CC..Hα-helixtrans-57.7-45.6177.5-54.70000112.4C36 F39 F40 S83 T84 L85 T90 M91C36-S87 PolarHBondContact SG-O 3.48Å; F39-S87 VanDerWaalsContact C-OG 3.28Å; F39-S87 WeakPolarHBondContact CB-OG 3.31Å; F40-S87 PolarHBondContact N-OG 2.95Å; F40-S87 VanDerWaalsContact N-OG 3.1Å; S83-S87 WeakPolarHBondContact O-CB 3.33Å; S83-S87 PolarHBondContact O-N 3.39Å; S83-S87 PolarHBondContact O-OG 3Å; T84-S87 WeakPolarHBondContact O-CB 3.36Å; T84-S87 PolarHBondContact O-N 3.45Å; L85-S87 VanDerWaalsContact C-N 3.32Å; L85-S87 PolarHBondContact O-N 3.36Å; S87-T90 PolarHBondContact O-N 3.01Å; S87-M91 VanDerWaalsContact O-CB 3.28Å; S87-M91 WeakPolarHBondContact O-CB 3.46Å; S87-M91 PolarHBondContact O-N 3.21Å
88L92.2Very high89.7Confident16 Ų1641.1 Ų41.18%0.08423%0.231CC..Hα-helixtrans-62.1-45.7177.5-73.1169000111.2T84 L85 V86 M91 G92 Y122 A125 A126 L129T84-L88 HydrophobicContact CG2-CD1 4.16Å; T84-L88 HydrophobicContact CG2-CG 4.48Å; T84-L88 WeakPolarHBondContact O-CG 3.35Å; T84-L88 PolarHBondContact O-N 3.35Å; L85-L88 PolarHBondContact O-N 3.39Å; V86-L88 PolarHBondContact O-N 3.06Å; L88-M91 PolarHBondContact O-N 3.1Å; L88-G92 PolarHBondContact O-N 3.31Å; L88-Y122 HydrophobicContact CB-CE2 4.11Å; L88-Y122 HydrophobicContact CD2-CD1 4.4Å; L88-Y122 HydrophobicContact CD2-CD2 3.61Å; L88-Y122 HydrophobicContact CD2-CE1 4.28Å; L88-Y122 HydrophobicContact CD2-CE2 3.48Å; L88-Y122 VanDerWaalsContact CD2-CE2 3.48Å; L88-Y122 HydrophobicContact CD2-CG 4.09Å; L88-Y122 HydrophobicContact CG-CE2 4.42Å; L88-Y122 WeakPolarHBondContact O-CE2 3.35Å; L88-A125 HydrophobicContact CD2-CB 3.93Å; L88-A126 HydrophobicContact CD1-CB 4.15Å; L88-A126 HydrophobicContact CD2-CB 4.36Å; L88-L129 HydrophobicContact CD1-CD2 3.92Å
89I92.7Very high88.8Confident94 Ų9441.3 Ų41.348%0.48223%0.226SC..Hα-helixtrans-63-48.1177.9-66.4167.4000110.4L85 V86 M91 G92 V93L85-I89 HydrophobicContact CD1-CD1 4.2Å; L85-I89 HydrophobicContact CG-CD1 4.01Å; L85-I89 WeakPolarHBondContact O-CG1 3.4Å; L85-I89 PolarHBondContact O-N 3.45Å; V86-I89 PolarHBondContact O-N 3.27Å; I89-M91 PolarHBondContact O-N 3.47Å; I89-G92 PolarHBondContact O-N 3.34Å; I89-V93 HydrophobicContact CG2-CG2 4.25Å; I89-V93 WeakPolarHBondContact O-CB 3.33Å; I89-V93 WeakPolarHBondContact O-CG2 3.28Å; I89-V93 PolarHBondContact O-N 2.71Å
90T90.8Very high87.9Confident33 Ų3344.3 Ų44.320%0.20223%0.234CC..Hα-helixtrans-62.8-42.1-179.2-50.80000111.6W32 A35 C36 V86 S87 G94W32-T90 HydrophobicContact CB-CG2 4.06Å; W32-T90 VanDerWaalsContact O-CG2 3.31Å; W32-T90 WeakPolarHBondContact O-CG2 3.4Å; A35-T90 HydrophobicContact CB-CG2 4.34Å; C36-T90 HydrophobicContact CB-CG2 4.49Å; V86-T90 WeakPolarHBondContact O-CB 3.43Å; V86-T90 PolarHBondContact O-N 2.97Å; V86-T90 PolarHBondContact O-OG1 2.91Å; S87-T90 PolarHBondContact O-N 3.01Å; T90-G94 WeakPolarHBondContact O-CA 3.47Å; T90-G94 PolarHBondContact O-N 3.24Å
91M88.3Confident86.8Confident40 Ų4047.6 Ų47.620%0.19725%0.251CS..Hα-helixtrans-63.9-46.1175-169.680.3-170.200111.4W32 S87 L88 I89 G94 I95 Y122W32-M91 HydrophobicContact CH2-CE 4.37Å; W32-M91 HydrophobicContact CH2-SD 4.37Å; W32-M91 HydrophobicContact CZ3-CE 4.25Å; W32-M91 HydrophobicContact CZ3-SD 3.67Å; S87-M91 VanDerWaalsContact O-CB 3.28Å; S87-M91 WeakPolarHBondContact O-CB 3.46Å; S87-M91 PolarHBondContact O-N 3.21Å; L88-M91 PolarHBondContact O-N 3.1Å; I89-M91 PolarHBondContact O-N 3.47Å; M91-G94 PolarHBondContact O-N 3.28Å; M91-I95 HydrophobicContact CE-CD1 3.75Å; M91-I95 HydrophobicContact CE-CG1 4.17Å; M91-I95 HydrophobicContact CG-CD1 3.92Å; M91-I95 VanDerWaalsContact O-CG1 3.31Å; M91-I95 WeakPolarHBondContact O-CG1 3.33Å; M91-I95 PolarHBondContact O-N 3.47Å; M91-Y122 HydrophobicContact CB-CD2 4.25Å; M91-Y122 HydrophobicContact CB-CE2 4.28Å; M91-Y122 HydrophobicContact CG-CD2 4.09Å
92G87.1Confident85.5Confident20 Ų2048.5 Ų48.521%0.20625%0.253CS..Hα-helixtrans-62.6-47.1-179.500000112.5L88 I89 D96L88-G92 PolarHBondContact O-N 3.31Å; I89-G92 PolarHBondContact O-N 3.34Å; G92-D96 WeakPolarHBondContact O-CB 3.38Å; G92-D96 PolarHBondContact O-N 3.45Å
93V87.8Confident84.2Confident83 Ų8350.8 Ų50.850%0.50326%0.258SS..Hα-helixtrans-66.8-39.4176.1174.40000111.2I89 D96 T97I89-V93 HydrophobicContact CG2-CG2 4.25Å; I89-V93 WeakPolarHBondContact O-CB 3.33Å; I89-V93 WeakPolarHBondContact O-CG2 3.28Å; I89-V93 PolarHBondContact O-N 2.71Å; V93-D96 PolarHBondContact O-N 3.19Å; V93-T97 WeakPolarHBondContact O-CB 3.42Å; V93-T97 PolarHBondContact O-N 3.21Å; V93-T97 PolarHBondContact O-OG1 2.85Å
94G84.7Confident82.9Confident3 Ų354.6 Ų54.63%0.03129%0.289CS..Hα-helixtrans-58-54.1176.300000111.6T90 M91 D96 T97 E98T90-G94 WeakPolarHBondContact O-CA 3.47Å; T90-G94 PolarHBondContact O-N 3.24Å; M91-G94 PolarHBondContact O-N 3.28Å; G94-D96 PolarHBondContact O-N 2.92Å; G94-T97 WeakPolarHBondContact O-CB 3.47Å; G94-T97 PolarHBondContact O-N 3.25Å; G94-E98 WeakPolarHBondContact O-CG 3.47Å; G94-E98 PolarHBondContact O-N 2.94Å
95I80.5Confident81.4Confident16 Ų1656.4 Ų56.48%0.08231%0.305CS..Hα-helixtrans-60.5-45.5177.9-66.6168.2000111.3M91 T97 E98 Q99 L118M91-I95 HydrophobicContact CE-CD1 3.75Å; M91-I95 HydrophobicContact CE-CG1 4.17Å; M91-I95 HydrophobicContact CG-CD1 3.92Å; M91-I95 VanDerWaalsContact O-CG1 3.31Å; M91-I95 WeakPolarHBondContact O-CG1 3.33Å; M91-I95 PolarHBondContact O-N 3.47Å; I95-T97 VanDerWaalsContact C-N 3.27Å; I95-T97 PolarHBondContact O-N 3.18Å; I95-E98 PolarHBondContact O-N 3.22Å; I95-Q99 WeakPolarHBondContact O-CB 3.33Å; I95-Q99 PolarHBondContact O-N 3.41Å; I95-L118 HydrophobicContact CD1-CD2 3.73Å; I95-L118 HydrophobicContact CD1-CG 4.38Å
96D82.4Confident79.6Confident66 Ų6661.9 Ų61.935%0.35333%0.325SS..Hα-helixtrans-61.3-38.2178.517859.3000111.7G92 V93 G94 Q99 K100G92-D96 WeakPolarHBondContact O-CB 3.38Å; G92-D96 PolarHBondContact O-N 3.45Å; V93-D96 PolarHBondContact O-N 3.19Å; G94-D96 PolarHBondContact O-N 2.92Å; D96-Q99 PolarHBondContact O-N 3.18Å; D96-K100 VanDerWaalsContact O-CG 3.29Å; D96-K100 WeakPolarHBondContact O-CG 3.31Å; D96-K100 PolarHBondContact O-N 3.45Å; D96-K100 WeakPolarHBondContact OD1-CE 3.38Å; D96-K100 IonicContact OD1-NZ 2.87Å; D96-K100 WeakPolarHBondContact OD2-CE 3.09Å; D96-K100 IonicContact OD2-NZ 3.5Å; D96-K100 PolarHBondContact OD2-NZ 3.4Å
97T80.5Confident77.6Confident60 Ų6065.4 Ų65.437%0.36834%0.339SS..Hα-helixtrans-66.3-43.9175.7-54.60000111.4V93 G94 I95 Q99 K100 I101V93-T97 WeakPolarHBondContact O-CB 3.42Å; V93-T97 PolarHBondContact O-N 3.21Å; V93-T97 PolarHBondContact O-OG1 2.85Å; G94-T97 WeakPolarHBondContact O-CB 3.47Å; G94-T97 PolarHBondContact O-N 3.25Å; I95-T97 VanDerWaalsContact C-N 3.27Å; I95-T97 PolarHBondContact O-N 3.18Å; T97-Q99 VanDerWaalsContact C-N 3.34Å; T97-Q99 PolarHBondContact O-N 2.69Å; T97-K100 PolarHBondContact O-N 3.2Å; T97-I101 HydrophobicContact CG2-CD1 4.08Å; T97-I101 WeakPolarHBondContact O-CG1 3.4Å; T97-I101 PolarHBondContact O-N 2.89Å
98E74.8Confident75.6Confident40 Ų4069.7 Ų69.719%0.18737%0.369CS..Hα-helixtrans-60.1-45.9174.4-64.3-50.4151.900111.4R30 W32 G94 I95 K100 I101 E102R30-E98 WeakPolarHBondContact CD-OE1 3.41Å; R30-E98 IonicContact CZ-OE1 3.46Å; R30-E98 IonicContact CZ-OE2 3.36Å; R30-E98 IonicContact NE-OE1 3.73Å; R30-E98 PolarHBondContact NE-OE1 3.31Å; R30-E98 IonicContact NH1-OE1 2.64Å; R30-E98 PolarHBondContact NH1-OE1 3.32Å; R30-E98 IonicContact NH1-OE2 2.64Å; R30-E98 PolarHBondContact NH1-OE2 2.93Å; W32-E98 HydrophobicContact CZ2-CG 4.08Å; W32-E98 PolarHBondContact NE1-OE1 3.34Å; G94-E98 WeakPolarHBondContact O-CG 3.47Å; G94-E98 PolarHBondContact O-N 2.94Å; I95-E98 PolarHBondContact O-N 3.22Å; E98-K100 PolarHBondContact O-N 2.8Å; E98-I101 PolarHBondContact O-N 3.3Å; E98-I101 VanDerWaalsContact O-N 3.11Å; E98-E102 WeakPolarHBondContact O-CB 2.88Å; E98-E102 PolarHBondContact O-N 3.28Å
99Q74.2Confident73.7Confident60 Ų6076.1 Ų76.128%0.2839%0.392SS..Hα-helixtrans-62.7-35.1-178.2-161.2-179.313.800111.6I95 D96 T97 R103I95-Q99 WeakPolarHBondContact O-CB 3.33Å; I95-Q99 PolarHBondContact O-N 3.41Å; D96-Q99 PolarHBondContact O-N 3.18Å; T97-Q99 VanDerWaalsContact C-N 3.34Å; T97-Q99 PolarHBondContact O-N 2.69Å; Q99-R103 WeakPolarHBondContact O-CG 3.13Å; Q99-R103 PolarHBondContact O-N 2.9Å
100K75.7Confident71.6Confident125 Ų12573.3 Ų73.354%0.54338%0.378SS..Hα-helixtrans-68.3-42.6173.9-74.9167.2178.5167.60112.3D96 T97 E98 A104D96-K100 VanDerWaalsContact O-CG 3.29Å; D96-K100 WeakPolarHBondContact O-CG 3.31Å; D96-K100 PolarHBondContact O-N 3.45Å; D96-K100 WeakPolarHBondContact OD1-CE 3.38Å; D96-K100 IonicContact OD1-NZ 2.87Å; D96-K100 WeakPolarHBondContact OD2-CE 3.09Å; D96-K100 IonicContact OD2-NZ 3.5Å; D96-K100 PolarHBondContact OD2-NZ 3.4Å; T97-K100 PolarHBondContact O-N 3.2Å; E98-K100 PolarHBondContact O-N 2.8Å; K100-A104 PolarHBondContact O-N 3.46Å
101I71.7Confident69.4Low75 Ų7578.9 Ų78.939%0.38540%0.402SS..Hα-helixtrans-64.5-43.4177.7-67.8165.5000110.5R30 T97 E98 A104 A105R30-I101 VanDerWaalsContact NH1-CD1 3.34Å; T97-I101 HydrophobicContact CG2-CD1 4.08Å; T97-I101 WeakPolarHBondContact O-CG1 3.4Å; T97-I101 PolarHBondContact O-N 2.89Å; E98-I101 PolarHBondContact O-N 3.3Å; E98-I101 VanDerWaalsContact O-N 3.11Å; I101-A104 WeakPolarHBondContact O-CB 3.13Å; I101-A104 PolarHBondContact O-N 3.42Å; I101-A104 VanDerWaalsContact O-N 3.15Å; I101-A105 WeakPolarHBondContact O-CB 3.48Å; I101-A105 PolarHBondContact O-N 2.87Å
102E67Low67.5Low34 Ų3483.1 Ų83.116%0.15943%0.425CS..Hα-helixtrans-60.3-48.5179.2-175.6-177.9170.100111.9E98 A104 A105 L110E98-E102 WeakPolarHBondContact O-CB 2.88Å; E98-E102 PolarHBondContact O-N 3.28Å; E102-A104 PolarHBondContact O-N 3.46Å; E102-A105 PolarHBondContact O-N 2.84Å; E102-A105 VanDerWaalsContact O-N 3.09Å; E102-L110 HydrophobicContact CG-CB 3.99Å; E102-L110 HydrophobicContact CG-CD2 3.89Å; E102-L110 HydrophobicContact CG-CG 4.45Å
103R67.7Low65.8Low180 Ų18086.5 Ų86.568%0.67944%0.438SS*.Hα-helixtrans-59.4-34.1175.5-72.7179.8-164.4173.48.9112.3Q99Q99-R103 WeakPolarHBondContact O-CG 3.13Å; Q99-R103 PolarHBondContact O-N 2.9Å
104A66.6Low63.8Low83 Ų8385.3 Ų85.369%0.68644%0.442SS*.Hα-helixtrans-73.6-31.7177.300000112.8K100 I101 E102K100-A104 PolarHBondContact O-N 3.46Å; I101-A104 WeakPolarHBondContact O-CB 3.13Å; I101-A104 PolarHBondContact O-N 3.42Å; I101-A104 VanDerWaalsContact O-N 3.15Å; E102-A104 PolarHBondContact O-N 3.46Å
105A62.3Low62.1Low39 Ų3993.4 Ų93.432%0.32248%0.48SS..Hα-helixtrans-79.7-14.4-172.500000115.2I101 E102 H107I101-A105 WeakPolarHBondContact O-CB 3.48Å; I101-A105 PolarHBondContact O-N 2.87Å; E102-A105 PolarHBondContact O-N 2.84Å; E102-A105 VanDerWaalsContact O-N 3.09Å; A105-H107 PolarHBondContact O-N 2.97Å
106K57.2Low60.8Low197 Ų19795.3 Ų95.386%0.85749%0.49SS*.  trans4532-180-78.8-170.4177.4-177.40114.5S108K106-S108 PolarHBondContact O-N 3.22Å
107H51.7Low59.6Low106 Ų10696.6 Ų96.649%0.49150%0.504SS..  trans-87.4110.5179-77.1-34.6000109.9A105 W109 L110A105-H107 PolarHBondContact O-N 2.97Å; H107-W109 AromaticContact CG-NE1 3.92Å; H107-W109 PolarHBondContact O-N 2.87Å; H107-L110 HydrophobicContact CB-CD1 3.99Å; H107-L110 WeakPolarHBondContact O-CB 3.48Å; H107-L110 PolarHBondContact O-N 3.39Å
108S52Low58.8Low94 Ų9497.8 Ų97.866%0.65751%0.508SS*.THydrogen-bonded Turntrans-61.1-14-177.454.20000115.3K106K106-S108 PolarHBondContact O-N 3.22Å
109W51.1Low58.8Low150 Ų15098.4 Ų98.457%0.56852%0.516SS*.THydrogen-bonded Turntrans-84.7-15.7173.471.1-88.8000113.1H107H107-W109 AromaticContact CG-NE1 3.92Å; H107-W109 PolarHBondContact O-N 2.87Å
110L48.5Very low59Low35 Ų35106.8 Ų106.818%0.18355%0.546CS..THydrogen-bonded Turntrans-87-17172-93135.4000112.2E102 H107 D112 L113E102-L110 HydrophobicContact CG-CB 3.99Å; E102-L110 HydrophobicContact CG-CD2 3.89Å; E102-L110 HydrophobicContact CG-CG 4.45Å; H107-L110 HydrophobicContact CB-CD1 3.99Å; H107-L110 WeakPolarHBondContact O-CB 3.48Å; H107-L110 PolarHBondContact O-N 3.39Å; L110-D112 PolarHBondContact O-N 3.31Å; L110-L113 HydrophobicContact CD2-CB 4.33Å; L110-L113 HydrophobicContact CD2-CD1 3.55Å; L110-L113 HydrophobicContact CG-CD1 4.09Å; L110-L113 WeakPolarHBondContact O-CA 3.32Å; L110-L113 VanDerWaalsContact O-CB 3.29Å; L110-L113 WeakPolarHBondContact O-CB 3.44Å; L110-L113 PolarHBondContact O-N 2.92Å
111E46.4Very low59.4Low151 Ų151105 Ų10571%0.70655%0.548SS*.G310 helixtrans-54.6-30.5177.4-106.7173158.400113.4L113 G114E111-L113 VanDerWaalsContact C-N 3.34Å; E111-G114 PolarHBondContact O-N 2.98Å; E111-G114 VanDerWaalsContact O-N 3.16Å
112D48.2Very low60.1Low128 Ų128104.4 Ų104.468%0.68454%0.542SS*.G310 helixtrans-74.4-19174.4-80.9-25.1000113.7L110 G114L110-D112 PolarHBondContact O-N 3.31Å; D112-G114 PolarHBondContact O-N 3.49Å
113L50.2Low61.1Low92 Ų92104.3 Ų104.348%0.48255%0.55SS.*G310 helixtrans-79.61.1168.5-78.7154.1000112.4L110 E111 Q115 N116L110-L113 HydrophobicContact CD2-CB 4.33Å; L110-L113 HydrophobicContact CD2-CD1 3.55Å; L110-L113 HydrophobicContact CG-CD1 4.09Å; L110-L113 WeakPolarHBondContact O-CA 3.32Å; L110-L113 VanDerWaalsContact O-CB 3.29Å; L110-L113 WeakPolarHBondContact O-CB 3.44Å; L110-L113 PolarHBondContact O-N 2.92Å; E111-L113 VanDerWaalsContact C-N 3.34Å; L113-Q115 CarbonylContact O-C 3.47Å; L113-Q115 PolarHBondContact O-N 3.17Å; L113-N116 PolarHBondContact O-N 3.45Å
114G46.5Very low62.1Low57 Ų57101 Ų10159%0.58855%0.545SS*.THydrogen-bonded Turntrans-55.4-3.6174.700000115.4E111 D112 N116E111-G114 PolarHBondContact O-N 2.98Å; E111-G114 VanDerWaalsContact O-N 3.16Å; D112-G114 PolarHBondContact O-N 3.49Å; G114-N116 VanDerWaalsContact C-N 3.26Å; G114-N116 PolarHBondContact O-N 3.37Å
115Q49Very low63.2Low174 Ų17497.5 Ų97.581%0.81352%0.516SS*.THydrogen-bonded Turntrans-86.632.7162.7-65-162.1-15.500114.1L113 S117L113-Q115 CarbonylContact O-C 3.47Å; L113-Q115 PolarHBondContact O-N 3.17Å; Q115-S117 PolarHBondContact O-N 2.89Å
116N52.9Low64.5Low56 Ų5697.3 Ų97.330%0.29952%0.515SS..  trans-68.342.5163.5-116.5-5.3000111.7L113 G114L113-N116 PolarHBondContact O-N 3.45Å; G114-N116 VanDerWaalsContact C-N 3.26Å; G114-N116 PolarHBondContact O-N 3.37Å
117S57.6Low66.1Low92 Ų9293.6 Ų93.664%0.64350%0.503SS*.PPolyproline II helixtrans-72.1138.5165.976.60000107.6Q115 S119Q115-S117 PolarHBondContact O-N 2.89Å; S117-S119 PolarHBondContact O-N 3.5Å
118L63.4Low67.9Low86 Ų8691 Ų9145%0.4550%0.497SS..PPolyproline II helixtrans-48120.2174.2-80.8149.2000108.9I95 Y122I95-L118 HydrophobicContact CD1-CD2 3.73Å; I95-L118 HydrophobicContact CD1-CG 4.38Å; L118-Y122 HydrophobicContact CB-CD1 4.15Å; L118-Y122 HydrophobicContact CB-CG 4.33Å; L118-Y122 HydrophobicContact CD1-CD1 4.44Å; L118-Y122 HydrophobicContact CD1-CE1 4.27Å; L118-Y122 HydrophobicContact CD2-CD1 3.6Å; L118-Y122 HydrophobicContact CD2-CD2 3.52Å; L118-Y122 HydrophobicContact CD2-CE1 3.77Å; L118-Y122 HydrophobicContact CD2-CE2 3.67Å; L118-Y122 HydrophobicContact CD2-CG 3.47Å; L118-Y122 VanDerWaalsContact CD2-CG 3.47Å; L118-Y122 HydrophobicContact CG-CD1 4.28Å; L118-Y122 HydrophobicContact CG-CG 4.46Å
119S74.4Confident69.7Low52 Ų5287.6 Ų87.636%0.36447%0.471SS..PPolyproline II helixtrans-55.6153.1-175.968.70000111.5S117 S121 Y122 G123S117-S119 PolarHBondContact O-N 3.5Å; S119-S121 PolarHBondContact O-N 3.26Å; S119-S121 VanDerWaalsContact O-N 3.1Å; S119-Y122 VanDerWaalsContact O-CB 3.25Å; S119-Y122 WeakPolarHBondContact O-CB 3.31Å; S119-Y122 PolarHBondContact O-N 3.38Å; S119-Y122 PolarHBondContact OG-N 3.47Å; S119-G123 PolarHBondContact O-N 3.12Å
120W79.8Confident71.6Confident237 Ų23786 Ų8690%0.89847%0.473SS*.Hα-helixtrans-51.9-34.6172.7-78.290.9000112.6Y122 G123 I124W120-Y122 VanDerWaalsContact C-N 3.29Å; W120-Y122 PolarHBondContact O-N 3.45Å; W120-G123 PolarHBondContact O-N 3.1Å; W120-I124 WeakPolarHBondContact O-CG1 3.31Å; W120-I124 PolarHBondContact O-N 2.99Å
121S84.1Confident73.5Confident86 Ų8687.8 Ų87.860%0.60149%0.489SS*.Hα-helixtrans-60.5-35.6175.8-51.60000112.9S119 I124 A125S119-S121 PolarHBondContact O-N 3.26Å; S119-S121 VanDerWaalsContact O-N 3.1Å; S121-I124 PolarHBondContact O-N 3.05Å; S121-A125 VanDerWaalsContact O-CB 3.31Å; S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 3.02Å
122Y86Confident75.6Confident63 Ų6381.1 Ų81.125%0.24746%0.458CS..Hα-helixtrans-63.7-45.8174.1-178.9-86.8000111.4L88 M91 L118 S119 W120 A125 A126L88-Y122 HydrophobicContact CB-CE2 4.11Å; L88-Y122 HydrophobicContact CD2-CD1 4.4Å; L88-Y122 HydrophobicContact CD2-CD2 3.61Å; L88-Y122 HydrophobicContact CD2-CE1 4.28Å; L88-Y122 HydrophobicContact CD2-CE2 3.48Å; L88-Y122 VanDerWaalsContact CD2-CE2 3.48Å; L88-Y122 HydrophobicContact CD2-CG 4.09Å; L88-Y122 HydrophobicContact CG-CE2 4.42Å; L88-Y122 WeakPolarHBondContact O-CE2 3.35Å; M91-Y122 HydrophobicContact CB-CD2 4.25Å; M91-Y122 HydrophobicContact CB-CE2 4.28Å; M91-Y122 HydrophobicContact CG-CD2 4.09Å; L118-Y122 HydrophobicContact CB-CD1 4.15Å; L118-Y122 HydrophobicContact CB-CG 4.33Å; L118-Y122 HydrophobicContact CD1-CD1 4.44Å; L118-Y122 HydrophobicContact CD1-CE1 4.27Å; L118-Y122 HydrophobicContact CD2-CD1 3.6Å; L118-Y122 HydrophobicContact CD2-CD2 3.52Å; L118-Y122 HydrophobicContact CD2-CE1 3.77Å; L118-Y122 HydrophobicContact CD2-CE2 3.67Å; L118-Y122 HydrophobicContact CD2-CG 3.47Å; L118-Y122 VanDerWaalsContact CD2-CG 3.47Å; L118-Y122 HydrophobicContact CG-CD1 4.28Å; L118-Y122 HydrophobicContact CG-CG 4.46Å; S119-Y122 VanDerWaalsContact O-CB 3.25Å; S119-Y122 WeakPolarHBondContact O-CB 3.31Å; S119-Y122 PolarHBondContact O-N 3.38Å; S119-Y122 PolarHBondContact OG-N 3.47Å; W120-Y122 VanDerWaalsContact C-N 3.29Å; W120-Y122 PolarHBondContact O-N 3.45Å; Y122-A125 PolarHBondContact O-N 3.01Å; Y122-A126 PolarHBondContact O-N 3.29Å
123G86.5Confident77.6Confident33 Ų3377.3 Ų77.334%0.3444%0.441SS..Hα-helixtrans-61.6-44.6177.500000112.2S119 W120 A125 A126 I127S119-G123 PolarHBondContact O-N 3.12Å; W120-G123 PolarHBondContact O-N 3.1Å; G123-A125 PolarHBondContact O-N 3.48Å; G123-A126 PolarHBondContact O-N 3.46Å; G123-I127 WeakPolarHBondContact O-CG1 3.25Å; G123-I127 PolarHBondContact O-N 3.27Å
124I89.4Confident79.6Confident110 Ų11077.5 Ų77.556%0.56444%0.442SS*.Hα-helixtrans-63.1-42.8176.7-65.8168.4000110.9W120 S121 A126 I127 S128W120-I124 WeakPolarHBondContact O-CG1 3.31Å; W120-I124 PolarHBondContact O-N 2.99Å; S121-I124 PolarHBondContact O-N 3.05Å; I124-A126 VanDerWaalsContact C-N 3.34Å; I124-A126 PolarHBondContact O-N 2.85Å; I124-I127 PolarHBondContact O-N 2.87Å; I124-S128 PolarHBondContact O-N 3.38Å
125A89.1Confident81.6Confident10 Ų1077.6 Ų77.68%0.08343%0.431CS..Hα-helixtrans-60.7-42.7176.500000111.8F40 L88 S121 Y122 G123 I127 S128 L129F40-A125 HydrophobicContact CE2-CB 4.09Å; L88-A125 HydrophobicContact CD2-CB 3.93Å; S121-A125 VanDerWaalsContact O-CB 3.31Å; S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 3.02Å; Y122-A125 PolarHBondContact O-N 3.01Å; G123-A125 PolarHBondContact O-N 3.48Å; A125-I127 PolarHBondContact O-N 2.92Å; A125-S128 PolarHBondContact O-N 3.3Å; A125-S128 PolarHBondContact O-OG 2.87Å; A125-L129 PolarHBondContact O-N 2.64Å
126A90.1Very high83.5Confident35 Ų3570.6 Ų70.629%0.28940%0.4SS..Hα-helixtrans-62.6-40.4175.800000112.9L88 Y122 G123 I124 L129 L130L88-A126 HydrophobicContact CD1-CB 4.15Å; L88-A126 HydrophobicContact CD2-CB 4.36Å; Y122-A126 PolarHBondContact O-N 3.29Å; G123-A126 PolarHBondContact O-N 3.46Å; I124-A126 VanDerWaalsContact C-N 3.34Å; I124-A126 PolarHBondContact O-N 2.85Å; A126-L129 WeakPolarHBondContact O-CB 3.45Å; A126-L129 PolarHBondContact O-N 3.46Å; A126-L130 PolarHBondContact O-N 2.88Å
127I91.6Very high85.3Confident118 Ų11872.7 Ų72.761%0.60541%0.41SS*.Hα-helixtrans-65.7-41.1175.1-65.7166000110.7G123 I124 A125 L129 L130 S131G123-I127 WeakPolarHBondContact O-CG1 3.25Å; G123-I127 PolarHBondContact O-N 3.27Å; I124-I127 PolarHBondContact O-N 2.87Å; A125-I127 PolarHBondContact O-N 2.92Å; I127-L129 VanDerWaalsContact C-N 3.26Å; I127-L129 PolarHBondContact O-N 2.95Å; I127-L130 WeakPolarHBondContact O-CB 3.35Å; I127-L130 PolarHBondContact O-N 3.06Å; I127-S131 PolarHBondContact O-N 3.36Å
128S89.5Confident86.8Confident52 Ų5272.2 Ų72.236%0.36440%0.4SS..Hα-helixtrans-62.6-33.6178.481.50000112.8I124 A125 S131 S132I124-S128 PolarHBondContact O-N 3.38Å; A125-S128 PolarHBondContact O-N 3.3Å; A125-S128 PolarHBondContact O-OG 2.87Å; S128-S131 PolarHBondContact O-N 2.91Å; S128-S132 PolarHBondContact O-N 3.47Å; S128-S132 VanDerWaalsContact O-N 3.1Å; S128-S132 PolarHBondContact O-OG 3.35Å
129L89.8Confident87.9Confident22 Ų2269.6 Ų69.612%0.11539%0.386CS..Hα-helixtrans-63.7-43.8175.5177.262.6000111.2C81 T84 L85 L88 A125 A126 I127 S131 S132 C133C81-L129 HydrophobicContact CB-CD1 3.76Å; C81-L129 WeakPolarHBondContact O-CD1 3.38Å; T84-L129 HydrophobicContact CG2-CB 4.13Å; T84-L129 HydrophobicContact CG2-CD1 4.45Å; L85-L129 HydrophobicContact CB-CD2 4.18Å; L85-L129 HydrophobicContact CD1-CD2 4.01Å; L88-L129 HydrophobicContact CD1-CD2 3.92Å; A125-L129 PolarHBondContact O-N 2.64Å; A126-L129 WeakPolarHBondContact O-CB 3.45Å; A126-L129 PolarHBondContact O-N 3.46Å; I127-L129 VanDerWaalsContact C-N 3.26Å; I127-L129 PolarHBondContact O-N 2.95Å; L129-S131 VanDerWaalsContact C-N 3.35Å; L129-S131 PolarHBondContact O-N 3.22Å; L129-S132 PolarHBondContact O-N 3.21Å; L129-C133 WeakPolarHBondContact O-CB 3.41Å; L129-C133 PolarHBondContact O-N 3.45Å; L129-C133 PolarHBondContact O-SG 2.78Å; L129-C133 VanDerWaalsContact O-SG 3.35Å
130L90.8Very high88.3Confident116 Ų11668.4 Ų68.461%0.60738%0.382SS*.Hα-helixtrans-59.5-46.5178.7-70.1172.4000111.6A126 I127 S132 C133 I134A126-L130 PolarHBondContact O-N 2.88Å; I127-L130 WeakPolarHBondContact O-CB 3.35Å; I127-L130 PolarHBondContact O-N 3.06Å; L130-S132 PolarHBondContact O-N 2.72Å; L130-C133 PolarHBondContact O-N 2.87Å; L130-I134 VanDerWaalsContact O-CG1 3.28Å; L130-I134 WeakPolarHBondContact O-CG1 3.34Å; L130-I134 PolarHBondContact O-N 2.97Å
131S89.2Confident88.5Confident74 Ų7466.7 Ų66.752%0.51738%0.375SS..Hα-helixtrans-58.1-49176.7-174.40000111.2I127 S128 L129 C133 I134 T135I127-S131 PolarHBondContact O-N 3.36Å; S128-S131 PolarHBondContact O-N 2.91Å; L129-S131 VanDerWaalsContact C-N 3.35Å; L129-S131 PolarHBondContact O-N 3.22Å; S131-C133 PolarHBondContact O-N 3.03Å; S131-I134 PolarHBondContact O-N 2.73Å; S131-T135 PolarHBondContact O-N 3.46Å; S131-T135 PolarHBondContact O-OG1 3.11Å; S131-T135 VanDerWaalsContact O-OG1 3.1Å
132S89.2Confident88.2Confident10 Ų1069.9 Ų69.97%0.0738%0.378CS..Hα-helixtrans-61.1-42179.9-58.40000112.3N80 C81 S128 L129 L130 T135 V136N80-S132 PolarHBondContact ND2-OG 2.71Å; C81-S132 WeakPolarHBondContact SG-CB 3.4Å; S128-S132 PolarHBondContact O-N 3.47Å; S128-S132 VanDerWaalsContact O-N 3.1Å; S128-S132 PolarHBondContact O-OG 3.35Å; L129-S132 PolarHBondContact O-N 3.21Å; L130-S132 PolarHBondContact O-N 2.72Å; S132-T135 PolarHBondContact O-N 2.94Å; S132-V136 WeakPolarHBondContact O-CG2 3.45Å; S132-V136 PolarHBondContact O-N 3.33Å
133C89.8Confident87.7Confident48 Ų4870.1 Ų70.132%0.32439%0.386SS..Hα-helixtrans-62.6-44.5176.1-74.50000112.1L129 L130 S131 T135 V136 I137L129-C133 WeakPolarHBondContact O-CB 3.41Å; L129-C133 PolarHBondContact O-N 3.45Å; L129-C133 PolarHBondContact O-SG 2.78Å; L129-C133 VanDerWaalsContact O-SG 3.35Å; L130-C133 PolarHBondContact O-N 2.87Å; S131-C133 PolarHBondContact O-N 3.03Å; C133-T135 VanDerWaalsContact C-N 3.32Å; C133-T135 PolarHBondContact O-N 3.45Å; C133-V136 PolarHBondContact O-N 3.49Å; C133-I137 VanDerWaalsContact O-CG1 3.28Å; C133-I137 WeakPolarHBondContact O-CG1 3.29Å; C133-I137 PolarHBondContact O-N 2.86Å
134I92.2Very high86.8Confident97 Ų9772.7 Ų72.750%0.49739%0.387SS..Hα-helixtrans-60.5-44.4177.4-68.8165.3000110.1L130 S131 V136 I137 I138L130-I134 VanDerWaalsContact O-CG1 3.28Å; L130-I134 WeakPolarHBondContact O-CG1 3.34Å; L130-I134 PolarHBondContact O-N 2.97Å; S131-I134 PolarHBondContact O-N 2.73Å; I134-V136 PolarHBondContact O-N 3.02Å; I134-I137 PolarHBondContact O-N 3.29Å; I134-I138 HydrophobicContact CG2-CD1 3.68Å; I134-I138 HydrophobicContact CG2-CG1 4.32Å; I134-I138 VanDerWaalsContact O-CG1 3.32Å; I134-I138 WeakPolarHBondContact O-CG1 3.37Å; I134-I138 PolarHBondContact O-N 3.17Å
135T89.4Confident85.2Confident58 Ų5870.1 Ų70.136%0.35638%0.377SS..Hα-helixtrans-59.4-45.3176.9-54.50000111.9L77 S131 S132 C133 I137 I138 L139L77-T135 HydrophobicContact CD1-CG2 3.74Å; S131-T135 PolarHBondContact O-N 3.46Å; S131-T135 PolarHBondContact O-OG1 3.11Å; S131-T135 VanDerWaalsContact O-OG1 3.1Å; S132-T135 PolarHBondContact O-N 2.94Å; C133-T135 VanDerWaalsContact C-N 3.32Å; C133-T135 PolarHBondContact O-N 3.45Å; T135-I137 PolarHBondContact O-N 2.98Å; T135-I138 PolarHBondContact O-N 3.15Å; T135-L139 HydrophobicContact CG2-CD1 4Å; T135-L139 HydrophobicContact CG2-CG 4.4Å; T135-L139 WeakPolarHBondContact O-CB 3.32Å; T135-L139 VanDerWaalsContact O-CG 3.32Å; T135-L139 WeakPolarHBondContact O-CG 3.4Å; T135-L139 PolarHBondContact O-N 3.06Å
136V89.2Confident83.6Confident28 Ų2878.6 Ų78.617%0.1741%0.412CS..Hα-helixtrans-61.9-44177.5173.30000111.3L77 S132 C133 I134 I138 L139 G140L77-V136 HydrophobicContact CB-CG2 3.4Å; L77-V136 HydrophobicContact CD1-CG2 4.23Å; L77-V136 HydrophobicContact CG-CG2 4.47Å; S132-V136 WeakPolarHBondContact O-CG2 3.45Å; S132-V136 PolarHBondContact O-N 3.33Å; C133-V136 PolarHBondContact O-N 3.49Å; I134-V136 PolarHBondContact O-N 3.02Å; V136-I138 PolarHBondContact O-N 3.42Å; V136-L139 PolarHBondContact O-N 2.64Å; V136-G140 PolarHBondContact O-N 2.78Å
137I89.6Confident81.7Confident99 Ų9982.5 Ų82.551%0.50843%0.428SS..Hα-helixtrans-60.7-47177.9-68.4165000110.1C133 I134 T135 G140 W141C133-I137 VanDerWaalsContact O-CG1 3.28Å; C133-I137 WeakPolarHBondContact O-CG1 3.29Å; C133-I137 PolarHBondContact O-N 2.86Å; I134-I137 PolarHBondContact O-N 3.29Å; T135-I137 PolarHBondContact O-N 2.98Å; I137-G140 PolarHBondContact O-N 3.05Å; I137-W141 WeakPolarHBondContact O-CB 3.49Å; I137-W141 PolarHBondContact O-N 3.09Å
138I88.8Confident79.6Confident83 Ų8385 Ų8543%0.42644%0.435SS..Hα-helixtrans-62.6-47.1-179.8-68.8170000110.9I134 T135 V136 G140 W141 F142I134-I138 HydrophobicContact CG2-CD1 3.68Å; I134-I138 HydrophobicContact CG2-CG1 4.32Å; I134-I138 VanDerWaalsContact O-CG1 3.32Å; I134-I138 WeakPolarHBondContact O-CG1 3.37Å; I134-I138 PolarHBondContact O-N 3.17Å; T135-I138 PolarHBondContact O-N 3.15Å; V136-I138 PolarHBondContact O-N 3.42Å; I138-G140 VanDerWaalsContact C-N 3.34Å; I138-G140 PolarHBondContact O-N 3.16Å; I138-W141 PolarHBondContact O-N 3.35Å; I138-F142 HydrophobicContact CB-CD2 4.42Å; I138-F142 HydrophobicContact CG2-CD2 4.09Å; I138-F142 WeakPolarHBondContact O-CB 3.29Å; I138-F142 WeakPolarHBondContact O-CD2 3.22Å; I138-F142 PolarHBondContact O-N 3.04Å
139L86.7Confident77.2Confident31 Ų3192.5 Ų92.516%0.16246%0.456CS..Iπ-helixtrans-62.9-42179.1-70.2175.3000111.8V70 I73 M74 L77 T135 V136 V143 Y144V70-L139 HydrophobicContact CG1-CD2 4.4Å; I73-L139 HydrophobicContact CG2-CD1 3.75Å; M74-L139 HydrophobicContact CG-CB 3.72Å; M74-L139 HydrophobicContact CG-CD1 4.18Å; M74-L139 HydrophobicContact SD-CB 4.08Å; L77-L139 HydrophobicContact CD1-CD1 4.41Å; T135-L139 HydrophobicContact CG2-CD1 4Å; T135-L139 HydrophobicContact CG2-CG 4.4Å; T135-L139 WeakPolarHBondContact O-CB 3.32Å; T135-L139 VanDerWaalsContact O-CG 3.32Å; T135-L139 WeakPolarHBondContact O-CG 3.4Å; T135-L139 PolarHBondContact O-N 3.06Å; V136-L139 PolarHBondContact O-N 2.64Å; L139-V143 HydrophobicContact CD2-CB 4.3Å; L139-V143 HydrophobicContact CD2-CG2 3.85Å; L139-V143 WeakPolarHBondContact O-CB 3.46Å; L139-V143 PolarHBondContact O-N 2.91Å; L139-V143 VanDerWaalsContact O-N 3.13Å; L139-Y144 PolarHBondContact O-N 3.18Å
140G84.3Confident74.8Confident26 Ų2696.1 Ų96.127%0.26848%0.481SS..Iπ-helixtrans-68.6-41179.600000113.7V136 I137 I138V136-G140 PolarHBondContact O-N 2.78Å; I137-G140 PolarHBondContact O-N 3.05Å; I138-G140 VanDerWaalsContact C-N 3.34Å; I138-G140 PolarHBondContact O-N 3.16Å
141W83.4Confident72.3Confident201 Ų20197.9 Ų97.976%0.76149%0.488SS*.Iπ-helixtrans-85.7-31.9-176.7-83.164.9000114.3I137 I138 P145I137-W141 WeakPolarHBondContact O-CB 3.49Å; I137-W141 PolarHBondContact O-N 3.09Å; I138-W141 PolarHBondContact O-N 3.35Å; W141-P145 VanDerWaalsContact O-CG 3.22Å; W141-P145 WeakPolarHBondContact O-CG 3.32Å
142F77.8Confident70Confident153 Ų153101.7 Ų101.767%0.67150%0.503SS*.Iπ-helixtrans-110.9-29.3-172-64.2-79.7000113.8I138I138-F142 HydrophobicContact CB-CD2 4.42Å; I138-F142 HydrophobicContact CG2-CD2 4.09Å; I138-F142 WeakPolarHBondContact O-CB 3.29Å; I138-F142 WeakPolarHBondContact O-CD2 3.22Å; I138-F142 PolarHBondContact O-N 3.04Å
143V74.4Confident67.5Low69 Ų69108.5 Ų108.542%0.41854%0.539SS..Iπ-helixtrans-99.7-46.1-173.7-174.10000111.8V70 L139 P145V70-V143 HydrophobicContact CB-CG1 4.42Å; V70-V143 HydrophobicContact CG1-CB 4.3Å; V70-V143 HydrophobicContact CG1-CG1 3.85Å; V70-V143 HydrophobicContact CG2-CG1 3.84Å; L139-V143 HydrophobicContact CD2-CB 4.3Å; L139-V143 HydrophobicContact CD2-CG2 3.85Å; L139-V143 WeakPolarHBondContact O-CB 3.46Å; L139-V143 PolarHBondContact O-N 2.91Å; L139-V143 VanDerWaalsContact O-N 3.13Å; V143-P145 VanDerWaalsContact C-CD 3.41Å
144Y68.4Low65.1Low87 Ų87112 Ų11234%0.34155%0.553SS.*G310 helixtrans-72-29.1-176.7-156.8-100.9000116.7L71 M74 L139 K146L71-Y144 HydrophobicContact CB-CE2 4.2Å; L71-Y144 HydrophobicContact CD1-CD2 4.46Å; L71-Y144 HydrophobicContact CD1-CE2 3.64Å; M74-Y144 HydrophobicContact SD-CD2 4.43Å; M74-Y144 HydrophobicContact SD-CG 4.48Å; L139-Y144 PolarHBondContact O-N 3.18Å; Y144-K146 PolarHBondContact O-N 2.95Å
145P56.8Low62.6Low55 Ų55120 Ų12036%0.35759%0.588SS.*G310 helixtrans-73.33.2-168.728.6-34.6000115.6W141 V143 N147W141-P145 VanDerWaalsContact O-CG 3.22Å; W141-P145 WeakPolarHBondContact O-CG 3.32Å; V143-P145 VanDerWaalsContact C-CD 3.41Å; P145-N147 PolarHBondContact O-N 3.44Å; P145-N147 VanDerWaalsContact O-N 3.12Å
146K54.2Low61.3Low188 Ų188123.1 Ų123.182%0.81760%0.6SS**G310 helixtrans-65.9-12.4178.1-89.1-177174175.40115.1Y144Y144-K146 PolarHBondContact O-N 2.95Å
147N51.4Low59.8Low118 Ų118128.1 Ų128.163%0.63162%0.622SS**G310 helixtrans-114.12.3-175.8-66.1-11.1000115.4P145P145-N147 PolarHBondContact O-N 3.44Å; P145-N147 VanDerWaalsContact O-N 3.12Å
148F46.2Very low58.1Low170 Ų170129.7 Ų129.775%0.74663%0.629SS**SBendtrans-110.26.2-175.9-116-83.6000115.4P150F148-P150 VanDerWaalsContact O-CD 3.28Å; F148-P150 WeakPolarHBondContact O-CD 3.42Å
149Y40.3Very low56.3Low209 Ų209132.5 Ų132.582%0.8264%0.641SS**  trans-89.2107.5158.7-83.2-83.7000108.3M151Y149-M151 PolarHBondContact O-N 3.26Å
150P39.8Very low54.4Low98 Ų98138.8 Ų138.864%0.63667%0.67SS**  trans-60.7138.9158.828.9-30.8000106.7F148 N152F148-P150 VanDerWaalsContact O-CD 3.28Å; F148-P150 WeakPolarHBondContact O-CD 3.42Å; P150-N152 VanDerWaalsContact C-N 3.32Å; P150-N152 PolarHBondContact O-N 3.09Å
151M38.4Very low52.4Low154 Ų154146.3 Ų146.376%0.75970%0.697SS**  trans-52.897.9167.6-72.2-155.9-91.900109.6Y149 L154Y149-M151 PolarHBondContact O-N 3.26Å; M151-L154 HydrophobicContact CE-CD1 3.88Å; M151-L154 HydrophobicContact SD-CD1 3.59Å; M151-L154 VanDerWaalsContact SD-CD1 3.59Å
152N39.7Very low50.2Low153 Ų153142.4 Ų142.482%0.81869%0.693SS**  trans-87.923.1159.2-95.67.9000111.3P150P150-N152 VanDerWaalsContact C-N 3.32Å; P150-N152 PolarHBondContact O-N 3.09Å
153N37.4Very low48.1Very low154 Ų154141.6 Ų141.682%0.82469%0.694SS**  trans-125.761.4173.6-80.5-14.2000110.5
154L38.1Very low45.9Very low121 Ų121147.7 Ų147.763%0.63472%0.717SS**  trans-143.4110.8156.8-97.8127.4000108.4M151M151-L154 HydrophobicContact CE-CD1 3.88Å; M151-L154 HydrophobicContact SD-CD1 3.59Å; M151-L154 VanDerWaalsContact SD-CD1 3.59Å
155H40.6Very low43.9Very low265 Ų265153.2 Ų153.2100%1.22775%0.752SS**  trans85.60178.2-69.8-74.9000118.2

Retrieved 155 of 155 residues in 34.3 ms (Link to these results)