A0A060WHW5_ONCMY Loading...

Transmembrane protein 141

AlphaFold DB , UniProt , Accession A0A060WHW5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tmem141, Length 126 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
1M34.1Very low51Low228 Ų228118.6 Ų118.6100%1.12366%0.663SS**  0110.20-81.2162.1153.500107.4N3M1-N3 PolarHBondContact O-N 2.97Å
2V40.8Very low51.9Low114 Ų114114.3 Ų114.369%0.69165%0.654SS**  trans-76.3114.9173.7-82.90000107.3L4V2-L4 VanDerWaalsContact C-N 3.31Å; V2-L4 HydrophobicContact CG2-CD1 4.23Å; V2-L4 PolarHBondContact O-N 3.07Å
3N37.3Very low52.7Low151 Ų151111.1 Ų111.181%0.80763%0.633SS**  trans-69.190.6172.9-77.9-76.8000107.7M1 G5M1-N3 PolarHBondContact O-N 2.97Å; N3-G5 PolarHBondContact O-N 3.16Å
4L53.3Low53.4Low103 Ų103105.1 Ų105.154%0.53960%0.604SS.*  trans-64.6118.8156.3-84.588.7000105.8V2 L6V2-L4 VanDerWaalsContact C-N 3.31Å; V2-L4 HydrophobicContact CG2-CD1 4.23Å; V2-L4 PolarHBondContact O-N 3.07Å; L4-L6 PolarHBondContact O-N 2.92Å
5G52.9Low53.8Low80 Ų80103.9 Ų103.983%0.82561%0.612SS**SBendtrans-70.646-17700000114.1N3N3-G5 PolarHBondContact O-N 3.16Å
6L49.7Very low54.5Low89 Ų89107.7 Ų107.747%0.46662%0.618SS.*  trans-127.619-171.8-83.8161.5000113L4 K8 V9 D10L4-L6 PolarHBondContact O-N 2.92Å; L6-K8 PolarHBondContact O-N 3.37Å; L6-V9 HydrophobicContact CD2-CB 4.49Å; L6-V9 PolarHBondContact O-N 2.98Å; L6-D10 WeakPolarHBondContact CB-OD2 3.35Å; L6-D10 PolarHBondContact O-N 3.22Å
7T56.6Low55Low91 Ų91104.7 Ų104.756%0.55860%0.597SS**Hα-helixtrans-46.6-38.5-170.949.30000115.4D11T7-D11 VanDerWaalsContact O-CG 3.23Å; T7-D11 PolarHBondContact O-N 2.92Å
8K53.8Low55.4Low183 Ų183104.1 Ų104.180%0.79660%0.597SS**Hα-helixtrans-77.3-32.8-178-73.9-88.7-175.6169.60114.2L6L6-K8 PolarHBondContact O-N 3.37Å
9V57.8Low56.1Low91 Ų9198.6 Ų98.655%0.55257%0.567SS**Hα-helixtrans-84.2-38.9-178.8-179.20000109.5L6 D11 A12 L13L6-V9 HydrophobicContact CD2-CB 4.49Å; L6-V9 PolarHBondContact O-N 2.98Å; V9-D11 PolarHBondContact O-N 3.46Å; V9-A12 PolarHBondContact O-N 3.15Å; V9-L13 WeakPolarHBondContact O-CB 3.48Å; V9-L13 PolarHBondContact O-N 3.46Å
10D63.4Low56.6Low54 Ų5496 Ų9629%0.28955%0.55SS.*Hα-helixtrans-61.2-40.5175.2-79.3-53.4000112L6 A12 L13 A14L6-D10 WeakPolarHBondContact CB-OD2 3.35Å; L6-D10 PolarHBondContact O-N 3.22Å; D10-A12 PolarHBondContact O-N 2.93Å; D10-L13 PolarHBondContact O-N 3.05Å; D10-A14 WeakPolarHBondContact O-CA 3.34Å; D10-A14 WeakPolarHBondContact O-CB 3.43Å; D10-A14 PolarHBondContact O-N 3.01Å
11D61.3Low57.3Low121 Ų12198.7 Ų98.765%0.64756%0.558SS**Hα-helixtrans-67.6-39.1-179.8-73.5-25.3000112.8T7 V9 A15T7-D11 VanDerWaalsContact O-CG 3.23Å; T7-D11 PolarHBondContact O-N 2.92Å; V9-D11 PolarHBondContact O-N 3.46Å; D11-A15 WeakPolarHBondContact O-CB 3.47Å; D11-A15 PolarHBondContact O-N 3.35Å
12A62.2Low59Low67 Ų6793 Ų9355%0.55453%0.529SS*.Hα-helixtrans-73.2-31.7177.600000112.5V9 D10V9-A12 PolarHBondContact O-N 3.15Å; D10-A12 PolarHBondContact O-N 2.93Å
13L62.4Low60.4Low72 Ų7290.8 Ų90.838%0.37751%0.508SS..Hα-helixtrans-84-37179-166.265.2000112.1V9 D10 A15 K16 H17 L20V9-L13 WeakPolarHBondContact O-CB 3.48Å; V9-L13 PolarHBondContact O-N 3.46Å; D10-L13 PolarHBondContact O-N 3.05Å; L13-A15 VanDerWaalsContact C-N 3.26Å; L13-A15 PolarHBondContact O-N 3.16Å; L13-K16 CarbonylContact O-C 3.59Å; L13-K16 WeakPolarHBondContact O-CA 3.32Å; L13-K16 PolarHBondContact O-N 3.24Å; L13-H17 PolarHBondContact O-N 2.91Å; L13-L20 HydrophobicContact CD2-CD1 3.89Å; L13-L20 HydrophobicContact CG-CD1 3.93Å
14A61.4Low62.2Low28 Ų2886.1 Ų86.123%0.23149%0.491CS..Hα-helixtrans-64.6-31.3173.600000111.8D10 K16 H17D10-A14 WeakPolarHBondContact O-CA 3.34Å; D10-A14 WeakPolarHBondContact O-CB 3.43Å; D10-A14 PolarHBondContact O-N 3.01Å; A14-K16 PolarHBondContact O-N 2.94Å; A14-H17 CarbonylContact O-C 3.3Å; A14-H17 VanDerWaalsContact O-C 3.3Å; A14-H17 PolarHBondContact O-N 3.49Å
15A60.1Low63.3Low87 Ų8784 Ų8472%0.71949%0.489SS*.THydrogen-bonded Turntrans-64.7-2817100000113D11 L13D11-A15 WeakPolarHBondContact O-CB 3.47Å; D11-A15 PolarHBondContact O-N 3.35Å; L13-A15 VanDerWaalsContact C-N 3.26Å; L13-A15 PolarHBondContact O-N 3.16Å
16K65.1Low64.5Low164 Ų16482.2 Ų82.271%0.71346%0.463SS*.THydrogen-bonded Turntrans-89.3-30.2175.1-71.4-173.9176.6177.50113.1L13 A14L13-K16 CarbonylContact O-C 3.59Å; L13-K16 WeakPolarHBondContact O-CA 3.32Å; L13-K16 PolarHBondContact O-N 3.24Å; A14-K16 PolarHBondContact O-N 2.94Å
17H62.9Low65.8Low57 Ų5782.3 Ų82.326%0.26446%0.461SS..  trans-129.888.3-177.1-59.6-72.3000110.4L13 A14 G19 L20 E94L13-H17 PolarHBondContact O-N 2.91Å; A14-H17 CarbonylContact O-C 3.3Å; A14-H17 VanDerWaalsContact O-C 3.3Å; A14-H17 PolarHBondContact O-N 3.49Å; H17-G19 PolarHBondContact O-N 2.92Å; H17-L20 HydrophobicContact CB-CD1 4.12Å; H17-L20 PolarHBondContact O-N 3.38Å; H17-L20 VanDerWaalsContact O-N 3.14Å; H17-E94 IonicContact CE1-OE1 2.74Å; H17-E94 PolarHBondContact CE1-OE1 3.49Å; H17-E94 IonicContact CG-OE1 3.44Å; H17-E94 IonicContact ND1-OE1 3.67Å; H17-E94 PolarHBondContact ND1-OE1 3.14Å; H17-E94 IonicContact ND1-OE2 3.78Å
18P62.9Low66.9Low93 Ų9380.6 Ų80.660%0.60445%0.452SS*.THydrogen-bonded Turntrans-62.4-16.6-177.525.1-34000113.4L20P18-L20 VanDerWaalsContact C-N 3.34Å; P18-L20 PolarHBondContact O-N 2.88Å
19G67Low68.1Low1 Ų177.4 Ų77.41%0.0144%0.44CS..Hα-helixtrans-71.7-20.7176.900000114.9H17 Q21 Q22 Y23H17-G19 PolarHBondContact O-N 2.92Å; G19-Q21 PolarHBondContact O-N 3.5Å; G19-Q22 PolarHBondContact O-N 3.48Å; G19-Y23 WeakPolarHBondContact O-CB 3.42Å; G19-Y23 PolarHBondContact O-N 3.23Å
20L67Low69.2Low45 Ų4573.1 Ų73.124%0.23641%0.414CS..Hα-helixtrans-65.1-39.7-177.4-114.3152.9000112.2L13 H17 P18 Y23 A24L13-L20 HydrophobicContact CD2-CD1 3.89Å; L13-L20 HydrophobicContact CG-CD1 3.93Å; H17-L20 HydrophobicContact CB-CD1 4.12Å; H17-L20 PolarHBondContact O-N 3.38Å; H17-L20 VanDerWaalsContact O-N 3.14Å; P18-L20 VanDerWaalsContact C-N 3.34Å; P18-L20 PolarHBondContact O-N 2.88Å; L20-Y23 PolarHBondContact O-N 3.41Å; L20-A24 WeakPolarHBondContact O-CB 3.34Å; L20-A24 PolarHBondContact O-N 3.42Å
21Q70.3Confident69.8Low153 Ų15376.8 Ų76.872%0.71543%0.428SS*.Hα-helixtrans-67.9-38.3177.2-165.9-177.8-1.600111.7G19 A24 A25G19-Q21 PolarHBondContact O-N 3.5Å; Q21-A24 PolarHBondContact O-N 3.16Å; Q21-A25 WeakPolarHBondContact O-CB 3.5Å; Q21-A25 PolarHBondContact O-N 2.94Å
22Q70.3Confident71Confident109 Ų10977.1 Ų77.151%0.50943%0.427SS..Hα-helixtrans-68-39.3175.3-66.1-156.2-5.200111.9G19 A25 C26G19-Q22 PolarHBondContact O-N 3.48Å; Q22-A25 PolarHBondContact O-N 3.22Å; Q22-C26 VanDerWaalsContact O-CB 3.25Å; Q22-C26 WeakPolarHBondContact O-CB 3.14Å; Q22-C26 PolarHBondContact O-N 2.83Å
23Y70.1Confident72.1Confident67 Ų6777.9 Ų77.926%0.26342%0.418SS..Hα-helixtrans-61.6-47.2173.6176.8-100.7000111.7G19 L20 A25 C26 Q27 C86 W90G19-Y23 WeakPolarHBondContact O-CB 3.42Å; G19-Y23 PolarHBondContact O-N 3.23Å; L20-Y23 PolarHBondContact O-N 3.41Å; Y23-A25 PolarHBondContact O-N 3.4Å; Y23-C26 CarbonylContact O-C 3.6Å; Y23-C26 PolarHBondContact O-N 3.4Å; Y23-Q27 WeakPolarHBondContact O-CB 3.32Å; Y23-Q27 PolarHBondContact O-N 3Å; Y23-C86 HydrophobicContact CD2-CB 4.19Å; Y23-C86 HydrophobicContact CE2-CB 4.28Å; Y23-W90 HydrophobicContact CD2-CB 4.38Å
24A75.1Confident73Confident53 Ų5374.6 Ų74.644%0.43840%0.401SS..Hα-helixtrans-62-42.3178.800000112.5L20 Q21 Q27 S28L20-A24 WeakPolarHBondContact O-CB 3.34Å; L20-A24 PolarHBondContact O-N 3.42Å; Q21-A24 PolarHBondContact O-N 3.16Å; A24-Q27 PolarHBondContact O-N 2.98Å; A24-S28 PolarHBondContact O-N 2.94Å
25A77Confident74.1Confident60 Ų6076 Ų7650%0.49641%0.407SS..Hα-helixtrans-61.1-45.5173.700000111.1Q21 Q22 Y23 S28 H29Q21-A25 WeakPolarHBondContact O-CB 3.5Å; Q21-A25 PolarHBondContact O-N 2.94Å; Q22-A25 PolarHBondContact O-N 3.22Å; Y23-A25 PolarHBondContact O-N 3.4Å; A25-S28 PolarHBondContact O-N 3.49Å; A25-S28 PolarHBondContact O-OG 3.47Å; A25-H29 PolarHBondContact O-N 3.31Å; A25-H29 VanDerWaalsContact O-N 3.17Å
26C78Confident75.5Confident41 Ų4174.1 Ų74.128%0.27739%0.391SS..Hα-helixtrans-65.9-39.6179.5-1660000112.6Q22 Y23 S28 H29 A30 C86Q22-C26 VanDerWaalsContact O-CB 3.25Å; Q22-C26 WeakPolarHBondContact O-CB 3.14Å; Q22-C26 PolarHBondContact O-N 2.83Å; Y23-C26 CarbonylContact O-C 3.6Å; Y23-C26 PolarHBondContact O-N 3.4Å; C26-S28 VanDerWaalsContact C-N 3.33Å; C26-S28 PolarHBondContact O-N 3.01Å; C26-H29 PolarHBondContact O-N 3.27Å; C26-A30 WeakPolarHBondContact O-CB 3.42Å; C26-A30 PolarHBondContact O-N 2.9Å; C26-C86 HydrophobicContact CB-CB 3.59Å; C26-C86 WeakPolarHBondContact CB-SG 3.28Å; C26-C86 PolarHBondContact O-SG 3.35Å; C26-C86 VanDerWaalsContact O-SG 3.37Å; C26-C86 WeakPolarHBondContact SG-CA 3.25Å; C26-C86 WeakPolarHBondContact SG-CB 3.02Å; C26-C86 CovalentContact SG-SG 2.02Å; C26-C86 PolarHBondContact SG-SG 3.07Å
27Q77.9Confident76.5Confident91 Ų9168.5 Ų68.543%0.42537%0.371SS..Hα-helixtrans-60.7-42175.9-176.8-180-6.400111.8Y23 A24 H29 A30 F31Y23-Q27 WeakPolarHBondContact O-CB 3.32Å; Y23-Q27 PolarHBondContact O-N 3Å; A24-Q27 PolarHBondContact O-N 2.98Å; Q27-H29 VanDerWaalsContact C-N 3.33Å; Q27-H29 PolarHBondContact O-N 3.17Å; Q27-A30 PolarHBondContact O-N 3.48Å; Q27-F31 WeakPolarHBondContact O-CB 3.17Å; Q27-F31 PolarHBondContact O-N 3.3Å
28S78.4Confident77.6Confident55 Ų5569.2 Ų69.239%0.38537%0.373SS..Hα-helixtrans-65.8-37.1176.876.80000112.2A24 A25 C26 F31 M32A24-S28 PolarHBondContact O-N 2.94Å; A25-S28 PolarHBondContact O-N 3.49Å; A25-S28 PolarHBondContact O-OG 3.47Å; C26-S28 VanDerWaalsContact C-N 3.33Å; C26-S28 PolarHBondContact O-N 3.01Å; S28-F31 PolarHBondContact O-N 3.41Å; S28-M32 WeakPolarHBondContact O-CG 3.33Å; S28-M32 PolarHBondContact O-N 3.4Å
29H80.3Confident78.9Confident116 Ų11670.1 Ų70.154%0.53737%0.372SS..Hα-helixtrans-69.4-42.6176.3-174.7-96.3000111.8A25 C26 Q27 F31 M32 K33A25-H29 PolarHBondContact O-N 3.31Å; A25-H29 VanDerWaalsContact O-N 3.17Å; C26-H29 PolarHBondContact O-N 3.27Å; Q27-H29 VanDerWaalsContact C-N 3.33Å; Q27-H29 PolarHBondContact O-N 3.17Å; H29-F31 VanDerWaalsContact C-N 3.32Å; H29-F31 PolarHBondContact O-N 2.94Å; H29-M32 PolarHBondContact O-N 2.66Å; H29-K33 WeakPolarHBondContact O-CB 3.34Å; H29-K33 PolarHBondContact O-N 3.5Å
30A79.1Confident80Confident1 Ų176 Ų761%0.00840%0.403CS..Hα-helixtrans-59.6-42.7173.900000111.5C26 Q27 K33 G34 E82 T83C26-A30 WeakPolarHBondContact O-CB 3.42Å; C26-A30 PolarHBondContact O-N 2.9Å; Q27-A30 PolarHBondContact O-N 3.48Å; A30-K33 PolarHBondContact O-N 2.83Å; A30-G34 PolarHBondContact O-N 3.49Å; A30-E82 HydrophobicContact CB-CB 3.64Å; A30-T83 HydrophobicContact CB-CG2 3.92Å
31F77.7Confident81Confident131 Ų13175.1 Ų75.158%0.57540%0.404SS*.Hα-helixtrans-64.1-46.4175.3-179.1-99.4000112.5Q27 S28 H29 K33 G34 T35Q27-F31 WeakPolarHBondContact O-CB 3.17Å; Q27-F31 PolarHBondContact O-N 3.3Å; S28-F31 PolarHBondContact O-N 3.41Å; H29-F31 VanDerWaalsContact C-N 3.32Å; H29-F31 PolarHBondContact O-N 2.94Å; F31-K33 VanDerWaalsContact C-N 3.29Å; F31-K33 PolarHBondContact O-N 3.46Å; F31-G34 PolarHBondContact O-N 2.88Å; F31-T35 HydrophobicContact CD1-CG2 4.39Å; F31-T35 HydrophobicContact CE1-CG2 3.92Å; F31-T35 HydrophobicContact CE2-CG2 4.26Å; F31-T35 HydrophobicContact CZ-CG2 3.85Å; F31-T35 PolarHBondContact O-N 3.31Å; F31-T35 PolarHBondContact O-OG1 2.94Å
32M85.6Confident81.8Confident128 Ų12869.3 Ų69.363%0.63138%0.379SS*.Hα-helixtrans-62-37.9176.2-72.5-133.4-58.600112.5S28 H29 T35 A36S28-M32 WeakPolarHBondContact O-CG 3.33Å; S28-M32 PolarHBondContact O-N 3.4Å; H29-M32 PolarHBondContact O-N 2.66Å; M32-T35 PolarHBondContact O-OG1 3.49Å; M32-A36 VanDerWaalsContact O-CB 3.3Å; M32-A36 WeakPolarHBondContact O-CB 3.3Å; M32-A36 PolarHBondContact O-N 2.91Å
33K85.3Confident82.6Confident84 Ų8466.9 Ų66.937%0.36537%0.374SS..Hα-helixtrans-65.5-42.8175.5-171.8168.8175.4-175.50111.1H29 A30 F31 A36 T37 E82H29-K33 WeakPolarHBondContact O-CB 3.34Å; H29-K33 PolarHBondContact O-N 3.5Å; A30-K33 PolarHBondContact O-N 2.83Å; F31-K33 VanDerWaalsContact C-N 3.29Å; F31-K33 PolarHBondContact O-N 3.46Å; K33-A36 PolarHBondContact O-N 3.42Å; K33-T37 WeakPolarHBondContact O-CG2 3.23Å; K33-T37 PolarHBondContact O-N 3.38Å; K33-T37 PolarHBondContact O-OG1 3.24Å; K33-E82 HydrophobicContact CD-CG 3.99Å; K33-E82 VanDerWaalsContact NZ-CD 3.34Å; K33-E82 IonicContact NZ-OE1 3.91Å; K33-E82 PolarHBondContact NZ-OE1 2.98Å; K33-E82 IonicContact NZ-OE2 2.71Å
34G82.1Confident83.5Confident2 Ų265 Ų652%0.02138%0.375CS..Hα-helixtrans-57.5-49.9174.500000113.4A30 F31 T37 F38 T79A30-G34 PolarHBondContact O-N 3.49Å; F31-G34 PolarHBondContact O-N 2.88Å; G34-T37 WeakPolarHBondContact CA-OG1 3.42Å; G34-T37 PolarHBondContact O-N 2.87Å; G34-T37 PolarHBondContact O-OG1 2.97Å; G34-F38 PolarHBondContact O-N 3.05Å; G34-T79 VanDerWaalsContact CA-OG1 3.26Å; G34-T79 WeakPolarHBondContact CA-OG1 3.48Å
35T85.1Confident84Confident59 Ų5965.4 Ų65.436%0.36237%0.37SS..Hα-helixtrans-66.4-38.2178.456.20000112.2F31 M32 F38 I39F31-T35 HydrophobicContact CD1-CG2 4.39Å; F31-T35 HydrophobicContact CE1-CG2 3.92Å; F31-T35 HydrophobicContact CE2-CG2 4.26Å; F31-T35 HydrophobicContact CZ-CG2 3.85Å; F31-T35 PolarHBondContact O-N 3.31Å; F31-T35 PolarHBondContact O-OG1 2.94Å; M32-T35 PolarHBondContact O-OG1 3.49Å; T35-F38 WeakPolarHBondContact O-CB 3.4Å; T35-F38 PolarHBondContact O-N 2.71Å; T35-I39 WeakPolarHBondContact O-CG1 3.24Å; T35-I39 PolarHBondContact O-N 2.81Å; T35-I39 VanDerWaalsContact O-N 3.11Å
36A88.4Confident84.4Confident46 Ų4665.9 Ų65.938%0.3836%0.361SS..Hα-helixtrans-61.5-44.2173.300000111.7M32 K33 F38 I39 L40M32-A36 VanDerWaalsContact O-CB 3.3Å; M32-A36 WeakPolarHBondContact O-CB 3.3Å; M32-A36 PolarHBondContact O-N 2.91Å; K33-A36 PolarHBondContact O-N 3.42Å; A36-F38 VanDerWaalsContact C-N 3.29Å; A36-F38 PolarHBondContact O-N 2.88Å; A36-I39 PolarHBondContact O-N 3.45Å; A36-L40 WeakPolarHBondContact O-CB 3.39Å; A36-L40 WeakPolarHBondContact O-CG 3.2Å; A36-L40 PolarHBondContact O-N 3.09Å
37T86.1Confident84.8Confident46 Ų4669.2 Ų69.228%0.28238%0.375SS..Hα-helixtrans-65.4-31.4176.1530000113K33 G34 G41 V78K33-T37 WeakPolarHBondContact O-CG2 3.23Å; K33-T37 PolarHBondContact O-N 3.38Å; K33-T37 PolarHBondContact O-OG1 3.24Å; G34-T37 WeakPolarHBondContact CA-OG1 3.42Å; G34-T37 PolarHBondContact O-N 2.87Å; G34-T37 PolarHBondContact O-OG1 2.97Å; T37-G41 WeakPolarHBondContact O-CA 3.39Å; T37-G41 PolarHBondContact O-N 3.49Å; T37-V78 HydrophobicContact CG2-CG1 4.21Å
38F86.4Confident85.1Confident72 Ų7269.8 Ų69.832%0.31638%0.38SS..Hα-helixtrans-64.8-48.8174.5-178.2-107.8000112.1G34 T35 A36 G41 T42 T68 S71 S75G34-F38 PolarHBondContact O-N 3.05Å; T35-F38 WeakPolarHBondContact O-CB 3.4Å; T35-F38 PolarHBondContact O-N 2.71Å; A36-F38 VanDerWaalsContact C-N 3.29Å; A36-F38 PolarHBondContact O-N 2.88Å; F38-G41 PolarHBondContact O-N 3.49Å; F38-T42 WeakPolarHBondContact O-CB 3.44Å; F38-T42 PolarHBondContact O-N 3.24Å; F38-T42 PolarHBondContact O-OG1 3.41Å; F38-T68 HydrophobicContact CZ-CG2 4.28Å; F38-S71 VanDerWaalsContact CD2-OG 3.23Å; F38-S71 WeakPolarHBondContact CD2-OG 3.11Å; F38-S71 PolarHBondContact O-OG 2.92Å; F38-S75 WeakPolarHBondContact CA-OG 3.39Å; F38-S75 WeakPolarHBondContact CB-OG 3.3Å; F38-S75 PolarHBondContact N-OG 3.06Å; F38-S75 VanDerWaalsContact N-OG 3.15Å
39I89.7Confident85.3Confident113 Ų11368.4 Ų68.458%0.57937%0.367SS*.Hα-helixtrans-65.1-46.4-178.4-64.7167.7000110.3T35 A36 S43T35-I39 WeakPolarHBondContact O-CG1 3.24Å; T35-I39 PolarHBondContact O-N 2.81Å; T35-I39 VanDerWaalsContact O-N 3.11Å; A36-I39 PolarHBondContact O-N 3.45Å; I39-S43 WeakPolarHBondContact O-CB 3.36Å; I39-S43 PolarHBondContact O-N 2.77Å; I39-S43 VanDerWaalsContact O-N 3.14Å; I39-S43 PolarHBondContact O-OG 3.05Å
40L90.3Very high85.3Confident125 Ų12568.9 Ų68.965%0.65437%0.368SS*.Hα-helixtrans-67.9-38.1178-67.8175.6000112.3A36 S43 G44A36-L40 WeakPolarHBondContact O-CB 3.39Å; A36-L40 WeakPolarHBondContact O-CG 3.2Å; A36-L40 PolarHBondContact O-N 3.09Å; L40-S43 WeakPolarHBondContact CA-OG 3.28Å; L40-S43 PolarHBondContact O-OG 2.89Å; L40-S43 VanDerWaalsContact O-OG 3.05Å; L40-G44 PolarHBondContact O-N 3.03Å
41G88.1Confident85.6Confident26 Ų2673.6 Ų73.627%0.26840%0.396SS..Hα-helixtrans-64.6-48.9177.600000112.3T37 F38 S43 G44 L45T37-G41 WeakPolarHBondContact O-CA 3.39Å; T37-G41 PolarHBondContact O-N 3.49Å; F38-G41 PolarHBondContact O-N 3.49Å; G41-S43 PolarHBondContact O-N 2.91Å; G41-G44 PolarHBondContact O-N 3.46Å; G41-L45 VanDerWaalsContact O-CB 3.3Å; G41-L45 WeakPolarHBondContact O-CB 3.35Å; G41-L45 VanDerWaalsContact O-CG 3.32Å; G41-L45 WeakPolarHBondContact O-CG 3.45Å; G41-L45 PolarHBondContact O-N 2.72Å
42T87.6Confident85.7Confident31 Ų3171.8 Ų71.819%0.1939%0.392CS..Hα-helixtrans-64.1-43.4179.8-55.40000111.3F38 F46 S67 S71F38-T42 WeakPolarHBondContact O-CB 3.44Å; F38-T42 PolarHBondContact O-N 3.24Å; F38-T42 PolarHBondContact O-OG1 3.41Å; T42-F46 VanDerWaalsContact O-CB 3.23Å; T42-F46 WeakPolarHBondContact O-CB 3.44Å; T42-F46 PolarHBondContact O-N 3.23Å; T42-S67 PolarHBondContact O-OG 3.41Å; T42-S67 VanDerWaalsContact O-OG 3.09Å; T42-S71 PolarHBondContact N-OG 3.33Å; T42-S71 WeakPolarHBondContact OG1-CB 3.38Å; T42-S71 PolarHBondContact OG1-OG 2.68Å
43S87.2Confident85.2Confident58 Ų5868 Ų6841%0.40637%0.372SS..Hα-helixtrans-67.9-43.8178.555.80000112.3I39 L40 G41 F46 L47I39-S43 WeakPolarHBondContact O-CB 3.36Å; I39-S43 PolarHBondContact O-N 2.77Å; I39-S43 VanDerWaalsContact O-N 3.14Å; I39-S43 PolarHBondContact O-OG 3.05Å; L40-S43 WeakPolarHBondContact CA-OG 3.28Å; L40-S43 PolarHBondContact O-OG 2.89Å; L40-S43 VanDerWaalsContact O-OG 3.05Å; G41-S43 PolarHBondContact O-N 2.91Å; S43-F46 PolarHBondContact O-N 3.25Å; S43-L47 WeakPolarHBondContact O-CG 3.23Å; S43-L47 PolarHBondContact O-N 3.05Å; S43-L47 VanDerWaalsContact O-N 3.07Å
44G88.2Confident84.8Confident28 Ų2872.8 Ų72.829%0.28939%0.393SS..Hα-helixtrans-61.1-50.1175.700000112.6L40 G41 F46 L47 I48L40-G44 PolarHBondContact O-N 3.03Å; G41-G44 PolarHBondContact O-N 3.46Å; G44-F46 VanDerWaalsContact C-N 3.31Å; G44-F46 PolarHBondContact O-N 3.09Å; G44-L47 PolarHBondContact O-N 2.8Å; G44-I48 WeakPolarHBondContact O-CG1 3.4Å; G44-I48 PolarHBondContact O-N 3.39Å
45L86.2Confident84.5Confident61 Ų6183.5 Ų83.532%0.31943%0.433SS..Hα-helixtrans-61.4-39.6177.8-75.6171.1000111.9G41 I48 Q49 S67 A70G41-L45 VanDerWaalsContact O-CB 3.3Å; G41-L45 WeakPolarHBondContact O-CB 3.35Å; G41-L45 VanDerWaalsContact O-CG 3.32Å; G41-L45 WeakPolarHBondContact O-CG 3.45Å; G41-L45 PolarHBondContact O-N 2.72Å; L45-I48 PolarHBondContact O-N 3.14Å; L45-Q49 WeakPolarHBondContact O-CB 3.08Å; L45-Q49 WeakPolarHBondContact O-CG 3.36Å; L45-Q49 PolarHBondContact O-N 2.92Å; L45-S67 WeakPolarHBondContact CB-OG 3.11Å; L45-A70 HydrophobicContact CD1-CB 3.94Å
46F84.2Confident83.8Confident70 Ų7085.8 Ų85.831%0.30744%0.443SS..Hα-helixtrans-64.2-41.2177.5-176.6-103.2000112.6T42 S43 G44 Q49 K50 L60T42-F46 VanDerWaalsContact O-CB 3.23Å; T42-F46 WeakPolarHBondContact O-CB 3.44Å; T42-F46 PolarHBondContact O-N 3.23Å; S43-F46 PolarHBondContact O-N 3.25Å; G44-F46 VanDerWaalsContact C-N 3.31Å; G44-F46 PolarHBondContact O-N 3.09Å; F46-Q49 PolarHBondContact O-N 2.97Å; F46-K50 WeakPolarHBondContact O-CB 3.3Å; F46-K50 PolarHBondContact O-N 3.24Å; F46-L60 HydrophobicContact CE2-CD2 4.4Å
47L86.8Confident82.8Confident111 Ų11189.6 Ų89.658%0.58146%0.464SS*.Hα-helixtrans-65.2-43.5176.1-69.9176.5000111.7S43 G44 K50 V51S43-L47 WeakPolarHBondContact O-CG 3.23Å; S43-L47 PolarHBondContact O-N 3.05Å; S43-L47 VanDerWaalsContact O-N 3.07Å; G44-L47 PolarHBondContact O-N 2.8Å; L47-K50 PolarHBondContact O-N 3.16Å; L47-V51 WeakPolarHBondContact O-CG2 3.42Å; L47-V51 PolarHBondContact O-N 3.46Å
48I85.1Confident81.8Confident102 Ų10295.1 Ų95.152%0.52348%0.481SS..Hα-helixtrans-61.8-47.3177-67.4165.3000110.3G44 L45 K50 V51 I52G44-I48 WeakPolarHBondContact O-CG1 3.4Å; G44-I48 PolarHBondContact O-N 3.39Å; L45-I48 PolarHBondContact O-N 3.14Å; I48-K50 VanDerWaalsContact C-N 3.28Å; I48-K50 PolarHBondContact O-N 3.4Å; I48-V51 PolarHBondContact O-N 3.29Å; I48-V51 VanDerWaalsContact O-N 3.16Å; I48-I52 HydrophobicContact CG2-CD1 3.75Å; I48-I52 WeakPolarHBondContact O-CG1 3.45Å; I48-I52 PolarHBondContact O-N 3.25Å
49Q81.4Confident81.1Confident26 Ų2695.2 Ų95.212%0.12149%0.488CS..Hα-helixtrans-59.6-38.2176.2-73.8169.5-15.400112L45 F46 I52 Q53 N63L45-Q49 WeakPolarHBondContact O-CB 3.08Å; L45-Q49 WeakPolarHBondContact O-CG 3.36Å; L45-Q49 PolarHBondContact O-N 2.92Å; F46-Q49 PolarHBondContact O-N 2.97Å; Q49-I52 PolarHBondContact O-N 3.12Å; Q49-Q53 WeakPolarHBondContact O-CB 3.49Å; Q49-Q53 WeakPolarHBondContact O-CG 3.09Å; Q49-Q53 PolarHBondContact O-N 3.33Å; Q49-N63 HydrophobicContact CB-CB 4.27Å; Q49-N63 PolarHBondContact NE2-O 2.74Å; Q49-N63 PolarHBondContact OE1-O 3.16Å
50K81.3Confident80Confident126 Ų12694.7 Ų94.755%0.54849%0.486SS..Hα-helixtrans-67.6-34.3176.5-172172.2-177163.30112.9F46 L47 I48F46-K50 WeakPolarHBondContact O-CB 3.3Å; F46-K50 PolarHBondContact O-N 3.24Å; L47-K50 PolarHBondContact O-N 3.16Å; I48-K50 VanDerWaalsContact C-N 3.28Å; I48-K50 PolarHBondContact O-N 3.4Å
51V84.6Confident79.4Confident100 Ų10096.5 Ų96.561%0.60649%0.491SS*.Hα-helixtrans-70.1-42.3173.71730000110.7L47 I48 Q53 K54L47-V51 WeakPolarHBondContact O-CG2 3.42Å; L47-V51 PolarHBondContact O-N 3.46Å; I48-V51 PolarHBondContact O-N 3.29Å; I48-V51 VanDerWaalsContact O-N 3.16Å; V51-Q53 VanDerWaalsContact C-N 3.32Å; V51-Q53 PolarHBondContact O-N 3.11Å; V51-K54 WeakPolarHBondContact O-CB 3.18Å; V51-K54 PolarHBondContact O-N 2.9Å; V51-K54 VanDerWaalsContact O-N 3.15Å
52I81.3Confident78.9Confident94 Ų94102.8 Ų102.848%0.48251%0.507SS..Hα-helixtrans-65.5-35.8177.7-66.6166.7000111.3I48 Q49 K54 R55 L56I48-I52 HydrophobicContact CG2-CD1 3.75Å; I48-I52 WeakPolarHBondContact O-CG1 3.45Å; I48-I52 PolarHBondContact O-N 3.25Å; Q49-I52 PolarHBondContact O-N 3.12Å; I52-K54 PolarHBondContact O-N 3.33Å; I52-K54 VanDerWaalsContact O-N 3.16Å; I52-R55 PolarHBondContact O-N 2.92Å; I52-L56 PolarHBondContact O-N 3Å; I52-L56 VanDerWaalsContact O-N 3.07Å
53Q74.4Confident78.4Confident47 Ų47102.2 Ų102.222%0.2250%0.503CS..Hα-helixtrans-59.6-23.6173.9-87.8-172.9-34.500114Q49 V51 R55 L56 Y58 N63Q49-Q53 WeakPolarHBondContact O-CB 3.49Å; Q49-Q53 WeakPolarHBondContact O-CG 3.09Å; Q49-Q53 PolarHBondContact O-N 3.33Å; V51-Q53 VanDerWaalsContact C-N 3.32Å; V51-Q53 PolarHBondContact O-N 3.11Å; Q53-R55 PolarHBondContact O-N 2.9Å; Q53-L56 WeakPolarHBondContact CA-O 3.25Å; Q53-Y58 PolarHBondContact NE2-O 3.44Å; Q53-N63 WeakPolarHBondContact CG-ND2 3.5Å; Q53-N63 PolarHBondContact NE2-ND2 3.21Å
54K76.4Confident78.1Confident185 Ų185104 Ų10480%0.80451%0.507SS*.THydrogen-bonded Turntrans-64.8-18.9172.8-67.3-164.3173.6-173.50112.9V51 I52V51-K54 WeakPolarHBondContact O-CB 3.18Å; V51-K54 PolarHBondContact O-N 2.9Å; V51-K54 VanDerWaalsContact O-N 3.15Å; I52-K54 PolarHBondContact O-N 3.33Å; I52-K54 VanDerWaalsContact O-N 3.16Å
55R76.4Confident78Confident227 Ų227108.4 Ų108.486%0.85752%0.523SS*.THydrogen-bonded Turntrans-110.8-29.9-178.3-71.4-68.7-167.4148.20.8113.5I52 Q53I52-R55 PolarHBondContact O-N 2.92Å; Q53-R55 PolarHBondContact O-N 2.9Å
56L70.1Confident77.9Confident107 Ų107109.3 Ų109.356%0.5653%0.528SS*.SBendtrans-130.8108-178.8-81.3150.1000109.7I52 Q53 Y58I52-L56 PolarHBondContact O-N 3Å; I52-L56 VanDerWaalsContact O-N 3.07Å; Q53-L56 WeakPolarHBondContact CA-O 3.25Å; L56-Y58 PolarHBondContact O-N 3.43Å
57P66.9Low77.8Confident127 Ų127106 Ų10683%0.82551%0.514SS*.  trans-73.293.7-178.728.3-32.5000111.1
58Y65.6Low77.7Confident162 Ų162103.4 Ų103.464%0.63550%0.502SS*.  trans-108.2149.1171.7-108-99.5000111.1Q53 L56 L60Q53-Y58 PolarHBondContact NE2-O 3.44Å; L56-Y58 PolarHBondContact O-N 3.43Å; Y58-L60 PolarHBondContact O-N 3.41Å
59P70.9Confident77.9Confident74 Ų74101.3 Ų101.348%0.48150%0.5SS..  trans-61.9132.1178.724.8-34.7000112.6Q61 W62P59-Q61 PolarHBondContact O-N 2.83Å; P59-Q61 VanDerWaalsContact O-N 3.16Å; P59-W62 PolarHBondContact O-N 3.33Å
60L67.1Low78.2Confident102 Ų102102.5 Ų102.553%0.53451%0.514SS..Hα-helixtrans-60.1-26.8-174.4-122.2146.3000114.2F46 Y58 W62 N63 L64F46-L60 HydrophobicContact CE2-CD2 4.4Å; Y58-L60 PolarHBondContact O-N 3.41Å; L60-W62 PolarHBondContact O-N 2.86Å; L60-N63 PolarHBondContact O-N 2.87Å; L60-L64 PolarHBondContact O-N 2.97Å
61Q77.2Confident78.5Confident162 Ų16296.7 Ų96.776%0.75749%0.49SS*.Hα-helixtrans-64.4-38179.5-65.7176.9-44.500112.6P59 L65P59-Q61 PolarHBondContact O-N 2.83Å; P59-Q61 VanDerWaalsContact O-N 3.16Å; Q61-L65 PolarHBondContact O-N 2.98Å
62W78.3Confident78.6Confident158 Ų15895 Ų9560%0.59848%0.482SS*.Hα-helixtrans-70.8-32.8-179.6-101.194.4000112.6P59 L60 L65 I66P59-W62 PolarHBondContact O-N 3.33Å; L60-W62 PolarHBondContact O-N 2.86Å; W62-L65 PolarHBondContact O-N 2.65Å; W62-I66 HydrophobicContact CE3-CD1 3.54Å; W62-I66 HydrophobicContact CE3-CG1 3.79Å; W62-I66 HydrophobicContact CZ3-CD1 4.01Å; W62-I66 HydrophobicContact CZ3-CG1 4.11Å; W62-I66 WeakPolarHBondContact O-CB 3.49Å; W62-I66 VanDerWaalsContact O-CG1 3.28Å; W62-I66 WeakPolarHBondContact O-CG1 3.37Å; W62-I66 PolarHBondContact O-N 2.88Å
63N77.3Confident79Confident19 Ų1995.5 Ų95.510%0.10249%0.49CS..Hα-helixtrans-65.7-44.5177.1-74.1-13.8000111.8Q49 Q53 L60 L65 I66 S67Q49-N63 HydrophobicContact CB-CB 4.27Å; Q49-N63 PolarHBondContact NE2-O 2.74Å; Q49-N63 PolarHBondContact OE1-O 3.16Å; Q53-N63 WeakPolarHBondContact CG-ND2 3.5Å; Q53-N63 PolarHBondContact NE2-ND2 3.21Å; L60-N63 PolarHBondContact O-N 2.87Å; N63-L65 PolarHBondContact O-N 3.21Å; N63-I66 PolarHBondContact O-N 3.25Å; N63-S67 WeakPolarHBondContact O-CB 3.48Å; N63-S67 PolarHBondContact O-N 2.98Å
64L79.8Confident79.6Confident95 Ų9595 Ų9550%0.49750%0.496SS..Hα-helixtrans-64.3-41.5179.2-126156.2000111.6L60 T68L60-L64 PolarHBondContact O-N 2.97Å; L64-T68 WeakPolarHBondContact O-CB 3.35Å; L64-T68 PolarHBondContact O-N 2.89Å; L64-T68 PolarHBondContact O-OG1 3.28Å
65L85.7Confident79.9Confident121 Ų12186.6 Ų86.663%0.63446%0.461SS*.Hα-helixtrans-63.5-51.8174.2-92.4166.8000112.1Q61 W62 N63 S67 T68 A69Q61-L65 PolarHBondContact O-N 2.98Å; W62-L65 PolarHBondContact O-N 2.65Å; N63-L65 PolarHBondContact O-N 3.21Å; L65-S67 PolarHBondContact O-N 2.92Å; L65-T68 PolarHBondContact O-N 3.15Å; L65-A69 VanDerWaalsContact O-CB 3.28Å; L65-A69 WeakPolarHBondContact O-CB 3.26Å; L65-A69 PolarHBondContact O-N 2.92Å
66I84.1Confident80.2Confident81 Ų8182.3 Ų82.342%0.41545%0.446SS..Hα-helixtrans-62.9-42.9-179.4-68.9167.8000110.8W62 N63 A70W62-I66 HydrophobicContact CE3-CD1 3.54Å; W62-I66 HydrophobicContact CE3-CG1 3.79Å; W62-I66 HydrophobicContact CZ3-CD1 4.01Å; W62-I66 HydrophobicContact CZ3-CG1 4.11Å; W62-I66 WeakPolarHBondContact O-CB 3.49Å; W62-I66 VanDerWaalsContact O-CG1 3.28Å; W62-I66 WeakPolarHBondContact O-CG1 3.37Å; W62-I66 PolarHBondContact O-N 2.88Å; N63-I66 PolarHBondContact O-N 3.25Å; I66-A70 WeakPolarHBondContact O-CB 3.31Å; I66-A70 PolarHBondContact O-N 2.98Å
67S83.2Confident81Confident1 Ų179.9 Ų79.91%0.00744%0.441CS..Hα-helixtrans-61.7-46.7179.4179.70000111.4T42 L45 N63 L65 S71T42-S67 PolarHBondContact O-OG 3.41Å; T42-S67 VanDerWaalsContact O-OG 3.09Å; L45-S67 WeakPolarHBondContact CB-OG 3.11Å; N63-S67 WeakPolarHBondContact O-CB 3.48Å; N63-S67 PolarHBondContact O-N 2.98Å; L65-S67 PolarHBondContact O-N 2.92Å; S67-S71 WeakPolarHBondContact O-CB 3.27Å; S67-S71 PolarHBondContact O-N 3.11Å
68T85.3Confident81.7Confident56 Ų5675.8 Ų75.834%0.34441%0.414SS..Hα-helixtrans-68-43.4-179.4-50.80000111.5F38 L64 L65 S71 S72F38-T68 HydrophobicContact CZ-CG2 4.28Å; L64-T68 WeakPolarHBondContact O-CB 3.35Å; L64-T68 PolarHBondContact O-N 2.89Å; L64-T68 PolarHBondContact O-OG1 3.28Å; L65-T68 PolarHBondContact O-N 3.15Å; T68-S71 PolarHBondContact O-N 3.31Å; T68-S72 VanDerWaalsContact O-CB 3.27Å; T68-S72 WeakPolarHBondContact O-CB 2.97Å; T68-S72 PolarHBondContact O-N 3.38Å
69A89.5Confident82.4Confident58 Ų5869.7 Ų69.748%0.47939%0.394SS..Hα-helixtrans-64.1-47.717800000111.6L65 S71 S72 V73L65-A69 VanDerWaalsContact O-CB 3.28Å; L65-A69 WeakPolarHBondContact O-CB 3.26Å; L65-A69 PolarHBondContact O-N 2.92Å; A69-S71 PolarHBondContact O-N 3.37Å; A69-S72 PolarHBondContact O-N 3.37Å; A69-V73 WeakPolarHBondContact O-CG2 3.42Å; A69-V73 PolarHBondContact O-N 3.38Å
70A87.7Confident82.8Confident50 Ų5070.6 Ų70.641%0.41339%0.387SS..Hα-helixtrans-63-43.2177.700000111.7L45 I66 V73 G74L45-A70 HydrophobicContact CD1-CB 3.94Å; I66-A70 WeakPolarHBondContact O-CB 3.31Å; I66-A70 PolarHBondContact O-N 2.98Å; A70-V73 PolarHBondContact O-N 3.01Å; A70-G74 PolarHBondContact O-N 2.84Å
71S86.4Confident83.6Confident5 Ų573.7 Ų73.74%0.03539%0.392CS..Hα-helixtrans-64.2-40.4176.5-173.80000112.1F38 T42 S67 T68 A69 G74 S75F38-S71 VanDerWaalsContact CD2-OG 3.23Å; F38-S71 WeakPolarHBondContact CD2-OG 3.11Å; F38-S71 PolarHBondContact O-OG 2.92Å; T42-S71 PolarHBondContact N-OG 3.33Å; T42-S71 WeakPolarHBondContact OG1-CB 3.38Å; T42-S71 PolarHBondContact OG1-OG 2.68Å; S67-S71 WeakPolarHBondContact O-CB 3.27Å; S67-S71 PolarHBondContact O-N 3.11Å; T68-S71 PolarHBondContact O-N 3.31Å; A69-S71 PolarHBondContact O-N 3.37Å; S71-G74 PolarHBondContact O-N 3.41Å; S71-S75 VanDerWaalsContact O-CB 3.24Å; S71-S75 WeakPolarHBondContact O-CB 3.45Å; S71-S75 PolarHBondContact O-N 3.28Å; S71-S75 PolarHBondContact O-OG 3.26Å
72S86.5Confident83.8Confident64 Ų6467.2 Ų67.245%0.44836%0.362SS..Hα-helixtrans-60.9-50.4176.7-178.20000111.6T68 A69 G74 S75 Y76T68-S72 VanDerWaalsContact O-CB 3.27Å; T68-S72 WeakPolarHBondContact O-CB 2.97Å; T68-S72 PolarHBondContact O-N 3.38Å; A69-S72 PolarHBondContact O-N 3.37Å; S72-G74 PolarHBondContact O-N 3.24Å; S72-S75 PolarHBondContact O-N 3.11Å; S72-Y76 WeakPolarHBondContact O-CB 3.42Å; S72-Y76 PolarHBondContact O-N 3.4Å
73V90.8Very high83.9Confident105 Ų10561.4 Ų61.464%0.63634%0.344SS*.Hα-helixtrans-61.6-44.8177.7175.20000111.1A69 A70 S75 Y76 A77A69-V73 WeakPolarHBondContact O-CG2 3.42Å; A69-V73 PolarHBondContact O-N 3.38Å; A70-V73 PolarHBondContact O-N 3.01Å; V73-S75 PolarHBondContact O-N 3.21Å; V73-Y76 PolarHBondContact O-N 3.36Å; V73-A77 WeakPolarHBondContact O-CB 3.16Å; V73-A77 PolarHBondContact O-N 2.93Å
74G87.1Confident84.1Confident35 Ų3564.4 Ų64.436%0.36136%0.358SS..Hα-helixtrans-61.7-43.3177.500000112.6A70 S71 S72 A77 V78A70-G74 PolarHBondContact O-N 2.84Å; S71-G74 PolarHBondContact O-N 3.41Å; S72-G74 PolarHBondContact O-N 3.24Å; G74-A77 PolarHBondContact O-N 2.92Å; G74-V78 WeakPolarHBondContact O-CG2 3.36Å; G74-V78 PolarHBondContact O-N 3.18Å
75S81.2Confident84.2Confident10 Ų1064 Ų647%0.0735%0.352CS..Hα-helixtrans-68.6-39179.7-56.20000111.8F38 S71 S72 V73 V78 T79F38-S75 WeakPolarHBondContact CA-OG 3.39Å; F38-S75 WeakPolarHBondContact CB-OG 3.3Å; F38-S75 PolarHBondContact N-OG 3.06Å; F38-S75 VanDerWaalsContact N-OG 3.15Å; S71-S75 VanDerWaalsContact O-CB 3.24Å; S71-S75 WeakPolarHBondContact O-CB 3.45Å; S71-S75 PolarHBondContact O-N 3.28Å; S71-S75 PolarHBondContact O-OG 3.26Å; S72-S75 PolarHBondContact O-N 3.11Å; V73-S75 PolarHBondContact O-N 3.21Å; S75-V78 PolarHBondContact O-N 2.97Å; S75-T79 VanDerWaalsContact O-CB 3.31Å; S75-T79 WeakPolarHBondContact O-CB 3.28Å; S75-T79 PolarHBondContact O-N 2.02Å; S75-T79 PolarHBondContact O-OG1 3.17Å
76Y84.5Confident83.9Confident137 Ų13758.4 Ų58.454%0.53732%0.323SS..Hα-helixtrans-62-45.9173.1-179.3-102000111.1S72 V73 V78 T79 R80S72-Y76 WeakPolarHBondContact O-CB 3.42Å; S72-Y76 PolarHBondContact O-N 3.4Å; V73-Y76 PolarHBondContact O-N 3.36Å; Y76-V78 PolarHBondContact O-N 3.15Å; Y76-T79 PolarHBondContact O-N 3.37Å; Y76-R80 VanDerWaalsContact O-CB 3.25Å; Y76-R80 WeakPolarHBondContact O-CB 3.49Å; Y76-R80 PolarHBondContact O-N 2.83Å
77A86.1Confident83.6Confident55 Ų5556.3 Ų56.346%0.45531%0.314SS..Hα-helixtrans-61.4-45.1177.900000112.2V73 G74 R80 W81V73-A77 WeakPolarHBondContact O-CB 3.16Å; V73-A77 PolarHBondContact O-N 2.93Å; G74-A77 PolarHBondContact O-N 2.92Å; A77-R80 PolarHBondContact O-N 2.97Å; A77-W81 WeakPolarHBondContact O-CB 3.47Å; A77-W81 PolarHBondContact O-N 3.4Å
78V82.6Confident83.5Confident42 Ų4258.9 Ų58.926%0.25533%0.328SS..Hα-helixtrans-62.9-46.5175.81700000111.2T37 G74 S75 Y76 R80 W81 E82T37-V78 HydrophobicContact CG2-CG1 4.21Å; G74-V78 WeakPolarHBondContact O-CG2 3.36Å; G74-V78 PolarHBondContact O-N 3.18Å; S75-V78 PolarHBondContact O-N 2.97Å; Y76-V78 PolarHBondContact O-N 3.15Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.45Å; V78-W81 PolarHBondContact O-N 3.43Å; V78-E82 HydrophobicContact CG1-CG 4.38Å; V78-E82 WeakPolarHBondContact O-CG 3.45Å; V78-E82 PolarHBondContact O-N 3.33Å
79T80.4Confident83.1Confident34 Ų3460.6 Ų60.621%0.20934%0.335CS..Hα-helixtrans-59.8-46178.5-53.70000110.3G34 S75 Y76 W81 E82 T83G34-T79 VanDerWaalsContact CA-OG1 3.26Å; G34-T79 WeakPolarHBondContact CA-OG1 3.48Å; S75-T79 VanDerWaalsContact O-CB 3.31Å; S75-T79 WeakPolarHBondContact O-CB 3.28Å; S75-T79 PolarHBondContact O-N 2.02Å; S75-T79 PolarHBondContact O-OG1 3.17Å; Y76-T79 PolarHBondContact O-N 3.37Å; T79-W81 VanDerWaalsContact C-N 3.31Å; T79-W81 PolarHBondContact O-N 3.49Å; T79-E82 PolarHBondContact O-N 3.4Å; T79-T83 WeakPolarHBondContact O-CG2 3.48Å; T79-T83 PolarHBondContact O-N 3.28Å; T79-T83 PolarHBondContact O-OG1 3.41Å
80R79.1Confident82.5Confident92 Ų9260.2 Ų60.235%0.34732%0.321SS..Hα-helixtrans-63.5-37.1178.8-158.9176.9-159.9177.63.5111.5Y76 A77 V78 T83 M84 E107Y76-R80 VanDerWaalsContact O-CB 3.25Å; Y76-R80 WeakPolarHBondContact O-CB 3.49Å; Y76-R80 PolarHBondContact O-N 2.83Å; A77-R80 PolarHBondContact O-N 2.97Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.45Å; R80-T83 WeakPolarHBondContact CA-OG1 3.28Å; R80-T83 PolarHBondContact O-OG1 3.47Å; R80-M84 WeakPolarHBondContact O-CG 3.38Å; R80-M84 PolarHBondContact O-N 3Å; R80-M84 VanDerWaalsContact O-N 3.11Å; R80-E107 PolarHBondContact NH1-O 3.39Å
81W83.1Confident81.9Confident168 Ų16859.1 Ų59.164%0.63631%0.308SS*.Hα-helixtrans-69.8-43.5176.7-17519.5000112.1A77 V78 T79 M84 K85A77-W81 WeakPolarHBondContact O-CB 3.47Å; A77-W81 PolarHBondContact O-N 3.4Å; V78-W81 PolarHBondContact O-N 3.43Å; T79-W81 VanDerWaalsContact C-N 3.31Å; T79-W81 PolarHBondContact O-N 3.49Å; W81-M84 WeakPolarHBondContact O-CB 3.46Å; W81-M84 PolarHBondContact O-N 3.01Å; W81-K85 PolarHBondContact O-N 3.48Å; W81-K85 VanDerWaalsContact O-N 3.16Å
82E82.1Confident81.4Confident25 Ų2562.6 Ų62.612%0.11733%0.326CS..Hα-helixtrans-68-38.2178.6-68.1-67.4158.400111.9A30 K33 V78 T79 M84 K85 C86A30-E82 HydrophobicContact CB-CB 3.64Å; K33-E82 HydrophobicContact CD-CG 3.99Å; K33-E82 VanDerWaalsContact NZ-CD 3.34Å; K33-E82 IonicContact NZ-OE1 3.91Å; K33-E82 PolarHBondContact NZ-OE1 2.98Å; K33-E82 IonicContact NZ-OE2 2.71Å; V78-E82 HydrophobicContact CG1-CG 4.38Å; V78-E82 WeakPolarHBondContact O-CG 3.45Å; V78-E82 PolarHBondContact O-N 3.33Å; T79-E82 PolarHBondContact O-N 3.4Å; E82-M84 VanDerWaalsContact C-N 3.32Å; E82-M84 PolarHBondContact O-N 3.46Å; E82-K85 WeakPolarHBondContact O-CB 2.99Å; E82-K85 PolarHBondContact O-N 2.94Å; E82-K85 IonicContact OE1-NZ 2.97Å; E82-K85 PolarHBondContact OE1-NZ 3.05Å; E82-K85 IonicContact OE2-NZ 3.86Å; E82-C86 PolarHBondContact O-N 3.17Å; E82-C86 VanDerWaalsContact O-N 3.12Å; E82-C86 PolarHBondContact O-SG 3.31Å
83T80.3Confident80.8Confident36 Ų3663.1 Ų63.122%0.22132%0.323CS..Hα-helixtrans-64.3-37.4172.747.50000112.1A30 T79 R80 K85 C86 T87A30-T83 HydrophobicContact CB-CG2 3.92Å; T79-T83 WeakPolarHBondContact O-CG2 3.48Å; T79-T83 PolarHBondContact O-N 3.28Å; T79-T83 PolarHBondContact O-OG1 3.41Å; R80-T83 WeakPolarHBondContact CA-OG1 3.28Å; R80-T83 PolarHBondContact O-OG1 3.47Å; T83-K85 VanDerWaalsContact C-N 3.31Å; T83-K85 PolarHBondContact O-N 3.38Å; T83-C86 WeakPolarHBondContact O-CB 3.43Å; T83-C86 PolarHBondContact O-N 3.19Å; T83-C86 VanDerWaalsContact O-N 3.15Å; T83-T87 PolarHBondContact O-N 3.47Å; T83-T87 PolarHBondContact O-OG1 3.17Å; T83-T87 VanDerWaalsContact O-OG1 3.11Å
84M80.7Confident79.8Confident83 Ų8361.6 Ų61.641%0.40931%0.308SS..Hα-helixtrans-61-39174.5-71-72.8-177.300112.2R80 W81 E82 C86 T87 D88 R101R80-M84 WeakPolarHBondContact O-CG 3.38Å; R80-M84 PolarHBondContact O-N 3Å; R80-M84 VanDerWaalsContact O-N 3.11Å; W81-M84 WeakPolarHBondContact O-CB 3.46Å; W81-M84 PolarHBondContact O-N 3.01Å; E82-M84 VanDerWaalsContact C-N 3.32Å; E82-M84 PolarHBondContact O-N 3.46Å; M84-C86 VanDerWaalsContact C-N 3.34Å; M84-T87 PolarHBondContact O-N 2.9Å; M84-D88 WeakPolarHBondContact O-CB 3.38Å; M84-D88 PolarHBondContact O-N 3.28Å; M84-R101 PolarHBondContact SD-NH1 2.69Å
85K81Confident79.2Confident85 Ų8563.6 Ų63.637%0.3731%0.314SS..Hα-helixtrans-63.7-40174.4-65.4175-170.71690111.9W81 E82 T83 T87 D88 L89W81-K85 PolarHBondContact O-N 3.48Å; W81-K85 VanDerWaalsContact O-N 3.16Å; E82-K85 WeakPolarHBondContact O-CB 2.99Å; E82-K85 PolarHBondContact O-N 2.94Å; E82-K85 IonicContact OE1-NZ 2.97Å; E82-K85 PolarHBondContact OE1-NZ 3.05Å; E82-K85 IonicContact OE2-NZ 3.86Å; T83-K85 VanDerWaalsContact C-N 3.31Å; T83-K85 PolarHBondContact O-N 3.38Å; K85-T87 VanDerWaalsContact C-N 3.35Å; K85-D88 PolarHBondContact O-N 2.95Å; K85-L89 PolarHBondContact O-N 3.49Å; K85-L89 VanDerWaalsContact O-N 3.09Å
86C80Confident78.6Confident4 Ų466 Ų663%0.02734%0.341CS..Hα-helixtrans-62.8-42.3176-61.20000111.9Y23 C26 E82 T83 M84 W90Y23-C86 HydrophobicContact CD2-CB 4.19Å; Y23-C86 HydrophobicContact CE2-CB 4.28Å; C26-C86 HydrophobicContact CB-CB 3.59Å; C26-C86 WeakPolarHBondContact CB-SG 3.28Å; C26-C86 PolarHBondContact O-SG 3.35Å; C26-C86 VanDerWaalsContact O-SG 3.37Å; C26-C86 WeakPolarHBondContact SG-CA 3.25Å; C26-C86 WeakPolarHBondContact SG-CB 3.02Å; C26-C86 CovalentContact SG-SG 2.02Å; C26-C86 PolarHBondContact SG-SG 3.07Å; E82-C86 PolarHBondContact O-N 3.17Å; E82-C86 VanDerWaalsContact O-N 3.12Å; E82-C86 PolarHBondContact O-SG 3.31Å; T83-C86 WeakPolarHBondContact O-CB 3.43Å; T83-C86 PolarHBondContact O-N 3.19Å; T83-C86 VanDerWaalsContact O-N 3.15Å; M84-C86 VanDerWaalsContact C-N 3.34Å; C86-W90 PolarHBondContact O-N 3.45Å
87T79.2Confident77.6Confident37 Ų3767.3 Ų67.323%0.22735%0.349CS..Hα-helixtrans-65.4-41.2177-53.70000111.5T83 M84 K85 W90 M91T83-T87 PolarHBondContact O-N 3.47Å; T83-T87 PolarHBondContact O-OG1 3.17Å; T83-T87 VanDerWaalsContact O-OG1 3.11Å; M84-T87 PolarHBondContact O-N 2.9Å; K85-T87 VanDerWaalsContact C-N 3.35Å; T87-W90 WeakPolarHBondContact O-CB 3.45Å; T87-W90 PolarHBondContact O-N 2.79Å; T87-M91 HydrophobicContact CG2-CG 4.46Å; T87-M91 VanDerWaalsContact O-CG 3.28Å; T87-M91 WeakPolarHBondContact O-CG 3.5Å; T87-M91 PolarHBondContact O-N 2.98Å
88D79.3Confident76.5Confident55 Ų5568.3 Ų68.329%0.29435%0.349SS..Hα-helixtrans-63.4-43.6179.7-172.135.3000112.6M84 K85 W90 M91 L92 V98 P99M84-D88 WeakPolarHBondContact O-CB 3.38Å; M84-D88 PolarHBondContact O-N 3.28Å; K85-D88 PolarHBondContact O-N 2.95Å; D88-W90 VanDerWaalsContact C-N 3.31Å; D88-W90 PolarHBondContact O-N 2.76Å; D88-M91 WeakPolarHBondContact O-CB 3.34Å; D88-M91 PolarHBondContact O-N 3.42Å; D88-L92 WeakPolarHBondContact O-CB 3.47Å; D88-L92 PolarHBondContact O-N 2.89Å; D88-V98 WeakPolarHBondContact OD1-CG1 3.5Å; D88-P99 VanDerWaalsContact OD1-CD 3.3Å; D88-P99 WeakPolarHBondContact OD1-CD 3.19Å
89L78.6Confident75.4Confident93 Ų9368.6 Ų68.649%0.48735%0.352SS..Hα-helixtrans-60.8-42.1174.9-162.386.4000111.7K85 L92 I93K85-L89 PolarHBondContact O-N 3.49Å; K85-L89 VanDerWaalsContact O-N 3.09Å; L89-L92 PolarHBondContact O-N 3.35Å; L89-I93 HydrophobicContact CD2-CD1 4.38Å; L89-I93 HydrophobicContact CG-CD1 4.26Å; L89-I93 WeakPolarHBondContact O-CD1 3.29Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.49Å; L89-I93 PolarHBondContact O-N 3.39Å
90W76.8Confident74.1Confident49 Ų4974.7 Ų74.719%0.18638%0.383CS..Hα-helixtrans-62.4-45.9176.4177.660.9000111.6Y23 C86 T87 D88 L92 I93 E94 Y121Y23-W90 HydrophobicContact CD2-CB 4.38Å; C86-W90 PolarHBondContact O-N 3.45Å; T87-W90 WeakPolarHBondContact O-CB 3.45Å; T87-W90 PolarHBondContact O-N 2.79Å; D88-W90 VanDerWaalsContact C-N 3.31Å; D88-W90 PolarHBondContact O-N 2.76Å; W90-L92 VanDerWaalsContact C-N 3.31Å; W90-L92 PolarHBondContact O-N 3.05Å; W90-I93 PolarHBondContact O-N 3.44Å; W90-E94 WeakPolarHBondContact O-CB 3.42Å; W90-E94 PolarHBondContact O-N 2.74Å; W90-Y121 HydrophobicContact CH2-CD1 4.45Å; W90-Y121 HydrophobicContact CH2-CE1 4.13Å; W90-Y121 HydrophobicContact CZ3-CE1 4.01Å; W90-Y121 AromaticContact CZ3-CZ 3.92Å
91M73.9Confident73.2Confident27 Ų2778.6 Ų78.613%0.13340%0.398CS..Hα-helixtrans-59.1-40.7175.8-72.4-59.3-73.100112.8T87 D88 E94 T95 P99 Y121T87-M91 HydrophobicContact CG2-CG 4.46Å; T87-M91 VanDerWaalsContact O-CG 3.28Å; T87-M91 WeakPolarHBondContact O-CG 3.5Å; T87-M91 PolarHBondContact O-N 2.98Å; D88-M91 WeakPolarHBondContact O-CB 3.34Å; D88-M91 PolarHBondContact O-N 3.42Å; M91-E94 PolarHBondContact O-N 3.4Å; M91-T95 HydrophobicContact CE-CG2 4.24Å; M91-T95 WeakPolarHBondContact O-CB 3.37Å; M91-T95 PolarHBondContact O-N 2.98Å; M91-T95 PolarHBondContact O-OG1 3.03Å; M91-P99 HydrophobicContact CG-CG 4.45Å; M91-Y121 HydrophobicContact CE-CE1 3.64Å; M91-Y121 HydrophobicContact SD-CE1 3.34Å; M91-Y121 WeakPolarHBondContact SD-CE1 3.4Å; M91-Y121 VanDerWaalsContact SD-CZ 3.59Å; M91-Y121 PolarHBondContact SD-OH 3.47Å
92L76.9Confident71.4Confident79 Ų7976.1 Ų76.141%0.41440%0.402SS..Hα-helixtrans-65.8-40177.7-179.7135.4000111.9D88 L89 W90 E94 G96 V98D88-L92 WeakPolarHBondContact O-CB 3.47Å; D88-L92 PolarHBondContact O-N 2.89Å; L89-L92 PolarHBondContact O-N 3.35Å; W90-L92 VanDerWaalsContact C-N 3.31Å; W90-L92 PolarHBondContact O-N 3.05Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-G96 WeakPolarHBondContact O-CA 3.48Å; L92-G96 PolarHBondContact O-N 3.44Å; L92-V98 HydrophobicContact CD1-CG2 3.52Å
93I72.4Confident70Confident75 Ų7580.7 Ų80.739%0.38543%0.434SS..Hα-helixtrans-67.4-38.8177.7-67163.2000110.8L89 W90L89-I93 HydrophobicContact CD2-CD1 4.38Å; L89-I93 HydrophobicContact CG-CD1 4.26Å; L89-I93 WeakPolarHBondContact O-CD1 3.29Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.49Å; L89-I93 PolarHBondContact O-N 3.39Å; W90-I93 PolarHBondContact O-N 3.44Å
94E71.6Confident68.2Low73 Ų7385.8 Ų85.834%0.34146%0.459SS..Hα-helixtrans-82.6-39.9-175-159.967.5-151.300113H17 W90 M91 L92H17-E94 IonicContact CE1-OE1 2.74Å; H17-E94 PolarHBondContact CE1-OE1 3.49Å; H17-E94 IonicContact CG-OE1 3.44Å; H17-E94 IonicContact ND1-OE1 3.67Å; H17-E94 PolarHBondContact ND1-OE1 3.14Å; H17-E94 IonicContact ND1-OE2 3.78Å; W90-E94 WeakPolarHBondContact O-CB 3.42Å; W90-E94 PolarHBondContact O-N 2.74Å; M91-E94 PolarHBondContact O-N 3.4Å; L92-E94 VanDerWaalsContact C-N 3.35Å
95T73.7Confident66.3Low76 Ų7688.6 Ų88.647%0.46647%0.474SS..Hα-helixtrans-115-11.8-171.269.40000114.3M91 K97M91-T95 HydrophobicContact CE-CG2 4.24Å; M91-T95 WeakPolarHBondContact O-CB 3.37Å; M91-T95 PolarHBondContact O-N 2.98Å; M91-T95 PolarHBondContact O-OG1 3.03Å; T95-K97 PolarHBondContact O-N 3.39Å; T95-K97 PolarHBondContact OG1-N 3.44Å; T95-K97 PolarHBondContact OG1-O 2.87Å
96G67.8Low65Low62 Ų6289.1 Ų89.164%0.63949%0.494SS*.SBendtrans69.27.5-173.600000114.6L92L92-G96 WeakPolarHBondContact O-CA 3.48Å; L92-G96 PolarHBondContact O-N 3.44Å
97K64.4Low62.8Low163 Ų16396.5 Ų96.571%0.70953%0.528SS*.  trans-127136.4179.4-87.9179.31751690111.7T95T95-K97 PolarHBondContact O-N 3.39Å; T95-K97 PolarHBondContact OG1-N 3.44Å; T95-K97 PolarHBondContact OG1-O 2.87Å
98V62.7Low60.8Low76 Ų76100 Ų10046%0.46155%0.551SS.*  trans-83.9122.8170.3178.90000108.1D88 L92 D100D88-V98 WeakPolarHBondContact OD1-CG1 3.5Å; L92-V98 HydrophobicContact CD1-CG2 3.52Å; V98-D100 PolarHBondContact O-N 3.41Å
99P59.6Low59Low49 Ų49101.5 Ų101.532%0.31857%0.571SS.*  trans-64.1114.4166.523.2-32.9000110.9D88 M91 R101D88-P99 VanDerWaalsContact OD1-CD 3.3Å; D88-P99 WeakPolarHBondContact OD1-CD 3.19Å; M91-P99 HydrophobicContact CG-CG 4.45Å; P99-R101 PolarHBondContact O-N 3.01Å
100D53.2Low57Low161 Ų161102.8 Ų102.886%0.86159%0.586SS**  trans-61.1106.4172.4-101-40.3000110.2V98V98-D100 PolarHBondContact O-N 3.41Å
101R60.2Low55.1Low174 Ų174109.1 Ų109.166%0.65762%0.617SS**  trans-122.485.4174.4-70.3-175.9170.8177.3-0.4109.3M84 P99M84-R101 PolarHBondContact SD-NH1 2.69Å; P99-R101 PolarHBondContact O-N 3.01Å
102T46Very low53.6Low117 Ų117117.1 Ų117.172%0.71865%0.654SS**  trans-54.2129168.4-45.70000109.2L104T102-L104 PolarHBondContact O-N 3.41Å
103P52.1Low51.8Low121 Ų121117.3 Ų117.379%0.78666%0.66SS**  trans-78.293.9-167.131.1-33.6000110.3
104L43Very low50.3Low142 Ų142119 Ų11974%0.74369%0.685SS**  trans-105.1108.3168-71.1167.9000108.6T102T102-L104 PolarHBondContact O-N 3.41Å
105I39.3Very low48.8Very low143 Ų143118 Ų11873%0.73369%0.694SS**  48.3121.6129.1-55.5167.9000115.6E107I105-E107 PolarHBondContact O-N 2.97Å; I105-E107 VanDerWaalsContact O-N 3.17Å
106A53.7Low47.5Very low96 Ų96119.7 Ų119.779%0.79371%0.706SS**  trans-32115.1170.400000114.1
107E34.2Very low46.6Very low159 Ų159122.4 Ų122.474%0.74370%0.701SS**  trans-129.4144159.7-89.6-171.9130.300111.4R80 I105R80-E107 PolarHBondContact NH1-O 3.39Å; I105-E107 PolarHBondContact O-N 2.97Å; I105-E107 VanDerWaalsContact O-N 3.17Å
108P38.2Very low45.7Very low109 Ų109122.5 Ų122.571%0.70870%0.701SS**PPolyproline II helixtrans-70166.5-172.933.3-36.5000110.8P110P108-P110 WeakPolarHBondContact O-CD 3.11Å
109A41.8Very low45.8Very low87 Ų87120.7 Ų120.772%0.71969%0.691SS**PPolyproline II helixtrans-47.4130178.900000112.3
110P36.5Very low45.5Very low121 Ų121124.3 Ų124.379%0.78671%0.714SS**PPolyproline II helixtrans-86.2128.1162.2-3.622.6000109.5P108P108-P110 WeakPolarHBondContact O-CD 3.11Å
111E35.6Very low45.5Very low181 Ų181121.7 Ų121.785%0.84669%0.693SS**PPolyproline II helixtrans-51.4151.8174.7-64.1167.5141.500113.3P113E111-P113 VanDerWaalsContact O-CD 3.29Å; E111-P113 WeakPolarHBondContact O-CD 3.45Å
112E42.7Very low45Very low196 Ų196116.2 Ų116.292%0.91669%0.69SS**PPolyproline II helixtrans-54.6138.1166.4-76.6-178.8111.100111.5
113P39.3Very low45.4Very low83 Ų83115.6 Ų115.654%0.53968%0.683SS.*  trans-113.4129.7143.331.2-30.5000111.9E111 K117E111-P113 VanDerWaalsContact O-CD 3.29Å; E111-P113 WeakPolarHBondContact O-CD 3.45Å; P113-K117 VanDerWaalsContact CD-NZ 3.29Å; P113-K117 VanDerWaalsContact CG-NZ 3.32Å; P113-K117 WeakPolarHBondContact O-CE 2.95Å; P113-K117 PolarHBondContact O-NZ 3.49Å
114A40.1Very low45.2Very low110 Ų110114.3 Ų114.391%0.90967%0.672SS**  trans-62129.4172.500000112
115G40.8Very low45.5Very low51 Ų51113.1 Ų113.153%0.52667%0.665SS.*SBendtrans148.2147.7174.700000111.3K117G115-K117 PolarHBondContact O-N 3.22Å
116P46.3Very low45.6Very low112 Ų112118.8 Ų118.873%0.72769%0.688SS**  trans-69.2105-17427.5-32.4000109.7
117K49.5Very low45.2Very low119 Ų119119.9 Ų119.952%0.51768%0.682SS.*PPolyproline II helixtrans-92.3119.4-179.9-72174.1-173.6171.30108.8P113 G115 T119P113-K117 VanDerWaalsContact CD-NZ 3.29Å; P113-K117 VanDerWaalsContact CG-NZ 3.32Å; P113-K117 WeakPolarHBondContact O-CE 2.95Å; P113-K117 PolarHBondContact O-NZ 3.49Å; G115-K117 PolarHBondContact O-N 3.22Å; K117-T119 PolarHBondContact O-N 3.3Å
118K44.5Very low45.8Very low165 Ų165117.8 Ų117.872%0.71768%0.679SS**BIsolated β-bridgetrans-66.8122.6160.4-64.5-168.9176.9-1750107.5V124K118-V124 HydrophobicContact CG-CG2 4.4Å
119T65.5Low46.2Very low39 Ų39118.3 Ų118.324%0.23968%0.678CS.*PPolyproline II helixtrans-69.8155.9177.868.30000108.9K117 Y121 G122 D123 M125K117-T119 PolarHBondContact O-N 3.3Å; T119-Y121 PolarHBondContact O-N 2.96Å; T119-Y121 PolarHBondContact OG1-N 3Å; T119-G122 PolarHBondContact O-N 3.42Å; T119-D123 PolarHBondContact N-O 2.77Å; T119-D123 PolarHBondContact OG1-N 2.98Å; T119-D123 PolarHBondContact OG1-O 2.96Å; T119-M125 HydrophobicContact CG2-CG 3.89Å; T119-M125 HydrophobicContact CG2-SD 4.43Å
120P53.8Low46.5Very low124 Ų124120.2 Ų120.281%0.80568%0.675SS**THydrogen-bonded Turntrans-59.6-2.7171.422.8-32000113.7
121Y52.8Low47.1Very low106 Ų106120.1 Ų120.142%0.41667%0.668SS.*THydrogen-bonded Turntrans-100.12.3177.1-54.5-75.6000113.4W90 M91 T119 D123W90-Y121 HydrophobicContact CH2-CD1 4.45Å; W90-Y121 HydrophobicContact CH2-CE1 4.13Å; W90-Y121 HydrophobicContact CZ3-CE1 4.01Å; W90-Y121 AromaticContact CZ3-CZ 3.92Å; M91-Y121 HydrophobicContact CE-CE1 3.64Å; M91-Y121 HydrophobicContact SD-CE1 3.34Å; M91-Y121 WeakPolarHBondContact SD-CE1 3.4Å; M91-Y121 VanDerWaalsContact SD-CZ 3.59Å; M91-Y121 PolarHBondContact SD-OH 3.47Å; T119-Y121 PolarHBondContact O-N 2.96Å; T119-Y121 PolarHBondContact OG1-N 3Å; Y121-D123 VanDerWaalsContact C-N 3.28Å; Y121-D123 PolarHBondContact O-N 3.3Å
122G50Low47.8Very low59 Ų59116.1 Ų116.161%0.60866%0.656SS**SBendtrans83.6-3176.400000114.9T119T119-G122 PolarHBondContact O-N 3.42Å
123D54.6Low48.2Very low105 Ų105110.4 Ų110.456%0.56164%0.638SS**  trans-77.9132.5175.2-65-44.1000111.1T119 Y121T119-D123 PolarHBondContact N-O 2.77Å; T119-D123 PolarHBondContact OG1-N 2.98Å; T119-D123 PolarHBondContact OG1-O 2.96Å; Y121-D123 VanDerWaalsContact C-N 3.28Å; Y121-D123 PolarHBondContact O-N 3.3Å
124V47Very low48.9Very low93 Ų93112.5 Ų112.556%0.56465%0.645SS**BIsolated β-bridgetrans-88.5113.4172-173.40000107.1K118K118-V124 HydrophobicContact CG-CG2 4.4Å
125M49.7Very low49.6Very low118 Ų118112.7 Ų112.758%0.58162%0.624SS**  trans-80.9118.8170-57.5-68.4-78.300107.7T119T119-M125 HydrophobicContact CG2-CG 3.89Å; T119-M125 HydrophobicContact CG2-SD 4.43Å
126E41Very low50.4Low261 Ų261118.3 Ų118.3100%1.2263%0.632SS**  trans-76.70167.5-92.4170.9102.700111.8

Retrieved 126 of 126 residues in 34.2 ms (Link to these results)