A0A096N579_PAPAN Loading...

P2Y purinoceptor 2

AlphaFold DB , UniProt , Accession A0A096N579, Species PAPAN (Papio anubis, Olive baboon), Gene P2RY2, Length 377 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
1M32.2Very low34.4Very low245 Ų245140.3 Ų140.3100%1.20784%0.842SS**  0128.10-151.5172.2-167.700106.8
2A32.2Very low34.6Very low109 Ų109141.3 Ų141.390%0.90184%0.836SS**  trans71.9130166.100000120.4
3A39Very low34.6Very low93 Ų93143 Ų14377%0.76984%0.84SS**  trans-102.3166.1174.800000110.4
4D32.3Very low34.6Very low144 Ų144135.5 Ų135.577%0.7781%0.808SS**  trans-179.1117136.3-110.90.3000109.8
5L35.2Very low34.4Very low165 Ų165135.4 Ų135.486%0.86481%0.809SS**  70.2113.187.6-74.5-178000115
6G31.3Very low35.3Very low76 Ų76141.6 Ų141.678%0.78481%0.813SS**  trans151.4104159.500000117
7P40.6Very low35.3Very low110 Ų110142.8 Ų142.871%0.71482%0.817SS**  trans-109.7168.8-170.931.5-14.4000114.1
8W35.2Very low35.5Very low247 Ų247137.8 Ų137.894%0.93680%0.802SS**  trans76.488.6168.5-57.591000117.5
9N31.8Very low35.9Very low158 Ų158133.8 Ų133.885%0.84578%0.777SS**  trans-143.186.2148.3-151.512.7000109.6
10G32.6Very low36.4Very low64 Ų64137.8 Ų137.866%0.6679%0.788SS**  trans-133.972.4177.300000109.1I12G10-I12 PolarHBondContact O-N 3.28Å
11T36.4Very low36.9Very low132 Ų132135.2 Ų135.281%0.8177%0.771SS**  trans-63.983.3162.527.30000108.8
12I37.1Very low37.6Very low152 Ų152127.1 Ų127.178%0.77975%0.75SS**  trans-90.7105.2165.4-59-179.5000106.7G10 G14G10-I12 PolarHBondContact O-N 3.28Å; I12-G14 PolarHBondContact O-N 3.29Å
13N34.3Very low38.7Very low164 Ų164126.3 Ų126.388%0.87773%0.725SS**  trans-59.780.7160.3-85.7-17.3000108.8T15N13-T15 PolarHBondContact O-N 3.14Å
14G34.6Very low40Very low38 Ų38131.2 Ų131.239%0.39272%0.723SS.*  trans-74.2104.8173.300000109.8I12 W16I12-G14 PolarHBondContact O-N 3.29Å; G14-W16 PolarHBondContact O-N 3.47Å; G14-W16 PolarHBondContact O-NE1 3.2Å
15T32.2Very low41.9Very low134 Ų134124.9 Ų124.982%0.82269%0.69SS**  trans-48.9117.5151.335.30000108.6N13 D17N13-T15 PolarHBondContact O-N 3.14Å; T15-D17 PolarHBondContact O-N 3.14Å; T15-D17 VanDerWaalsContact O-N 3.13Å
16W48Very low43.9Very low234 Ų234127.1 Ų127.189%0.88669%0.687SS**  trans-79.792.7-172.9-58.691.4000110.3G14 G18G14-W16 PolarHBondContact O-N 3.47Å; G14-W16 PolarHBondContact O-NE1 3.2Å; W16-G18 PolarHBondContact O-N 2.89Å
17D35.2Very low46.2Very low162 Ų162125.6 Ų125.687%0.86666%0.659SS**  trans-73.7103.3157.5-84-24.9000107.5T15T15-D17 PolarHBondContact O-N 3.14Å; T15-D17 VanDerWaalsContact O-N 3.13Å
18G38.7Very low47.9Very low53 Ų53125 Ų12555%0.54665%0.65SS.*  trans-58.3147.6168.200000110W16 E20W16-G18 PolarHBondContact O-N 2.89Å; G18-E20 PolarHBondContact O-N 3.42Å
19D44.1Very low50.2Low63 Ų63115.4 Ų115.434%0.33762%0.616SS.*  trans-52.5144.7166.4-72-32.2000108.3L21 G22D19-L21 PolarHBondContact O-N 3.04Å; D19-G22 PolarHBondContact O-N 3.4Å
20E44.5Very low52.8Low212 Ų212113.1 Ų113.199%0.99160%0.603SS**THydrogen-bonded Turntrans-51.71.3-179.9-69.9-163.3147.700115.7G18G18-E20 PolarHBondContact O-N 3.42Å
21L47.6Very low55.5Low85 Ų85112.8 Ų112.845%0.44558%0.584SS.*THydrogen-bonded Turntrans-103.4-2.2-179.2-98.8143.3000114.5D19 Y23D19-L21 PolarHBondContact O-N 3.04Å; L21-Y23 VanDerWaalsContact C-N 3.32Å; L21-Y23 HydrophobicContact CB-CD2 3.74Å; L21-Y23 HydrophobicContact CB-CE2 3.91Å; L21-Y23 HydrophobicContact CD2-CD2 4.44Å; L21-Y23 HydrophobicContact CD2-CE2 3.74Å; L21-Y23 HydrophobicContact CG-CE2 4.31Å; L21-Y23 PolarHBondContact O-N 3.39Å
22G47.1Very low58.1Low74 Ų74107 Ų10776%0.76355%0.548SS*.  trans71.322.8178.300000114.4D19D19-G22 PolarHBondContact O-N 3.4Å
23Y54.6Low60.8Low93 Ų93103.4 Ų103.437%0.36552%0.524SS..  trans-89.1135.2174.2-65.5-50.9000111.5L21 C25L21-Y23 VanDerWaalsContact C-N 3.32Å; L21-Y23 HydrophobicContact CB-CD2 3.74Å; L21-Y23 HydrophobicContact CB-CE2 3.91Å; L21-Y23 HydrophobicContact CD2-CD2 4.44Å; L21-Y23 HydrophobicContact CD2-CE2 3.74Å; L21-Y23 HydrophobicContact CG-CE2 4.31Å; L21-Y23 PolarHBondContact O-N 3.39Å; Y23-C25 PolarHBondContact O-N 3.24Å; Y23-C25 VanDerWaalsContact O-N 3.15Å
24R66.2Low63.6Low195 Ų195100.5 Ų100.574%0.73651%0.512SS*.SBendtrans-62.9-14.7178.4-79.4-177.1161.6-177.2-8.1114.9D275R24-D275 IonicContact CZ-OD1 2.59Å; R24-D275 IonicContact NH1-OD1 3.87Å; R24-D275 PolarHBondContact NH1-OD1 2.67Å; R24-D275 IonicContact NH1-OD2 2.64Å; R24-D275 PolarHBondContact NH1-OD2 3.06Å
25C73.7Confident66.4Low12 Ų12101.7 Ų101.78%0.08151%0.51CS..SBendtrans-142.2138.4-173.7-57.40000111.8Y23 F27 C278Y23-C25 PolarHBondContact O-N 3.24Å; Y23-C25 VanDerWaalsContact O-N 3.15Å; C25-F27 HydrophobicContact CB-CE1 4.32Å; C25-F27 HydrophobicContact CB-CZ 4.18Å; C25-C278 HydrophobicContact CB-CB 3.69Å; C25-C278 WeakPolarHBondContact CB-SG 3.43Å; C25-C278 WeakPolarHBondContact SG-CA 3.45Å; C25-C278 WeakPolarHBondContact SG-CB 3.17Å; C25-C278 CovalentContact SG-SG 2.04Å; C25-C278 PolarHBondContact SG-SG 3.33Å
26R75.8Confident69.3Low211 Ų21195.4 Ų95.480%0.79647%0.471SS*.  trans-89124.3170.5-170.8170.4177.4175.71.5110.1
27F79.8Confident71.6Confident45 Ų4585 Ų8520%0.19743%0.433CS..  trans-96.6133.4179.6-60.4-66.7000110.6C25 E29 L281 N282 N285C25-F27 HydrophobicContact CB-CE1 4.32Å; C25-F27 HydrophobicContact CB-CZ 4.18Å; F27-E29 HydrophobicContact CB-CG 3.8Å; F27-E29 PolarHBondContact O-N 3.42Å; F27-L281 HydrophobicContact CE1-CB 3.74Å; F27-L281 HydrophobicContact CZ-CB 4.07Å; F27-N282 HydrophobicContact CD1-CB 3.9Å; F27-N282 HydrophobicContact CE1-CB 4.31Å; F27-N285 HydrophobicContact CD1-CB 4.4Å
28N76.6Confident74.5Confident97 Ų9781.6 Ų81.652%0.51942%0.418SS..  trans-84.5112.5169.9-176.3-12.2000108.2D30 N282 M286N28-D30 PolarHBondContact OD1-N 3.25Å; N28-N282 PolarHBondContact N-OD1 3.32Å; N28-M286 WeakPolarHBondContact O-CE 3.34Å
29E82.9Confident77.3Confident46 Ų4680.2 Ų80.222%0.21540%0.4CS..  trans-121.63.8-171.8-49.3-164.5145.600113.8F27 F31 K32 N285 K289F27-E29 HydrophobicContact CB-CG 3.8Å; F27-E29 PolarHBondContact O-N 3.42Å; E29-F31 PolarHBondContact O-N 3.39Å; E29-K32 HydrophobicContact CB-CD 4Å; E29-K32 VanDerWaalsContact O-CB 3.3Å; E29-K32 WeakPolarHBondContact O-CB 3.49Å; E29-K32 WeakPolarHBondContact O-CD 3.38Å; E29-K32 WeakPolarHBondContact O-CG 3.42Å; E29-K32 PolarHBondContact O-N 3.19Å; E29-K32 IonicContact OE2-NZ 3.93Å; E29-K32 PolarHBondContact OE2-NZ 2.99Å; E29-N285 PolarHBondContact OE1-ND2 3.43Å; E29-K289 VanDerWaalsContact CG-NZ 3.28Å; E29-K289 IonicContact OE1-NZ 3.1Å; E29-K289 PolarHBondContact OE1-NZ 3.45Å; E29-K289 IonicContact OE2-NZ 2.97Å; E29-K289 PolarHBondContact OE2-NZ 2.94Å
30D86.4Confident79.8Confident110 Ų11077.2 Ų77.259%0.58838%0.384SS*.THydrogen-bonded Turntrans-65.1-30.3-167.3-64.8-26.1000112.9N28 K32 Y33N28-D30 PolarHBondContact OD1-N 3.25Å; D30-K32 PolarHBondContact O-N 3.08Å; D30-Y33 HydrophobicContact CB-CD2 4.46Å; D30-Y33 VanDerWaalsContact O-CD2 3.31Å; D30-Y33 WeakPolarHBondContact O-CD2 3.26Å; D30-Y33 PolarHBondContact O-N 2.85Å; D30-Y33 VanDerWaalsContact O-N 3.11Å
31F90.1Very high82.3Confident57 Ų5768.1 Ų68.125%0.2535%0.348CS..THydrogen-bonded Turntrans-54.8-28.2174.379.2-77.4000113E29 Y33 V34 L35 M286 K289 I290E29-F31 PolarHBondContact O-N 3.39Å; F31-Y33 PolarHBondContact O-N 2.96Å; F31-V34 PolarHBondContact O-N 3.15Å; F31-L35 HydrophobicContact CD2-CB 4.34Å; F31-L35 HydrophobicContact CD2-CD2 3.9Å; F31-L35 HydrophobicContact CE2-CD2 3.8Å; F31-L35 WeakPolarHBondContact O-CB 3.47Å; F31-L35 PolarHBondContact O-N 2.84Å; F31-M286 HydrophobicContact CD1-CE 3.14Å; F31-M286 HydrophobicContact CD1-SD 3.8Å; F31-M286 HydrophobicContact CD2-SD 4.5Å; F31-M286 HydrophobicContact CE1-CE 3.11Å; F31-M286 HydrophobicContact CE1-CG 4.1Å; F31-M286 HydrophobicContact CE1-SD 3.37Å; F31-M286 WeakPolarHBondContact CE1-SD 3.39Å; F31-M286 HydrophobicContact CE2-SD 4.12Å; F31-M286 HydrophobicContact CG-CE 4.02Å; F31-M286 HydrophobicContact CG-SD 4.34Å; F31-M286 HydrophobicContact CZ-CE 3.94Å; F31-M286 HydrophobicContact CZ-CG 4.22Å; F31-M286 HydrophobicContact CZ-SD 3.54Å; F31-M286 VanDerWaalsContact CZ-SD 3.54Å; F31-K289 HydrophobicContact CE1-CD 4.38Å; F31-K289 HydrophobicContact CE2-CB 4.31Å; F31-K289 HydrophobicContact CZ-CB 3.92Å; F31-K289 HydrophobicContact CZ-CD 3.97Å; F31-I290 HydrophobicContact CE2-CG1 3.98Å
32K91.4Very high84.6Confident11 Ų1167.8 Ų67.85%0.04835%0.349CS..Hα-helixtrans-64.8-29.7-177.885.8-169.7156.1173.90111.9E29 D30 V34 L36 P37 D97 K289E29-K32 HydrophobicContact CB-CD 4Å; E29-K32 VanDerWaalsContact O-CB 3.3Å; E29-K32 WeakPolarHBondContact O-CB 3.49Å; E29-K32 WeakPolarHBondContact O-CD 3.38Å; E29-K32 WeakPolarHBondContact O-CG 3.42Å; E29-K32 PolarHBondContact O-N 3.19Å; E29-K32 IonicContact OE2-NZ 3.93Å; E29-K32 PolarHBondContact OE2-NZ 2.99Å; D30-K32 PolarHBondContact O-N 3.08Å; K32-V34 PolarHBondContact O-N 2.93Å; K32-L36 HydrophobicContact CB-CD1 3.86Å; K32-L36 HydrophobicContact CB-CG 4.26Å; K32-L36 HydrophobicContact CG-CD1 4.4Å; K32-L36 VanDerWaalsContact O-CB 3.27Å; K32-L36 WeakPolarHBondContact O-CB 3.36Å; K32-L36 WeakPolarHBondContact O-CG 3.31Å; K32-L36 PolarHBondContact O-N 2.96Å; K32-P37 WeakPolarHBondContact O-CD 3.4Å; K32-D97 WeakPolarHBondContact CE-OD2 3.24Å; K32-D97 IonicContact NZ-OD2 3.03Å; K32-D97 PolarHBondContact NZ-OD2 3.22Å; K32-K289 HydrophobicContact CB-CD 4.31Å; K32-K289 HydrophobicContact CD-CD 4.34Å
33Y92.3Very high86.9Confident75 Ų7564.7 Ų64.729%0.29432%0.315SS..Hα-helixtrans-72.4-14-179.3-55.2-53.7000113.1D30 F31 P37 Y93 D97D30-Y33 HydrophobicContact CB-CD2 4.46Å; D30-Y33 VanDerWaalsContact O-CD2 3.31Å; D30-Y33 WeakPolarHBondContact O-CD2 3.26Å; D30-Y33 PolarHBondContact O-N 2.85Å; D30-Y33 VanDerWaalsContact O-N 3.11Å; F31-Y33 PolarHBondContact O-N 2.96Å; Y33-P37 WeakPolarHBondContact O-CD 3.41Å; Y33-P37 VanDerWaalsContact O-CG 3.26Å; Y33-P37 WeakPolarHBondContact O-CG 3.42Å; Y33-Y93 WeakPolarHBondContact CD1-O 3.31Å; Y33-D97 HydrophobicContact CE1-CB 4.33Å
34V93.3Very high88.9Confident103 Ų10361 Ų6162%0.62430%0.303SS*.Hα-helixtrans-104.7-49.6171.3-179.30000110.1F31 K32 L36 V38F31-V34 PolarHBondContact O-N 3.15Å; K32-V34 PolarHBondContact O-N 2.93Å; V34-L36 PolarHBondContact O-N 3.33Å; V34-V38 HydrophobicContact CG1-CG2 4.37Å; V34-V38 WeakPolarHBondContact O-CB 3.46Å; V34-V38 WeakPolarHBondContact O-CG2 3.35Å; V34-V38 PolarHBondContact O-N 3.21Å
35L93.8Very high90.3Very high64 Ų6456.1 Ų56.134%0.33530%0.295SS..Hα-helixtrans-60.5-47.9-175179.666.1000112.5F31 S39 I290F31-L35 HydrophobicContact CD2-CB 4.34Å; F31-L35 HydrophobicContact CD2-CD2 3.9Å; F31-L35 HydrophobicContact CE2-CD2 3.8Å; F31-L35 WeakPolarHBondContact O-CB 3.47Å; F31-L35 PolarHBondContact O-N 2.84Å; L35-S39 VanDerWaalsContact O-CB 3.23Å; L35-S39 WeakPolarHBondContact O-CB 3.29Å; L35-S39 PolarHBondContact O-N 3.32Å; L35-S39 PolarHBondContact O-OG 2.98Å; L35-I290 HydrophobicContact CD2-CB 4.46Å; L35-I290 HydrophobicContact CD2-CG1 3.8Å
36L93.9Very high91.3Very high1 Ų159.7 Ų59.71%0.00531%0.312CS..Hα-helixtrans-72-47.7-173.6-60.6176.4000112.2K32 V34 V38 S39 Y40 Y93 P293K32-L36 HydrophobicContact CB-CD1 3.86Å; K32-L36 HydrophobicContact CB-CG 4.26Å; K32-L36 HydrophobicContact CG-CD1 4.4Å; K32-L36 VanDerWaalsContact O-CB 3.27Å; K32-L36 WeakPolarHBondContact O-CB 3.36Å; K32-L36 WeakPolarHBondContact O-CG 3.31Å; K32-L36 PolarHBondContact O-N 2.96Å; V34-L36 PolarHBondContact O-N 3.33Å; L36-V38 PolarHBondContact O-N 3.28Å; L36-S39 PolarHBondContact O-OG 2.75Å; L36-Y40 HydrophobicContact CB-CD2 4.1Å; L36-Y40 HydrophobicContact CB-CE2 3.9Å; L36-Y40 HydrophobicContact CD2-CE2 4.04Å; L36-Y40 HydrophobicContact CG-CE2 4.45Å; L36-Y40 VanDerWaalsContact O-CB 3.27Å; L36-Y40 WeakPolarHBondContact O-CB 3.49Å; L36-Y40 WeakPolarHBondContact O-CD2 3.41Å; L36-Y40 VanDerWaalsContact O-CG 3.3Å; L36-Y40 PolarHBondContact O-N 3.44Å; L36-Y93 HydrophobicContact CB-CD1 4.32Å; L36-Y93 HydrophobicContact CB-CD2 3.68Å; L36-Y93 HydrophobicContact CB-CE2 4.18Å; L36-Y93 HydrophobicContact CB-CG 3.78Å; L36-Y93 HydrophobicContact CD1-CD1 3.56Å; L36-Y93 HydrophobicContact CD1-CD2 3.95Å; L36-Y93 HydrophobicContact CD1-CE1 3.35Å; L36-Y93 HydrophobicContact CD1-CE2 3.79Å; L36-Y93 HydrophobicContact CD1-CG 3.87Å; L36-Y93 VanDerWaalsContact CD1-CZ 3.48Å; L36-Y93 HydrophobicContact CG-CD2 4.46Å; L36-Y93 HydrophobicContact CG-CG 4.49Å; L36-P293 HydrophobicContact CD2-CG 3.54Å
37P95.8Very high92.1Very high15 Ų1549.6 Ų49.610%0.09727%0.274CS..Hα-helixtrans-59.8-44.7175.6-27.537.7000113.4K32 Y33 G41 V90 A94K32-P37 WeakPolarHBondContact O-CD 3.4Å; Y33-P37 WeakPolarHBondContact O-CD 3.41Å; Y33-P37 VanDerWaalsContact O-CG 3.26Å; Y33-P37 WeakPolarHBondContact O-CG 3.42Å; P37-G41 WeakPolarHBondContact O-CA 3.35Å; P37-G41 PolarHBondContact O-N 2.96Å; P37-V90 HydrophobicContact CB-CG1 4.19Å; P37-A94 HydrophobicContact CB-CB 4.34Å; P37-A94 HydrophobicContact CG-CB 4.16Å
38V96.7Very high92.8Very high91 Ų9150.4 Ų50.455%0.55228%0.28SS*.Hα-helixtrans-64.2-50.3-178.91720000110.2V34 L36 G41 V42V34-V38 HydrophobicContact CG1-CG2 4.37Å; V34-V38 WeakPolarHBondContact O-CB 3.46Å; V34-V38 WeakPolarHBondContact O-CG2 3.35Å; V34-V38 PolarHBondContact O-N 3.21Å; L36-V38 PolarHBondContact O-N 3.28Å; V38-G41 PolarHBondContact O-N 2.97Å; V38-V42 WeakPolarHBondContact O-CG2 3.37Å; V38-V42 PolarHBondContact O-N 3.41Å
39S96.1Very high93.6Very high24 Ų2449.5 Ų49.517%0.16828%0.281CS..Hα-helixtrans-66.3-44.1-178.260.50000112.7L35 L36 G41 V42 V43 P293L35-S39 VanDerWaalsContact O-CB 3.23Å; L35-S39 WeakPolarHBondContact O-CB 3.29Å; L35-S39 PolarHBondContact O-N 3.32Å; L35-S39 PolarHBondContact O-OG 2.98Å; L36-S39 PolarHBondContact O-OG 2.75Å; S39-G41 VanDerWaalsContact C-N 3.34Å; S39-G41 PolarHBondContact O-N 2.93Å; S39-V42 PolarHBondContact O-N 2.81Å; S39-V43 VanDerWaalsContact O-CG2 3.31Å; S39-V43 WeakPolarHBondContact O-CG2 3.39Å; S39-V43 PolarHBondContact O-N 2.97Å; S39-P293 WeakPolarHBondContact OG-CB 3.44Å; S39-P293 WeakPolarHBondContact OG-CG 3.38Å
40Y96.4Very high94Very high0 Ų049.8 Ų49.80%028%0.284CS..Hα-helixtrans-67.4-33.8175.3-66.9-37.1000112.7L36 V43 C44 L86 L89 Y93 R292 P293 S296L36-Y40 HydrophobicContact CB-CD2 4.1Å; L36-Y40 HydrophobicContact CB-CE2 3.9Å; L36-Y40 HydrophobicContact CD2-CE2 4.04Å; L36-Y40 HydrophobicContact CG-CE2 4.45Å; L36-Y40 VanDerWaalsContact O-CB 3.27Å; L36-Y40 WeakPolarHBondContact O-CB 3.49Å; L36-Y40 WeakPolarHBondContact O-CD2 3.41Å; L36-Y40 VanDerWaalsContact O-CG 3.3Å; L36-Y40 PolarHBondContact O-N 3.44Å; Y40-V43 PolarHBondContact O-N 3.1Å; Y40-C44 WeakPolarHBondContact O-CB 3.18Å; Y40-C44 PolarHBondContact O-N 3.31Å; Y40-L86 HydrophobicContact CD1-CD2 3.82Å; Y40-L86 HydrophobicContact CE1-CD2 4.46Å; Y40-L86 HydrophobicContact CG-CD2 4.05Å; Y40-L89 HydrophobicContact CD2-CB 4.09Å; Y40-L89 HydrophobicContact CD2-CD2 4.4Å; Y40-L89 HydrophobicContact CE2-CB 4.43Å; Y40-L89 HydrophobicContact CE2-CD2 4.04Å; Y40-Y93 HydrophobicContact CD2-CD2 4.16Å; Y40-Y93 HydrophobicContact CD2-CE2 4.29Å; Y40-Y93 AromaticContact CE2-CD2 3.96Å; Y40-Y93 HydrophobicContact CE2-CD2 3.96Å; Y40-Y93 AromaticContact CE2-CE2 3.67Å; Y40-Y93 HydrophobicContact CE2-CE2 3.67Å; Y40-R292 VanDerWaalsContact OH-CZ 3.23Å; Y40-R292 PolarHBondContact OH-NH1 3.22Å; Y40-R292 PolarHBondContact OH-NH2 3.33Å; Y40-P293 HydrophobicContact CE1-CG 4.38Å; Y40-S296 WeakPolarHBondContact CE1-OG 3.47Å
41G97.1Very high94.3Very high22 Ų2244.6 Ų44.623%0.22726%0.256CS..Hα-helixtrans-62.4-46.2172.900000111.7P37 V38 S39 C44 V45P37-G41 WeakPolarHBondContact O-CA 3.35Å; P37-G41 PolarHBondContact O-N 2.96Å; V38-G41 PolarHBondContact O-N 2.97Å; S39-G41 VanDerWaalsContact C-N 3.34Å; S39-G41 PolarHBondContact O-N 2.93Å; G41-C44 WeakPolarHBondContact O-CB 3.13Å; G41-C44 PolarHBondContact O-N 3.47Å; G41-V45 WeakPolarHBondContact O-CG2 3.42Å; G41-V45 PolarHBondContact O-N 3.45Å
42V96Very high94.5Very high78 Ų7844.6 Ų44.647%0.47327%0.266SS..Hα-helixtrans-60.6-48.4174.9170.50000111V38 S39 C44 V45 L46V38-V42 WeakPolarHBondContact O-CG2 3.37Å; V38-V42 PolarHBondContact O-N 3.41Å; S39-V42 PolarHBondContact O-N 2.81Å; V42-C44 VanDerWaalsContact C-N 3.3Å; V42-C44 PolarHBondContact O-N 3.4Å; V42-V45 PolarHBondContact O-N 3.08Å; V42-L46 HydrophobicContact CG1-CD1 3.68Å; V42-L46 HydrophobicContact CG1-CG 4.31Å; V42-L46 WeakPolarHBondContact O-CB 3.38Å; V42-L46 WeakPolarHBondContact O-CG 3.28Å; V42-L46 PolarHBondContact O-N 3.21Å
43V95.3Very high94.4Very high9 Ų947.8 Ų47.86%0.05529%0.286CS..Hα-helixtrans-63.6-36.8178.3175.20000111.4S39 Y40 G47 L86 S296 A297S39-V43 VanDerWaalsContact O-CG2 3.31Å; S39-V43 WeakPolarHBondContact O-CG2 3.39Å; S39-V43 PolarHBondContact O-N 2.97Å; Y40-V43 PolarHBondContact O-N 3.1Å; V43-G47 WeakPolarHBondContact O-CA 3.28Å; V43-G47 PolarHBondContact O-N 2.78Å; V43-L86 HydrophobicContact CB-CD1 3.86Å; V43-L86 HydrophobicContact CG1-CD1 3.53Å; V43-S296 VanDerWaalsContact CG1-O 3.3Å; V43-S296 WeakPolarHBondContact CG1-O 3.31Å; V43-A297 HydrophobicContact CG2-CB 4.43Å
44C96.4Very high94.3Very high14 Ų1444.5 Ų44.510%0.09527%0.274CS..Hα-helixtrans-61.8-54.5176.6-177.90000111Y40 G41 V42 L48 A83 L86Y40-C44 WeakPolarHBondContact O-CB 3.18Å; Y40-C44 PolarHBondContact O-N 3.31Å; G41-C44 WeakPolarHBondContact O-CB 3.13Å; G41-C44 PolarHBondContact O-N 3.47Å; V42-C44 VanDerWaalsContact C-N 3.3Å; V42-C44 PolarHBondContact O-N 3.4Å; C44-L48 WeakPolarHBondContact O-CB 3.07Å; C44-L48 VanDerWaalsContact O-CG 3.23Å; C44-L48 WeakPolarHBondContact O-CG 3.49Å; C44-L48 PolarHBondContact O-N 3.02Å; C44-A83 PolarHBondContact SG-O 3.08Å; C44-L86 HydrophobicContact CB-CB 3.87Å; C44-L86 HydrophobicContact CB-CD1 4.1Å
45V96Very high94.3Very high94 Ų9441 Ų4157%0.5725%0.252SS*.Hα-helixtrans-65.6-52.6-176.8174.80000110.8G41 V42 C49G41-V45 WeakPolarHBondContact O-CG2 3.42Å; G41-V45 PolarHBondContact O-N 3.45Å; V42-V45 PolarHBondContact O-N 3.08Å; V45-C49 WeakPolarHBondContact O-CB 3.2Å; V45-C49 PolarHBondContact O-N 3.46Å; V45-C49 VanDerWaalsContact O-N 3.07Å; V45-C49 PolarHBondContact O-SG 3.19Å
46L94.4Very high94.1Very high86 Ų8644.3 Ų44.345%0.4526%0.261SS..Hα-helixtrans-66.3-44.4-178.9-65.9-179.2000111.4V42 C49 L50V42-L46 HydrophobicContact CG1-CD1 3.68Å; V42-L46 HydrophobicContact CG1-CG 4.31Å; V42-L46 WeakPolarHBondContact O-CB 3.38Å; V42-L46 WeakPolarHBondContact O-CG 3.28Å; V42-L46 PolarHBondContact O-N 3.21Å; L46-C49 PolarHBondContact O-N 3.03Å; L46-L50 HydrophobicContact CB-CD1 4.41Å; L46-L50 VanDerWaalsContact O-CB 3.23Å; L46-L50 WeakPolarHBondContact O-CB 3.46Å; L46-L50 WeakPolarHBondContact O-CD1 3.39Å; L46-L50 WeakPolarHBondContact O-CG 3.47Å; L46-L50 PolarHBondContact O-N 3.26Å
47G93.2Very high93.8Very high0 Ų045.8 Ų45.80%027%0.269CS..Hα-helixtrans-62.3-47.3-179.500000112V43 N51 C300V43-G47 WeakPolarHBondContact O-CA 3.28Å; V43-G47 PolarHBondContact O-N 2.78Å; G47-N51 WeakPolarHBondContact O-CB 3.02Å; G47-N51 PolarHBondContact O-N 3.4Å; G47-N51 PolarHBondContact O-ND2 3.06Å; G47-C300 PolarHBondContact N-SG 2.68Å; G47-C300 VanDerWaalsContact N-SG 3.44Å
48L94.3Very high93.5Very high62 Ų6245.7 Ų45.733%0.32527%0.267SS..Hα-helixtrans-63.5-48.4176.8-74173.4000111.6C44 A52 A83 A84C44-L48 WeakPolarHBondContact O-CB 3.07Å; C44-L48 VanDerWaalsContact O-CG 3.23Å; C44-L48 WeakPolarHBondContact O-CG 3.49Å; C44-L48 PolarHBondContact O-N 3.02Å; L48-A52 WeakPolarHBondContact O-CB 3.48Å; L48-A52 PolarHBondContact O-N 3.31Å; L48-A83 HydrophobicContact CD2-CB 3.94Å; L48-A83 HydrophobicContact CG-CB 3.86Å; L48-A84 HydrophobicContact CD2-CB 4.09Å
49C93.1Very high93.2Very high78 Ų7846.9 Ų46.953%0.52727%0.269SS..Hα-helixtrans-60.8-51.3-179.6-71.40000112.1V45 L46 V53V45-C49 WeakPolarHBondContact O-CB 3.2Å; V45-C49 PolarHBondContact O-N 3.46Å; V45-C49 VanDerWaalsContact O-N 3.07Å; V45-C49 PolarHBondContact O-SG 3.19Å; L46-C49 PolarHBondContact O-N 3.03Å; C49-V53 VanDerWaalsContact O-CG2 3.28Å; C49-V53 WeakPolarHBondContact O-CG2 3.45Å; C49-V53 PolarHBondContact O-N 3.4Å; C49-V53 VanDerWaalsContact O-N 3.09Å
50L91.9Very high92.9Very high52 Ų5249.7 Ų49.727%0.27229%0.288SS..Hα-helixtrans-65.3-44.5-177.4-69.5169000111.9L46 A54 C300 P303 V304L46-L50 HydrophobicContact CB-CD1 4.41Å; L46-L50 VanDerWaalsContact O-CB 3.23Å; L46-L50 WeakPolarHBondContact O-CB 3.46Å; L46-L50 WeakPolarHBondContact O-CD1 3.39Å; L46-L50 WeakPolarHBondContact O-CG 3.47Å; L46-L50 PolarHBondContact O-N 3.26Å; L50-A54 WeakPolarHBondContact O-CB 3.35Å; L50-A54 PolarHBondContact O-N 2.86Å; L50-C300 HydrophobicContact CD1-CB 4.46Å; L50-P303 HydrophobicContact CB-CB 4.22Å; L50-P303 HydrophobicContact CB-CG 4.31Å; L50-V304 HydrophobicContact CD1-CG2 3.75Å; L50-V304 HydrophobicContact CD2-CG2 4.42Å
51N93.5Very high92.3Very high1 Ų155.1 Ų55.11%0.00531%0.309CS..Hα-helixtrans-75.2-34.6-178.9-69.1-68.3000112.3G47 A54 L55 A76 D79 A80 S299 P303G47-N51 WeakPolarHBondContact O-CB 3.02Å; G47-N51 PolarHBondContact O-N 3.4Å; G47-N51 PolarHBondContact O-ND2 3.06Å; N51-A54 PolarHBondContact O-N 3.11Å; N51-L55 WeakPolarHBondContact O-CB 3.17Å; N51-L55 WeakPolarHBondContact O-CG 3.31Å; N51-L55 PolarHBondContact O-N 2.88Å; N51-A76 WeakPolarHBondContact OD1-CA 3.43Å; N51-D79 WeakPolarHBondContact ND2-CB 3.4Å; N51-A80 HydrophobicContact CB-CB 4.14Å; N51-S299 PolarHBondContact ND2-O 3.32Å; N51-P303 VanDerWaalsContact OD1-CG 3.26Å; N51-P303 WeakPolarHBondContact OD1-CG 3.44Å
52A92.5Very high91.7Very high56 Ų5655.5 Ų55.546%0.46331%0.305SS..Hα-helixtrans-62.1-44.8173.300000111.5L48 L55 Y56L48-A52 WeakPolarHBondContact O-CB 3.48Å; L48-A52 PolarHBondContact O-N 3.31Å; A52-L55 PolarHBondContact O-N 2.8Å; A52-Y56 WeakPolarHBondContact O-CB 3.3Å; A52-Y56 PolarHBondContact O-N 3.41Å
53V91.1Very high91Very high79 Ų7961.2 Ų61.248%0.47932%0.324SS..Hα-helixtrans-62-44.6174.3171.50000110.9C49 Y56 I57C49-V53 VanDerWaalsContact O-CG2 3.28Å; C49-V53 WeakPolarHBondContact O-CG2 3.45Å; C49-V53 PolarHBondContact O-N 3.4Å; C49-V53 VanDerWaalsContact O-N 3.09Å; V53-Y56 PolarHBondContact O-N 2.98Å; V53-I57 HydrophobicContact CG1-CD1 3.88Å; V53-I57 VanDerWaalsContact O-CG1 3.28Å; V53-I57 WeakPolarHBondContact O-CG1 3.49Å; V53-I57 PolarHBondContact O-N 3.44Å
54A89.3Confident90.5Very high5 Ų565.5 Ų65.54%0.04135%0.35CS..Hα-helixtrans-60.5-47177.600000111.9L50 N51 I57 F58 A76L50-A54 WeakPolarHBondContact O-CB 3.35Å; L50-A54 PolarHBondContact O-N 2.86Å; N51-A54 PolarHBondContact O-N 3.11Å; A54-I57 PolarHBondContact O-N 3.23Å; A54-F58 HydrophobicContact CB-CD2 4.46Å; A54-F58 HydrophobicContact CB-CE2 4.18Å; A54-F58 WeakPolarHBondContact O-CD2 3.21Å; A54-F58 WeakPolarHBondContact O-CG 3.27Å; A54-F58 PolarHBondContact O-N 3.3Å; A54-A76 HydrophobicContact CB-CB 4.4Å
55L92.5Very high90.1Very high30 Ų3069.7 Ų69.716%0.15736%0.364CS..Hα-helixtrans-61.6-44177-71.3171.9000111.6N51 A52 I57 F58 L59 F73 A76 V77 A80N51-L55 WeakPolarHBondContact O-CB 3.17Å; N51-L55 WeakPolarHBondContact O-CG 3.31Å; N51-L55 PolarHBondContact O-N 2.88Å; A52-L55 PolarHBondContact O-N 2.8Å; L55-I57 VanDerWaalsContact C-N 3.32Å; L55-I57 PolarHBondContact O-N 3.37Å; L55-F58 PolarHBondContact O-N 3.23Å; L55-L59 WeakPolarHBondContact O-CB 3.27Å; L55-L59 VanDerWaalsContact O-CG 3.28Å; L55-L59 WeakPolarHBondContact O-CG 3.16Å; L55-L59 PolarHBondContact O-N 2.86Å; L55-F73 HydrophobicContact CD2-CD2 3.77Å; L55-F73 HydrophobicContact CD2-CE2 3.59Å; L55-F73 HydrophobicContact CD2-CZ 4.42Å; L55-A76 HydrophobicContact CD2-CB 3.87Å; L55-A76 HydrophobicContact CG-CB 4.03Å; L55-V77 HydrophobicContact CD2-CG2 3.6Å; L55-A80 HydrophobicContact CD1-CB 3.94Å
56Y91Very high89.7Confident133 Ų13367.9 Ų67.952%0.52235%0.351SS..Hα-helixtrans-57.1-45.8174172.2-104.9000111.7A52 V53 L59 C60A52-Y56 WeakPolarHBondContact O-CB 3.3Å; A52-Y56 PolarHBondContact O-N 3.41Å; V53-Y56 PolarHBondContact O-N 2.98Å; Y56-L59 PolarHBondContact O-N 3.24Å; Y56-C60 HydrophobicContact CD2-CB 4.11Å; Y56-C60 HydrophobicContact CE2-CB 3.82Å; Y56-C60 VanDerWaalsContact O-CB 3.26Å; Y56-C60 WeakPolarHBondContact O-CB 3.38Å; Y56-C60 PolarHBondContact O-N 2.9Å
57I87.3Confident89.4Confident33 Ų3363.8 Ų63.817%0.16933%0.33CS..Iπ-helixtrans-64.4-43.3178-66.4169000111V53 A54 L55 R61 L62 F307 L313V53-I57 HydrophobicContact CG1-CD1 3.88Å; V53-I57 VanDerWaalsContact O-CG1 3.28Å; V53-I57 WeakPolarHBondContact O-CG1 3.49Å; V53-I57 PolarHBondContact O-N 3.44Å; A54-I57 PolarHBondContact O-N 3.23Å; L55-I57 VanDerWaalsContact C-N 3.32Å; L55-I57 PolarHBondContact O-N 3.37Å; I57-R61 HydrophobicContact CG2-CB 4.25Å; I57-R61 CarbonylContact O-C 3.54Å; I57-R61 WeakPolarHBondContact O-CA 3.5Å; I57-R61 WeakPolarHBondContact O-CB 3.38Å; I57-R61 PolarHBondContact O-N 2.82Å; I57-L62 PolarHBondContact O-N 3.08Å; I57-F307 HydrophobicContact CD1-CZ 4.28Å; I57-L313 HydrophobicContact CB-CD2 4.38Å; I57-L313 HydrophobicContact CD1-CD2 3.69Å; I57-L313 HydrophobicContact CG2-CD2 3.83Å; I57-L313 HydrophobicContact CG2-CG 4.29Å
58F88.8Confident88.9Confident12 Ų1264.3 Ų64.35%0.05333%0.333CS..Iπ-helixtrans-63.6-43177.9-72.2-51.9000112.6A54 L55 L62 W65 M72 F73A54-F58 HydrophobicContact CB-CD2 4.46Å; A54-F58 HydrophobicContact CB-CE2 4.18Å; A54-F58 WeakPolarHBondContact O-CD2 3.21Å; A54-F58 WeakPolarHBondContact O-CG 3.27Å; A54-F58 PolarHBondContact O-N 3.3Å; L55-F58 PolarHBondContact O-N 3.23Å; F58-L62 HydrophobicContact CD1-CD2 3.83Å; F58-L62 HydrophobicContact CE1-CD2 4.4Å; F58-L62 WeakPolarHBondContact O-CB 3.47Å; F58-W65 HydrophobicContact CB-CH2 4.18Å; F58-W65 VanDerWaalsContact O-CZ2 3.31Å; F58-W65 WeakPolarHBondContact O-CZ2 3.36Å; F58-M72 HydrophobicContact CE2-CB 4.37Å; F58-M72 HydrophobicContact CZ-CB 3.78Å; F58-F73 HydrophobicContact CB-CD2 3.67Å; F58-F73 HydrophobicContact CB-CE2 4.39Å; F58-F73 HydrophobicContact CD2-CB 4.15Å; F58-F73 HydrophobicContact CD2-CD2 4.06Å; F58-F73 HydrophobicContact CG-CB 4.25Å; F58-F73 HydrophobicContact CG-CD2 4.09Å
59L90.4Very high88.6Confident116 Ų11662.2 Ų62.261%0.60732%0.323SS*.Iπ-helixtrans-79-40.9-175.9-66.5172.4000112.5L55 Y56 F73L55-L59 WeakPolarHBondContact O-CB 3.27Å; L55-L59 VanDerWaalsContact O-CG 3.28Å; L55-L59 WeakPolarHBondContact O-CG 3.16Å; L55-L59 PolarHBondContact O-N 2.86Å; Y56-L59 PolarHBondContact O-N 3.24Å; L59-F73 HydrophobicContact CD1-CE2 4.49Å; L59-F73 HydrophobicContact CD2-CE2 3.7Å; L59-F73 HydrophobicContact CD2-CZ 3.97Å; L59-F73 HydrophobicContact CG-CE2 3.97Å
60C89.6Confident88.5Confident83 Ų8358.6 Ų58.656%0.56130%0.298SS*.Iπ-helixtrans-104.1-22.5-168.7-57.10000113.9Y56Y56-C60 HydrophobicContact CD2-CB 4.11Å; Y56-C60 HydrophobicContact CE2-CB 3.82Å; Y56-C60 VanDerWaalsContact O-CB 3.26Å; Y56-C60 WeakPolarHBondContact O-CB 3.38Å; Y56-C60 PolarHBondContact O-N 2.9Å
61R84.7Confident88.5Confident115 Ų11556.4 Ų56.443%0.43429%0.287SS..Iπ-helixtrans-118.3-25.2-171.3-52-63.2-70.8-143.5-3.3113.4I57 K63I57-R61 HydrophobicContact CG2-CB 4.25Å; I57-R61 CarbonylContact O-C 3.54Å; I57-R61 WeakPolarHBondContact O-CA 3.5Å; I57-R61 WeakPolarHBondContact O-CB 3.38Å; I57-R61 PolarHBondContact O-N 2.82Å; R61-K63 PolarHBondContact O-N 2.9Å; R61-K63 VanDerWaalsContact O-N 3.15Å
62L83.8Confident88.4Confident29 Ų2957.8 Ų57.815%0.15229%0.294CS..  trans-79.8100.8-177.2-172.666000111.6I57 F58 T64 W65 T69I57-L62 PolarHBondContact O-N 3.08Å; F58-L62 HydrophobicContact CD1-CD2 3.83Å; F58-L62 HydrophobicContact CE1-CD2 4.4Å; F58-L62 WeakPolarHBondContact O-CB 3.47Å; L62-T64 WeakPolarHBondContact CD1-O 3.49Å; L62-T64 WeakPolarHBondContact CG-O 3.5Å; L62-W65 HydrophobicContact CD2-CD2 4.08Å; L62-W65 HydrophobicContact CD2-CE3 4.33Å; L62-W65 HydrophobicContact CD2-CG 4.5Å; L62-W65 HydrophobicContact CD2-CZ2 4.41Å; L62-T69 HydrophobicContact CD2-CG2 4.05Å
63K82.8Confident88.4Confident198 Ų19856.9 Ų56.986%0.86128%0.279SS*.  trans-73.3-28.2176.4-64.7-176178.8-176.90114.1R61R61-K63 PolarHBondContact O-N 2.9Å; R61-K63 VanDerWaalsContact O-N 3.15Å
64T84.8Confident88.6Confident100 Ų10054.9 Ų54.961%0.61327%0.265SS*.  trans-125.2123.1-173.7540000112.2L62L62-T64 WeakPolarHBondContact CD1-O 3.49Å; L62-T64 WeakPolarHBondContact CG-O 3.5Å
65W87.8Confident88.7Confident102 Ų10254.8 Ų54.839%0.38626%0.263SS..  trans-100.6137.4-179.4-68.878.7000111.2F58 L62 F73 A147F58-W65 HydrophobicContact CB-CH2 4.18Å; F58-W65 VanDerWaalsContact O-CZ2 3.31Å; F58-W65 WeakPolarHBondContact O-CZ2 3.36Å; L62-W65 HydrophobicContact CD2-CD2 4.08Å; L62-W65 HydrophobicContact CD2-CE3 4.33Å; L62-W65 HydrophobicContact CD2-CG 4.5Å; L62-W65 HydrophobicContact CD2-CZ2 4.41Å; W65-F73 HydrophobicContact CH2-CB 4.12Å; W65-F73 HydrophobicContact CH2-CD1 4.4Å; W65-F73 HydrophobicContact CH2-CD2 4.01Å; W65-F73 AromaticContact CH2-CG 3.91Å; W65-F73 HydrophobicContact CH2-CG 3.91Å; W65-F73 HydrophobicContact CZ3-CB 3.81Å; W65-F73 HydrophobicContact CZ3-CD1 4.39Å; W65-F73 AromaticContact CZ3-CG 3.99Å; W65-F73 HydrophobicContact CZ3-CG 3.99Å; W65-A147 HydrophobicContact CB-CB 3.75Å
66N86.4Confident88.8Confident56 Ų5653.5 Ų53.530%0.29926%0.257SS..BIsolated β-bridgetrans-137.8173.8172.560.546.5000109.7S68 T69 T70N66-S68 VanDerWaalsContact C-N 3.33Å; N66-S68 PolarHBondContact O-N 3.1Å; N66-S68 PolarHBondContact OD1-N 3.32Å; N66-T69 VanDerWaalsContact CG-OG1 3.3Å; N66-T69 PolarHBondContact N-OG1 2.97Å; N66-T69 PolarHBondContact O-N 2.96Å; N66-T69 PolarHBondContact O-OG1 3.44Å; N66-T69 PolarHBondContact OD1-N 3.22Å; N66-T69 PolarHBondContact OD1-OG1 3.29Å; N66-T70 WeakPolarHBondContact O-CB 3.3Å; N66-T70 PolarHBondContact O-N 3.34Å; N66-T70 PolarHBondContact O-OG1 3.49Å
67A88.2Confident89.1Confident0 Ų049.1 Ų49.10%024%0.244CC..Hα-helixtrans-56.2-44.1-176.700000114T69 T70 Y71 G145 A150A67-T69 PolarHBondContact O-N 3.41Å; A67-T70 PolarHBondContact O-N 2.93Å; A67-Y71 HydrophobicContact CB-CE2 4.18Å; A67-Y71 WeakPolarHBondContact O-CD2 3.28Å; A67-Y71 PolarHBondContact O-N 2.9Å; A67-G145 PolarHBondContact N-O 3.49Å; A67-A150 VanDerWaalsContact CA-CB 3.44Å; A67-A150 HydrophobicContact CB-CB 3.69Å
68S83.8Confident89.5Confident10 Ų1047.7 Ų47.77%0.0724%0.237CC..Hα-helixtrans-64.5-43.8-179.2-167.70000112.5N66 T70 M72 R131N66-S68 VanDerWaalsContact C-N 3.33Å; N66-S68 PolarHBondContact O-N 3.1Å; N66-S68 PolarHBondContact OD1-N 3.32Å; S68-T70 VanDerWaalsContact C-N 3.34Å; S68-M72 WeakPolarHBondContact O-CE 3.39Å; S68-M72 VanDerWaalsContact O-CG 3.27Å; S68-M72 WeakPolarHBondContact O-CG 3.03Å; S68-M72 PolarHBondContact O-N 3.27Å; S68-M72 VanDerWaalsContact O-N 3.08Å; S68-R131 PolarHBondContact OG-NH2 3.21Å; S68-R131 VanDerWaalsContact OG-NH2 3.09Å
69T87.3Confident89.9Confident18 Ų1847.1 Ų47.111%0.1123%0.234CC..Hα-helixtrans-70-33178.446.10000112.1L62 N66 A67 M72 F73L62-T69 HydrophobicContact CD2-CG2 4.05Å; N66-T69 VanDerWaalsContact CG-OG1 3.3Å; N66-T69 PolarHBondContact N-OG1 2.97Å; N66-T69 PolarHBondContact O-N 2.96Å; N66-T69 PolarHBondContact O-OG1 3.44Å; N66-T69 PolarHBondContact OD1-N 3.22Å; N66-T69 PolarHBondContact OD1-OG1 3.29Å; A67-T69 PolarHBondContact O-N 3.41Å; T69-M72 HydrophobicContact CG2-CE 3.82Å; T69-F73 WeakPolarHBondContact O-CB 3.31Å; T69-F73 PolarHBondContact O-N 3.23Å
70T91.9Very high90.1Very high2 Ų242.5 Ų42.51%0.01221%0.213CC..Hα-helixtrans-63.8-48.9173.6-51.90000111.1N66 A67 S68 M72 F73 H74 A150 R151N66-T70 WeakPolarHBondContact O-CB 3.3Å; N66-T70 PolarHBondContact O-N 3.34Å; N66-T70 PolarHBondContact O-OG1 3.49Å; A67-T70 PolarHBondContact O-N 2.93Å; S68-T70 VanDerWaalsContact C-N 3.34Å; T70-M72 PolarHBondContact O-N 3.2Å; T70-F73 WeakPolarHBondContact O-CB 3.28Å; T70-F73 PolarHBondContact O-N 3.5Å; T70-H74 PolarHBondContact O-CD2 2.87Å; T70-H74 VanDerWaalsContact O-CD2 3.23Å; T70-H74 PolarHBondContact O-N 3.34Å; T70-A150 HydrophobicContact CG2-CB 4.01Å; T70-R151 HydrophobicContact CG2-CG 3.82Å
71Y92Very high90.5Very high7 Ų742.7 Ų42.73%0.02721%0.208CC..Hα-helixtrans-65.2-40178.1-58.6-38.7000112.6A67 F73 H74 L75 F123 C126 I127 A150 V153A67-Y71 HydrophobicContact CB-CE2 4.18Å; A67-Y71 WeakPolarHBondContact O-CD2 3.28Å; A67-Y71 PolarHBondContact O-N 2.9Å; Y71-F73 VanDerWaalsContact C-N 3.31Å; Y71-F73 PolarHBondContact O-N 3.08Å; Y71-H74 PolarHBondContact O-N 3.41Å; Y71-L75 WeakPolarHBondContact O-CB 3.26Å; Y71-L75 PolarHBondContact O-N 2.96Å; Y71-F123 AromaticContact CD1-CD1 3.94Å; Y71-F123 HydrophobicContact CD1-CD1 3.94Å; Y71-F123 HydrophobicContact CD1-CE1 4.22Å; Y71-F123 HydrophobicContact CG-CD1 4.36Å; Y71-C126 HydrophobicContact CD1-CB 4.34Å; Y71-C126 HydrophobicContact CD2-CB 3.89Å; Y71-C126 HydrophobicContact CE1-CB 4.17Å; Y71-C126 HydrophobicContact CE2-CB 3.69Å; Y71-C126 HydrophobicContact CG-CB 4.23Å; Y71-I127 HydrophobicContact CD2-CG1 3.9Å; Y71-I127 HydrophobicContact CG-CG1 4.29Å; Y71-A150 HydrophobicContact CE1-CB 3.87Å; Y71-A150 WeakPolarHBondContact CE1-O 3.31Å; Y71-V153 HydrophobicContact CE1-CB 4.19Å; Y71-V153 HydrophobicContact CE1-CG1 4.06Å
72M89.8Confident91.1Very high30 Ų3037.2 Ų37.215%0.14819%0.188CC..Hα-helixtrans-63.8-35.4175.4-71.2-178.2-5600112.6F58 S68 T69 T70 L75 A76 I127 Y306F58-M72 HydrophobicContact CE2-CB 4.37Å; F58-M72 HydrophobicContact CZ-CB 3.78Å; S68-M72 WeakPolarHBondContact O-CE 3.39Å; S68-M72 VanDerWaalsContact O-CG 3.27Å; S68-M72 WeakPolarHBondContact O-CG 3.03Å; S68-M72 PolarHBondContact O-N 3.27Å; S68-M72 VanDerWaalsContact O-N 3.08Å; T69-M72 HydrophobicContact CG2-CE 3.82Å; T70-M72 PolarHBondContact O-N 3.2Å; M72-L75 WeakPolarHBondContact O-CB 3.21Å; M72-L75 PolarHBondContact O-N 2.9Å; M72-A76 PolarHBondContact O-N 3.37Å; M72-I127 HydrophobicContact CG-CD1 4.29Å; M72-Y306 HydrophobicContact CG-CD2 4.32Å; M72-Y306 HydrophobicContact CG-CE1 4.49Å; M72-Y306 HydrophobicContact CG-CE2 4.38Å; M72-Y306 HydrophobicContact CG-CG 4.45Å; M72-Y306 HydrophobicContact SD-CD1 3.8Å; M72-Y306 HydrophobicContact SD-CD2 4.23Å; M72-Y306 HydrophobicContact SD-CE1 4.27Å; M72-Y306 HydrophobicContact SD-CG 3.8Å
73F92.6Very high91.7Very high37 Ų3735.9 Ų35.916%0.16218%0.18CC..Hα-helixtrans-62.2-48.7174.2170.9-100.4000111.5L55 F58 L59 W65 T69 T70 Y71 L75 A76 V77L55-F73 HydrophobicContact CD2-CD2 3.77Å; L55-F73 HydrophobicContact CD2-CE2 3.59Å; L55-F73 HydrophobicContact CD2-CZ 4.42Å; F58-F73 HydrophobicContact CB-CD2 3.67Å; F58-F73 HydrophobicContact CB-CE2 4.39Å; F58-F73 HydrophobicContact CD2-CB 4.15Å; F58-F73 HydrophobicContact CD2-CD2 4.06Å; F58-F73 HydrophobicContact CG-CB 4.25Å; F58-F73 HydrophobicContact CG-CD2 4.09Å; L59-F73 HydrophobicContact CD1-CE2 4.49Å; L59-F73 HydrophobicContact CD2-CE2 3.7Å; L59-F73 HydrophobicContact CD2-CZ 3.97Å; L59-F73 HydrophobicContact CG-CE2 3.97Å; W65-F73 HydrophobicContact CH2-CB 4.12Å; W65-F73 HydrophobicContact CH2-CD1 4.4Å; W65-F73 HydrophobicContact CH2-CD2 4.01Å; W65-F73 AromaticContact CH2-CG 3.91Å; W65-F73 HydrophobicContact CH2-CG 3.91Å; W65-F73 HydrophobicContact CZ3-CB 3.81Å; W65-F73 HydrophobicContact CZ3-CD1 4.39Å; W65-F73 AromaticContact CZ3-CG 3.99Å; W65-F73 HydrophobicContact CZ3-CG 3.99Å; T69-F73 WeakPolarHBondContact O-CB 3.31Å; T69-F73 PolarHBondContact O-N 3.23Å; T70-F73 WeakPolarHBondContact O-CB 3.28Å; T70-F73 PolarHBondContact O-N 3.5Å; Y71-F73 VanDerWaalsContact C-N 3.31Å; Y71-F73 PolarHBondContact O-N 3.08Å; F73-L75 VanDerWaalsContact C-N 3.3Å; F73-L75 PolarHBondContact O-N 3.03Å; F73-A76 PolarHBondContact O-N 3.09Å; F73-V77 HydrophobicContact CD1-CG2 4.41Å; F73-V77 HydrophobicContact CE1-CG2 3.95Å; F73-V77 HydrophobicContact CE2-CG2 4.2Å; F73-V77 HydrophobicContact CZ-CG2 3.84Å; F73-V77 WeakPolarHBondContact O-CG2 3.42Å; F73-V77 PolarHBondContact O-N 3.45Å
74H95.1Very high92.3Very high37 Ų3729.3 Ų29.317%0.17116%0.163CC..Hα-helixtrans-66.1-33178.3-73.5-73.7000113.2T70 Y71 V77 S78 F123 A154 W158T70-H74 PolarHBondContact O-CD2 2.87Å; T70-H74 VanDerWaalsContact O-CD2 3.23Å; T70-H74 PolarHBondContact O-N 3.34Å; Y71-H74 PolarHBondContact O-N 3.41Å; H74-V77 PolarHBondContact O-N 3.23Å; H74-S78 WeakPolarHBondContact O-CB 3.49Å; H74-S78 PolarHBondContact O-N 3.18Å; H74-F123 HydrophobicContact CB-CD1 4.46Å; H74-F123 HydrophobicContact CB-CD2 4.32Å; H74-F123 HydrophobicContact CB-CE1 3.82Å; H74-F123 HydrophobicContact CB-CE2 3.67Å; H74-F123 HydrophobicContact CB-CZ 3.41Å; H74-F123 VanDerWaalsContact CB-CZ 3.41Å; H74-A154 WeakPolarHBondContact CD2-CB 3.39Å; H74-A154 WeakPolarHBondContact NE2-CB 3.46Å; H74-W158 AromaticContact CG-NE1 3.75Å; H74-W158 AromaticContact ND1-CD1 3.86Å; H74-W158 AromaticContact ND1-NE1 3.2Å; H74-W158 PolarHBondContact ND1-NE1 3.04Å; H74-W158 VanDerWaalsContact ND1-NE1 3.2Å
75L93.2Very high92.9Very high2 Ų225 Ų251%0.0114%0.137CC..Hα-helixtrans-60-49.9171.3-168.262.4000110.8Y71 M72 F73 V77 S78 D79 S120 F123 D302 Y306Y71-L75 WeakPolarHBondContact O-CB 3.26Å; Y71-L75 PolarHBondContact O-N 2.96Å; M72-L75 WeakPolarHBondContact O-CB 3.21Å; M72-L75 PolarHBondContact O-N 2.9Å; F73-L75 VanDerWaalsContact C-N 3.3Å; F73-L75 PolarHBondContact O-N 3.03Å; L75-V77 VanDerWaalsContact C-N 3.32Å; L75-V77 PolarHBondContact O-N 2.89Å; L75-S78 WeakPolarHBondContact O-CB 3.47Å; L75-S78 PolarHBondContact O-N 2.97Å; L75-S78 VanDerWaalsContact O-N 3.14Å; L75-D79 WeakPolarHBondContact O-CB 3.31Å; L75-D79 VanDerWaalsContact O-CG 3.31Å; L75-D79 PolarHBondContact O-N 2.94Å; L75-S120 VanDerWaalsContact CD1-CA 3.45Å; L75-S120 VanDerWaalsContact CD1-OG 3.28Å; L75-S120 WeakPolarHBondContact CD1-OG 3.47Å; L75-F123 HydrophobicContact CD1-CB 4.35Å; L75-D302 HydrophobicContact CD2-CB 3.88Å; L75-D302 HydrophobicContact CG-CB 4.37Å; L75-Y306 HydrophobicContact CD2-CE2 3.69Å
76A94.1Very high93.3Very high4 Ų420.1 Ų20.13%0.03312%0.119CC..Hα-helixtrans-62.2-35.717700000113.2N51 A54 L55 M72 F73 A80N51-A76 WeakPolarHBondContact OD1-CA 3.43Å; A54-A76 HydrophobicContact CB-CB 4.4Å; L55-A76 HydrophobicContact CD2-CB 3.87Å; L55-A76 HydrophobicContact CG-CB 4.03Å; M72-A76 PolarHBondContact O-N 3.37Å; F73-A76 PolarHBondContact O-N 3.09Å; A76-A80 VanDerWaalsContact O-CB 3.28Å; A76-A80 WeakPolarHBondContact O-CB 3.49Å; A76-A80 PolarHBondContact O-N 2.85Å
77V96.5Very high93.8Very high40 Ų4020.6 Ų20.624%0.24213%0.125CC..Hα-helixtrans-62.5-49.9173170.70000110.4L55 F73 H74 L75 D79 A80 L81 W158L55-V77 HydrophobicContact CD2-CG2 3.6Å; F73-V77 HydrophobicContact CD1-CG2 4.41Å; F73-V77 HydrophobicContact CE1-CG2 3.95Å; F73-V77 HydrophobicContact CE2-CG2 4.2Å; F73-V77 HydrophobicContact CZ-CG2 3.84Å; F73-V77 WeakPolarHBondContact O-CG2 3.42Å; F73-V77 PolarHBondContact O-N 3.45Å; H74-V77 PolarHBondContact O-N 3.23Å; L75-V77 VanDerWaalsContact C-N 3.32Å; L75-V77 PolarHBondContact O-N 2.89Å; V77-D79 VanDerWaalsContact C-N 3.33Å; V77-D79 PolarHBondContact O-N 3.47Å; V77-A80 PolarHBondContact O-N 3.2Å; V77-L81 HydrophobicContact CG1-CD1 4.03Å; V77-L81 VanDerWaalsContact O-CG 3.31Å; V77-L81 WeakPolarHBondContact O-CG 3.27Å; V77-L81 PolarHBondContact O-N 2.86Å; V77-W158 HydrophobicContact CG1-CZ2 4.36Å
78S96.8Very high94.3Very high3 Ų322.5 Ų22.52%0.02114%0.135CC..Hα-helixtrans-60.3-42.2179.1176.40000112.1H74 L75 Y82 N116 C119H74-S78 WeakPolarHBondContact O-CB 3.49Å; H74-S78 PolarHBondContact O-N 3.18Å; L75-S78 WeakPolarHBondContact O-CB 3.47Å; L75-S78 PolarHBondContact O-N 2.97Å; L75-S78 VanDerWaalsContact O-N 3.14Å; S78-Y82 PolarHBondContact O-N 3.39Å; S78-Y82 VanDerWaalsContact O-N 3.16Å; S78-N116 PolarHBondContact O-ND2 3.02Å; S78-N116 VanDerWaalsContact OG-CA 3.31Å; S78-N116 WeakPolarHBondContact OG-CA 3.42Å; S78-N116 PolarHBondContact OG-ND2 3.37Å; S78-N116 VanDerWaalsContact OG-ND2 3.14Å; S78-C119 WeakPolarHBondContact OG-CB 3.4Å
79D95.9Very high94.8Very high0 Ų022.1 Ų22.10%013%0.132CC..Hα-helixtrans-67.3-42.7178-71.8-31.4000112.3N51 L75 V77 Y82 A83 N116 S299N51-D79 WeakPolarHBondContact ND2-CB 3.4Å; L75-D79 WeakPolarHBondContact O-CB 3.31Å; L75-D79 VanDerWaalsContact O-CG 3.31Å; L75-D79 PolarHBondContact O-N 2.94Å; V77-D79 VanDerWaalsContact C-N 3.33Å; V77-D79 PolarHBondContact O-N 3.47Å; D79-Y82 PolarHBondContact O-N 3.35Å; D79-A83 VanDerWaalsContact O-CB 3.23Å; D79-A83 WeakPolarHBondContact O-CB 3.24Å; D79-A83 PolarHBondContact O-N 3.09Å; D79-N116 VanDerWaalsContact CA-ND2 3.3Å; D79-N116 WeakPolarHBondContact CA-ND2 3.23Å; D79-N116 PolarHBondContact N-ND2 2.92Å; D79-N116 PolarHBondContact OD1-ND2 3.13Å; D79-S299 VanDerWaalsContact CG-CA 3.48Å; D79-S299 VanDerWaalsContact OD1-CA 3.32Å; D79-S299 WeakPolarHBondContact OD1-CA 3.5Å; D79-S299 VanDerWaalsContact OD1-CB 3.3Å; D79-S299 WeakPolarHBondContact OD1-CB 3.35Å; D79-S299 PolarHBondContact OD1-OG 2.73Å
80A95.9Very high95.2Very high19 Ų1923 Ų2316%0.15714%0.137CC..Hα-helixtrans-63.7-42.6176.600000112.1N51 L55 A76 V77 A83 A84N51-A80 HydrophobicContact CB-CB 4.14Å; L55-A80 HydrophobicContact CD1-CB 3.94Å; A76-A80 VanDerWaalsContact O-CB 3.28Å; A76-A80 WeakPolarHBondContact O-CB 3.49Å; A76-A80 PolarHBondContact O-N 2.85Å; V77-A80 PolarHBondContact O-N 3.2Å; A80-A83 PolarHBondContact O-N 2.8Å; A80-A84 VanDerWaalsContact O-CB 3.31Å; A80-A84 WeakPolarHBondContact O-CB 3.43Å; A80-A84 PolarHBondContact O-N 3.48Å
81L96.9Very high95.5Very high88 Ų8827.6 Ų27.646%0.46116%0.155SC..Hα-helixtrans-61.7-43.9177.6-73172.7000111.9V77 L112 W158V77-L81 HydrophobicContact CG1-CD1 4.03Å; V77-L81 VanDerWaalsContact O-CG 3.31Å; V77-L81 WeakPolarHBondContact O-CG 3.27Å; V77-L81 PolarHBondContact O-N 2.86Å; L81-L112 HydrophobicContact CB-CD2 4.38Å; L81-W158 HydrophobicContact CD1-CH2 4.47Å
82Y97.1Very high95.6Very high0 Ų027.8 Ų27.80%016%0.156CC..Hα-helixtrans-68.1-46.8176.1171.6-122.2000112S78 D79 A84 S85 L86 F113 N116 S296S78-Y82 PolarHBondContact O-N 3.39Å; S78-Y82 VanDerWaalsContact O-N 3.16Å; D79-Y82 PolarHBondContact O-N 3.35Å; Y82-A84 VanDerWaalsContact C-N 3.25Å; Y82-A84 PolarHBondContact O-N 3.09Å; Y82-S85 WeakPolarHBondContact O-CA 3.31Å; Y82-S85 WeakPolarHBondContact O-CB 3.08Å; Y82-S85 PolarHBondContact O-N 3.4Å; Y82-S85 PolarHBondContact O-OG 2.99Å; Y82-L86 HydrophobicContact CE1-CD1 4.3Å; Y82-L86 HydrophobicContact CE1-CD2 4.13Å; Y82-L86 HydrophobicContact CE1-CG 4.4Å; Y82-L86 HydrophobicContact CE2-CD2 3.74Å; Y82-L86 HydrophobicContact CE2-CG 4.32Å; Y82-L86 VanDerWaalsContact CZ-CD2 3.47Å; Y82-L86 PolarHBondContact O-N 3.28Å; Y82-L86 WeakPolarHBondContact OH-CD2 3.39Å; Y82-F113 HydrophobicContact CD2-CB 4.2Å; Y82-F113 HydrophobicContact CE1-CD2 4.42Å; Y82-F113 HydrophobicContact CE2-CB 3.73Å; Y82-F113 AromaticContact CE2-CD2 3.82Å; Y82-F113 HydrophobicContact CE2-CD2 3.82Å; Y82-F113 HydrophobicContact CE2-CG 4.28Å; Y82-F113 AromaticContact CZ-CD2 3.64Å; Y82-F113 WeakPolarHBondContact OH-CD2 3.48Å; Y82-N116 HydrophobicContact CD1-CB 4.37Å; Y82-N116 HydrophobicContact CG-CB 4.01Å; Y82-S296 WeakPolarHBondContact OH-CB 3.44Å; Y82-S296 PolarHBondContact OH-OG 3.37Å
83A96.6Very high95.8Very high0 Ų026.6 Ų26.60%015%0.149CC..Hα-helixtrans-59.6-36.8179.500000112.1C44 L48 D79 A80 S85 L86C44-A83 PolarHBondContact SG-O 3.08Å; L48-A83 HydrophobicContact CD2-CB 3.94Å; L48-A83 HydrophobicContact CG-CB 3.86Å; D79-A83 VanDerWaalsContact O-CB 3.23Å; D79-A83 WeakPolarHBondContact O-CB 3.24Å; D79-A83 PolarHBondContact O-N 3.09Å; A80-A83 PolarHBondContact O-N 2.8Å; A83-S85 PolarHBondContact O-N 2.83Å; A83-L86 WeakPolarHBondContact O-CB 3.5Å; A83-L86 PolarHBondContact O-N 2.99Å
84A96.8Very high95.9Very high61 Ų6127.9 Ų27.950%0.50417%0.167SC..Hα-helixtrans-64.1-22.8174.700000113.7L48 A80 Y82 P87L48-A84 HydrophobicContact CD2-CB 4.09Å; A80-A84 VanDerWaalsContact O-CB 3.31Å; A80-A84 WeakPolarHBondContact O-CB 3.43Å; A80-A84 PolarHBondContact O-N 3.48Å; Y82-A84 VanDerWaalsContact C-N 3.25Å; Y82-A84 PolarHBondContact O-N 3.09Å; A84-P87 WeakPolarHBondContact O-CD 3.17Å
85S96.7Very high95.9Very high9 Ų933.3 Ų33.36%0.06319%0.186CC..Hα-helixtrans-88.1-18.3179.279.80000113.7Y82 A83 L88Y82-S85 WeakPolarHBondContact O-CA 3.31Å; Y82-S85 WeakPolarHBondContact O-CB 3.08Å; Y82-S85 PolarHBondContact O-N 3.4Å; Y82-S85 PolarHBondContact O-OG 2.99Å; A83-S85 PolarHBondContact O-N 2.83Å; S85-L88 PolarHBondContact O-N 2.92Å
86L96.4Very high95.7Very high0 Ų034.1 Ų34.10%020%0.195CC..Hα-helixtrans-59.9-32.8-177.1-73.4178.2000115.9Y40 V43 C44 Y82 A83 L88 L89 V90Y40-L86 HydrophobicContact CD1-CD2 3.82Å; Y40-L86 HydrophobicContact CE1-CD2 4.46Å; Y40-L86 HydrophobicContact CG-CD2 4.05Å; V43-L86 HydrophobicContact CB-CD1 3.86Å; V43-L86 HydrophobicContact CG1-CD1 3.53Å; C44-L86 HydrophobicContact CB-CB 3.87Å; C44-L86 HydrophobicContact CB-CD1 4.1Å; Y82-L86 HydrophobicContact CE1-CD1 4.3Å; Y82-L86 HydrophobicContact CE1-CD2 4.13Å; Y82-L86 HydrophobicContact CE1-CG 4.4Å; Y82-L86 HydrophobicContact CE2-CD2 3.74Å; Y82-L86 HydrophobicContact CE2-CG 4.32Å; Y82-L86 VanDerWaalsContact CZ-CD2 3.47Å; Y82-L86 PolarHBondContact O-N 3.28Å; Y82-L86 WeakPolarHBondContact OH-CD2 3.39Å; A83-L86 WeakPolarHBondContact O-CB 3.5Å; A83-L86 PolarHBondContact O-N 2.99Å; L86-L88 PolarHBondContact O-N 3.36Å; L86-L88 VanDerWaalsContact O-N 3.13Å; L86-L89 WeakPolarHBondContact O-CB 3.49Å; L86-L89 PolarHBondContact O-N 3.49Å; L86-V90 WeakPolarHBondContact O-CG2 3.28Å; L86-V90 PolarHBondContact O-N 3.27Å
87P97.2Very high95.5Very high66 Ų6634.9 Ų34.943%0.42920%0.198SC..Hα-helixtrans-54.5-33.9177.8-28.936.7000113.5A84 V90 Y91A84-P87 WeakPolarHBondContact O-CD 3.17Å; P87-V90 PolarHBondContact O-N 3.01Å; P87-Y91 WeakPolarHBondContact O-CB 3.45Å; P87-Y91 PolarHBondContact O-N 3.42Å
88L96.9Very high95.4Very high39 Ų3935.2 Ų35.220%0.20420%0.197CC..Hα-helixtrans-65.3-39.4176.9-62.8168.1000111.7S85 L86 Y92 W99 F101 L105 V109S85-L88 PolarHBondContact O-N 2.92Å; L86-L88 PolarHBondContact O-N 3.36Å; L86-L88 VanDerWaalsContact O-N 3.13Å; L88-Y92 WeakPolarHBondContact O-CB 3.27Å; L88-Y92 PolarHBondContact O-N 2.94Å; L88-W99 HydrophobicContact CB-CH2 3.81Å; L88-W99 HydrophobicContact CB-CZ3 4.19Å; L88-F101 HydrophobicContact CB-CE2 4.35Å; L88-F101 HydrophobicContact CD2-CD1 3.91Å; L88-F101 HydrophobicContact CD2-CD2 3.89Å; L88-F101 HydrophobicContact CD2-CE1 3.72Å; L88-F101 HydrophobicContact CD2-CE2 3.69Å; L88-F101 HydrophobicContact CD2-CG 4Å; L88-F101 HydrophobicContact CD2-CZ 3.61Å; L88-L105 HydrophobicContact CD1-CD2 4.29Å; L88-V109 HydrophobicContact CB-CG2 4.11Å; L88-V109 HydrophobicContact CD1-CG2 3.49Å; L88-V109 VanDerWaalsContact CD1-CG2 3.49Å; L88-V109 HydrophobicContact CG-CG2 4.43Å
89L95Very high95.3Very high2 Ų235 Ų351%0.0120%0.196CC..Hα-helixtrans-72.1-39.2176.4-103.154.6000111.9Y40 L86 Y91 Y92 Y93 W99 V109Y40-L89 HydrophobicContact CD2-CB 4.09Å; Y40-L89 HydrophobicContact CD2-CD2 4.4Å; Y40-L89 HydrophobicContact CE2-CB 4.43Å; Y40-L89 HydrophobicContact CE2-CD2 4.04Å; L86-L89 WeakPolarHBondContact O-CB 3.49Å; L86-L89 PolarHBondContact O-N 3.49Å; L89-Y91 VanDerWaalsContact C-N 3.34Å; L89-Y92 PolarHBondContact O-N 3.16Å; L89-Y93 HydrophobicContact CB-CE2 4.47Å; L89-Y93 HydrophobicContact CG-CE2 4.12Å; L89-Y93 WeakPolarHBondContact O-CD2 3.31Å; L89-Y93 PolarHBondContact O-N 2.71Å; L89-W99 HydrophobicContact CD1-CZ3 4.17Å; L89-V109 HydrophobicContact CD1-CB 3.96Å; L89-V109 HydrophobicContact CD1-CG1 3.29Å; L89-V109 HydrophobicContact CD1-CG2 4.44Å; L89-V109 HydrophobicContact CD2-CG1 4.11Å; L89-V109 HydrophobicContact CG-CG1 4.26Å
90V96.8Very high95.2Very high36 Ų3638.1 Ų38.122%0.21822%0.216CC..Hα-helixtrans-57.8-50.3174.4173.60000109.8P37 L86 P87 Y92 A94P37-V90 HydrophobicContact CB-CG1 4.19Å; L86-V90 WeakPolarHBondContact O-CG2 3.28Å; L86-V90 PolarHBondContact O-N 3.27Å; P87-V90 PolarHBondContact O-N 3.01Å; V90-Y92 PolarHBondContact O-N 3.14Å; V90-A94 WeakPolarHBondContact O-CB 3.39Å; V90-A94 PolarHBondContact O-N 3.44Å
91Y96.6Very high95.1Very high100 Ų10040.3 Ų40.339%0.39222%0.222SC..Hα-helixtrans-59.8-46.6177.6-177.1-82.5000111.9P87 L89 Y93 A94 R95 P100 F101P87-Y91 WeakPolarHBondContact O-CB 3.45Å; P87-Y91 PolarHBondContact O-N 3.42Å; L89-Y91 VanDerWaalsContact C-N 3.34Å; Y91-Y93 PolarHBondContact O-N 3.28Å; Y91-A94 PolarHBondContact O-N 2.87Å; Y91-R95 HydrophobicContact CD1-CG 4.16Å; Y91-R95 HydrophobicContact CE1-CB 4.34Å; Y91-R95 HydrophobicContact CE1-CG 3.66Å; Y91-R95 HydrophobicContact CE2-CG 4.18Å; Y91-R95 WeakPolarHBondContact O-CB 3.37Å; Y91-R95 WeakPolarHBondContact O-CG 3.42Å; Y91-R95 PolarHBondContact O-N 3.03Å; Y91-P100 HydrophobicContact CD1-CG 4.13Å; Y91-P100 HydrophobicContact CE1-CG 3.42Å; Y91-P100 VanDerWaalsContact CE1-CG 3.42Å; Y91-F101 AromaticContact CD1-CE2 3.72Å; Y91-F101 HydrophobicContact CD1-CE2 3.72Å; Y91-F101 AromaticContact CD1-CZ 3.75Å; Y91-F101 HydrophobicContact CD1-CZ 3.75Å; Y91-F101 HydrophobicContact CE1-CE2 4.46Å; Y91-F101 HydrophobicContact CE1-CZ 4.35Å; Y91-F101 HydrophobicContact CG-CE2 4.23Å; Y91-F101 AromaticContact CG-CZ 3.98Å; Y91-F101 HydrophobicContact CG-CZ 3.98Å
92Y95.3Very high95Very high10 Ų1038.9 Ų38.94%0.03922%0.219CC..Hα-helixtrans-55.2-52.7-180171.5-111.5000113L88 L89 V90 R95 D97 W99 C183L88-Y92 WeakPolarHBondContact O-CB 3.27Å; L88-Y92 PolarHBondContact O-N 2.94Å; L89-Y92 PolarHBondContact O-N 3.16Å; V90-Y92 PolarHBondContact O-N 3.14Å; Y92-R95 PolarHBondContact O-N 2.97Å; Y92-D97 HydrophobicContact CE1-CB 4.44Å; Y92-D97 HydrophobicContact CE2-CB 4.12Å; Y92-D97 WeakPolarHBondContact CE2-O 3.5Å; Y92-D97 PolarHBondContact O-N 3.17Å; Y92-W99 HydrophobicContact CD2-CB 3.71Å; Y92-W99 HydrophobicContact CD2-CD2 4.42Å; Y92-W99 AromaticContact CD2-CE3 3.7Å; Y92-W99 HydrophobicContact CD2-CE3 3.7Å; Y92-W99 HydrophobicContact CD2-CG 4.48Å; Y92-W99 HydrophobicContact CE2-CB 3.83Å; Y92-W99 HydrophobicContact CE2-CE3 4.48Å; Y92-W99 AromaticContact CG-CE3 3.82Å; Y92-W99 HydrophobicContact CG-CE3 3.82Å; Y92-W99 HydrophobicContact CG-CZ3 4.42Å; Y92-C183 HydrophobicContact CE2-CB 4.19Å; Y92-C183 PolarHBondContact OH-N 2.79Å; Y92-C183 PolarHBondContact OH-O 2.99Å
93Y94.6Very high94.9Very high5 Ų541.5 Ų41.52%0.0224%0.235CC..Hα-helixtrans-73.6-32.3-178.9-69.7-64.1000111.9Y33 L36 Y40 L89 Y91 R95 G96 D97 D185 R292Y33-Y93 WeakPolarHBondContact CD1-O 3.31Å; L36-Y93 HydrophobicContact CB-CD1 4.32Å; L36-Y93 HydrophobicContact CB-CD2 3.68Å; L36-Y93 HydrophobicContact CB-CE2 4.18Å; L36-Y93 HydrophobicContact CB-CG 3.78Å; L36-Y93 HydrophobicContact CD1-CD1 3.56Å; L36-Y93 HydrophobicContact CD1-CD2 3.95Å; L36-Y93 HydrophobicContact CD1-CE1 3.35Å; L36-Y93 HydrophobicContact CD1-CE2 3.79Å; L36-Y93 HydrophobicContact CD1-CG 3.87Å; L36-Y93 VanDerWaalsContact CD1-CZ 3.48Å; L36-Y93 HydrophobicContact CG-CD2 4.46Å; L36-Y93 HydrophobicContact CG-CG 4.49Å; Y40-Y93 HydrophobicContact CD2-CD2 4.16Å; Y40-Y93 HydrophobicContact CD2-CE2 4.29Å; Y40-Y93 AromaticContact CE2-CD2 3.96Å; Y40-Y93 HydrophobicContact CE2-CD2 3.96Å; Y40-Y93 AromaticContact CE2-CE2 3.67Å; Y40-Y93 HydrophobicContact CE2-CE2 3.67Å; L89-Y93 HydrophobicContact CB-CE2 4.47Å; L89-Y93 HydrophobicContact CG-CE2 4.12Å; L89-Y93 WeakPolarHBondContact O-CD2 3.31Å; L89-Y93 PolarHBondContact O-N 2.71Å; Y91-Y93 PolarHBondContact O-N 3.28Å; Y93-R95 PolarHBondContact O-N 3.45Å; Y93-G96 PolarHBondContact O-N 2.79Å; Y93-D97 WeakPolarHBondContact CD1-OD1 3.3Å; Y93-D185 PolarHBondContact OH-OD2 3.34Å; Y93-R292 PolarHBondContact OH-NH1 3.39Å; Y93-R292 PolarHBondContact OH-NH2 2.99Å
94A94.6Very high94.9Very high65 Ų6546.5 Ų46.554%0.53727%0.266SS..Hα-helixtrans-66.9-25175.200000112.8P37 V90 Y91P37-A94 HydrophobicContact CB-CB 4.34Å; P37-A94 HydrophobicContact CG-CB 4.16Å; V90-A94 WeakPolarHBondContact O-CB 3.39Å; V90-A94 PolarHBondContact O-N 3.44Å; Y91-A94 PolarHBondContact O-N 2.87Å
95R93.6Very high94.8Very high151 Ų15146.5 Ų46.557%0.5726%0.257SS*.THydrogen-bonded Turntrans-95.118.7177-70.3-70.4-66.1-178.5-3.5113.9Y91 Y92 Y93 H98Y91-R95 HydrophobicContact CD1-CG 4.16Å; Y91-R95 HydrophobicContact CE1-CB 4.34Å; Y91-R95 HydrophobicContact CE1-CG 3.66Å; Y91-R95 HydrophobicContact CE2-CG 4.18Å; Y91-R95 WeakPolarHBondContact O-CB 3.37Å; Y91-R95 WeakPolarHBondContact O-CG 3.42Å; Y91-R95 PolarHBondContact O-N 3.03Å; Y92-R95 PolarHBondContact O-N 2.97Å; Y93-R95 PolarHBondContact O-N 3.45Å; R95-H98 HydrophobicContact CB-CB 4.3Å
96G89.8Confident94.8Very high18 Ų1846 Ų4619%0.18625%0.254CS..THydrogen-bonded Turntrans68.248.1174.500000113Y93 H98 R180Y93-G96 PolarHBondContact O-N 2.79Å; G96-H98 VanDerWaalsContact C-N 3.28Å; G96-H98 PolarHBondContact O-N 3.47Å; G96-R180 PolarHBondContact O-NH1 3.16Å; G96-R180 VanDerWaalsContact O-NH1 3.11Å
97D90.8Very high94.7Very high21 Ų2148.8 Ų48.811%0.11227%0.266CS..SBendtrans62.427.2-177.8-67.6-14.9000114.6K32 Y33 Y92 Y93 T182K32-D97 WeakPolarHBondContact CE-OD2 3.24Å; K32-D97 IonicContact NZ-OD2 3.03Å; K32-D97 PolarHBondContact NZ-OD2 3.22Å; Y33-D97 HydrophobicContact CE1-CB 4.33Å; Y92-D97 HydrophobicContact CE1-CB 4.44Å; Y92-D97 HydrophobicContact CE2-CB 4.12Å; Y92-D97 WeakPolarHBondContact CE2-O 3.5Å; Y92-D97 PolarHBondContact O-N 3.17Å; Y93-D97 WeakPolarHBondContact CD1-OD1 3.3Å; D97-T182 WeakPolarHBondContact O-CG2 3.48Å
98H93.1Very high94.7Very high46 Ų4649.2 Ų49.221%0.21326%0.264CS..  trans-93.6117.4171.4-172.972.4000111R95 G96 P100R95-H98 HydrophobicContact CB-CB 4.3Å; G96-H98 VanDerWaalsContact C-N 3.28Å; G96-H98 PolarHBondContact O-N 3.47Å; H98-P100 WeakPolarHBondContact O-CD 3.4Å
99W95Very high94.7Very high0 Ų047.5 Ų47.50%026%0.255CS..  trans-101.793.7178.2-174.8-92.6000110.2L88 L89 Y92 F101 S102 L105 C106 V109 V181 C183L88-W99 HydrophobicContact CB-CH2 3.81Å; L88-W99 HydrophobicContact CB-CZ3 4.19Å; L89-W99 HydrophobicContact CD1-CZ3 4.17Å; Y92-W99 HydrophobicContact CD2-CB 3.71Å; Y92-W99 HydrophobicContact CD2-CD2 4.42Å; Y92-W99 AromaticContact CD2-CE3 3.7Å; Y92-W99 HydrophobicContact CD2-CE3 3.7Å; Y92-W99 HydrophobicContact CD2-CG 4.48Å; Y92-W99 HydrophobicContact CE2-CB 3.83Å; Y92-W99 HydrophobicContact CE2-CE3 4.48Å; Y92-W99 AromaticContact CG-CE3 3.82Å; Y92-W99 HydrophobicContact CG-CE3 3.82Å; Y92-W99 HydrophobicContact CG-CZ3 4.42Å; W99-F101 VanDerWaalsContact C-N 3.25Å; W99-F101 HydrophobicContact CD2-CB 4.45Å; W99-F101 AromaticContact CD2-CD2 3.94Å; W99-F101 HydrophobicContact CD2-CD2 3.94Å; W99-F101 AromaticContact CE2-CD2 3.81Å; W99-F101 HydrophobicContact CE3-CD2 4.03Å; W99-F101 AromaticContact CH2-CD2 3.9Å; W99-F101 HydrophobicContact CH2-CD2 3.9Å; W99-F101 HydrophobicContact CZ2-CB 3.78Å; W99-F101 AromaticContact CZ2-CD2 3.78Å; W99-F101 HydrophobicContact CZ2-CD2 3.78Å; W99-F101 HydrophobicContact CZ2-CG 4.2Å; W99-F101 HydrophobicContact CZ3-CD2 4.02Å; W99-F101 HydrophobicContact CZ3-CE2 4.49Å; W99-F101 PolarHBondContact NE1-O 3Å; W99-F101 VanDerWaalsContact NE1-O 3.1Å; W99-F101 PolarHBondContact O-N 2.78Å; W99-S102 PolarHBondContact NE1-O 3.21Å; W99-L105 HydrophobicContact CZ2-CB 3.84Å; W99-C106 HydrophobicContact CD2-CB 4.4Å; W99-C106 VanDerWaalsContact CZ2-CA 3.46Å; W99-C106 HydrophobicContact CZ2-CB 3.9Å; W99-V109 HydrophobicContact CH2-CG2 4.26Å; W99-V181 HydrophobicContact CB-CG1 4.43Å; W99-V181 PolarHBondContact N-O 3.3Å; W99-V181 WeakPolarHBondContact O-CB 3.46Å; W99-C183 HydrophobicContact CB-CB 3.93Å; W99-C183 HydrophobicContact CD2-CB 3.62Å; W99-C183 HydrophobicContact CE3-CB 3.77Å; W99-C183 HydrophobicContact CG-CB 3.68Å
100P93.9Very high94.6Very high64 Ų6447.8 Ų47.842%0.41626%0.256SS..  trans-81-7179.636.9-40.6000113Y91 H98Y91-P100 HydrophobicContact CD1-CG 4.13Å; Y91-P100 HydrophobicContact CE1-CG 3.42Å; Y91-P100 VanDerWaalsContact CE1-CG 3.42Å; H98-P100 WeakPolarHBondContact O-CD 3.4Å
101F94.8Very high94.6Very high66 Ų6647.3 Ų47.329%0.28925%0.251SS..SBendtrans-83.2176.5-178.3-45.1-75.4000111.2L88 Y91 W99 L105L88-F101 HydrophobicContact CB-CE2 4.35Å; L88-F101 HydrophobicContact CD2-CD1 3.91Å; L88-F101 HydrophobicContact CD2-CD2 3.89Å; L88-F101 HydrophobicContact CD2-CE1 3.72Å; L88-F101 HydrophobicContact CD2-CE2 3.69Å; L88-F101 HydrophobicContact CD2-CG 4Å; L88-F101 HydrophobicContact CD2-CZ 3.61Å; Y91-F101 AromaticContact CD1-CE2 3.72Å; Y91-F101 HydrophobicContact CD1-CE2 3.72Å; Y91-F101 AromaticContact CD1-CZ 3.75Å; Y91-F101 HydrophobicContact CD1-CZ 3.75Å; Y91-F101 HydrophobicContact CE1-CE2 4.46Å; Y91-F101 HydrophobicContact CE1-CZ 4.35Å; Y91-F101 HydrophobicContact CG-CE2 4.23Å; Y91-F101 AromaticContact CG-CZ 3.98Å; Y91-F101 HydrophobicContact CG-CZ 3.98Å; W99-F101 VanDerWaalsContact C-N 3.25Å; W99-F101 HydrophobicContact CD2-CB 4.45Å; W99-F101 AromaticContact CD2-CD2 3.94Å; W99-F101 HydrophobicContact CD2-CD2 3.94Å; W99-F101 AromaticContact CE2-CD2 3.81Å; W99-F101 HydrophobicContact CE3-CD2 4.03Å; W99-F101 AromaticContact CH2-CD2 3.9Å; W99-F101 HydrophobicContact CH2-CD2 3.9Å; W99-F101 HydrophobicContact CZ2-CB 3.78Å; W99-F101 AromaticContact CZ2-CD2 3.78Å; W99-F101 HydrophobicContact CZ2-CD2 3.78Å; W99-F101 HydrophobicContact CZ2-CG 4.2Å; W99-F101 HydrophobicContact CZ3-CD2 4.02Å; W99-F101 HydrophobicContact CZ3-CE2 4.49Å; W99-F101 PolarHBondContact NE1-O 3Å; W99-F101 VanDerWaalsContact NE1-O 3.1Å; W99-F101 PolarHBondContact O-N 2.78Å; F101-L105 HydrophobicContact CB-CB 4.28Å; F101-L105 HydrophobicContact CB-CD1 3.89Å
102S94.4Very high94.6Very high57 Ų5744 Ų4440%0.39924%0.24SC..  trans-69.1156.2178.568.80000112.9W99 V104 L105 C106W99-S102 PolarHBondContact NE1-O 3.21Å; S102-V104 PolarHBondContact O-N 2.89Å; S102-L105 PolarHBondContact O-N 3.04Å; S102-L105 VanDerWaalsContact O-N 3.17Å; S102-L105 WeakPolarHBondContact OG-CG 3.39Å; S102-L105 PolarHBondContact OG-N 2.98Å; S102-C106 PolarHBondContact O-N 3.11Å; S102-C106 VanDerWaalsContact O-N 3.14Å
103T94.3Very high94.6Very high55 Ų5544.3 Ų44.334%0.33724%0.242SC..Hα-helixtrans-58.4-31.7169.3-48.40000111.7C106 K107 T174T103-C106 WeakPolarHBondContact O-CB 3.28Å; T103-C106 PolarHBondContact O-N 3.42Å; T103-K107 HydrophobicContact CG2-CD 4.46Å; T103-K107 WeakPolarHBondContact O-CG 3.24Å; T103-K107 PolarHBondContact O-N 3.45Å; T103-T174 HydrophobicContact CG2-CG2 4.12Å; T103-T174 WeakPolarHBondContact CG2-OG1 3.38Å; T103-T174 PolarHBondContact OG1-OG1 3.28Å
104V95.6Very high94.7Very high106 Ų10644.6 Ų44.664%0.64224%0.243SC*.Hα-helixtrans-61.3-46.6175.9178.30000110.7S102 C106 K107 L108S102-V104 PolarHBondContact O-N 2.89Å; V104-C106 VanDerWaalsContact C-N 3.34Å; V104-C106 PolarHBondContact O-N 3.3Å; V104-K107 PolarHBondContact O-N 3.45Å; V104-L108 WeakPolarHBondContact O-CB 3.49Å; V104-L108 PolarHBondContact O-N 2.84Å
105L96Very high94.7Very high60 Ų6041.7 Ų41.731%0.31422%0.218SC..Hα-helixtrans-65.5-38.2176.9-72.8170.7000111.6L88 W99 F101 S102 K107 L108 V109L88-L105 HydrophobicContact CD1-CD2 4.29Å; W99-L105 HydrophobicContact CZ2-CB 3.84Å; F101-L105 HydrophobicContact CB-CB 4.28Å; F101-L105 HydrophobicContact CB-CD1 3.89Å; S102-L105 PolarHBondContact O-N 3.04Å; S102-L105 VanDerWaalsContact O-N 3.17Å; S102-L105 WeakPolarHBondContact OG-CG 3.39Å; S102-L105 PolarHBondContact OG-N 2.98Å; L105-K107 PolarHBondContact O-N 3.3Å; L105-L108 HydrophobicContact CD2-CD2 4.41Å; L105-L108 PolarHBondContact O-N 3.39Å; L105-V109 WeakPolarHBondContact O-CG2 3.49Å; L105-V109 PolarHBondContact O-N 2.83Å
106C95.8Very high94.9Very high0 Ų034.7 Ų34.70%019%0.192CC..Hα-helixtrans-57.2-52.7174.8172.80000110.4W99 S102 T103 V104 L108 V109 R110 T174 C183W99-C106 HydrophobicContact CD2-CB 4.4Å; W99-C106 VanDerWaalsContact CZ2-CA 3.46Å; W99-C106 HydrophobicContact CZ2-CB 3.9Å; S102-C106 PolarHBondContact O-N 3.11Å; S102-C106 VanDerWaalsContact O-N 3.14Å; T103-C106 WeakPolarHBondContact O-CB 3.28Å; T103-C106 PolarHBondContact O-N 3.42Å; V104-C106 VanDerWaalsContact C-N 3.34Å; V104-C106 PolarHBondContact O-N 3.3Å; C106-L108 VanDerWaalsContact C-N 3.34Å; C106-L108 PolarHBondContact O-N 3.22Å; C106-V109 PolarHBondContact O-N 3.45Å; C106-R110 WeakPolarHBondContact O-CG 3.33Å; C106-R110 PolarHBondContact O-N 3.4Å; C106-T174 HydrophobicContact CB-CG2 3.77Å; C106-C183 VanDerWaalsContact CA-SG 3.6Å; C106-C183 HydrophobicContact CB-CB 3.91Å; C106-C183 WeakPolarHBondContact CB-SG 3.5Å; C106-C183 VanDerWaalsContact SG-CA 3.57Å; C106-C183 WeakPolarHBondContact SG-CB 3.26Å; C106-C183 CovalentContact SG-SG 2.03Å; C106-C183 PolarHBondContact SG-SG 3.44Å
107K95.8Very high95.1Very high58 Ų5833.9 Ų33.925%0.25218%0.184SC..Hα-helixtrans-57.3-45.7176.6-70174.4179.9-133.30111.9T103 V104 L105 R110 F111 L169 V172T103-K107 HydrophobicContact CG2-CD 4.46Å; T103-K107 WeakPolarHBondContact O-CG 3.24Å; T103-K107 PolarHBondContact O-N 3.45Å; V104-K107 PolarHBondContact O-N 3.45Å; L105-K107 PolarHBondContact O-N 3.3Å; K107-R110 PolarHBondContact O-N 3.03Å; K107-F111 VanDerWaalsContact O-CB 3.24Å; K107-F111 WeakPolarHBondContact O-CB 3.23Å; K107-F111 PolarHBondContact O-N 2.91Å; K107-L169 HydrophobicContact CB-CD2 3.94Å; K107-L169 VanDerWaalsContact CD-O 3.29Å; K107-L169 WeakPolarHBondContact CD-O 3.35Å; K107-L169 WeakPolarHBondContact CE-O 3.32Å; K107-L169 PolarHBondContact NZ-O 3.49Å; K107-V172 WeakPolarHBondContact CE-O 3.46Å; K107-V172 HydrophobicContact CG-CB 4.24Å; K107-V172 HydrophobicContact CG-CG1 4.1Å; K107-V172 WeakPolarHBondContact CG-O 3.46Å
108L96.2Very high95.4Very high75 Ų7533 Ų3339%0.39318%0.179SC..Hα-helixtrans-62.1-45.4-178.7-178.262.8000112V104 L105 C106 R110 F111 L112V104-L108 WeakPolarHBondContact O-CB 3.49Å; V104-L108 PolarHBondContact O-N 2.84Å; L105-L108 HydrophobicContact CD2-CD2 4.41Å; L105-L108 PolarHBondContact O-N 3.39Å; C106-L108 VanDerWaalsContact C-N 3.34Å; C106-L108 PolarHBondContact O-N 3.22Å; L108-R110 PolarHBondContact O-N 2.88Å; L108-F111 PolarHBondContact O-N 2.85Å; L108-L112 HydrophobicContact CD1-CD1 4.22Å; L108-L112 HydrophobicContact CD1-CG 4.19Å; L108-L112 HydrophobicContact CG-CD1 4.03Å; L108-L112 HydrophobicContact CG-CG 4.41Å; L108-L112 WeakPolarHBondContact O-CB 3.18Å; L108-L112 WeakPolarHBondContact O-CG 3.5Å; L108-L112 PolarHBondContact O-N 3.46Å
109V96.1Very high95.5Very high2 Ų230.8 Ų30.81%0.01217%0.169CC..Hα-helixtrans-67.3-40.1-179.4-175.10000111.4L88 L89 W99 L105 C106 F111 L112 F113L88-V109 HydrophobicContact CB-CG2 4.11Å; L88-V109 HydrophobicContact CD1-CG2 3.49Å; L88-V109 VanDerWaalsContact CD1-CG2 3.49Å; L88-V109 HydrophobicContact CG-CG2 4.43Å; L89-V109 HydrophobicContact CD1-CB 3.96Å; L89-V109 HydrophobicContact CD1-CG1 3.29Å; L89-V109 HydrophobicContact CD1-CG2 4.44Å; L89-V109 HydrophobicContact CD2-CG1 4.11Å; L89-V109 HydrophobicContact CG-CG1 4.26Å; W99-V109 HydrophobicContact CH2-CG2 4.26Å; L105-V109 WeakPolarHBondContact O-CG2 3.49Å; L105-V109 PolarHBondContact O-N 2.83Å; C106-V109 PolarHBondContact O-N 3.45Å; V109-F111 VanDerWaalsContact C-N 3.33Å; V109-F111 PolarHBondContact O-N 3.19Å; V109-L112 PolarHBondContact O-N 3.3Å; V109-F113 PolarHBondContact O-N 2.95Å
110R94.9Very high95.5Very high8 Ų830.8 Ų30.83%0.0317%0.169CC..Hα-helixtrans-63.3-41.3174.3-59.3-43.2178.2171.96.2111.7C106 K107 L108 F113 Y114 V168 V172 C183 H184 D185C106-R110 WeakPolarHBondContact O-CG 3.33Å; C106-R110 PolarHBondContact O-N 3.4Å; K107-R110 PolarHBondContact O-N 3.03Å; L108-R110 PolarHBondContact O-N 2.88Å; R110-F113 PolarHBondContact O-N 3.21Å; R110-Y114 VanDerWaalsContact O-CD2 3.25Å; R110-Y114 WeakPolarHBondContact O-CD2 3.32Å; R110-Y114 PolarHBondContact O-N 3.01Å; R110-V168 HydrophobicContact CB-CG1 4.21Å; R110-V172 HydrophobicContact CB-CG1 4.17Å; R110-V172 HydrophobicContact CB-CG2 3.84Å; R110-V172 HydrophobicContact CG-CB 4.46Å; R110-V172 HydrophobicContact CG-CG1 3.67Å; R110-V172 HydrophobicContact CG-CG2 3.97Å; R110-C183 PolarHBondContact NH2-O 3.47Å; R110-H184 PolarHBondContact NE-O 2.88Å; R110-D185 IonicContact CZ-OD1 2.84Å; R110-D185 IonicContact NE-OD1 3.82Å; R110-D185 IonicContact NH1-OD1 2.61Å; R110-D185 PolarHBondContact NH1-OD1 2.92Å; R110-D185 IonicContact NH2-OD1 3.68Å; R110-D185 PolarHBondContact NH2-OD1 3.39Å; R110-D185 VanDerWaalsContact NH2-OD1 3.1Å; R110-D185 IonicContact NH2-OD2 3.34Å
111F96.1Very high95.6Very high26 Ų2627.8 Ų27.811%0.11415%0.149CC..Hα-helixtrans-63.1-45.1176.4175.8-95.8000112.2K107 L108 V109 F113 Y114 T115 L162 Q165 L169K107-F111 VanDerWaalsContact O-CB 3.24Å; K107-F111 WeakPolarHBondContact O-CB 3.23Å; K107-F111 PolarHBondContact O-N 2.91Å; L108-F111 PolarHBondContact O-N 2.85Å; V109-F111 VanDerWaalsContact C-N 3.33Å; V109-F111 PolarHBondContact O-N 3.19Å; F111-F113 PolarHBondContact O-N 3.4Å; F111-Y114 PolarHBondContact O-N 3.16Å; F111-T115 WeakPolarHBondContact CE1-OG1 3.33Å; F111-T115 WeakPolarHBondContact CZ-OG1 3.46Å; F111-T115 VanDerWaalsContact O-CB 3.24Å; F111-T115 WeakPolarHBondContact O-CB 3.38Å; F111-T115 PolarHBondContact O-N 3.15Å; F111-T115 PolarHBondContact O-OG1 3.4Å; F111-L162 HydrophobicContact CE1-CD2 3.97Å; F111-L162 HydrophobicContact CZ-CD2 3.61Å; F111-Q165 HydrophobicContact CD2-CB 4.05Å; F111-Q165 WeakPolarHBondContact CD2-O 3.21Å; F111-Q165 HydrophobicContact CE2-CB 3.7Å; F111-L169 HydrophobicContact CB-CD2 3.68Å; F111-L169 HydrophobicContact CB-CG 4.4Å; F111-L169 HydrophobicContact CD2-CD1 4.31Å; F111-L169 HydrophobicContact CD2-CD2 4.13Å; F111-L169 HydrophobicContact CD2-CG 3.95Å; F111-L169 HydrophobicContact CG-CD2 3.96Å; F111-L169 HydrophobicContact CG-CG 4.29Å
112L96.7Very high95.6Very high32 Ų3225.6 Ų25.617%0.16814%0.14CC..Hα-helixtrans-63.9-39.2177.9-74.4173.3000112L81 L108 V109 T115 N116L81-L112 HydrophobicContact CB-CD2 4.38Å; L108-L112 HydrophobicContact CD1-CD1 4.22Å; L108-L112 HydrophobicContact CD1-CG 4.19Å; L108-L112 HydrophobicContact CG-CD1 4.03Å; L108-L112 HydrophobicContact CG-CG 4.41Å; L108-L112 WeakPolarHBondContact O-CB 3.18Å; L108-L112 WeakPolarHBondContact O-CG 3.5Å; L108-L112 PolarHBondContact O-N 3.46Å; V109-L112 PolarHBondContact O-N 3.3Å; L112-T115 PolarHBondContact O-N 3.31Å; L112-N116 VanDerWaalsContact O-CB 3.22Å; L112-N116 WeakPolarHBondContact O-CB 3.23Å; L112-N116 PolarHBondContact O-N 2.94Å
113F95.4Very high95.6Very high16 Ų1622.9 Ų22.97%0.0712%0.121CC..Hα-helixtrans-56.7-53.1173.6170-105.4000112Y82 V109 R110 F111 N116 L117 F261 A295Y82-F113 HydrophobicContact CD2-CB 4.2Å; Y82-F113 HydrophobicContact CE1-CD2 4.42Å; Y82-F113 HydrophobicContact CE2-CB 3.73Å; Y82-F113 AromaticContact CE2-CD2 3.82Å; Y82-F113 HydrophobicContact CE2-CD2 3.82Å; Y82-F113 HydrophobicContact CE2-CG 4.28Å; Y82-F113 AromaticContact CZ-CD2 3.64Å; Y82-F113 WeakPolarHBondContact OH-CD2 3.48Å; V109-F113 PolarHBondContact O-N 2.95Å; R110-F113 PolarHBondContact O-N 3.21Å; F111-F113 PolarHBondContact O-N 3.4Å; F113-N116 PolarHBondContact O-N 3.31Å; F113-L117 WeakPolarHBondContact O-CB 3.48Å; F113-L117 PolarHBondContact O-N 3.22Å; F113-F261 HydrophobicContact CE1-CE1 4.1Å; F113-F261 HydrophobicContact CE1-CE2 4.2Å; F113-F261 AromaticContact CE1-CZ 3.6Å; F113-F261 HydrophobicContact CE1-CZ 3.6Å; F113-F261 HydrophobicContact CZ-CE1 4.09Å; F113-F261 AromaticContact CZ-CE2 3.98Å; F113-F261 HydrophobicContact CZ-CE2 3.98Å; F113-F261 AromaticContact CZ-CZ 3.71Å; F113-F261 HydrophobicContact CZ-CZ 3.71Å; F113-A295 HydrophobicContact CE2-CB 4.36Å; F113-A295 HydrophobicContact CZ-CB 4.33Å
114Y95.1Very high95.4Very high10 Ų1020.3 Ų20.34%0.03911%0.105CC..Hα-helixtrans-71.5-36.2-178.8-71.5-62.5000113R110 F111 N116 L117 Y118 Q165 V168 F261R110-Y114 VanDerWaalsContact O-CD2 3.25Å; R110-Y114 WeakPolarHBondContact O-CD2 3.32Å; R110-Y114 PolarHBondContact O-N 3.01Å; F111-Y114 PolarHBondContact O-N 3.16Å; Y114-N116 VanDerWaalsContact C-N 3.3Å; Y114-N116 PolarHBondContact O-N 2.93Å; Y114-L117 HydrophobicContact CD1-CD2 4.26Å; Y114-L117 PolarHBondContact O-N 2.92Å; Y114-Y118 HydrophobicContact CD1-CE2 4.23Å; Y114-Y118 WeakPolarHBondContact O-CD2 3.14Å; Y114-Y118 PolarHBondContact O-N 2.88Å; Y114-Q165 VanDerWaalsContact CB-NE2 3.29Å; Y114-V168 HydrophobicContact CD2-CG1 4.07Å; Y114-V168 HydrophobicContact CD2-CG2 4.01Å; Y114-V168 HydrophobicContact CE2-CG1 4.44Å; Y114-F261 HydrophobicContact CE1-CE1 4.35Å; Y114-F261 HydrophobicContact CE1-CZ 4.11Å
115T96.4Very high95.3Very high5 Ų515.7 Ų15.73%0.0318%0.078CC..Hα-helixtrans-60.1-44.8174.4-62.50000110.1F111 L112 C119 W158 V161 L162F111-T115 WeakPolarHBondContact CE1-OG1 3.33Å; F111-T115 WeakPolarHBondContact CZ-OG1 3.46Å; F111-T115 VanDerWaalsContact O-CB 3.24Å; F111-T115 WeakPolarHBondContact O-CB 3.38Å; F111-T115 PolarHBondContact O-N 3.15Å; F111-T115 PolarHBondContact O-OG1 3.4Å; L112-T115 PolarHBondContact O-N 3.31Å; T115-C119 WeakPolarHBondContact O-CB 3.48Å; T115-C119 PolarHBondContact O-N 3.35Å; T115-C119 PolarHBondContact O-SG 3.07Å; T115-W158 HydrophobicContact CG2-CZ3 3.94Å; T115-V161 HydrophobicContact CG2-CG1 3.97Å; T115-L162 HydrophobicContact CG2-CD2 4.01Å
116N96.4Very high95.2Very high4 Ų414 Ų142%0.0217%0.07CC..Hα-helixtrans-60.8-53.4175.9174.6-92.5000111.9S78 D79 Y82 L112 F113 Y114 Y118 C119 S120 S299S78-N116 PolarHBondContact O-ND2 3.02Å; S78-N116 VanDerWaalsContact OG-CA 3.31Å; S78-N116 WeakPolarHBondContact OG-CA 3.42Å; S78-N116 PolarHBondContact OG-ND2 3.37Å; S78-N116 VanDerWaalsContact OG-ND2 3.14Å; D79-N116 VanDerWaalsContact CA-ND2 3.3Å; D79-N116 WeakPolarHBondContact CA-ND2 3.23Å; D79-N116 PolarHBondContact N-ND2 2.92Å; D79-N116 PolarHBondContact OD1-ND2 3.13Å; Y82-N116 HydrophobicContact CD1-CB 4.37Å; Y82-N116 HydrophobicContact CG-CB 4.01Å; L112-N116 VanDerWaalsContact O-CB 3.22Å; L112-N116 WeakPolarHBondContact O-CB 3.23Å; L112-N116 PolarHBondContact O-N 2.94Å; F113-N116 PolarHBondContact O-N 3.31Å; Y114-N116 VanDerWaalsContact C-N 3.3Å; Y114-N116 PolarHBondContact O-N 2.93Å; N116-Y118 VanDerWaalsContact C-N 3.32Å; N116-Y118 PolarHBondContact O-N 3.14Å; N116-C119 PolarHBondContact O-N 2.85Å; N116-S120 WeakPolarHBondContact O-CB 3.42Å; N116-S120 PolarHBondContact O-N 3.26Å; N116-S120 PolarHBondContact O-OG 2.85Å; N116-S299 PolarHBondContact OD1-OG 3.2Å
117L94.9Very high94.8Very high1 Ų114 Ų141%0.0057%0.07CC..Hα-helixtrans-50.4-50.8179.8-177.868.7000112.3F113 Y114 S120 I121 F258 F261 A295F113-L117 WeakPolarHBondContact O-CB 3.48Å; F113-L117 PolarHBondContact O-N 3.22Å; Y114-L117 HydrophobicContact CD1-CD2 4.26Å; Y114-L117 PolarHBondContact O-N 2.92Å; L117-S120 PolarHBondContact O-N 3.25Å; L117-I121 HydrophobicContact CD1-CD1 4.48Å; L117-I121 HydrophobicContact CG-CD1 4.27Å; L117-I121 WeakPolarHBondContact O-CD1 3.45Å; L117-I121 WeakPolarHBondContact O-CG1 3.33Å; L117-I121 PolarHBondContact O-N 3.28Å; L117-I121 VanDerWaalsContact O-N 3.13Å; L117-F258 HydrophobicContact CD1-CD1 3.5Å; L117-F258 VanDerWaalsContact CD1-CD1 3.5Å; L117-F258 HydrophobicContact CD1-CE1 3.79Å; L117-F261 HydrophobicContact CD2-CD1 3.84Å; L117-F261 HydrophobicContact CD2-CE1 3.5Å; L117-F261 VanDerWaalsContact CD2-CE1 3.5Å; L117-A295 HydrophobicContact CD1-CB 4.22Å
118Y96.2Very high94.5Very high2 Ų211.2 Ų11.21%0.0086%0.058CC..Hα-helixtrans-79.4-32.7-176.3-66.7-55.2000113.5Y114 N116 S120 I121 L122 Q165 L206 H262 R265Y114-Y118 HydrophobicContact CD1-CE2 4.23Å; Y114-Y118 WeakPolarHBondContact O-CD2 3.14Å; Y114-Y118 PolarHBondContact O-N 2.88Å; N116-Y118 VanDerWaalsContact C-N 3.32Å; N116-Y118 PolarHBondContact O-N 3.14Å; Y118-S120 VanDerWaalsContact C-N 3.31Å; Y118-S120 PolarHBondContact O-N 2.92Å; Y118-I121 HydrophobicContact CD1-CD1 4.11Å; Y118-L122 WeakPolarHBondContact O-CB 3.33Å; Y118-L122 WeakPolarHBondContact O-CG 3.16Å; Y118-L122 PolarHBondContact O-N 2.86Å; Y118-Q165 VanDerWaalsContact CD2-CD 3.45Å; Y118-Q165 HydrophobicContact CD2-CG 4.05Å; Y118-L206 HydrophobicContact CD1-CB 3.26Å; Y118-L206 HydrophobicContact CD1-CD1 4Å; Y118-L206 HydrophobicContact CD1-CG 4.26Å; Y118-L206 HydrophobicContact CD2-CD1 3.8Å; Y118-L206 HydrophobicContact CE1-CB 3.45Å; Y118-L206 VanDerWaalsContact CE1-CB 3.45Å; Y118-L206 HydrophobicContact CE1-CD1 4.28Å; Y118-L206 HydrophobicContact CE2-CD1 4.13Å; Y118-L206 HydrophobicContact CG-CB 3.86Å; Y118-L206 HydrophobicContact CG-CD1 3.72Å; Y118-L206 HydrophobicContact CG-CG 4.42Å; Y118-H262 AromaticContact CE1-NE2 3.66Å; Y118-R265 PolarHBondContact OH-NH1 3.02Å; Y118-R265 PolarHBondContact OH-NH2 3.44Å
119C96.3Very high94.2Very high0 Ų09.4 Ų9.40%05%0.05CC..Hα-helixtrans-58-47.4168.2-77.50000110.3S78 T115 N116 I121 L122 F123S78-C119 WeakPolarHBondContact OG-CB 3.4Å; T115-C119 WeakPolarHBondContact O-CB 3.48Å; T115-C119 PolarHBondContact O-N 3.35Å; T115-C119 PolarHBondContact O-SG 3.07Å; N116-C119 PolarHBondContact O-N 2.85Å; C119-I121 PolarHBondContact O-N 3.46Å; C119-L122 PolarHBondContact O-N 3.43Å; C119-F123 HydrophobicContact CB-CD2 4.09Å; C119-F123 HydrophobicContact CB-CE2 4.03Å; C119-F123 WeakPolarHBondContact O-CB 3.39Å; C119-F123 WeakPolarHBondContact O-CD2 3.3Å; C119-F123 WeakPolarHBondContact O-CG 3.3Å; C119-F123 PolarHBondContact O-N 2.78Å
120S94.7Very high93.8Very high0 Ų010.4 Ų10.40%06%0.055CC..Hα-helixtrans-61.2-47.9-179.2-59.90000112L75 N116 L117 Y118 L122 F123 L124 N298L75-S120 VanDerWaalsContact CD1-CA 3.45Å; L75-S120 VanDerWaalsContact CD1-OG 3.28Å; L75-S120 WeakPolarHBondContact CD1-OG 3.47Å; N116-S120 WeakPolarHBondContact O-CB 3.42Å; N116-S120 PolarHBondContact O-N 3.26Å; N116-S120 PolarHBondContact O-OG 2.85Å; L117-S120 PolarHBondContact O-N 3.25Å; Y118-S120 VanDerWaalsContact C-N 3.31Å; Y118-S120 PolarHBondContact O-N 2.92Å; S120-L122 PolarHBondContact O-N 2.84Å; S120-F123 PolarHBondContact O-N 2.98Å; S120-L124 VanDerWaalsContact O-CB 3.26Å; S120-L124 WeakPolarHBondContact O-CB 3.17Å; S120-L124 WeakPolarHBondContact O-CD1 3.49Å; S120-L124 WeakPolarHBondContact O-CG 3.32Å; S120-L124 PolarHBondContact O-N 3.42Å; S120-N298 VanDerWaalsContact CB-ND2 3.33Å; S120-N298 WeakPolarHBondContact CB-ND2 3.21Å; S120-N298 PolarHBondContact OG-ND2 3.31Å
121I94.8Very high93.3Very high0 Ų012.4 Ų12.40%06%0.062CC..Hα-helixtrans-56.6-48175.6-71.5162.3000111.8L117 Y118 C119 T125 L206 F207 P210 F254 F258L117-I121 HydrophobicContact CD1-CD1 4.48Å; L117-I121 HydrophobicContact CG-CD1 4.27Å; L117-I121 WeakPolarHBondContact O-CD1 3.45Å; L117-I121 WeakPolarHBondContact O-CG1 3.33Å; L117-I121 PolarHBondContact O-N 3.28Å; L117-I121 VanDerWaalsContact O-N 3.13Å; Y118-I121 HydrophobicContact CD1-CD1 4.11Å; C119-I121 PolarHBondContact O-N 3.46Å; I121-T125 WeakPolarHBondContact O-CB 3.31Å; I121-T125 PolarHBondContact O-N 2.78Å; I121-T125 PolarHBondContact O-OG1 3.25Å; I121-L206 VanDerWaalsContact CG2-O 3.28Å; I121-L206 WeakPolarHBondContact CG2-O 3.38Å; I121-F207 HydrophobicContact CD1-CD2 4Å; I121-P210 HydrophobicContact CG2-CB 3.52Å; I121-P210 HydrophobicContact CG2-CG 4.01Å; I121-F254 HydrophobicContact CB-CZ 4.38Å; I121-F254 HydrophobicContact CG1-CE1 4.31Å; I121-F254 HydrophobicContact CG1-CZ 4.23Å; I121-F254 HydrophobicContact CG2-CE1 4.23Å; I121-F254 HydrophobicContact CG2-CZ 3.95Å; I121-F258 HydrophobicContact CD1-CD1 4.43Å; I121-F258 HydrophobicContact CD1-CD2 4.43Å; I121-F258 HydrophobicContact CD1-CG 4.23Å; I121-F258 HydrophobicContact CG1-CD1 4.28Å; I121-F258 HydrophobicContact CG1-CD2 3.71Å; I121-F258 HydrophobicContact CG1-CE1 4.33Å; I121-F258 HydrophobicContact CG1-CE2 3.77Å; I121-F258 HydrophobicContact CG1-CG 3.97Å; I121-F258 HydrophobicContact CG1-CZ 4.08Å
122L95.9Very high92.8Very high21 Ų2111.5 Ų11.511%0.116%0.059CC..Hα-helixtrans-72-38-177.5-69.2-178000112.8Y118 C119 S120 T125 C126 V157 L160 V161 L206 P210Y118-L122 WeakPolarHBondContact O-CB 3.33Å; Y118-L122 WeakPolarHBondContact O-CG 3.16Å; Y118-L122 PolarHBondContact O-N 2.86Å; C119-L122 PolarHBondContact O-N 3.43Å; S120-L122 PolarHBondContact O-N 2.84Å; L122-T125 WeakPolarHBondContact O-CB 3.45Å; L122-T125 PolarHBondContact O-N 2.94Å; L122-C126 PolarHBondContact O-N 3.26Å; L122-C126 PolarHBondContact O-SG 2.66Å; L122-V157 HydrophobicContact CB-CG1 3.79Å; L122-V157 HydrophobicContact CB-CG2 4.37Å; L122-V157 HydrophobicContact CD1-CG1 4.05Å; L122-L160 HydrophobicContact CD1-CD2 4.07Å; L122-V161 HydrophobicContact CD1-CG2 3.65Å; L122-L206 HydrophobicContact CD1-CD2 4.11Å; L122-P210 HydrophobicContact CD2-CB 4.25Å; L122-P210 HydrophobicContact CD2-CG 3.57Å
123F94.3Very high92.3Very high0 Ų011.7 Ų11.70%06%0.06CC..Hα-helixtrans-67.7-40.4174.9-76-54.7000111.8Y71 H74 L75 C119 S120 T125 C126 I127 A154 V157 W158Y71-F123 AromaticContact CD1-CD1 3.94Å; Y71-F123 HydrophobicContact CD1-CD1 3.94Å; Y71-F123 HydrophobicContact CD1-CE1 4.22Å; Y71-F123 HydrophobicContact CG-CD1 4.36Å; H74-F123 HydrophobicContact CB-CD1 4.46Å; H74-F123 HydrophobicContact CB-CD2 4.32Å; H74-F123 HydrophobicContact CB-CE1 3.82Å; H74-F123 HydrophobicContact CB-CE2 3.67Å; H74-F123 HydrophobicContact CB-CZ 3.41Å; H74-F123 VanDerWaalsContact CB-CZ 3.41Å; L75-F123 HydrophobicContact CD1-CB 4.35Å; C119-F123 HydrophobicContact CB-CD2 4.09Å; C119-F123 HydrophobicContact CB-CE2 4.03Å; C119-F123 WeakPolarHBondContact O-CB 3.39Å; C119-F123 WeakPolarHBondContact O-CD2 3.3Å; C119-F123 WeakPolarHBondContact O-CG 3.3Å; C119-F123 PolarHBondContact O-N 2.78Å; S120-F123 PolarHBondContact O-N 2.98Å; F123-T125 VanDerWaalsContact C-N 3.3Å; F123-T125 PolarHBondContact O-N 3.05Å; F123-C126 WeakPolarHBondContact O-CB 3.05Å; F123-C126 PolarHBondContact O-N 2.7Å; F123-I127 VanDerWaalsContact O-CG1 3.27Å; F123-I127 WeakPolarHBondContact O-CG1 3.12Å; F123-I127 PolarHBondContact O-N 3.34Å; F123-A154 HydrophobicContact CE1-CB 3.77Å; F123-A154 HydrophobicContact CZ-CB 4.24Å; F123-V157 HydrophobicContact CD1-CG1 4.46Å; F123-V157 HydrophobicContact CD2-CG1 4.45Å; F123-V157 HydrophobicContact CE1-CB 4.16Å; F123-V157 HydrophobicContact CE1-CG1 4.03Å; F123-V157 HydrophobicContact CE2-CG1 4.01Å; F123-V157 HydrophobicContact CZ-CB 4.13Å; F123-V157 HydrophobicContact CZ-CG1 3.76Å; F123-W158 AromaticContact CE2-NE1 3.97Å; F123-W158 AromaticContact CZ-CD1 3.95Å; F123-W158 AromaticContact CZ-NE1 3.66Å
124L90.5Very high91.8Very high0 Ų012.4 Ų12.40%07%0.072CC..Hα-helixtrans-59.2-43.5171.5-72.8165.5000110.8S120 C126 I127 S128 V250 V253 F254 F258 Y306S120-L124 VanDerWaalsContact O-CB 3.26Å; S120-L124 WeakPolarHBondContact O-CB 3.17Å; S120-L124 WeakPolarHBondContact O-CD1 3.49Å; S120-L124 WeakPolarHBondContact O-CG 3.32Å; S120-L124 PolarHBondContact O-N 3.42Å; L124-C126 PolarHBondContact O-N 3.38Å; L124-I127 WeakPolarHBondContact O-CB 3.48Å; L124-I127 PolarHBondContact O-N 3.31Å; L124-S128 PolarHBondContact O-N 3.18Å; L124-S128 PolarHBondContact O-OG 3.48Å; L124-V250 HydrophobicContact CB-CG1 4.44Å; L124-V250 HydrophobicContact CD2-CG2 3.93Å; L124-V253 HydrophobicContact CD1-CG1 4.04Å; L124-F254 HydrophobicContact CB-CE2 4.2Å; L124-F254 HydrophobicContact CD1-CE2 4.16Å; L124-F258 HydrophobicContact CD1-CE2 3.53Å; L124-F258 HydrophobicContact CD1-CZ 3.97Å; L124-Y306 WeakPolarHBondContact CD2-OH 2.82Å
125T93.2Very high91.2Very high10 Ų1014 Ų146%0.0618%0.083CC..Hα-helixtrans-59.6-46.2174.7-56.40000111.6I121 L122 F123 I127 S128 V129 P210 I213 I214I121-T125 WeakPolarHBondContact O-CB 3.31Å; I121-T125 PolarHBondContact O-N 2.78Å; I121-T125 PolarHBondContact O-OG1 3.25Å; L122-T125 WeakPolarHBondContact O-CB 3.45Å; L122-T125 PolarHBondContact O-N 2.94Å; F123-T125 VanDerWaalsContact C-N 3.3Å; F123-T125 PolarHBondContact O-N 3.05Å; T125-I127 VanDerWaalsContact C-N 3.32Å; T125-I127 PolarHBondContact O-N 2.77Å; T125-S128 PolarHBondContact O-N 2.96Å; T125-V129 HydrophobicContact CG2-CG2 4.37Å; T125-V129 WeakPolarHBondContact O-CG2 3.29Å; T125-V129 PolarHBondContact O-N 3.14Å; T125-P210 HydrophobicContact CG2-CB 4.49Å; T125-P210 WeakPolarHBondContact OG1-CB 3.22Å; T125-I213 HydrophobicContact CG2-CB 4.11Å; T125-I213 HydrophobicContact CG2-CG2 3.73Å; T125-I214 HydrophobicContact CG2-CG1 4.23Å; T125-I214 WeakPolarHBondContact OG1-CD1 3.41Å
126C92.9Very high90.6Very high23 Ų2316.4 Ų16.416%0.15510%0.095CC..Hα-helixtrans-60.5-40.8176.6-68.90000112.1Y71 L122 F123 L124 H130Y71-C126 HydrophobicContact CD1-CB 4.34Å; Y71-C126 HydrophobicContact CD2-CB 3.89Å; Y71-C126 HydrophobicContact CE1-CB 4.17Å; Y71-C126 HydrophobicContact CE2-CB 3.69Å; Y71-C126 HydrophobicContact CG-CB 4.23Å; L122-C126 PolarHBondContact O-N 3.26Å; L122-C126 PolarHBondContact O-SG 2.66Å; F123-C126 WeakPolarHBondContact O-CB 3.05Å; F123-C126 PolarHBondContact O-N 2.7Å; L124-C126 PolarHBondContact O-N 3.38Å; C126-H130 VanDerWaalsContact O-CB 3.27Å; C126-H130 WeakPolarHBondContact O-CB 3.48Å; C126-H130 PolarHBondContact O-N 3.49Å
127I88.6Confident90Very high1 Ų122.5 Ų22.51%0.00512%0.118CC..Hα-helixtrans-63.3-46.7174.7-67.7165.5000110.2Y71 M72 F123 L124 T125 H130 R131 T246 Y306Y71-I127 HydrophobicContact CD2-CG1 3.9Å; Y71-I127 HydrophobicContact CG-CG1 4.29Å; M72-I127 HydrophobicContact CG-CD1 4.29Å; F123-I127 VanDerWaalsContact O-CG1 3.27Å; F123-I127 WeakPolarHBondContact O-CG1 3.12Å; F123-I127 PolarHBondContact O-N 3.34Å; L124-I127 WeakPolarHBondContact O-CB 3.48Å; L124-I127 PolarHBondContact O-N 3.31Å; T125-I127 VanDerWaalsContact C-N 3.32Å; T125-I127 PolarHBondContact O-N 2.77Å; I127-H130 PolarHBondContact O-N 3.28Å; I127-R131 WeakPolarHBondContact O-CB 3.28Å; I127-R131 VanDerWaalsContact O-CG 3.24Å; I127-R131 WeakPolarHBondContact O-CG 3.48Å; I127-R131 PolarHBondContact O-N 3.29Å; I127-T246 HydrophobicContact CG2-CG2 4.25Å; I127-Y306 WeakPolarHBondContact CD1-OH 3.4Å
128S88.2Confident89.4Confident0 Ų026.4 Ų26.40%014%0.143CC..Hα-helixtrans-61.7-45.6178.6-60.70000112.3L124 T125 R131 C132 Y218L124-S128 PolarHBondContact O-N 3.18Å; L124-S128 PolarHBondContact O-OG 3.48Å; T125-S128 PolarHBondContact O-N 2.96Å; S128-R131 PolarHBondContact O-N 3.48Å; S128-C132 WeakPolarHBondContact O-CB 3.24Å; S128-C132 PolarHBondContact O-N 3.37Å; S128-Y218 VanDerWaalsContact OG-CZ 3.29Å; S128-Y218 PolarHBondContact OG-OH 2.8Å
129V90.6Very high88.7Confident37 Ų3733 Ų3322%0.22418%0.178CC..Hα-helixtrans-62.7-47176.6170.50000110.6T125 R131 C132 L133 I213T125-V129 HydrophobicContact CG2-CG2 4.37Å; T125-V129 WeakPolarHBondContact O-CG2 3.29Å; T125-V129 PolarHBondContact O-N 3.14Å; V129-R131 VanDerWaalsContact C-N 3.29Å; V129-R131 PolarHBondContact O-N 2.94Å; V129-C132 WeakPolarHBondContact O-CB 3.37Å; V129-C132 PolarHBondContact O-N 3.17Å; V129-L133 HydrophobicContact CG1-CD1 4.06Å; V129-L133 HydrophobicContact CG1-CG 4.39Å; V129-L133 WeakPolarHBondContact O-CB 3.4Å; V129-L133 WeakPolarHBondContact O-CG 3.33Å; V129-L133 PolarHBondContact O-N 3.14Å; V129-I213 HydrophobicContact CG2-CG2 3.65Å
130H87.3Confident88Confident23 Ų2340.1 Ų40.111%0.10621%0.205CC..Hα-helixtrans-60.5-39.6178176.5-122.7000111.8C126 I127 G134 G145C126-H130 VanDerWaalsContact O-CB 3.27Å; C126-H130 WeakPolarHBondContact O-CB 3.48Å; C126-H130 PolarHBondContact O-N 3.49Å; I127-H130 PolarHBondContact O-N 3.28Å; H130-G134 PolarHBondContact O-N 3.28Å; H130-G145 WeakPolarHBondContact NE2-CA 3.2Å
131R84.8Confident87.5Confident49 Ų4941 Ų4119%0.18521%0.211CC..Hα-helixtrans-66.4-44.2174.4-70.6-71178.1-136.2-12.5112.3S68 I127 S128 V129 G134 V135 T246S68-R131 PolarHBondContact OG-NH2 3.21Å; S68-R131 VanDerWaalsContact OG-NH2 3.09Å; I127-R131 WeakPolarHBondContact O-CB 3.28Å; I127-R131 VanDerWaalsContact O-CG 3.24Å; I127-R131 WeakPolarHBondContact O-CG 3.48Å; I127-R131 PolarHBondContact O-N 3.29Å; S128-R131 PolarHBondContact O-N 3.48Å; V129-R131 VanDerWaalsContact C-N 3.29Å; V129-R131 PolarHBondContact O-N 2.94Å; R131-G134 PolarHBondContact O-N 2.89Å; R131-G134 VanDerWaalsContact O-N 3.16Å; R131-V135 PolarHBondContact O-N 3.36Å; R131-V135 VanDerWaalsContact O-N 3.15Å; R131-T246 HydrophobicContact CG-CG2 4.35Å
132C85.8Confident86.9Confident7 Ų747 Ų475%0.04724%0.242CC..Hα-helixtrans-59-47.4176.5-170.30000110.8S128 V129 G134 V135 L136 C217S128-C132 WeakPolarHBondContact O-CB 3.24Å; S128-C132 PolarHBondContact O-N 3.37Å; V129-C132 WeakPolarHBondContact O-CB 3.37Å; V129-C132 PolarHBondContact O-N 3.17Å; C132-G134 VanDerWaalsContact C-N 3.3Å; C132-G134 PolarHBondContact O-N 2.78Å; C132-V135 PolarHBondContact O-N 2.74Å; C132-V135 VanDerWaalsContact O-N 3.09Å; C132-L136 WeakPolarHBondContact O-CB 3.22Å; C132-L136 WeakPolarHBondContact O-CG 3.25Å; C132-L136 PolarHBondContact O-N 2.96Å; C132-L136 WeakPolarHBondContact SG-CD1 3.44Å; C132-C217 HydrophobicContact CB-CB 3.83Å; C132-C217 PolarHBondContact SG-O 2.66Å
133L86.7Confident86.3Confident36 Ų3655.2 Ų55.219%0.18827%0.272CS..Hα-helixtrans-59.3-39174.4-71.8174.4000112.4V129 V135 L136 R137 W144V129-L133 HydrophobicContact CG1-CD1 4.06Å; V129-L133 HydrophobicContact CG1-CG 4.39Å; V129-L133 WeakPolarHBondContact O-CB 3.4Å; V129-L133 WeakPolarHBondContact O-CG 3.33Å; V129-L133 PolarHBondContact O-N 3.14Å; L133-V135 VanDerWaalsContact C-N 3.27Å; L133-V135 PolarHBondContact O-N 3.35Å; L133-L136 PolarHBondContact O-N 3Å; L133-R137 CarbonylContact O-C 3.56Å; L133-R137 WeakPolarHBondContact O-CA 3.01Å; L133-R137 PolarHBondContact O-N 2.81Å; L133-R137 VanDerWaalsContact O-O 3.12Å; L133-W144 HydrophobicContact CD1-CD2 3.93Å; L133-W144 HydrophobicContact CD1-CE3 3.71Å; L133-W144 HydrophobicContact CD1-CG 4.33Å; L133-W144 HydrophobicContact CD1-CZ3 4.21Å
134G83.8Confident85.9Confident31 Ų3160.1 Ų60.132%0.3229%0.29SS..Hα-helixtrans-60.4-34.317500000113.9H130 R131 C132 S141H130-G134 PolarHBondContact O-N 3.28Å; R131-G134 PolarHBondContact O-N 2.89Å; R131-G134 VanDerWaalsContact O-N 3.16Å; C132-G134 VanDerWaalsContact C-N 3.3Å; C132-G134 PolarHBondContact O-N 2.78Å; G134-S141 VanDerWaalsContact CA-CB 3.49Å; G134-S141 VanDerWaalsContact CA-OG 3.31Å; G134-S141 WeakPolarHBondContact CA-OG 3.14Å; G134-S141 PolarHBondContact N-OG 3.49Å
135V82.9Confident85.6Confident44 Ų4460.9 Ų60.927%0.26730%0.298SS..Hα-helixtrans-84.7-40.8178.2176.50000111.9R131 C132 L133 M221 R224 L225R131-V135 PolarHBondContact O-N 3.36Å; R131-V135 VanDerWaalsContact O-N 3.15Å; C132-V135 PolarHBondContact O-N 2.74Å; C132-V135 VanDerWaalsContact O-N 3.09Å; L133-V135 VanDerWaalsContact C-N 3.27Å; L133-V135 PolarHBondContact O-N 3.35Å; V135-M221 HydrophobicContact CB-CG 4.35Å; V135-M221 HydrophobicContact CB-SD 4.5Å; V135-M221 HydrophobicContact CG1-CG 4.29Å; V135-M221 HydrophobicContact CG2-CG 4.1Å; V135-M221 HydrophobicContact CG2-SD 3.8Å; V135-R224 HydrophobicContact CG1-CB 4.13Å; V135-L225 HydrophobicContact CG1-CD2 4.35Å
136L84.6Confident85.4Confident56 Ų5664.3 Ų64.329%0.29331%0.313SS..Hα-helixtrans-84.4-36.7-174.2-60.9-173.8000113.4C132 L133 L220 R224C132-L136 WeakPolarHBondContact O-CB 3.22Å; C132-L136 WeakPolarHBondContact O-CG 3.25Å; C132-L136 PolarHBondContact O-N 2.96Å; C132-L136 WeakPolarHBondContact SG-CD1 3.44Å; L133-L136 PolarHBondContact O-N 3Å; L136-L220 HydrophobicContact CD1-CB 4.01Å; L136-L220 HydrophobicContact CD1-CD1 4.09Å; L136-R224 HydrophobicContact CD2-CB 4.24Å; L136-R224 HydrophobicContact CD2-CG 3.35Å
137R84.1Confident85.3Confident132 Ų13264.1 Ų64.150%0.49831%0.313SS..  trans-146.572.2-170.6-61.4-170.7-171.5-157.13.7111L133 L139 R140 S141L133-R137 CarbonylContact O-C 3.56Å; L133-R137 WeakPolarHBondContact O-CA 3.01Å; L133-R137 PolarHBondContact O-N 2.81Å; L133-R137 VanDerWaalsContact O-O 3.12Å; R137-L139 VanDerWaalsContact C-N 3.3Å; R137-L139 PolarHBondContact O-N 3.4Å; R137-R140 HydrophobicContact CB-CB 4.2Å; R137-R140 HydrophobicContact CB-CG 4.48Å; R137-R140 VanDerWaalsContact NH1-CZ 3.33Å; R137-R140 PolarHBondContact O-N 2.83Å; R137-S141 PolarHBondContact O-N 2.98Å
138P81.5Confident85.5Confident83 Ų8371.4 Ų71.454%0.53934%0.341SS..Hα-helixtrans-56.9-37.5-171.819.8-31.7000113.9R140 S141 L142P138-R140 PolarHBondContact O-N 3.17Å; P138-S141 WeakPolarHBondContact O-CB 3.35Å; P138-S141 PolarHBondContact O-N 3.4Å; P138-L142 PolarHBondContact O-N 3.28Å; P138-L142 VanDerWaalsContact O-N 3.08Å
139L81.4Confident85.7Confident141 Ų14175 Ų7574%0.73836%0.355SS*.Hα-helixtrans-63.4-38.9177-63.1178.4000113.2R137 L142R137-L139 VanDerWaalsContact C-N 3.3Å; R137-L139 PolarHBondContact O-N 3.4Å; L139-L142 HydrophobicContact CD2-CD1 4.4Å
140R81.8Confident85.9Confident148 Ų14873.3 Ų73.356%0.55835%0.345SS*.Hα-helixtrans-72.3-36.2174.3-69.5-169.3-179.6-171.8-2.7111.4R137 P138 L142 R143 W144R137-R140 HydrophobicContact CB-CB 4.2Å; R137-R140 HydrophobicContact CB-CG 4.48Å; R137-R140 VanDerWaalsContact NH1-CZ 3.33Å; R137-R140 PolarHBondContact O-N 2.83Å; P138-R140 PolarHBondContact O-N 3.17Å; R140-L142 PolarHBondContact O-N 2.87Å; R140-R143 PolarHBondContact O-N 3.4Å; R140-W144 PolarHBondContact O-N 2.84Å; R140-W144 VanDerWaalsContact O-N 3.08Å
141S83.4Confident86.3Confident18 Ų1879.8 Ų79.813%0.12637%0.368CS..Hα-helixtrans-61.8-28.9176.2-171.10000113.1G134 R137 P138 G145G134-S141 VanDerWaalsContact CA-CB 3.49Å; G134-S141 VanDerWaalsContact CA-OG 3.31Å; G134-S141 WeakPolarHBondContact CA-OG 3.14Å; G134-S141 PolarHBondContact N-OG 3.49Å; R137-S141 PolarHBondContact O-N 2.98Å; P138-S141 WeakPolarHBondContact O-CB 3.35Å; P138-S141 PolarHBondContact O-N 3.4Å; S141-G145 WeakPolarHBondContact O-CA 3.31Å; S141-G145 PolarHBondContact O-N 3.41Å
142L82.6Confident86.8Confident126 Ų12686.9 Ų86.966%0.6640%0.395SS*.Hα-helixtrans-63.5-45.2174.4-78159.2000111.6P138 L139 R140 G145P138-L142 PolarHBondContact O-N 3.28Å; P138-L142 VanDerWaalsContact O-N 3.08Å; L139-L142 HydrophobicContact CD2-CD1 4.4Å; R140-L142 PolarHBondContact O-N 2.87Å; L142-G145 PolarHBondContact O-N 3.01Å
143R84.5Confident87.4Confident194 Ų19487.9 Ų87.973%0.73240%0.401SS*.Hα-helixtrans-65.8-47.9177-66.3-179.870.7-178.32.2111.6R140 G145 Q146R140-R143 PolarHBondContact O-N 3.4Å; R143-G145 PolarHBondContact O-N 3.5Å; R143-Q146 WeakPolarHBondContact O-CB 3.34Å; R143-Q146 WeakPolarHBondContact O-CG 3.42Å; R143-Q146 PolarHBondContact O-N 2.84Å
144W84.8Confident87.9Confident103 Ų10386.2 Ų86.239%0.3939%0.392SS..Hα-helixtrans-70.2-21.5178.9-80.453.4000113.2L133 R140 Q146 Y149L133-W144 HydrophobicContact CD1-CD2 3.93Å; L133-W144 HydrophobicContact CD1-CE3 3.71Å; L133-W144 HydrophobicContact CD1-CG 4.33Å; L133-W144 HydrophobicContact CD1-CZ3 4.21Å; R140-W144 PolarHBondContact O-N 2.84Å; R140-W144 VanDerWaalsContact O-N 3.08Å; W144-Q146 PolarHBondContact O-N 3.37Å; W144-Y149 HydrophobicContact CB-CD1 4.45Å; W144-Y149 HydrophobicContact CD2-CD1 4.27Å; W144-Y149 AromaticContact CD2-CE1 3.54Å; W144-Y149 HydrophobicContact CD2-CE1 3.54Å; W144-Y149 AromaticContact CD2-CZ 3.96Å; W144-Y149 AromaticContact CE2-CE1 3.98Å; W144-Y149 AromaticContact CE2-CZ 3.88Å; W144-Y149 HydrophobicContact CE3-CD1 4.34Å; W144-Y149 AromaticContact CE3-CE1 3.44Å; W144-Y149 HydrophobicContact CE3-CE1 3.44Å; W144-Y149 VanDerWaalsContact CE3-CE1 3.44Å; W144-Y149 HydrophobicContact CG-CD1 4.35Å; W144-Y149 HydrophobicContact CG-CE1 4.08Å; W144-Y149 HydrophobicContact CH2-CE1 4.22Å; W144-Y149 WeakPolarHBondContact CH2-OH 3.36Å; W144-Y149 HydrophobicContact CZ2-CE1 4.31Å; W144-Y149 AromaticContact CZ2-CZ 3.93Å; W144-Y149 WeakPolarHBondContact CZ2-OH 3.33Å; W144-Y149 AromaticContact CZ3-CE1 3.79Å; W144-Y149 HydrophobicContact CZ3-CE1 3.79Å
145G85.1Confident88.5Confident16 Ų1686.4 Ų86.417%0.16539%0.394CS..THydrogen-bonded Turntrans-74.8-11176.800000114.1A67 H130 S141 L142 R143A67-G145 PolarHBondContact N-O 3.49Å; H130-G145 WeakPolarHBondContact NE2-CA 3.2Å; S141-G145 WeakPolarHBondContact O-CA 3.31Å; S141-G145 PolarHBondContact O-N 3.41Å; L142-G145 PolarHBondContact O-N 3.01Å; R143-G145 PolarHBondContact O-N 3.5Å
146Q89.1Confident89.3Confident82 Ų8287.1 Ų87.138%0.38341%0.405SS..BIsolated β-bridgetrans-67.8132.2178.3-65.2-178.1-23.900111.3R143 W144 R148 Y149 A150R143-Q146 WeakPolarHBondContact O-CB 3.34Å; R143-Q146 WeakPolarHBondContact O-CG 3.42Å; R143-Q146 PolarHBondContact O-N 2.84Å; W144-Q146 PolarHBondContact O-N 3.37Å; Q146-R148 HydrophobicContact CB-CG 4.1Å; Q146-R148 PolarHBondContact O-N 2.99Å; Q146-R148 VanDerWaalsContact O-N 3.14Å; Q146-Y149 PolarHBondContact O-N 3.27Å; Q146-A150 PolarHBondContact O-N 3.22Å
147A89.9Confident89.9Confident19 Ų1985.1 Ų85.116%0.15740%0.395CS..Hα-helixtrans-57.4-32.2-17900000113.5W65 Y149 A150 R151W65-A147 HydrophobicContact CB-CB 3.75Å; A147-Y149 VanDerWaalsContact C-N 3.32Å; A147-Y149 PolarHBondContact O-N 3.49Å; A147-A150 PolarHBondContact O-N 3.45Å; A147-R151 WeakPolarHBondContact O-CB 3.18Å; A147-R151 WeakPolarHBondContact O-CG 3.14Å; A147-R151 PolarHBondContact O-N 2.86Å
148R92.8Very high90.6Very high155 Ų15580.8 Ų80.859%0.58538%0.379SS*.Hα-helixtrans-60.8-39.2176.565.7-178.6178.8169.4-0.9112.9Q146 R152Q146-R148 HydrophobicContact CB-CG 4.1Å; Q146-R148 PolarHBondContact O-N 2.99Å; Q146-R148 VanDerWaalsContact O-N 3.14Å; R148-R152 WeakPolarHBondContact O-CG 3.35Å; R148-R152 PolarHBondContact O-N 3.41Å
149Y92.8Very high91.4Very high76 Ų7681.8 Ų81.830%0.29838%0.383SS..Hα-helixtrans-73.3-45.4178.7-176.9-98.5000110.1W144 Q146 A147 R151 R152 V153W144-Y149 HydrophobicContact CB-CD1 4.45Å; W144-Y149 HydrophobicContact CD2-CD1 4.27Å; W144-Y149 AromaticContact CD2-CE1 3.54Å; W144-Y149 HydrophobicContact CD2-CE1 3.54Å; W144-Y149 AromaticContact CD2-CZ 3.96Å; W144-Y149 AromaticContact CE2-CE1 3.98Å; W144-Y149 AromaticContact CE2-CZ 3.88Å; W144-Y149 HydrophobicContact CE3-CD1 4.34Å; W144-Y149 AromaticContact CE3-CE1 3.44Å; W144-Y149 HydrophobicContact CE3-CE1 3.44Å; W144-Y149 VanDerWaalsContact CE3-CE1 3.44Å; W144-Y149 HydrophobicContact CG-CD1 4.35Å; W144-Y149 HydrophobicContact CG-CE1 4.08Å; W144-Y149 HydrophobicContact CH2-CE1 4.22Å; W144-Y149 WeakPolarHBondContact CH2-OH 3.36Å; W144-Y149 HydrophobicContact CZ2-CE1 4.31Å; W144-Y149 AromaticContact CZ2-CZ 3.93Å; W144-Y149 WeakPolarHBondContact CZ2-OH 3.33Å; W144-Y149 AromaticContact CZ3-CE1 3.79Å; W144-Y149 HydrophobicContact CZ3-CE1 3.79Å; Q146-Y149 PolarHBondContact O-N 3.27Å; A147-Y149 VanDerWaalsContact C-N 3.32Å; A147-Y149 PolarHBondContact O-N 3.49Å; Y149-R151 VanDerWaalsContact C-N 3.3Å; Y149-R151 PolarHBondContact O-N 3.27Å; Y149-R152 WeakPolarHBondContact O-CB 3.28Å; Y149-R152 PolarHBondContact O-N 3.02Å; Y149-R152 VanDerWaalsContact O-N 3.1Å; Y149-V153 HydrophobicContact CD1-CG2 3.94Å; Y149-V153 HydrophobicContact CE1-CG2 3.52Å; Y149-V153 WeakPolarHBondContact O-CG2 3.48Å; Y149-V153 PolarHBondContact O-N 2.87Å
150A93.6Very high92.2Very high0 Ų078.7 Ų78.70%037%0.366CS..Hα-helixtrans-60.8-36.5177.500000113.4A67 T70 Y71 Q146 A147 V153 A154A67-A150 VanDerWaalsContact CA-CB 3.44Å; A67-A150 HydrophobicContact CB-CB 3.69Å; T70-A150 HydrophobicContact CG2-CB 4.01Å; Y71-A150 HydrophobicContact CE1-CB 3.87Å; Y71-A150 WeakPolarHBondContact CE1-O 3.31Å; Q146-A150 PolarHBondContact O-N 3.22Å; A147-A150 PolarHBondContact O-N 3.45Å; A150-V153 PolarHBondContact O-N 3.41Å; A150-A154 VanDerWaalsContact O-CB 3.29Å; A150-A154 WeakPolarHBondContact O-CB 3.44Å; A150-A154 PolarHBondContact O-N 3.48Å
151R95.7Very high92.9Very high160 Ų16071.6 Ų71.660%0.60434%0.34SS*.Hα-helixtrans-62.9-41.1173.4-78.7-174.4-73.2150.5-8.4112.4T70 A147 Y149 A154 G155T70-R151 HydrophobicContact CG2-CG 3.82Å; A147-R151 WeakPolarHBondContact O-CB 3.18Å; A147-R151 WeakPolarHBondContact O-CG 3.14Å; A147-R151 PolarHBondContact O-N 2.86Å; Y149-R151 VanDerWaalsContact C-N 3.3Å; Y149-R151 PolarHBondContact O-N 3.27Å; R151-A154 PolarHBondContact O-N 2.88Å; R151-G155 PolarHBondContact O-N 2.79Å
152R96.8Very high93.6Very high197 Ų19774.2 Ų74.274%0.74335%0.352SS*.Hα-helixtrans-64.3-46.1175.2-69.4178.8-179.5-178.6-1.9111.5R148 Y149 A154 G155 A156R148-R152 WeakPolarHBondContact O-CG 3.35Å; R148-R152 PolarHBondContact O-N 3.41Å; Y149-R152 WeakPolarHBondContact O-CB 3.28Å; Y149-R152 PolarHBondContact O-N 3.02Å; Y149-R152 VanDerWaalsContact O-N 3.1Å; R152-A154 VanDerWaalsContact C-N 3.32Å; R152-A154 PolarHBondContact O-N 3.24Å; R152-G155 PolarHBondContact O-N 3.5Å; R152-A156 PolarHBondContact O-N 2.84Å
153V96.9Very high94.3Very high29 Ų2971.2 Ų71.218%0.17635%0.346CS..Hα-helixtrans-60.8-43.6175.9174.60000110.7Y71 Y149 A150 A156 V157Y71-V153 HydrophobicContact CE1-CB 4.19Å; Y71-V153 HydrophobicContact CE1-CG1 4.06Å; Y149-V153 HydrophobicContact CD1-CG2 3.94Å; Y149-V153 HydrophobicContact CE1-CG2 3.52Å; Y149-V153 WeakPolarHBondContact O-CG2 3.48Å; Y149-V153 PolarHBondContact O-N 2.87Å; A150-V153 PolarHBondContact O-N 3.41Å; V153-A156 WeakPolarHBondContact O-CB 3.26Å; V153-A156 PolarHBondContact O-N 3.47Å; V153-V157 HydrophobicContact CG1-CG2 4.47Å; V153-V157 WeakPolarHBondContact O-CG2 3.21Å; V153-V157 PolarHBondContact O-N 3.05Å
154A97.3Very high94.9Very high0 Ų062.9 Ų62.90%032%0.317CS..Hα-helixtrans-63.3-43.3177.800000112.3H74 F123 A150 R151 R152 A156 V157 W158H74-A154 WeakPolarHBondContact CD2-CB 3.39Å; H74-A154 WeakPolarHBondContact NE2-CB 3.46Å; F123-A154 HydrophobicContact CE1-CB 3.77Å; F123-A154 HydrophobicContact CZ-CB 4.24Å; A150-A154 VanDerWaalsContact O-CB 3.29Å; A150-A154 WeakPolarHBondContact O-CB 3.44Å; A150-A154 PolarHBondContact O-N 3.48Å; R151-A154 PolarHBondContact O-N 2.88Å; R152-A154 VanDerWaalsContact C-N 3.32Å; R152-A154 PolarHBondContact O-N 3.24Å; A154-A156 VanDerWaalsContact C-N 3.31Å; A154-A156 PolarHBondContact O-N 3.06Å; A154-V157 PolarHBondContact O-N 3.09Å; A154-W158 PolarHBondContact O-N 3.07Å
155G98.1Very high95.4Very high35 Ų3558.1 Ų58.136%0.36130%0.299SS..Hα-helixtrans-58-43.3172.700000112.4R151 R152 W158 V159R151-G155 PolarHBondContact O-N 2.79Å; R152-G155 PolarHBondContact O-N 3.5Å; G155-W158 PolarHBondContact O-N 3.5Å; G155-V159 WeakPolarHBondContact O-CG2 3.19Å; G155-V159 PolarHBondContact O-N 3.29Å
156A98.1Very high95.9Very high60 Ų6059.5 Ų59.550%0.49631%0.309SS..Hα-helixtrans-63.8-40.3175.800000112.7R152 V153 A154 V159 L160R152-A156 PolarHBondContact O-N 2.84Å; V153-A156 WeakPolarHBondContact O-CB 3.26Å; V153-A156 PolarHBondContact O-N 3.47Å; A154-A156 VanDerWaalsContact C-N 3.31Å; A154-A156 PolarHBondContact O-N 3.06Å; A156-V159 PolarHBondContact O-N 2.74Å; A156-L160 VanDerWaalsContact O-CB 3.27Å; A156-L160 WeakPolarHBondContact O-CB 3.37Å; A156-L160 PolarHBondContact O-N 3.32Å
157V98.2Very high96.1Very high13 Ų1357.8 Ų57.88%0.07931%0.305CS..Hα-helixtrans-60.6-46.7174.3168.60000110.7L122 F123 V153 A154 L160 V161L122-V157 HydrophobicContact CB-CG1 3.79Å; L122-V157 HydrophobicContact CB-CG2 4.37Å; L122-V157 HydrophobicContact CD1-CG1 4.05Å; F123-V157 HydrophobicContact CD1-CG1 4.46Å; F123-V157 HydrophobicContact CD2-CG1 4.45Å; F123-V157 HydrophobicContact CE1-CB 4.16Å; F123-V157 HydrophobicContact CE1-CG1 4.03Å; F123-V157 HydrophobicContact CE2-CG1 4.01Å; F123-V157 HydrophobicContact CZ-CB 4.13Å; F123-V157 HydrophobicContact CZ-CG1 3.76Å; V153-V157 HydrophobicContact CG1-CG2 4.47Å; V153-V157 WeakPolarHBondContact O-CG2 3.21Å; V153-V157 PolarHBondContact O-N 3.05Å; A154-V157 PolarHBondContact O-N 3.09Å; V157-L160 PolarHBondContact O-N 3.08Å; V157-V161 HydrophobicContact CG1-CG2 4.32Å; V157-V161 WeakPolarHBondContact O-CB 3.18Å; V157-V161 VanDerWaalsContact O-CG2 3.3Å; V157-V161 WeakPolarHBondContact O-CG2 3.32Å; V157-V161 PolarHBondContact O-N 3.37Å
158W98.2Very high96.2Very high42 Ų4257 Ų5716%0.15930%0.298CS..Hα-helixtrans-59.8-50177-84.1105.9000112.1H74 V77 L81 T115 F123 A154 G155 L160 V161 L162H74-W158 AromaticContact CG-NE1 3.75Å; H74-W158 AromaticContact ND1-CD1 3.86Å; H74-W158 AromaticContact ND1-NE1 3.2Å; H74-W158 PolarHBondContact ND1-NE1 3.04Å; H74-W158 VanDerWaalsContact ND1-NE1 3.2Å; V77-W158 HydrophobicContact CG1-CZ2 4.36Å; L81-W158 HydrophobicContact CD1-CH2 4.47Å; T115-W158 HydrophobicContact CG2-CZ3 3.94Å; F123-W158 AromaticContact CE2-NE1 3.97Å; F123-W158 AromaticContact CZ-CD1 3.95Å; F123-W158 AromaticContact CZ-NE1 3.66Å; A154-W158 PolarHBondContact O-N 3.07Å; G155-W158 PolarHBondContact O-N 3.5Å; W158-L160 VanDerWaalsContact C-N 3.32Å; W158-L160 PolarHBondContact O-N 3.25Å; W158-V161 PolarHBondContact O-N 3.43Å; W158-L162 HydrophobicContact CE3-CD1 4.25Å; W158-L162 HydrophobicContact CE3-CD2 4.44Å; W158-L162 HydrophobicContact CE3-CG 4.26Å; W158-L162 VanDerWaalsContact O-CB 3.31Å; W158-L162 WeakPolarHBondContact O-CB 3.4Å; W158-L162 WeakPolarHBondContact O-CG 3.35Å; W158-L162 PolarHBondContact O-N 2.99Å
159V98.4Very high96.2Very high104 Ų10452.8 Ų52.863%0.6329%0.287SS*.Hα-helixtrans-58.7-46.2178.6171.50000110.9G155 A156 A163G155-V159 WeakPolarHBondContact O-CG2 3.19Å; G155-V159 PolarHBondContact O-N 3.29Å; A156-V159 PolarHBondContact O-N 2.74Å; V159-A163 WeakPolarHBondContact O-CB 3.49Å; V159-A163 PolarHBondContact O-N 2.94Å
160L97.9Very high96.2Very high75 Ų7556.1 Ų56.139%0.39330%0.3SS..Hα-helixtrans-60.1-50.2178.4177.364.2000111.8L122 A156 V157 W158 A163 C164 L206L122-L160 HydrophobicContact CD1-CD2 4.07Å; A156-L160 VanDerWaalsContact O-CB 3.27Å; A156-L160 WeakPolarHBondContact O-CB 3.37Å; A156-L160 PolarHBondContact O-N 3.32Å; V157-L160 PolarHBondContact O-N 3.08Å; W158-L160 VanDerWaalsContact C-N 3.32Å; W158-L160 PolarHBondContact O-N 3.25Å; L160-A163 PolarHBondContact O-N 3.45Å; L160-C164 VanDerWaalsContact O-CB 3.28Å; L160-C164 WeakPolarHBondContact O-CB 3.45Å; L160-C164 PolarHBondContact O-N 3.13Å; L160-C164 PolarHBondContact O-SG 2.73Å; L160-L206 HydrophobicContact CD2-CD2 4.49Å
161V97.9Very high96.1Very high0 Ų057 Ų570%030%0.304CS..Hα-helixtrans-65-47.7-178.5174.80000110.5T115 L122 V157 W158 A163 C164 Q165T115-V161 HydrophobicContact CG2-CG1 3.97Å; L122-V161 HydrophobicContact CD1-CG2 3.65Å; V157-V161 HydrophobicContact CG1-CG2 4.32Å; V157-V161 WeakPolarHBondContact O-CB 3.18Å; V157-V161 VanDerWaalsContact O-CG2 3.3Å; V157-V161 WeakPolarHBondContact O-CG2 3.32Å; V157-V161 PolarHBondContact O-N 3.37Å; W158-V161 PolarHBondContact O-N 3.43Å; V161-A163 VanDerWaalsContact C-N 3.32Å; V161-A163 PolarHBondContact O-N 2.94Å; V161-C164 PolarHBondContact O-N 3.25Å; V161-Q165 HydrophobicContact CG1-CG 4Å; V161-Q165 VanDerWaalsContact O-CB 3.3Å; V161-Q165 WeakPolarHBondContact O-CB 3.27Å; V161-Q165 VanDerWaalsContact O-CG 3.24Å; V161-Q165 WeakPolarHBondContact O-CG 3.34Å; V161-Q165 PolarHBondContact O-N 2.94Å
162L97.6Very high95.8Very high72 Ų7249.4 Ų49.438%0.37728%0.275SS..Hα-helixtrans-61.3-41.8-179.8-66.5172.5000111.3F111 T115 W158 Q165 A166F111-L162 HydrophobicContact CE1-CD2 3.97Å; F111-L162 HydrophobicContact CZ-CD2 3.61Å; T115-L162 HydrophobicContact CG2-CD2 4.01Å; W158-L162 HydrophobicContact CE3-CD1 4.25Å; W158-L162 HydrophobicContact CE3-CD2 4.44Å; W158-L162 HydrophobicContact CE3-CG 4.26Å; W158-L162 VanDerWaalsContact O-CB 3.31Å; W158-L162 WeakPolarHBondContact O-CB 3.4Å; W158-L162 WeakPolarHBondContact O-CG 3.35Å; W158-L162 PolarHBondContact O-N 2.99Å; L162-Q165 PolarHBondContact O-N 3.37Å; L162-A166 WeakPolarHBondContact O-CB 3.41Å; L162-A166 PolarHBondContact O-N 2.96Å
163A97.3Very high95.6Very high64 Ų6442.1 Ų42.153%0.52925%0.253SS..Hα-helixtrans-64.7-47.3176.400000112.1V159 L160 V161 Q165 A166V159-A163 WeakPolarHBondContact O-CB 3.49Å; V159-A163 PolarHBondContact O-N 2.94Å; L160-A163 PolarHBondContact O-N 3.45Å; V161-A163 VanDerWaalsContact C-N 3.32Å; V161-A163 PolarHBondContact O-N 2.94Å; A163-Q165 VanDerWaalsContact C-N 3.29Å; A163-Q165 PolarHBondContact O-N 3.03Å; A163-A166 PolarHBondContact O-N 3.32Å
164C96.3Very high95.3Very high19 Ų1942.1 Ų42.113%0.12825%0.252CS..Hα-helixtrans-64.6-32.3178.1-76.10000113L160 V161 P167 Y198 M202 L206L160-C164 VanDerWaalsContact O-CB 3.28Å; L160-C164 WeakPolarHBondContact O-CB 3.45Å; L160-C164 PolarHBondContact O-N 3.13Å; L160-C164 PolarHBondContact O-SG 2.73Å; V161-C164 PolarHBondContact O-N 3.25Å; C164-P167 WeakPolarHBondContact O-CD 3.41Å; C164-Y198 WeakPolarHBondContact O-CE2 3.49Å; C164-Y198 PolarHBondContact O-OH 2.99Å; C164-M202 HydrophobicContact CB-CE 4.43Å; C164-M202 HydrophobicContact CB-SD 3.64Å; C164-L206 HydrophobicContact CB-CD1 3.8Å
165Q95.3Very high94.9Very high2 Ų243.6 Ų43.61%0.00926%0.263CS..Hα-helixtrans-91.9-14.3-178.7-61.1-37.7102.600113.9F111 Y114 Y118 V161 L162 A163 P167 V168 Y198F111-Q165 HydrophobicContact CD2-CB 4.05Å; F111-Q165 WeakPolarHBondContact CD2-O 3.21Å; F111-Q165 HydrophobicContact CE2-CB 3.7Å; Y114-Q165 VanDerWaalsContact CB-NE2 3.29Å; Y118-Q165 VanDerWaalsContact CD2-CD 3.45Å; Y118-Q165 HydrophobicContact CD2-CG 4.05Å; V161-Q165 HydrophobicContact CG1-CG 4Å; V161-Q165 VanDerWaalsContact O-CB 3.3Å; V161-Q165 WeakPolarHBondContact O-CB 3.27Å; V161-Q165 VanDerWaalsContact O-CG 3.24Å; V161-Q165 WeakPolarHBondContact O-CG 3.34Å; V161-Q165 PolarHBondContact O-N 2.94Å; L162-Q165 PolarHBondContact O-N 3.37Å; A163-Q165 VanDerWaalsContact C-N 3.29Å; A163-Q165 PolarHBondContact O-N 3.03Å; Q165-P167 VanDerWaalsContact C-N 3.29Å; Q165-V168 WeakPolarHBondContact O-CB 3.37Å; Q165-V168 VanDerWaalsContact O-CG2 3.31Å; Q165-V168 WeakPolarHBondContact O-CG2 3.24Å; Q165-V168 PolarHBondContact O-N 2.88Å; Q165-Y198 PolarHBondContact NE2-OH 2.79Å
166A95.4Very high94.4Very high46 Ų4645.8 Ų45.838%0.3828%0.277SS..THydrogen-bonded Turntrans-52-39.6177.400000113.7L162 A163 V168 L169L162-A166 WeakPolarHBondContact O-CB 3.41Å; L162-A166 PolarHBondContact O-N 2.96Å; A163-A166 PolarHBondContact O-N 3.32Å; A166-V168 PolarHBondContact O-N 3.02Å; A166-V168 VanDerWaalsContact O-N 3.11Å; A166-L169 VanDerWaalsContact O-CB 3.31Å; A166-L169 WeakPolarHBondContact O-CB 3.28Å; A166-L169 PolarHBondContact O-N 2.68Å
167P94.6Very high93.6Very high46 Ų4650.1 Ų50.130%0.29928%0.281SS..THydrogen-bonded Turntrans-59.1-22.7175.5-26.336.4000114.8C164 Q165 L169 Y170 F171 Y198C164-P167 WeakPolarHBondContact O-CD 3.41Å; Q165-P167 VanDerWaalsContact C-N 3.29Å; P167-L169 PolarHBondContact O-N 3.37Å; P167-Y170 WeakPolarHBondContact O-CA 3.23Å; P167-Y170 WeakPolarHBondContact O-CB 3.4Å; P167-Y170 PolarHBondContact O-N 2.89Å; P167-F171 HydrophobicContact CB-CD2 4.21Å; P167-F171 HydrophobicContact CB-CE2 4.07Å; P167-F171 WeakPolarHBondContact O-CD2 3.35Å; P167-F171 PolarHBondContact O-N 2.95Å; P167-Y198 HydrophobicContact CB-CD2 4.27Å; P167-Y198 HydrophobicContact CB-CE2 3.87Å; P167-Y198 HydrophobicContact CG-CD2 4.47Å; P167-Y198 HydrophobicContact CG-CE2 3.91Å
168V91.9Very high92.7Very high1 Ų153.7 Ų53.71%0.00632%0.32CS..Hα-helixtrans-56.8-36.2172.9176.70000110.8R110 Y114 Q165 A166 Y170 F171 V172 Y198R110-V168 HydrophobicContact CB-CG1 4.21Å; Y114-V168 HydrophobicContact CD2-CG1 4.07Å; Y114-V168 HydrophobicContact CD2-CG2 4.01Å; Y114-V168 HydrophobicContact CE2-CG1 4.44Å; Q165-V168 WeakPolarHBondContact O-CB 3.37Å; Q165-V168 VanDerWaalsContact O-CG2 3.31Å; Q165-V168 WeakPolarHBondContact O-CG2 3.24Å; Q165-V168 PolarHBondContact O-N 2.88Å; A166-V168 PolarHBondContact O-N 3.02Å; A166-V168 VanDerWaalsContact O-N 3.11Å; V168-Y170 PolarHBondContact O-N 3.26Å; V168-F171 PolarHBondContact O-N 3.24Å; V168-V172 HydrophobicContact CG1-CG2 3.6Å; V168-V172 WeakPolarHBondContact O-CB 3.4Å; V168-V172 WeakPolarHBondContact O-CG2 3.48Å; V168-V172 PolarHBondContact O-N 3.45Å; V168-Y198 HydrophobicContact CG2-CE1 4.19Å
169L93.1Very high91.9Very high68 Ų6855.4 Ų55.436%0.35635%0.351SS..Hα-helixtrans-66.8-23.7177.2-59.5173.9000112.5K107 F111 A166 P167K107-L169 HydrophobicContact CB-CD2 3.94Å; K107-L169 VanDerWaalsContact CD-O 3.29Å; K107-L169 WeakPolarHBondContact CD-O 3.35Å; K107-L169 WeakPolarHBondContact CE-O 3.32Å; K107-L169 PolarHBondContact NZ-O 3.49Å; F111-L169 HydrophobicContact CB-CD2 3.68Å; F111-L169 HydrophobicContact CB-CG 4.4Å; F111-L169 HydrophobicContact CD2-CD1 4.31Å; F111-L169 HydrophobicContact CD2-CD2 4.13Å; F111-L169 HydrophobicContact CD2-CG 3.95Å; F111-L169 HydrophobicContact CG-CD2 3.96Å; F111-L169 HydrophobicContact CG-CG 4.29Å; A166-L169 VanDerWaalsContact O-CB 3.31Å; A166-L169 WeakPolarHBondContact O-CB 3.28Å; A166-L169 PolarHBondContact O-N 2.68Å; P167-L169 PolarHBondContact O-N 3.37Å
170Y91.9Very high91.4Very high145 Ų14557 Ų5757%0.56935%0.346SS*.Hα-helixtrans-81.7-48.4173.4173.4-98.3000111.1P167 V168 L191P167-Y170 WeakPolarHBondContact O-CA 3.23Å; P167-Y170 WeakPolarHBondContact O-CB 3.4Å; P167-Y170 PolarHBondContact O-N 2.89Å; V168-Y170 PolarHBondContact O-N 3.26Å; Y170-L191 HydrophobicContact CE1-CD1 3.97Å; Y170-L191 HydrophobicContact CE1-CD2 4.31Å
171F90.5Very high91.1Very high20 Ų2055.5 Ų55.59%0.08834%0.34CS..Hα-helixtrans-72.5-42.7-173.9-72.9-66.8000114.2P167 V168 T173 S187 L191 R194 F195 Y198P167-F171 HydrophobicContact CB-CD2 4.21Å; P167-F171 HydrophobicContact CB-CE2 4.07Å; P167-F171 WeakPolarHBondContact O-CD2 3.35Å; P167-F171 PolarHBondContact O-N 2.95Å; V168-F171 PolarHBondContact O-N 3.24Å; F171-T173 PolarHBondContact O-N 3.34Å; F171-S187 VanDerWaalsContact O-CA 3.31Å; F171-S187 WeakPolarHBondContact O-CA 3.28Å; F171-L191 HydrophobicContact CD1-CB 4.13Å; F171-L191 HydrophobicContact CE1-CB 4.31Å; F171-R194 HydrophobicContact CE1-CB 4.03Å; F171-R194 HydrophobicContact CZ-CB 4.27Å; F171-F195 HydrophobicContact CB-CD2 3.62Å; F171-F195 HydrophobicContact CB-CE2 4.14Å; F171-F195 HydrophobicContact CD1-CB 3.91Å; F171-F195 HydrophobicContact CD1-CD2 4.12Å; F171-F195 AromaticContact CD2-CD2 3.81Å; F171-F195 HydrophobicContact CD2-CD2 3.81Å; F171-F195 HydrophobicContact CE1-CB 4.09Å; F171-F195 HydrophobicContact CE2-CD2 4.49Å; F171-F195 HydrophobicContact CG-CB 4.27Å; F171-F195 AromaticContact CG-CD2 3.6Å; F171-F195 HydrophobicContact CG-CD2 3.6Å; F171-F195 HydrophobicContact CG-CE2 4.47Å; F171-F195 HydrophobicContact CG-CG 4.4Å; F171-Y198 HydrophobicContact CD2-CD1 4.25Å; F171-Y198 HydrophobicContact CE2-CD1 4.08Å; F171-Y198 HydrophobicContact CE2-CG 4.02Å
172V90.9Very high90.7Very high0 Ų057.3 Ų57.30%035%0.35CS..  trans-67.3134.1-177.4170.60000109.6K107 R110 V168 T186K107-V172 WeakPolarHBondContact CE-O 3.46Å; K107-V172 HydrophobicContact CG-CB 4.24Å; K107-V172 HydrophobicContact CG-CG1 4.1Å; K107-V172 WeakPolarHBondContact CG-O 3.46Å; R110-V172 HydrophobicContact CB-CG1 4.17Å; R110-V172 HydrophobicContact CB-CG2 3.84Å; R110-V172 HydrophobicContact CG-CB 4.46Å; R110-V172 HydrophobicContact CG-CG1 3.67Å; R110-V172 HydrophobicContact CG-CG2 3.97Å; V168-V172 HydrophobicContact CG1-CG2 3.6Å; V168-V172 WeakPolarHBondContact O-CB 3.4Å; V168-V172 WeakPolarHBondContact O-CG2 3.48Å; V168-V172 PolarHBondContact O-N 3.45Å; V172-T186 WeakPolarHBondContact CA-O 3.41Å; V172-T186 WeakPolarHBondContact CG2-O 3.49Å
173T91.4Very high90.4Very high44 Ų4453.9 Ų53.927%0.2733%0.333SS..  trans-145.9168.5178.9-164.50000111.9F171 H184 A188F171-T173 PolarHBondContact O-N 3.34Å; T173-H184 WeakPolarHBondContact O-CB 3.39Å; T173-H184 PolarHBondContact O-CD2 3.49Å; T173-H184 PolarHBondContact O-N 2.92Å; T173-H184 VanDerWaalsContact O-N 3.14Å; T173-A188 HydrophobicContact CG2-CB 4.02Å
174T91.2Very high89.9Confident28 Ų2853.7 Ų53.717%0.17232%0.321CS..EExtended strand (participates in β ladder)trans-106.2145.5170.1510000109.7T103 C106 V181 T182 C183T103-T174 HydrophobicContact CG2-CG2 4.12Å; T103-T174 WeakPolarHBondContact CG2-OG1 3.38Å; T103-T174 PolarHBondContact OG1-OG1 3.28Å; C106-T174 HydrophobicContact CB-CG2 3.77Å; T174-V181 HydrophobicContact CG2-CG1 4.33Å; T174-T182 CarbonylContact C-O 3.09Å; T174-T182 WeakPolarHBondContact CA-O 3.47Å; T174-C183 HydrophobicContact CG2-CB 4.37Å
175S88.6Confident89.1Confident32 Ų3254.6 Ų54.622%0.22432%0.324CS..EExtended strand (participates in β ladder)trans-125.7140.4170.466.50000111.2V181 T182 H184S175-V181 CarbonylContact O-C 3.56Å; S175-V181 WeakPolarHBondContact O-CA 3.27Å; S175-T182 PolarHBondContact N-O 3Å; S175-T182 PolarHBondContact O-N 3.16Å; S175-T182 PolarHBondContact O-OG1 2.91Å; S175-T182 PolarHBondContact OG-OG1 3.47Å; S175-H184 WeakPolarHBondContact CB-NE2 3.25Å; S175-H184 PolarHBondContact OG-NE2 3.15Å
176A87.1Confident88.4Confident80 Ų8055.3 Ų55.366%0.66133%0.329SS*.EExtended strand (participates in β ladder)trans-99127173.400000110.1R180 V181A176-R180 CarbonylContact C-O 3.58Å; A176-R180 WeakPolarHBondContact CA-O 3.34Å; A176-V181 HydrophobicContact CB-CG2 4.24Å
177R82.8Confident87.8Confident152 Ų15253.4 Ų53.457%0.57431%0.313SS*.EExtended strand (participates in β ladder)trans-143.4130173.1-70-172.2178.4-154.23.7110G179 R180R177-G179 VanDerWaalsContact C-N 3.3Å; R177-G179 PolarHBondContact O-N 3.23Å; R177-R180 PolarHBondContact N-O 3.31Å; R177-R180 PolarHBondContact O-N 3.33Å; R177-R180 VanDerWaalsContact O-O 3.14Å
178G78.1Confident87Confident88 Ų8852.1 Ų52.191%0.90731%0.306SS*.THydrogen-bonded Turntrans54.840.6176.100000114.1R180G178-R180 PolarHBondContact O-N 2.83Å
179G82.3Confident86.2Confident77 Ų7757.1 Ų57.179%0.79434%0.338SS*.THydrogen-bonded Turntrans73.50.5-177.200000115.4R177R177-G179 VanDerWaalsContact C-N 3.3Å; R177-G179 PolarHBondContact O-N 3.23Å
180R86.8Confident85.5Confident138 Ų13859.7 Ų59.752%0.52135%0.353SS..EExtended strand (participates in β ladder)trans-105.5135.5173-65.7-171.2-175-160.45.3111.3G96 A176 R177 G178G96-R180 PolarHBondContact O-NH1 3.16Å; G96-R180 VanDerWaalsContact O-NH1 3.11Å; A176-R180 CarbonylContact C-O 3.58Å; A176-R180 WeakPolarHBondContact CA-O 3.34Å; R177-R180 PolarHBondContact N-O 3.31Å; R177-R180 PolarHBondContact O-N 3.33Å; R177-R180 VanDerWaalsContact O-O 3.14Å; G178-R180 PolarHBondContact O-N 2.83Å
181V91.3Very high85.1Confident44 Ų4453.9 Ų53.927%0.26733%0.331SS..EExtended strand (participates in β ladder)trans-98.8125.3170.6-1800000108.1W99 T174 S175 A176W99-V181 HydrophobicContact CB-CG1 4.43Å; W99-V181 PolarHBondContact N-O 3.3Å; W99-V181 WeakPolarHBondContact O-CB 3.46Å; T174-V181 HydrophobicContact CG2-CG1 4.33Å; S175-V181 CarbonylContact O-C 3.56Å; S175-V181 WeakPolarHBondContact O-CA 3.27Å; A176-V181 HydrophobicContact CB-CG2 4.24Å
182T90.8Very high84.8Confident37 Ų3755.2 Ų55.223%0.22734%0.337CS..EExtended strand (participates in β ladder)trans-107.6140.6176.655.50000110.1D97 T174 S175D97-T182 WeakPolarHBondContact O-CG2 3.48Å; T174-T182 CarbonylContact C-O 3.09Å; T174-T182 WeakPolarHBondContact CA-O 3.47Å; S175-T182 PolarHBondContact N-O 3Å; S175-T182 PolarHBondContact O-N 3.16Å; S175-T182 PolarHBondContact O-OG1 2.91Å; S175-T182 PolarHBondContact OG-OG1 3.47Å
183C91.2Very high84.5Confident1 Ų159.2 Ų59.21%0.00737%0.365CS..EExtended strand (participates in β ladder)trans-101.7104.5175.1169.60000109.3Y92 W99 C106 R110 T174Y92-C183 HydrophobicContact CE2-CB 4.19Å; Y92-C183 PolarHBondContact OH-N 2.79Å; Y92-C183 PolarHBondContact OH-O 2.99Å; W99-C183 HydrophobicContact CB-CB 3.93Å; W99-C183 HydrophobicContact CD2-CB 3.62Å; W99-C183 HydrophobicContact CE3-CB 3.77Å; W99-C183 HydrophobicContact CG-CB 3.68Å; C106-C183 VanDerWaalsContact CA-SG 3.6Å; C106-C183 HydrophobicContact CB-CB 3.91Å; C106-C183 WeakPolarHBondContact CB-SG 3.5Å; C106-C183 VanDerWaalsContact SG-CA 3.57Å; C106-C183 WeakPolarHBondContact SG-CB 3.26Å; C106-C183 CovalentContact SG-SG 2.03Å; C106-C183 PolarHBondContact SG-SG 3.44Å; R110-C183 PolarHBondContact NH2-O 3.47Å; T174-C183 HydrophobicContact CG2-CB 4.37Å
184H87.2Confident84.4Confident59 Ų5965 Ų6527%0.27338%0.382SS..  trans-66141.3-174.6-68.8-69.8000111.9R110 T173 S175 T186R110-H184 PolarHBondContact NE-O 2.88Å; T173-H184 WeakPolarHBondContact O-CB 3.39Å; T173-H184 PolarHBondContact O-CD2 3.49Å; T173-H184 PolarHBondContact O-N 2.92Å; T173-H184 VanDerWaalsContact O-N 3.14Å; S175-H184 WeakPolarHBondContact CB-NE2 3.25Å; S175-H184 PolarHBondContact OG-NE2 3.15Å; H184-T186 VanDerWaalsContact C-N 3.32Å
185D79.1Confident84.2Confident38 Ų3863.7 Ų63.720%0.20337%0.374CS..SBendtrans-73.7-24.8173.4-78.8-62.4000112.4Y93 R110 R292Y93-D185 PolarHBondContact OH-OD2 3.34Å; R110-D185 IonicContact CZ-OD1 2.84Å; R110-D185 IonicContact NE-OD1 3.82Å; R110-D185 IonicContact NH1-OD1 2.61Å; R110-D185 PolarHBondContact NH1-OD1 2.92Å; R110-D185 IonicContact NH2-OD1 3.68Å; R110-D185 PolarHBondContact NH2-OD1 3.39Å; R110-D185 VanDerWaalsContact NH2-OD1 3.1Å; R110-D185 IonicContact NH2-OD2 3.34Å; D185-R292 IonicContact OD1-CZ 2.73Å; D185-R292 IonicContact OD1-NE 2.68Å; D185-R292 IonicContact OD1-NH2 2.74Å; D185-R292 PolarHBondContact OD1-NH2 2.9Å
186T80.7Confident84.3Confident18 Ų1863.5 Ų63.511%0.1137%0.371CS..SBendtrans-118.5-109-171.156.30000111.9V172 H184 F195 Y269V172-T186 WeakPolarHBondContact CA-O 3.41Å; V172-T186 WeakPolarHBondContact CG2-O 3.49Å; H184-T186 VanDerWaalsContact C-N 3.32Å; T186-F195 HydrophobicContact CG2-CE1 3.76Å; T186-F195 HydrophobicContact CG2-CZ 4.38Å; T186-Y269 HydrophobicContact CG2-CE1 3.57Å
187S82.4Confident84.4Confident6 Ų662.6 Ų62.64%0.04236%0.364CS..  trans-137.4170.8-17972.30000111.1F171 F192F171-S187 VanDerWaalsContact O-CA 3.31Å; F171-S187 WeakPolarHBondContact O-CA 3.28Å; S187-F192 VanDerWaalsContact OG-CA 3.24Å; S187-F192 WeakPolarHBondContact OG-CA 3.46Å; S187-F192 PolarHBondContact OG-N 3.06Å
188A77.5Confident84.9Confident19 Ų1956.9 Ų56.916%0.15734%0.342CS..  trans-58.9150.4162.900000110.8T173 D190 L191 F192T173-A188 HydrophobicContact CG2-CB 4.02Å; A188-D190 VanDerWaalsContact C-N 3.26Å; A188-D190 WeakPolarHBondContact CB-OD1 3.44Å; A188-D190 PolarHBondContact O-N 2.98Å; A188-L191 PolarHBondContact O-N 3.25Å; A188-L191 VanDerWaalsContact O-N 3.09Å; A188-F192 PolarHBondContact O-N 3.23Å
189P75.9Confident85.5Confident105 Ų10553 Ų5368%0.68230%0.302SS*.G310 helixtrans-55.9-36.6-176.2-2735.2000114.3L191 F192P189-L191 VanDerWaalsContact C-N 3.31Å; P189-L191 PolarHBondContact O-N 2.91Å; P189-F192 WeakPolarHBondContact O-CB 3.16Å; P189-F192 PolarHBondContact O-N 3.43Å
190D77.6Confident85.9Confident123 Ų12352.2 Ų52.266%0.65828%0.284SS*.G310 helixtrans-66.9-28.4179.159.1-58000113.4A188A188-D190 VanDerWaalsContact C-N 3.26Å; A188-D190 WeakPolarHBondContact CB-OD1 3.44Å; A188-D190 PolarHBondContact O-N 2.98Å
191L83.3Confident86.3Confident22 Ų2250 Ų5012%0.11529%0.285CS..G310 helixtrans-98-0179-68.4170.2000113.3Y170 F171 A188 P189 S193 R194 F195Y170-L191 HydrophobicContact CE1-CD1 3.97Å; Y170-L191 HydrophobicContact CE1-CD2 4.31Å; F171-L191 HydrophobicContact CD1-CB 4.13Å; F171-L191 HydrophobicContact CE1-CB 4.31Å; A188-L191 PolarHBondContact O-N 3.25Å; A188-L191 VanDerWaalsContact O-N 3.09Å; P189-L191 VanDerWaalsContact C-N 3.31Å; P189-L191 PolarHBondContact O-N 2.91Å; L191-S193 PolarHBondContact O-N 3.24Å; L191-R194 PolarHBondContact O-N 3.01Å; L191-F195 PolarHBondContact O-N 2.98Å
192F83.9Confident86.4Confident48 Ų4848.7 Ų48.721%0.21128%0.276CS..Hα-helixtrans-60.9-43.2-170-172.1-106.5000113S187 A188 P189 R194 F195 V196 Y269 R272S187-F192 VanDerWaalsContact OG-CA 3.24Å; S187-F192 WeakPolarHBondContact OG-CA 3.46Å; S187-F192 PolarHBondContact OG-N 3.06Å; A188-F192 PolarHBondContact O-N 3.23Å; P189-F192 WeakPolarHBondContact O-CB 3.16Å; P189-F192 PolarHBondContact O-N 3.43Å; F192-R194 PolarHBondContact O-N 3.42Å; F192-F195 WeakPolarHBondContact O-CB 3.35Å; F192-F195 PolarHBondContact O-N 3.26Å; F192-V196 HydrophobicContact CD1-CG2 4.1Å; F192-V196 HydrophobicContact CE1-CG2 3.74Å; F192-V196 HydrophobicContact CE2-CG2 4.31Å; F192-V196 HydrophobicContact CZ-CG2 3.86Å; F192-V196 WeakPolarHBondContact O-CG2 3.42Å; F192-V196 PolarHBondContact O-N 3.46Å; F192-Y269 HydrophobicContact CZ-CD1 4.34Å; F192-R272 HydrophobicContact CE1-CB 4.23Å; F192-R272 HydrophobicContact CE1-CG 4.33Å; F192-R272 HydrophobicContact CZ-CB 4.49Å
193S85.5Confident86.6Confident85 Ų8548.6 Ų48.659%0.59427%0.274SS*.Hα-helixtrans-60.4-43.2177.958.30000112.6L191 V196 A197L191-S193 PolarHBondContact O-N 3.24Å; S193-V196 PolarHBondContact O-N 2.93Å; S193-A197 PolarHBondContact O-N 3.39Å
194R88.9Confident86.7Confident164 Ų16450 Ų5062%0.61929%0.289SS*.Hα-helixtrans-66-39.4175.7-63.8-178.2-175.5175.72.2111.4F171 L191 F192 A197 Y198F171-R194 HydrophobicContact CE1-CB 4.03Å; F171-R194 HydrophobicContact CZ-CB 4.27Å; L191-R194 PolarHBondContact O-N 3.01Å; F192-R194 PolarHBondContact O-N 3.42Å; R194-A197 PolarHBondContact O-N 2.94Å; R194-Y198 WeakPolarHBondContact O-CB 3.46Å; R194-Y198 PolarHBondContact O-N 2.97Å
195F87.8Confident87.1Confident1 Ų151.1 Ų51.10%0.00430%0.296CS..Hα-helixtrans-64.8-38.4176.1178.7-100.8000112.3F171 T186 L191 F192 Y198 S199 Y269F171-F195 HydrophobicContact CB-CD2 3.62Å; F171-F195 HydrophobicContact CB-CE2 4.14Å; F171-F195 HydrophobicContact CD1-CB 3.91Å; F171-F195 HydrophobicContact CD1-CD2 4.12Å; F171-F195 AromaticContact CD2-CD2 3.81Å; F171-F195 HydrophobicContact CD2-CD2 3.81Å; F171-F195 HydrophobicContact CE1-CB 4.09Å; F171-F195 HydrophobicContact CE2-CD2 4.49Å; F171-F195 HydrophobicContact CG-CB 4.27Å; F171-F195 AromaticContact CG-CD2 3.6Å; F171-F195 HydrophobicContact CG-CD2 3.6Å; F171-F195 HydrophobicContact CG-CE2 4.47Å; F171-F195 HydrophobicContact CG-CG 4.4Å; T186-F195 HydrophobicContact CG2-CE1 3.76Å; T186-F195 HydrophobicContact CG2-CZ 4.38Å; L191-F195 PolarHBondContact O-N 2.98Å; F192-F195 WeakPolarHBondContact O-CB 3.35Å; F192-F195 PolarHBondContact O-N 3.26Å; F195-Y198 HydrophobicContact CD2-CD1 4.18Å; F195-Y198 HydrophobicContact CE2-CD1 4.33Å; F195-Y198 HydrophobicContact CE2-CE1 4.46Å; F195-S199 VanDerWaalsContact O-CB 3.24Å; F195-S199 WeakPolarHBondContact O-CB 3.3Å; F195-S199 PolarHBondContact O-N 3.45Å; F195-S199 PolarHBondContact O-OG 3.42Å; F195-Y269 HydrophobicContact CE1-CE1 4.34Å; F195-Y269 AromaticContact CE1-CE2 3.81Å; F195-Y269 HydrophobicContact CE1-CE2 3.81Å; F195-Y269 AromaticContact CE1-CZ 3.64Å; F195-Y269 WeakPolarHBondContact CE1-OH 3.39Å
196V89.1Confident87.8Confident29 Ų2949.3 Ų49.318%0.17629%0.287CS..Hα-helixtrans-64.7-46.6174.6172.70000110.6F192 S193 Y198 S199 S200 Y269F192-V196 HydrophobicContact CD1-CG2 4.1Å; F192-V196 HydrophobicContact CE1-CG2 3.74Å; F192-V196 HydrophobicContact CE2-CG2 4.31Å; F192-V196 HydrophobicContact CZ-CG2 3.86Å; F192-V196 WeakPolarHBondContact O-CG2 3.42Å; F192-V196 PolarHBondContact O-N 3.46Å; S193-V196 PolarHBondContact O-N 2.93Å; V196-Y198 PolarHBondContact O-N 3.15Å; V196-S199 PolarHBondContact O-N 3.41Å; V196-S200 WeakPolarHBondContact O-CB 3.05Å; V196-S200 PolarHBondContact O-N 2.94Å; V196-S200 PolarHBondContact O-OG 2.89Å; V196-S200 VanDerWaalsContact O-OG 3.07Å; V196-Y269 HydrophobicContact CG2-CG 4.3Å
197A90.9Very high88.4Confident60 Ų6049.2 Ų49.250%0.49629%0.285SS..Hα-helixtrans-58.3-48.6176.200000111.8S193 R194 S199 S200 V201S193-A197 PolarHBondContact O-N 3.39Å; R194-A197 PolarHBondContact O-N 2.94Å; A197-S199 PolarHBondContact O-N 3.47Å; A197-S200 PolarHBondContact O-N 3.42Å; A197-V201 WeakPolarHBondContact O-CG2 3.33Å; A197-V201 PolarHBondContact O-N 2.96Å; A197-V201 VanDerWaalsContact O-N 3.1Å
198Y92.8Very high89Confident33 Ų3351.1 Ų51.113%0.12930%0.301CS..Hα-helixtrans-55-49.7172.9161.2-103.8000111.9C164 Q165 P167 V168 F171 R194 F195 V196 S200 V201 M202C164-Y198 WeakPolarHBondContact O-CE2 3.49Å; C164-Y198 PolarHBondContact O-OH 2.99Å; Q165-Y198 PolarHBondContact NE2-OH 2.79Å; P167-Y198 HydrophobicContact CB-CD2 4.27Å; P167-Y198 HydrophobicContact CB-CE2 3.87Å; P167-Y198 HydrophobicContact CG-CD2 4.47Å; P167-Y198 HydrophobicContact CG-CE2 3.91Å; V168-Y198 HydrophobicContact CG2-CE1 4.19Å; F171-Y198 HydrophobicContact CD2-CD1 4.25Å; F171-Y198 HydrophobicContact CE2-CD1 4.08Å; F171-Y198 HydrophobicContact CE2-CG 4.02Å; R194-Y198 WeakPolarHBondContact O-CB 3.46Å; R194-Y198 PolarHBondContact O-N 2.97Å; F195-Y198 HydrophobicContact CD2-CD1 4.18Å; F195-Y198 HydrophobicContact CE2-CD1 4.33Å; F195-Y198 HydrophobicContact CE2-CE1 4.46Å; V196-Y198 PolarHBondContact O-N 3.15Å; Y198-S200 VanDerWaalsContact C-N 3.29Å; Y198-S200 PolarHBondContact O-N 3.45Å; Y198-V201 PolarHBondContact O-N 3.02Å; Y198-M202 HydrophobicContact CD2-CE 4.17Å; Y198-M202 HydrophobicContact CD2-CG 4.05Å; Y198-M202 HydrophobicContact CE1-CG 4.18Å; Y198-M202 HydrophobicContact CE2-CE 3.85Å; Y198-M202 HydrophobicContact CE2-CG 3.51Å; Y198-M202 HydrophobicContact CE2-SD 3.94Å; Y198-M202 WeakPolarHBondContact O-CG 3.44Å; Y198-M202 PolarHBondContact O-N 2.94Å
199S91.1Very high89.8Confident7 Ų753.9 Ų53.95%0.04932%0.316CS..Hα-helixtrans-62.2-35.4-179.1-65.90000112.5F195 V196 A197 M202 L203F195-S199 VanDerWaalsContact O-CB 3.24Å; F195-S199 WeakPolarHBondContact O-CB 3.3Å; F195-S199 PolarHBondContact O-N 3.45Å; F195-S199 PolarHBondContact O-OG 3.42Å; V196-S199 PolarHBondContact O-N 3.41Å; A197-S199 PolarHBondContact O-N 3.47Å; S199-M202 PolarHBondContact O-N 3.34Å; S199-L203 WeakPolarHBondContact O-CB 3.34Å; S199-L203 PolarHBondContact O-N 3.01Å
200S91.1Very high90.7Very high60 Ų6049 Ų4942%0.4229%0.285SS..Hα-helixtrans-67.5-41.3175.7-660000112V196 A197 Y198 L203 G204V196-S200 WeakPolarHBondContact O-CB 3.05Å; V196-S200 PolarHBondContact O-N 2.94Å; V196-S200 PolarHBondContact O-OG 2.89Å; V196-S200 VanDerWaalsContact O-OG 3.07Å; A197-S200 PolarHBondContact O-N 3.42Å; Y198-S200 VanDerWaalsContact C-N 3.29Å; Y198-S200 PolarHBondContact O-N 3.45Å; S200-L203 WeakPolarHBondContact O-CB 3.34Å; S200-L203 PolarHBondContact O-N 2.79Å; S200-G204 PolarHBondContact O-N 3.44Å
201V94.1Very high91.3Very high90 Ų9045.8 Ų45.855%0.54527%0.265SS..Hα-helixtrans-62.8-44.5173.4177.90000110.4A197 Y198 L203 G204 L205A197-V201 WeakPolarHBondContact O-CG2 3.33Å; A197-V201 PolarHBondContact O-N 2.96Å; A197-V201 VanDerWaalsContact O-N 3.1Å; Y198-V201 PolarHBondContact O-N 3.02Å; V201-L203 VanDerWaalsContact C-N 3.34Å; V201-L203 PolarHBondContact O-N 3.32Å; V201-G204 PolarHBondContact O-N 3.13Å; V201-L205 WeakPolarHBondContact O-CB 3.34Å; V201-L205 PolarHBondContact O-N 2.03Å
202M94.3Very high91.8Very high17 Ų1747 Ų478%0.08428%0.278CS..Hα-helixtrans-64.4-37177.1-65.5-54.5114.900112.6C164 Y198 S199 L206C164-M202 HydrophobicContact CB-CE 4.43Å; C164-M202 HydrophobicContact CB-SD 3.64Å; Y198-M202 HydrophobicContact CD2-CE 4.17Å; Y198-M202 HydrophobicContact CD2-CG 4.05Å; Y198-M202 HydrophobicContact CE1-CG 4.18Å; Y198-M202 HydrophobicContact CE2-CE 3.85Å; Y198-M202 HydrophobicContact CE2-CG 3.51Å; Y198-M202 HydrophobicContact CE2-SD 3.94Å; Y198-M202 WeakPolarHBondContact O-CG 3.44Å; Y198-M202 PolarHBondContact O-N 2.94Å; S199-M202 PolarHBondContact O-N 3.34Å; M202-L206 WeakPolarHBondContact O-CA 3.41Å; M202-L206 WeakPolarHBondContact O-CB 3.33Å; M202-L206 PolarHBondContact O-N 2.69Å; M202-L206 HydrophobicContact SD-CD1 3.8Å; M202-L206 HydrophobicContact SD-CG 4.47Å
203L93.5Very high92.3Very high36 Ų3648 Ų4819%0.18829%0.285CS..Hα-helixtrans-59.7-46.6172.8173.368.6000111.2S199 S200 V201 F207 A208 H262 T266S199-L203 WeakPolarHBondContact O-CB 3.34Å; S199-L203 PolarHBondContact O-N 3.01Å; S200-L203 WeakPolarHBondContact O-CB 3.34Å; S200-L203 PolarHBondContact O-N 2.79Å; V201-L203 VanDerWaalsContact C-N 3.34Å; V201-L203 PolarHBondContact O-N 3.32Å; L203-F207 HydrophobicContact CD1-CB 4.26Å; L203-F207 HydrophobicContact CD1-CD1 3.74Å; L203-F207 HydrophobicContact CD1-CG 4.28Å; L203-F207 WeakPolarHBondContact O-CB 3.46Å; L203-F207 PolarHBondContact O-N 3.1Å; L203-A208 PolarHBondContact O-N 2.78Å; L203-H262 HydrophobicContact CD1-CB 3.92Å; L203-T266 HydrophobicContact CD2-CG2 4.14Å; L203-T266 WeakPolarHBondContact CD2-OG1 3.22Å
204G93.7Very high92.5Very high31 Ų3143.9 Ų43.932%0.3226%0.256SS..Iπ-helixtrans-63.2-54.5177.300000112.1S200 V201 A208 V209S200-G204 PolarHBondContact O-N 3.44Å; V201-G204 PolarHBondContact O-N 3.13Å; G204-A208 PolarHBondContact O-N 3.1Å; G204-V209 WeakPolarHBondContact O-CG2 3.12Å; G204-V209 PolarHBondContact O-N 2.96Å
205L95.6Very high92.6Very high81 Ų8139.3 Ų39.342%0.42424%0.244SC..Iπ-helixtrans-71.6-45-171.5-178.762.7000113.4V201 P210V201-L205 WeakPolarHBondContact O-CB 3.34Å; V201-L205 PolarHBondContact O-N 2.03Å; L205-P210 VanDerWaalsContact O-CD 3.27Å; L205-P210 WeakPolarHBondContact O-CD 3.44Å
206L94.9Very high92.8Very high1 Ų143.4 Ų43.41%0.00527%0.268CS..Iπ-helixtrans-105.3-4.7-168.5-59.1176.5000113.7Y118 I121 L122 L160 C164 M202Y118-L206 HydrophobicContact CD1-CB 3.26Å; Y118-L206 HydrophobicContact CD1-CD1 4Å; Y118-L206 HydrophobicContact CD1-CG 4.26Å; Y118-L206 HydrophobicContact CD2-CD1 3.8Å; Y118-L206 HydrophobicContact CE1-CB 3.45Å; Y118-L206 VanDerWaalsContact CE1-CB 3.45Å; Y118-L206 HydrophobicContact CE1-CD1 4.28Å; Y118-L206 HydrophobicContact CE2-CD1 4.13Å; Y118-L206 HydrophobicContact CG-CB 3.86Å; Y118-L206 HydrophobicContact CG-CD1 3.72Å; Y118-L206 HydrophobicContact CG-CG 4.42Å; I121-L206 VanDerWaalsContact CG2-O 3.28Å; I121-L206 WeakPolarHBondContact CG2-O 3.38Å; L122-L206 HydrophobicContact CD1-CD2 4.11Å; L160-L206 HydrophobicContact CD2-CD2 4.49Å; C164-L206 HydrophobicContact CB-CD1 3.8Å; M202-L206 WeakPolarHBondContact O-CA 3.41Å; M202-L206 WeakPolarHBondContact O-CB 3.33Å; M202-L206 PolarHBondContact O-N 2.69Å; M202-L206 HydrophobicContact SD-CD1 3.8Å; M202-L206 HydrophobicContact SD-CG 4.47Å
207F93.3Very high92.8Very high15 Ų1542.7 Ų42.77%0.06627%0.265CS..Iπ-helixtrans-124.7-58.5173.5174.9-97.1000112.6I121 L203 P210 F211 F254 F258 L259 H262I121-F207 HydrophobicContact CD1-CD2 4Å; L203-F207 HydrophobicContact CD1-CB 4.26Å; L203-F207 HydrophobicContact CD1-CD1 3.74Å; L203-F207 HydrophobicContact CD1-CG 4.28Å; L203-F207 WeakPolarHBondContact O-CB 3.46Å; L203-F207 PolarHBondContact O-N 3.1Å; F207-P210 WeakPolarHBondContact O-CD 3.17Å; F207-F211 WeakPolarHBondContact O-CB 3.4Å; F207-F211 PolarHBondContact O-N 3.15Å; F207-F254 HydrophobicContact CE2-CD1 4.26Å; F207-F254 HydrophobicContact CE2-CE1 4.38Å; F207-F258 HydrophobicContact CD2-CB 4.46Å; F207-F258 HydrophobicContact CE2-CB 3.9Å; F207-L259 HydrophobicContact CE1-CD1 4.18Å; F207-L259 HydrophobicContact CZ-CB 4.24Å; F207-L259 HydrophobicContact CZ-CD1 3.74Å; F207-H262 VanDerWaalsContact CB-CD2 3.5Å; F207-H262 WeakPolarHBondContact CB-CD2 3.12Å; F207-H262 HydrophobicContact CD1-CB 4.12Å; F207-H262 AromaticContact CD1-CD2 3.96Å; F207-H262 HydrophobicContact CD2-CB 4.36Å; F207-H262 AromaticContact CD2-CD2 3.71Å; F207-H262 AromaticContact CD2-CE1 3.66Å; F207-H262 AromaticContact CD2-CG 3.66Å; F207-H262 AromaticContact CD2-ND1 3.63Å; F207-H262 AromaticContact CD2-NE2 3.75Å; F207-H262 HydrophobicContact CE1-CB 4.03Å; F207-H262 HydrophobicContact CE2-CB 4.28Å; F207-H262 AromaticContact CE2-CG 3.95Å; F207-H262 AromaticContact CE2-ND1 3.85Å; F207-H262 HydrophobicContact CG-CB 4.29Å; F207-H262 AromaticContact CG-CD2 3.43Å; F207-H262 VanDerWaalsContact CG-CD2 3.43Å; F207-H262 WeakPolarHBondContact CG-CD2 3.24Å; F207-H262 AromaticContact CG-CG 3.71Å; F207-H262 AromaticContact CG-NE2 3.77Å; F207-H262 HydrophobicContact CZ-CB 4.12Å
208A93.6Very high92.6Very high47 Ų4740.3 Ų40.339%0.38824%0.243SC..Iπ-helixtrans-65-46-173.300000112.6L203 G204 F211 A212L203-A208 PolarHBondContact O-N 2.78Å; G204-A208 PolarHBondContact O-N 3.1Å; A208-F211 PolarHBondContact O-N 3.44Å; A208-A212 WeakPolarHBondContact O-CB 3.36Å; A208-A212 PolarHBondContact O-N 3.44Å
209V95.2Very high92.3Very high77 Ų7744 Ų4447%0.46726%0.262SS..Hα-helixtrans-62.5-52.8176.5167.20000111.8G204 F211 A212 I213G204-V209 WeakPolarHBondContact O-CG2 3.12Å; G204-V209 PolarHBondContact O-N 2.96Å; V209-F211 VanDerWaalsContact C-N 3.33Å; V209-F211 PolarHBondContact O-N 3.03Å; V209-A212 PolarHBondContact O-N 3.19Å; V209-I213 HydrophobicContact CG1-CD1 3.92Å; V209-I213 WeakPolarHBondContact O-CG1 3.23Å; V209-I213 PolarHBondContact O-N 3.14Å
210P94Very high92.2Very high3 Ų347 Ų472%0.01928%0.278CS..Hα-helixtrans-56.1-43174.6-30.838.2000113.8I121 L122 T125 L205 F207 I213 I214I121-P210 HydrophobicContact CG2-CB 3.52Å; I121-P210 HydrophobicContact CG2-CG 4.01Å; L122-P210 HydrophobicContact CD2-CB 4.25Å; L122-P210 HydrophobicContact CD2-CG 3.57Å; T125-P210 HydrophobicContact CG2-CB 4.49Å; T125-P210 WeakPolarHBondContact OG1-CB 3.22Å; L205-P210 VanDerWaalsContact O-CD 3.27Å; L205-P210 WeakPolarHBondContact O-CD 3.44Å; F207-P210 WeakPolarHBondContact O-CD 3.17Å; P210-I213 PolarHBondContact O-N 3.18Å; P210-I214 WeakPolarHBondContact O-CG1 3.36Å; P210-I214 PolarHBondContact O-N 3.07Å
211F91Very high91.8Very high54 Ų5444.1 Ų44.124%0.23726%0.258CS..Hα-helixtrans-62-45.7177.7-179.1-110.7000111.8F207 A208 V209 I213 I214 L215 F254F207-F211 WeakPolarHBondContact O-CB 3.4Å; F207-F211 PolarHBondContact O-N 3.15Å; A208-F211 PolarHBondContact O-N 3.44Å; V209-F211 VanDerWaalsContact C-N 3.33Å; V209-F211 PolarHBondContact O-N 3.03Å; F211-I213 VanDerWaalsContact C-N 3.34Å; F211-I213 PolarHBondContact O-N 2.8Å; F211-I214 PolarHBondContact O-N 3.48Å; F211-L215 HydrophobicContact CD1-CD1 3.86Å; F211-L215 HydrophobicContact CD1-CG 4.41Å; F211-L215 HydrophobicContact CE1-CD1 3.39Å; F211-L215 HydrophobicContact CE1-CG 4.1Å; F211-L215 HydrophobicContact CE2-CD1 4.48Å; F211-L215 HydrophobicContact CE2-CD2 4.47Å; F211-L215 HydrophobicContact CE2-CG 4.35Å; F211-L215 HydrophobicContact CZ-CD1 3.75Å; F211-L215 HydrophobicContact CZ-CD2 4.2Å; F211-L215 HydrophobicContact CZ-CG 4.06Å; F211-L215 WeakPolarHBondContact O-CG 3.49Å; F211-L215 PolarHBondContact O-N 3.3Å; F211-F254 HydrophobicContact CB-CE1 4.29Å; F211-F254 AromaticContact CD2-CD1 3.54Å; F211-F254 HydrophobicContact CD2-CD1 3.54Å; F211-F254 HydrophobicContact CD2-CE1 4.01Å; F211-F254 HydrophobicContact CD2-CG 4.2Å; F211-F254 HydrophobicContact CE2-CB 4.39Å; F211-F254 HydrophobicContact CE2-CD1 4.2Å
212A93.4Very high91.3Very high48 Ų4841.6 Ų41.640%0.39725%0.246SC..Hα-helixtrans-60.2-42.5175.100000111.9A208 V209 I214 L215 V216A208-A212 WeakPolarHBondContact O-CB 3.36Å; A208-A212 PolarHBondContact O-N 3.44Å; V209-A212 PolarHBondContact O-N 3.19Å; A212-I214 PolarHBondContact O-N 2.86Å; A212-L215 PolarHBondContact O-N 3.23Å; A212-V216 WeakPolarHBondContact O-CG2 3.35Å; A212-V216 PolarHBondContact O-N 3.44Å
213I93.9Very high90.8Very high68 Ų6848.7 Ų48.735%0.34927%0.272SS..Hα-helixtrans-59.5-46.3175.7-68165.9000110.8T125 V129 V209 P210 F211 V216 C217T125-I213 HydrophobicContact CG2-CB 4.11Å; T125-I213 HydrophobicContact CG2-CG2 3.73Å; V129-I213 HydrophobicContact CG2-CG2 3.65Å; V209-I213 HydrophobicContact CG1-CD1 3.92Å; V209-I213 WeakPolarHBondContact O-CG1 3.23Å; V209-I213 PolarHBondContact O-N 3.14Å; P210-I213 PolarHBondContact O-N 3.18Å; F211-I213 VanDerWaalsContact C-N 3.34Å; F211-I213 PolarHBondContact O-N 2.8Å; I213-V216 PolarHBondContact O-N 2.92Å; I213-C217 VanDerWaalsContact O-CB 3.28Å; I213-C217 WeakPolarHBondContact O-CB 3.48Å; I213-C217 PolarHBondContact O-N 3.18Å; I213-C217 PolarHBondContact O-SG 3Å
214I90.8Very high90.3Very high0 Ų053.8 Ų53.80%029%0.289CS..Hα-helixtrans-61.4-47.8178.4-71.2171.3000110.6T125 P210 F211 A212 V216 C217 Y218 V250 F254T125-I214 HydrophobicContact CG2-CG1 4.23Å; T125-I214 WeakPolarHBondContact OG1-CD1 3.41Å; P210-I214 WeakPolarHBondContact O-CG1 3.36Å; P210-I214 PolarHBondContact O-N 3.07Å; F211-I214 PolarHBondContact O-N 3.48Å; A212-I214 PolarHBondContact O-N 2.86Å; I214-V216 PolarHBondContact O-N 3.5Å; I214-C217 WeakPolarHBondContact O-CB 3.1Å; I214-C217 PolarHBondContact O-N 3.46Å; I214-Y218 HydrophobicContact CG2-CD2 3.6Å; I214-Y218 HydrophobicContact CG2-CE2 3.43Å; I214-Y218 VanDerWaalsContact CG2-CE2 3.43Å; I214-Y218 HydrophobicContact CG2-CG 4.34Å; I214-Y218 WeakPolarHBondContact O-CB 2.97Å; I214-Y218 VanDerWaalsContact O-CG 3.31Å; I214-Y218 PolarHBondContact O-N 2.95Å; I214-V250 HydrophobicContact CD1-CG1 4.14Å; I214-V250 HydrophobicContact CG2-CG1 4.1Å; I214-F254 HydrophobicContact CD1-CD2 4.11Å; I214-F254 HydrophobicContact CD1-CE1 4.22Å; I214-F254 HydrophobicContact CD1-CE2 3.2Å; I214-F254 HydrophobicContact CD1-CZ 3.25Å
215L90.1Very high89.4Confident68 Ų6853.3 Ų53.336%0.35628%0.279SS..Hα-helixtrans-56.9-52.3177.6-74.5179.8000111F211 A212 C217 Y218 M219 L251F211-L215 HydrophobicContact CD1-CD1 3.86Å; F211-L215 HydrophobicContact CD1-CG 4.41Å; F211-L215 HydrophobicContact CE1-CD1 3.39Å; F211-L215 HydrophobicContact CE1-CG 4.1Å; F211-L215 HydrophobicContact CE2-CD1 4.48Å; F211-L215 HydrophobicContact CE2-CD2 4.47Å; F211-L215 HydrophobicContact CE2-CG 4.35Å; F211-L215 HydrophobicContact CZ-CD1 3.75Å; F211-L215 HydrophobicContact CZ-CD2 4.2Å; F211-L215 HydrophobicContact CZ-CG 4.06Å; F211-L215 WeakPolarHBondContact O-CG 3.49Å; F211-L215 PolarHBondContact O-N 3.3Å; A212-L215 PolarHBondContact O-N 3.23Å; L215-C217 VanDerWaalsContact C-N 3.34Å; L215-C217 PolarHBondContact O-N 3.44Å; L215-Y218 PolarHBondContact O-N 3.29Å; L215-Y218 VanDerWaalsContact O-N 3.16Å; L215-M219 WeakPolarHBondContact O-CB 3.24Å; L215-M219 VanDerWaalsContact O-CG 3.26Å; L215-M219 WeakPolarHBondContact O-CG 3.47Å; L215-M219 PolarHBondContact O-N 3.38Å; L215-L251 HydrophobicContact CD2-CD2 4.4Å
216V91.9Very high88.5Confident86 Ų8656.2 Ų56.252%0.52129%0.294SS..Hα-helixtrans-58.9-46.2178.4172.20000111A212 I213 I214 Y218 M219 L220A212-V216 WeakPolarHBondContact O-CG2 3.35Å; A212-V216 PolarHBondContact O-N 3.44Å; I213-V216 PolarHBondContact O-N 2.92Å; I214-V216 PolarHBondContact O-N 3.5Å; V216-Y218 VanDerWaalsContact C-N 3.27Å; V216-Y218 PolarHBondContact O-N 3.49Å; V216-M219 PolarHBondContact O-N 2.96Å; V216-L220 HydrophobicContact CG1-CD1 3.96Å; V216-L220 HydrophobicContact CG1-CG 4.33Å; V216-L220 WeakPolarHBondContact O-CB 3.27Å; V216-L220 VanDerWaalsContact O-CG 3.27Å; V216-L220 WeakPolarHBondContact O-CG 3.34Å; V216-L220 PolarHBondContact O-N 3.32Å
217C89.4Confident87.7Confident15 Ų1562.3 Ų62.310%0.10132%0.32CS..Hα-helixtrans-56.9-42177.7-76.50000112.1C132 I213 I214 L215 M221C132-C217 HydrophobicContact CB-CB 3.83Å; C132-C217 PolarHBondContact SG-O 2.66Å; I213-C217 VanDerWaalsContact O-CB 3.28Å; I213-C217 WeakPolarHBondContact O-CB 3.48Å; I213-C217 PolarHBondContact O-N 3.18Å; I213-C217 PolarHBondContact O-SG 3Å; I214-C217 WeakPolarHBondContact O-CB 3.1Å; I214-C217 PolarHBondContact O-N 3.46Å; L215-C217 VanDerWaalsContact C-N 3.34Å; L215-C217 PolarHBondContact O-N 3.44Å; C217-M221 VanDerWaalsContact O-CB 3.24Å; C217-M221 WeakPolarHBondContact O-CB 3.47Å; C217-M221 PolarHBondContact O-N 3.34Å
218Y86.1Confident86.2Confident10 Ų1067.1 Ų67.14%0.03935%0.353CS..Hα-helixtrans-77.3-35.8-178.4-69.7-9.8000112.7S128 I214 L215 V216 M221 A222 I247 V250 L251S128-Y218 VanDerWaalsContact OG-CZ 3.29Å; S128-Y218 PolarHBondContact OG-OH 2.8Å; I214-Y218 HydrophobicContact CG2-CD2 3.6Å; I214-Y218 HydrophobicContact CG2-CE2 3.43Å; I214-Y218 VanDerWaalsContact CG2-CE2 3.43Å; I214-Y218 HydrophobicContact CG2-CG 4.34Å; I214-Y218 WeakPolarHBondContact O-CB 2.97Å; I214-Y218 VanDerWaalsContact O-CG 3.31Å; I214-Y218 PolarHBondContact O-N 2.95Å; L215-Y218 PolarHBondContact O-N 3.29Å; L215-Y218 VanDerWaalsContact O-N 3.16Å; V216-Y218 VanDerWaalsContact C-N 3.27Å; V216-Y218 PolarHBondContact O-N 3.49Å; Y218-M221 HydrophobicContact CD1-CE 3.34Å; Y218-M221 HydrophobicContact CE1-CE 3.58Å; Y218-M221 HydrophobicContact CG-CE 4.42Å; Y218-M221 PolarHBondContact O-N 3.22Å; Y218-A222 VanDerWaalsContact O-CB 3.23Å; Y218-A222 WeakPolarHBondContact O-CB 3.31Å; Y218-A222 PolarHBondContact O-N 3.44Å; Y218-I247 HydrophobicContact CD1-CB 4.48Å; Y218-I247 HydrophobicContact CD1-CD1 4.46Å; Y218-I247 HydrophobicContact CD1-CG1 3.7Å; Y218-I247 HydrophobicContact CD1-CG2 4.45Å; Y218-I247 HydrophobicContact CD2-CB 4.29Å; Y218-I247 HydrophobicContact CD2-CG1 4.35Å; Y218-I247 HydrophobicContact CD2-CG2 3.66Å; Y218-I247 HydrophobicContact CE1-CB 4.41Å; Y218-I247 HydrophobicContact CE1-CG1 3.74Å; Y218-I247 HydrophobicContact CE2-CB 4.22Å; Y218-I247 HydrophobicContact CE2-CG1 4.4Å; Y218-I247 HydrophobicContact CE2-CG2 3.99Å; Y218-I247 HydrophobicContact CG-CB 4.39Å; Y218-I247 HydrophobicContact CG-CG1 3.98Å; Y218-I247 HydrophobicContact CG-CG2 3.88Å; Y218-V250 HydrophobicContact CE2-CB 3.96Å; Y218-V250 HydrophobicContact CE2-CG1 4.02Å; Y218-V250 WeakPolarHBondContact OH-CB 3.2Å; Y218-V250 WeakPolarHBondContact OH-CG2 3.43Å; Y218-L251 HydrophobicContact CD2-CD1 4.24Å; Y218-L251 HydrophobicContact CD2-CD2 3.94Å; Y218-L251 HydrophobicContact CD2-CG 3.88Å; Y218-L251 HydrophobicContact CE2-CD2 4.28Å; Y218-L251 HydrophobicContact CE2-CG 4.02Å
219M87.9Confident84.6Confident109 Ų10967.7 Ų67.754%0.53736%0.358SS..Hα-helixtrans-61.9-46171.1-68-52.2-71.100111.4L215 V216 A222 R223L215-M219 WeakPolarHBondContact O-CB 3.24Å; L215-M219 VanDerWaalsContact O-CG 3.26Å; L215-M219 WeakPolarHBondContact O-CG 3.47Å; L215-M219 PolarHBondContact O-N 3.38Å; V216-M219 PolarHBondContact O-N 2.96Å; M219-A222 PolarHBondContact O-N 2.92Å; M219-R223 WeakPolarHBondContact O-CB 3.32Å; M219-R223 VanDerWaalsContact O-CG 3.25Å; M219-R223 WeakPolarHBondContact O-CG 3.43Å; M219-R223 PolarHBondContact O-N 3.21Å
220L88.2Confident82.4Confident70 Ų7075.1 Ų75.137%0.36638%0.379SS..Hα-helixtrans-64.1-41.9177.1-67.9175.6000112.1L136 V216 R224L136-L220 HydrophobicContact CD1-CB 4.01Å; L136-L220 HydrophobicContact CD1-CD1 4.09Å; V216-L220 HydrophobicContact CG1-CD1 3.96Å; V216-L220 HydrophobicContact CG1-CG 4.33Å; V216-L220 WeakPolarHBondContact O-CB 3.27Å; V216-L220 VanDerWaalsContact O-CG 3.27Å; V216-L220 WeakPolarHBondContact O-CG 3.34Å; V216-L220 PolarHBondContact O-N 3.32Å; L220-R224 PolarHBondContact O-N 2.93Å; L220-R224 VanDerWaalsContact O-N 3.15Å
221M83.8Confident80.4Confident1 Ų178.9 Ų78.91%0.00542%0.418CS..Hα-helixtrans-65.8-47.4177.3178.8162.843.400111.3V135 C217 Y218 R223 R224 L225 I247V135-M221 HydrophobicContact CB-CG 4.35Å; V135-M221 HydrophobicContact CB-SD 4.5Å; V135-M221 HydrophobicContact CG1-CG 4.29Å; V135-M221 HydrophobicContact CG2-CG 4.1Å; V135-M221 HydrophobicContact CG2-SD 3.8Å; C217-M221 VanDerWaalsContact O-CB 3.24Å; C217-M221 WeakPolarHBondContact O-CB 3.47Å; C217-M221 PolarHBondContact O-N 3.34Å; Y218-M221 HydrophobicContact CD1-CE 3.34Å; Y218-M221 HydrophobicContact CE1-CE 3.58Å; Y218-M221 HydrophobicContact CG-CE 4.42Å; Y218-M221 PolarHBondContact O-N 3.22Å; M221-R223 PolarHBondContact O-N 2.81Å; M221-R224 PolarHBondContact O-N 3.16Å; M221-R224 VanDerWaalsContact O-N 3.15Å; M221-L225 HydrophobicContact CG-CD1 3.69Å; M221-L225 HydrophobicContact CG-CG 4.21Å; M221-L225 WeakPolarHBondContact O-CG 3.5Å; M221-L225 PolarHBondContact O-N 3.19Å; M221-I247 HydrophobicContact CE-CD1 3.27Å; M221-I247 HydrophobicContact CE-CG1 3.21Å; M221-I247 HydrophobicContact CG-CD1 4.06Å; M221-I247 HydrophobicContact SD-CD1 3.97Å; M221-I247 HydrophobicContact SD-CG1 4.36Å
222A82.4Confident78.5Confident36 Ų3680.9 Ų80.930%0.29844%0.435SS..Hα-helixtrans-57.2-48.3176.500000111.3Y218 M219 R224 L225 L226Y218-A222 VanDerWaalsContact O-CB 3.23Å; Y218-A222 WeakPolarHBondContact O-CB 3.31Å; Y218-A222 PolarHBondContact O-N 3.44Å; M219-A222 PolarHBondContact O-N 2.92Å; A222-R224 VanDerWaalsContact C-N 3.27Å; A222-R224 PolarHBondContact O-N 3.17Å; A222-L225 PolarHBondContact O-N 3.4Å; A222-L226 HydrophobicContact CB-CD1 4.4Å; A222-L226 WeakPolarHBondContact O-CB 3.41Å; A222-L226 WeakPolarHBondContact O-CD1 3.24Å; A222-L226 VanDerWaalsContact O-CG 3.28Å; A222-L226 WeakPolarHBondContact O-CG 3.46Å; A222-L226 PolarHBondContact O-N 3.36Å
223R84.8Confident76.1Confident166 Ų16685.3 Ų85.363%0.62646%0.463SS*.Hα-helixtrans-55.1-40.2175.9-75.7176.3-178.4-178.61.8112.7M219 M221M219-R223 WeakPolarHBondContact O-CB 3.32Å; M219-R223 VanDerWaalsContact O-CG 3.25Å; M219-R223 WeakPolarHBondContact O-CG 3.43Å; M219-R223 PolarHBondContact O-N 3.21Å; M221-R223 PolarHBondContact O-N 2.81Å
224R81.5Confident73.9Confident144 Ų14484.5 Ų84.554%0.54347%0.472SS..Hα-helixtrans-74.5-33.7176.7-73.3-56.6-172.5156.3-2.5113.4V135 L136 L220 M221 A222V135-R224 HydrophobicContact CG1-CB 4.13Å; L136-R224 HydrophobicContact CD2-CB 4.24Å; L136-R224 HydrophobicContact CD2-CG 3.35Å; L220-R224 PolarHBondContact O-N 2.93Å; L220-R224 VanDerWaalsContact O-N 3.15Å; M221-R224 PolarHBondContact O-N 3.16Å; M221-R224 VanDerWaalsContact O-N 3.15Å; A222-R224 VanDerWaalsContact C-N 3.27Å; A222-R224 PolarHBondContact O-N 3.17Å
225L76.1Confident72.1Confident21 Ų2188.1 Ų88.111%0.1151%0.509CS..Hα-helixtrans-73.7-32.6-179.9-66.3173.5000112.4V135 M221 A222 K240 V244V135-L225 HydrophobicContact CG1-CD2 4.35Å; M221-L225 HydrophobicContact CG-CD1 3.69Å; M221-L225 HydrophobicContact CG-CG 4.21Å; M221-L225 WeakPolarHBondContact O-CG 3.5Å; M221-L225 PolarHBondContact O-N 3.19Å; A222-L225 PolarHBondContact O-N 3.4Å; L225-K240 HydrophobicContact CD2-CB 3.74Å; L225-K240 HydrophobicContact CD2-CD 3.55Å; L225-K240 HydrophobicContact CD2-CG 3.4Å; L225-K240 VanDerWaalsContact CD2-CG 3.4Å; L225-K240 PolarHBondContact O-NZ 3.45Å; L225-V244 HydrophobicContact CD1-CG2 3.79Å
226L77.2Confident70.6Confident142 Ų14289.3 Ų89.374%0.74352%0.515SS*.Hα-helixtrans-78.6-15.6179.1-72.6161.6000114.1A222 P228A222-L226 HydrophobicContact CB-CD1 4.4Å; A222-L226 WeakPolarHBondContact O-CB 3.41Å; A222-L226 WeakPolarHBondContact O-CD1 3.24Å; A222-L226 VanDerWaalsContact O-CG 3.28Å; A222-L226 WeakPolarHBondContact O-CG 3.46Å; A222-L226 PolarHBondContact O-N 3.36Å; L226-P228 WeakPolarHBondContact O-CD 3.13Å
227K77.4Confident69.3Low128 Ų12888.2 Ų88.256%0.55751%0.51SS*.SBendtrans-63.9126.8172.9-76.9-172.1-179.9-158.10109.7A229K227-A229 PolarHBondContact O-N 2.96Å
228P61.1Low68Low117 Ų11796.1 Ų96.176%0.7654%0.537SS*.  trans-56.9124.9174.7-21.631.4000109.6L226 Y230L226-P228 WeakPolarHBondContact O-CD 3.13Å; P228-Y230 PolarHBondContact O-N 3.46Å
229A60.3Low66.9Low58 Ų5899.2 Ų99.248%0.47957%0.565SS.*  trans-79.2109.9164.600000106K227 G231K227-A229 PolarHBondContact O-N 2.96Å; A229-G231 PolarHBondContact O-N 3.4Å; A229-G231 VanDerWaalsContact O-N 3.13Å
230Y49.6Very low65.9Low234 Ų23496.2 Ų96.292%0.91855%0.549SS*.THydrogen-bonded Turntrans-53.6120.4171-100.8-94.2000108.5P228P228-Y230 PolarHBondContact O-N 3.46Å
231G52.5Low64.9Low82 Ų82101.2 Ų101.285%0.84556%0.563SS**THydrogen-bonded Turntrans92.615.117000000118.3A229A229-G231 PolarHBondContact O-N 3.4Å; A229-G231 VanDerWaalsContact O-N 3.13Å
232T51Low64.3Low96 Ų96105.3 Ų105.359%0.58958%0.581SS**  trans-116.485.9172.9-28.10000112.2G234T232-G234 VanDerWaalsContact C-N 3.3Å; T232-G234 PolarHBondContact O-N 3.07Å
233S42.3Very low63.6Low140 Ų140104.2 Ų104.298%0.97957%0.571SS**  trans-75.282.7166.1-66.90000109.5
234G47.8Very low62.9Low52 Ų5299.5 Ų99.554%0.53656%0.56SS.*SBendtrans179.7142.7178.100000109.9T232T232-G234 VanDerWaalsContact C-N 3.3Å; T232-G234 PolarHBondContact O-N 3.07Å
235G53.2Low62.5Low75 Ų7597.1 Ų97.177%0.77355%0.551SS**SBendtrans-50.4167.9-173.100000115.6P237G235-P237 WeakPolarHBondContact O-CD 3.48Å
236L58.3Low62.3Low93 Ų9396.7 Ų96.749%0.48755%0.55SS..PPolyproline II helixtrans-49.2121.3-171.1-147.878.7000112.6K240 V244L236-K240 HydrophobicContact CD1-CB 4.45Å; L236-K240 HydrophobicContact CD1-CD 4.07Å; L236-K240 HydrophobicContact CD2-CB 3.71Å; L236-K240 HydrophobicContact CG-CB 3.61Å; L236-K240 HydrophobicContact CG-CD 4.09Å; L236-K240 HydrophobicContact CG-CG 4.45Å; L236-V244 HydrophobicContact CD2-CG2 4.18Å
237P65.4Low62.2Low63 Ų6391 Ų9141%0.40952%0.52SS..PPolyproline II helixtrans-49.2143.6-178.9-28.828.8000112.9G235 A239 K240 R241G235-P237 WeakPolarHBondContact O-CD 3.48Å; P237-A239 PolarHBondContact O-N 3.1Å; P237-K240 HydrophobicContact CB-CG 4.13Å; P237-K240 HydrophobicContact CG-CD 4.23Å; P237-K240 HydrophobicContact CG-CG 4.19Å; P237-K240 WeakPolarHBondContact O-CA 3.35Å; P237-K240 VanDerWaalsContact O-CB 3.31Å; P237-K240 WeakPolarHBondContact O-CB 3.42Å; P237-K240 PolarHBondContact O-N 2.87Å; P237-R241 PolarHBondContact O-N 2.83Å
238R61.7Low62.1Low181 Ų18187.6 Ų87.668%0.68352%0.516SS*.Hα-helixtrans-52.2-33.8-174.4-166.7174.7-175.3166.95.2113.7K242R238-K242 PolarHBondContact O-N 3.19Å
239A62Low63Low75 Ų7582.8 Ų82.862%0.6248%0.483SS*.Hα-helixtrans-66.9-43.2173.400000112.7P237 K242 S243P237-A239 PolarHBondContact O-N 3.1Å; A239-K242 PolarHBondContact O-N 3.34Å; A239-S243 PolarHBondContact O-N 3.07Å; A239-S243 PolarHBondContact O-OG 3.27Å
240K67.8Low63.9Low46 Ų4680 Ų8020%0.246%0.46CS..Hα-helixtrans-62.5-45.4175.6-64.6-156.7-176.2-1800111.3L225 L236 P237 K242 S243 V244L225-K240 HydrophobicContact CD2-CB 3.74Å; L225-K240 HydrophobicContact CD2-CD 3.55Å; L225-K240 HydrophobicContact CD2-CG 3.4Å; L225-K240 VanDerWaalsContact CD2-CG 3.4Å; L225-K240 PolarHBondContact O-NZ 3.45Å; L236-K240 HydrophobicContact CD1-CB 4.45Å; L236-K240 HydrophobicContact CD1-CD 4.07Å; L236-K240 HydrophobicContact CD2-CB 3.71Å; L236-K240 HydrophobicContact CG-CB 3.61Å; L236-K240 HydrophobicContact CG-CD 4.09Å; L236-K240 HydrophobicContact CG-CG 4.45Å; P237-K240 HydrophobicContact CB-CG 4.13Å; P237-K240 HydrophobicContact CG-CD 4.23Å; P237-K240 HydrophobicContact CG-CG 4.19Å; P237-K240 WeakPolarHBondContact O-CA 3.35Å; P237-K240 VanDerWaalsContact O-CB 3.31Å; P237-K240 WeakPolarHBondContact O-CB 3.42Å; P237-K240 PolarHBondContact O-N 2.87Å; K240-K242 PolarHBondContact O-N 3.19Å; K240-S243 PolarHBondContact O-N 3.05Å; K240-V244 WeakPolarHBondContact O-CG2 3.42Å; K240-V244 PolarHBondContact O-N 2.86Å
241R67.4Low65.4Low175 Ų17572 Ų7266%0.6643%0.433SS*.Hα-helixtrans-63-39.2179.1-165.9175.7-174.6-1261.4112.8P237 R245P237-R241 PolarHBondContact O-N 2.83Å; R241-R245 WeakPolarHBondContact O-CB 3.36Å; R241-R245 PolarHBondContact O-N 3.34Å
242K69.5Low66.9Low88 Ų8869.9 Ų69.938%0.38341%0.408SS..Hα-helixtrans-63.7-41.4175.1-175.8-179.8178.4-1780112R238 A239 K240 T246R238-K242 PolarHBondContact O-N 3.19Å; A239-K242 PolarHBondContact O-N 3.34Å; K240-K242 PolarHBondContact O-N 3.19Å; K242-T246 PolarHBondContact O-N 3.29Å; K242-T246 VanDerWaalsContact O-N 3.09Å; K242-T246 PolarHBondContact O-OG1 3.33Å
243S69.3Low68.5Low12 Ų1265.4 Ų65.48%0.08438%0.38CS..Hα-helixtrans-65.7-51.1177.6-68.60000111.8A239 K240 R245 T246 I247A239-S243 PolarHBondContact O-N 3.07Å; A239-S243 PolarHBondContact O-OG 3.27Å; K240-S243 PolarHBondContact O-N 3.05Å; S243-R245 PolarHBondContact O-N 2.92Å; S243-T246 PolarHBondContact O-N 3.34Å; S243-I247 WeakPolarHBondContact O-CG1 3.48Å; S243-I247 PolarHBondContact O-N 3.48Å
244V70Confident70.6Confident67 Ų6758.8 Ų58.841%0.40633%0.334SS..Hα-helixtrans-55.6-40.5176.41740000111.8L225 L236 K240 I247 A248L225-V244 HydrophobicContact CD1-CG2 3.79Å; L236-V244 HydrophobicContact CD2-CG2 4.18Å; K240-V244 WeakPolarHBondContact O-CG2 3.42Å; K240-V244 PolarHBondContact O-N 2.86Å; V244-I247 WeakPolarHBondContact O-CB 3.49Å; V244-I247 PolarHBondContact O-N 2.91Å; V244-A248 PolarHBondContact O-N 3.47Å
245R72.7Confident72.3Confident94 Ų9459 Ų5936%0.35533%0.331SS..Hα-helixtrans-65.1-41.5177.1-172171.7-166-169.82113.3R241 S243 I247 A248 I249 L308 A309R241-R245 WeakPolarHBondContact O-CB 3.36Å; R241-R245 PolarHBondContact O-N 3.34Å; S243-R245 PolarHBondContact O-N 2.92Å; R245-I247 VanDerWaalsContact C-N 3.29Å; R245-A248 PolarHBondContact O-N 2.96Å; R245-I249 HydrophobicContact CG-CD1 4.06Å; R245-I249 WeakPolarHBondContact O-CD1 3.49Å; R245-I249 WeakPolarHBondContact O-CG1 3.33Å; R245-I249 PolarHBondContact O-N 3.35Å; R245-I249 VanDerWaalsContact O-N 3.08Å; R245-L308 PolarHBondContact NH1-O 3.41Å; R245-L308 PolarHBondContact NH2-O 2.63Å; R245-A309 HydrophobicContact CG-CB 4.38Å; R245-A309 VanDerWaalsContact NH1-CA 3.3Å; R245-A309 PolarHBondContact NH1-O 2.96Å; R245-A309 VanDerWaalsContact NH1-O 3.17Å
246T72.1Confident73.9Confident13 Ų1360.4 Ų60.48%0.0832%0.32CS..Hα-helixtrans-64.9-38.3176.4-500000110.3I127 R131 K242 S243 I249 V250I127-T246 HydrophobicContact CG2-CG2 4.25Å; R131-T246 HydrophobicContact CG-CG2 4.35Å; K242-T246 PolarHBondContact O-N 3.29Å; K242-T246 VanDerWaalsContact O-N 3.09Å; K242-T246 PolarHBondContact O-OG1 3.33Å; S243-T246 PolarHBondContact O-N 3.34Å; T246-I249 PolarHBondContact O-N 2.75Å; T246-V250 HydrophobicContact CG2-CG2 4.42Å; T246-V250 VanDerWaalsContact O-CG2 3.31Å; T246-V250 WeakPolarHBondContact O-CG2 3.44Å; T246-V250 PolarHBondContact O-N 3.01Å
247I74.6Confident75.3Confident22 Ų2256.1 Ų56.111%0.11330%0.298CS..Hα-helixtrans-56.7-54.5173.1-63.8167.6000110.6Y218 M221 S243 V244 R245 I249 V250 L251Y218-I247 HydrophobicContact CD1-CB 4.48Å; Y218-I247 HydrophobicContact CD1-CD1 4.46Å; Y218-I247 HydrophobicContact CD1-CG1 3.7Å; Y218-I247 HydrophobicContact CD1-CG2 4.45Å; Y218-I247 HydrophobicContact CD2-CB 4.29Å; Y218-I247 HydrophobicContact CD2-CG1 4.35Å; Y218-I247 HydrophobicContact CD2-CG2 3.66Å; Y218-I247 HydrophobicContact CE1-CB 4.41Å; Y218-I247 HydrophobicContact CE1-CG1 3.74Å; Y218-I247 HydrophobicContact CE2-CB 4.22Å; Y218-I247 HydrophobicContact CE2-CG1 4.4Å; Y218-I247 HydrophobicContact CE2-CG2 3.99Å; Y218-I247 HydrophobicContact CG-CB 4.39Å; Y218-I247 HydrophobicContact CG-CG1 3.98Å; Y218-I247 HydrophobicContact CG-CG2 3.88Å; M221-I247 HydrophobicContact CE-CD1 3.27Å; M221-I247 HydrophobicContact CE-CG1 3.21Å; M221-I247 HydrophobicContact CG-CD1 4.06Å; M221-I247 HydrophobicContact SD-CD1 3.97Å; M221-I247 HydrophobicContact SD-CG1 4.36Å; S243-I247 WeakPolarHBondContact O-CG1 3.48Å; S243-I247 PolarHBondContact O-N 3.48Å; V244-I247 WeakPolarHBondContact O-CB 3.49Å; V244-I247 PolarHBondContact O-N 2.91Å; R245-I247 VanDerWaalsContact C-N 3.29Å; I247-I249 VanDerWaalsContact C-N 3.29Å; I247-I249 PolarHBondContact O-N 3.33Å; I247-V250 PolarHBondContact O-N 3.04Å; I247-L251 HydrophobicContact CG2-CD1 3.64Å; I247-L251 HydrophobicContact CG2-CG 4.25Å; I247-L251 WeakPolarHBondContact O-CB 3.16Å; I247-L251 WeakPolarHBondContact O-CG 3.27Å; I247-L251 PolarHBondContact O-N 2.83Å
248A75.8Confident76.5Confident57 Ų5753.1 Ų53.147%0.47128%0.278SS..Hα-helixtrans-58.6-42.2-177.100000112.1V244 R245 A252V244-A248 PolarHBondContact O-N 3.47Å; R245-A248 PolarHBondContact O-N 2.96Å; A248-A252 VanDerWaalsContact O-CB 3.27Å; A248-A252 WeakPolarHBondContact O-CB 3.45Å; A248-A252 PolarHBondContact O-N 3.44Å
249I78.7Confident77.9Confident15 Ų1547.6 Ų47.68%0.07726%0.262CS..Hα-helixtrans-62.9-52.6178.4-75.6165.8000111.7R245 T246 I247 L251 A252 V253 L305 A309R245-I249 HydrophobicContact CG-CD1 4.06Å; R245-I249 WeakPolarHBondContact O-CD1 3.49Å; R245-I249 WeakPolarHBondContact O-CG1 3.33Å; R245-I249 PolarHBondContact O-N 3.35Å; R245-I249 VanDerWaalsContact O-N 3.08Å; T246-I249 PolarHBondContact O-N 2.75Å; I247-I249 VanDerWaalsContact C-N 3.29Å; I247-I249 PolarHBondContact O-N 3.33Å; I249-L251 VanDerWaalsContact C-N 3.33Å; I249-L251 PolarHBondContact O-N 2.95Å; I249-A252 PolarHBondContact O-N 2.94Å; I249-V253 WeakPolarHBondContact O-CG2 3.08Å; I249-V253 PolarHBondContact O-N 3.45Å; I249-L305 HydrophobicContact CB-CB 4.36Å; I249-L305 HydrophobicContact CD1-CB 4.09Å; I249-L305 VanDerWaalsContact CD1-O 3.28Å; I249-L305 WeakPolarHBondContact CD1-O 3.43Å; I249-L305 HydrophobicContact CG1-CB 4.02Å; I249-L305 HydrophobicContact CG1-CD2 4.3Å; I249-L305 HydrophobicContact CG2-CB 3.52Å; I249-L305 HydrophobicContact CG2-CD1 3.89Å; I249-L305 HydrophobicContact CG2-CG 4.25Å; I249-A309 HydrophobicContact CD1-CB 3.48Å; I249-A309 VanDerWaalsContact CD1-CB 3.48Å
250V79.8Confident79.3Confident0 Ų045.7 Ų45.70%024%0.243CC..Hα-helixtrans-63.7-43.1-177.9174.10000110.2L124 I214 Y218 T246 I247 A252 V253 F254L124-V250 HydrophobicContact CB-CG1 4.44Å; L124-V250 HydrophobicContact CD2-CG2 3.93Å; I214-V250 HydrophobicContact CD1-CG1 4.14Å; I214-V250 HydrophobicContact CG2-CG1 4.1Å; Y218-V250 HydrophobicContact CE2-CB 3.96Å; Y218-V250 HydrophobicContact CE2-CG1 4.02Å; Y218-V250 WeakPolarHBondContact OH-CB 3.2Å; Y218-V250 WeakPolarHBondContact OH-CG2 3.43Å; T246-V250 HydrophobicContact CG2-CG2 4.42Å; T246-V250 VanDerWaalsContact O-CG2 3.31Å; T246-V250 WeakPolarHBondContact O-CG2 3.44Å; T246-V250 PolarHBondContact O-N 3.01Å; I247-V250 PolarHBondContact O-N 3.04Å; V250-A252 VanDerWaalsContact C-N 3.34Å; V250-A252 PolarHBondContact O-N 3.49Å; V250-V253 PolarHBondContact O-N 3.49Å; V250-F254 HydrophobicContact CG1-CD2 3.8Å; V250-F254 HydrophobicContact CG1-CE2 3.88Å; V250-F254 WeakPolarHBondContact O-CD2 3.16Å; V250-F254 PolarHBondContact O-N 3.33Å
251L81.9Confident80.5Confident65 Ų6543.5 Ų43.534%0.3423%0.234SC..Hα-helixtrans-61.5-42176.4-71.8177.6000112.2L215 Y218 I247 I249 F254 A255L215-L251 HydrophobicContact CD2-CD2 4.4Å; Y218-L251 HydrophobicContact CD2-CD1 4.24Å; Y218-L251 HydrophobicContact CD2-CD2 3.94Å; Y218-L251 HydrophobicContact CD2-CG 3.88Å; Y218-L251 HydrophobicContact CE2-CD2 4.28Å; Y218-L251 HydrophobicContact CE2-CG 4.02Å; I247-L251 HydrophobicContact CG2-CD1 3.64Å; I247-L251 HydrophobicContact CG2-CG 4.25Å; I247-L251 WeakPolarHBondContact O-CB 3.16Å; I247-L251 WeakPolarHBondContact O-CG 3.27Å; I247-L251 PolarHBondContact O-N 2.83Å; I249-L251 VanDerWaalsContact C-N 3.33Å; I249-L251 PolarHBondContact O-N 2.95Å; L251-F254 PolarHBondContact O-N 3Å; L251-A255 VanDerWaalsContact O-CB 3.28Å; L251-A255 WeakPolarHBondContact O-CB 3.42Å; L251-A255 PolarHBondContact O-N 3.07Å
252A82.8Confident81.7Confident39 Ų3935.2 Ų35.232%0.32220%0.202SC..Hα-helixtrans-62.2-44.8176.400000111.7A248 I249 V250 F254 A255 L256A248-A252 VanDerWaalsContact O-CB 3.27Å; A248-A252 WeakPolarHBondContact O-CB 3.45Å; A248-A252 PolarHBondContact O-N 3.44Å; I249-A252 PolarHBondContact O-N 2.94Å; V250-A252 VanDerWaalsContact C-N 3.34Å; V250-A252 PolarHBondContact O-N 3.49Å; A252-F254 PolarHBondContact O-N 2.91Å; A252-A255 PolarHBondContact O-N 2.86Å; A252-L256 VanDerWaalsContact O-CB 3.25Å; A252-L256 WeakPolarHBondContact O-CB 3.47Å; A252-L256 WeakPolarHBondContact O-CG 3.29Å; A252-L256 PolarHBondContact O-N 3.16Å
253V85.9Confident82.8Confident1 Ų134.3 Ų34.31%0.00620%0.204CC..Hα-helixtrans-60.4-46.1176.4169.30000111.3L124 I249 V250 A255 C257 F258 N298 L305L124-V253 HydrophobicContact CD1-CG1 4.04Å; I249-V253 WeakPolarHBondContact O-CG2 3.08Å; I249-V253 PolarHBondContact O-N 3.45Å; V250-V253 PolarHBondContact O-N 3.49Å; V253-A255 PolarHBondContact O-N 3.03Å; V253-C257 WeakPolarHBondContact O-CA 3.31Å; V253-C257 VanDerWaalsContact O-CB 3.24Å; V253-C257 WeakPolarHBondContact O-CB 3.42Å; V253-C257 PolarHBondContact O-N 2.95Å; V253-F258 HydrophobicContact CG1-CD2 4.13Å; V253-F258 HydrophobicContact CG1-CE2 3.51Å; V253-F258 HydrophobicContact CG1-CZ 3.82Å; V253-F258 PolarHBondContact O-N 3.28Å; V253-N298 WeakPolarHBondContact CG1-OD1 3.33Å; V253-L305 HydrophobicContact CG2-CD1 3.5Å
254F85.7Confident83.8Confident2 Ų234.4 Ų34.41%0.00920%0.204CC..Iπ-helixtrans-62.1-45.4176.5-91.5-92.9000112.5I121 L124 F207 F211 I214 V250 L251 A252 F258 L259I121-F254 HydrophobicContact CB-CZ 4.38Å; I121-F254 HydrophobicContact CG1-CE1 4.31Å; I121-F254 HydrophobicContact CG1-CZ 4.23Å; I121-F254 HydrophobicContact CG2-CE1 4.23Å; I121-F254 HydrophobicContact CG2-CZ 3.95Å; L124-F254 HydrophobicContact CB-CE2 4.2Å; L124-F254 HydrophobicContact CD1-CE2 4.16Å; F207-F254 HydrophobicContact CE2-CD1 4.26Å; F207-F254 HydrophobicContact CE2-CE1 4.38Å; F211-F254 HydrophobicContact CB-CE1 4.29Å; F211-F254 AromaticContact CD2-CD1 3.54Å; F211-F254 HydrophobicContact CD2-CD1 3.54Å; F211-F254 HydrophobicContact CD2-CE1 4.01Å; F211-F254 HydrophobicContact CD2-CG 4.2Å; F211-F254 HydrophobicContact CE2-CB 4.39Å; F211-F254 HydrophobicContact CE2-CD1 4.2Å; I214-F254 HydrophobicContact CD1-CD2 4.11Å; I214-F254 HydrophobicContact CD1-CE1 4.22Å; I214-F254 HydrophobicContact CD1-CE2 3.2Å; I214-F254 HydrophobicContact CD1-CZ 3.25Å; V250-F254 HydrophobicContact CG1-CD2 3.8Å; V250-F254 HydrophobicContact CG1-CE2 3.88Å; V250-F254 WeakPolarHBondContact O-CD2 3.16Å; V250-F254 PolarHBondContact O-N 3.33Å; L251-F254 PolarHBondContact O-N 3Å; A252-F254 PolarHBondContact O-N 2.91Å; F254-F258 HydrophobicContact CD1-CB 4.33Å; F254-F258 AromaticContact CD1-CD2 3.84Å; F254-F258 HydrophobicContact CD1-CD2 3.84Å; F254-F258 AromaticContact CD2-CD2 3.98Å; F254-F258 HydrophobicContact CD2-CD2 3.98Å; F254-F258 HydrophobicContact CD2-CE2 4.28Å; F254-F258 AromaticContact CE1-CD2 3.96Å; F254-F258 HydrophobicContact CE1-CD2 3.96Å; F254-F258 HydrophobicContact CE2-CD2 4.09Å; F254-F258 HydrophobicContact CE2-CE2 4.15Å; F254-F258 AromaticContact CG-CD2 3.87Å; F254-F258 HydrophobicContact CG-CD2 3.87Å; F254-F258 HydrophobicContact CZ-CD2 4.09Å; F254-F258 HydrophobicContact CZ-CE2 4.37Å; F254-F258 PolarHBondContact O-N 3.34Å; F254-L259 WeakPolarHBondContact O-CB 3.38Å; F254-L259 PolarHBondContact O-N 3.48Å
255A84.8Confident84.7Confident56 Ų5631.5 Ų31.546%0.46319%0.186SC..Iπ-helixtrans-69.3-36.8-177.500000112.9L251 A252 V253 P260L251-A255 VanDerWaalsContact O-CB 3.28Å; L251-A255 WeakPolarHBondContact O-CB 3.42Å; L251-A255 PolarHBondContact O-N 3.07Å; A252-A255 PolarHBondContact O-N 2.86Å; V253-A255 PolarHBondContact O-N 3.03Å; A255-P260 VanDerWaalsContact O-CD 3.24Å; A255-P260 WeakPolarHBondContact O-CD 3.34Å; A255-P260 VanDerWaalsContact O-CG 3.22Å; A255-P260 WeakPolarHBondContact O-CG 3.45Å
256L86Confident85.4Confident105 Ų10529 Ų2955%0.5518%0.181SC..Iπ-helixtrans-92.3-35-174.4-61.5175.3000112.9A252 L294A252-L256 VanDerWaalsContact O-CB 3.25Å; A252-L256 WeakPolarHBondContact O-CB 3.47Å; A252-L256 WeakPolarHBondContact O-CG 3.29Å; A252-L256 PolarHBondContact O-N 3.16Å; L256-L294 WeakPolarHBondContact O-CD2 3.43Å
257C88.3Confident86.1Confident3 Ų331.5 Ų31.52%0.0219%0.194CC..Iπ-helixtrans-107.6-49.9-170.4-54.40000112.5V253 L294 A295 N298 L301V253-C257 WeakPolarHBondContact O-CA 3.31Å; V253-C257 VanDerWaalsContact O-CB 3.24Å; V253-C257 WeakPolarHBondContact O-CB 3.42Å; V253-C257 PolarHBondContact O-N 2.95Å; C257-L294 WeakPolarHBondContact CB-O 3.29Å; C257-L294 PolarHBondContact SG-O 3.02Å; C257-A295 WeakPolarHBondContact O-CA 3.39Å; C257-N298 HydrophobicContact CB-CB 4.19Å; C257-L301 WeakPolarHBondContact SG-CD1 3.44Å
258F90.8Very high86.7Confident0 Ų033.1 Ų33.10%020%0.199CC..Iπ-helixtrans-89.3-48.9-169.3-56.2-39.1000113.7L117 I121 L124 F207 V253 F254 F261 H262 N298L117-F258 HydrophobicContact CD1-CD1 3.5Å; L117-F258 VanDerWaalsContact CD1-CD1 3.5Å; L117-F258 HydrophobicContact CD1-CE1 3.79Å; I121-F258 HydrophobicContact CD1-CD1 4.43Å; I121-F258 HydrophobicContact CD1-CD2 4.43Å; I121-F258 HydrophobicContact CD1-CG 4.23Å; I121-F258 HydrophobicContact CG1-CD1 4.28Å; I121-F258 HydrophobicContact CG1-CD2 3.71Å; I121-F258 HydrophobicContact CG1-CE1 4.33Å; I121-F258 HydrophobicContact CG1-CE2 3.77Å; I121-F258 HydrophobicContact CG1-CG 3.97Å; I121-F258 HydrophobicContact CG1-CZ 4.08Å; L124-F258 HydrophobicContact CD1-CE2 3.53Å; L124-F258 HydrophobicContact CD1-CZ 3.97Å; F207-F258 HydrophobicContact CD2-CB 4.46Å; F207-F258 HydrophobicContact CE2-CB 3.9Å; V253-F258 HydrophobicContact CG1-CD2 4.13Å; V253-F258 HydrophobicContact CG1-CE2 3.51Å; V253-F258 HydrophobicContact CG1-CZ 3.82Å; V253-F258 PolarHBondContact O-N 3.28Å; F254-F258 HydrophobicContact CD1-CB 4.33Å; F254-F258 AromaticContact CD1-CD2 3.84Å; F254-F258 HydrophobicContact CD1-CD2 3.84Å; F254-F258 AromaticContact CD2-CD2 3.98Å; F254-F258 HydrophobicContact CD2-CD2 3.98Å; F254-F258 HydrophobicContact CD2-CE2 4.28Å; F254-F258 AromaticContact CE1-CD2 3.96Å; F254-F258 HydrophobicContact CE1-CD2 3.96Å; F254-F258 HydrophobicContact CE2-CD2 4.09Å; F254-F258 HydrophobicContact CE2-CE2 4.15Å; F254-F258 AromaticContact CG-CD2 3.87Å; F254-F258 HydrophobicContact CG-CD2 3.87Å; F254-F258 HydrophobicContact CZ-CD2 4.09Å; F254-F258 HydrophobicContact CZ-CE2 4.37Å; F254-F258 PolarHBondContact O-N 3.34Å; F258-F261 PolarHBondContact O-N 3.42Å; F258-H262 PolarHBondContact O-N 3.27Å; F258-H262 PolarHBondContact O-ND1 2.59Å; F258-N298 HydrophobicContact CE1-CB 3.78Å; F258-N298 HydrophobicContact CZ-CB 4.1Å; F258-N298 WeakPolarHBondContact CZ-OD1 3.41Å
259L90.6Very high87.1Confident65 Ų6530.9 Ų30.934%0.3418%0.178SC..Hα-helixtrans-61.2-47.3-176.1-179.967000112F207 F254 F261 H262 V263F207-L259 HydrophobicContact CE1-CD1 4.18Å; F207-L259 HydrophobicContact CZ-CB 4.24Å; F207-L259 HydrophobicContact CZ-CD1 3.74Å; F254-L259 WeakPolarHBondContact O-CB 3.38Å; F254-L259 PolarHBondContact O-N 3.48Å; L259-F261 VanDerWaalsContact C-N 3.31Å; L259-F261 PolarHBondContact O-N 3.14Å; L259-H262 PolarHBondContact O-N 2.98Å; L259-V263 HydrophobicContact CD1-CG2 3.83Å; L259-V263 HydrophobicContact CG-CG2 4.22Å; L259-V263 WeakPolarHBondContact O-CB 3.33Å; L259-V263 VanDerWaalsContact O-CG2 3.28Å; L259-V263 WeakPolarHBondContact O-CG2 3.22Å; L259-V263 PolarHBondContact O-N 2.86Å
260P92.1Very high87.1Confident35 Ų3532.7 Ų32.723%0.22719%0.192CC..Hα-helixtrans-60.4-42.1-179.6-24.336.5000112A255 T264 T291A255-P260 VanDerWaalsContact O-CD 3.24Å; A255-P260 WeakPolarHBondContact O-CD 3.34Å; A255-P260 VanDerWaalsContact O-CG 3.22Å; A255-P260 WeakPolarHBondContact O-CG 3.45Å; P260-T264 WeakPolarHBondContact O-CB 3.44Å; P260-T264 WeakPolarHBondContact O-CG2 3.21Å; P260-T264 PolarHBondContact O-N 3.22Å; P260-T264 PolarHBondContact O-OG1 2.84Å; P260-T291 HydrophobicContact CB-CG2 3.64Å
261F92.9Very high86.9Confident0 Ų035.7 Ų35.70%021%0.205CC..Hα-helixtrans-64.1-47.3177.2172.8-105.9000112.4F113 Y114 L117 F258 L259 V263 T264 R265 Y288 R292 A295F113-F261 HydrophobicContact CE1-CE1 4.1Å; F113-F261 HydrophobicContact CE1-CE2 4.2Å; F113-F261 AromaticContact CE1-CZ 3.6Å; F113-F261 HydrophobicContact CE1-CZ 3.6Å; F113-F261 HydrophobicContact CZ-CE1 4.09Å; F113-F261 AromaticContact CZ-CE2 3.98Å; F113-F261 HydrophobicContact CZ-CE2 3.98Å; F113-F261 AromaticContact CZ-CZ 3.71Å; F113-F261 HydrophobicContact CZ-CZ 3.71Å; Y114-F261 HydrophobicContact CE1-CE1 4.35Å; Y114-F261 HydrophobicContact CE1-CZ 4.11Å; L117-F261 HydrophobicContact CD2-CD1 3.84Å; L117-F261 HydrophobicContact CD2-CE1 3.5Å; L117-F261 VanDerWaalsContact CD2-CE1 3.5Å; F258-F261 PolarHBondContact O-N 3.42Å; L259-F261 VanDerWaalsContact C-N 3.31Å; L259-F261 PolarHBondContact O-N 3.14Å; F261-V263 PolarHBondContact O-N 2.78Å; F261-T264 PolarHBondContact O-OG1 3.03Å; F261-R265 WeakPolarHBondContact O-CB 3.25Å; F261-R265 PolarHBondContact O-N 2.95Å; F261-Y288 AromaticContact CE2-CE2 3.86Å; F261-Y288 HydrophobicContact CE2-CE2 3.86Å; F261-R292 HydrophobicContact CD2-CG 3.89Å; F261-R292 HydrophobicContact CE2-CG 3.63Å; F261-A295 HydrophobicContact CB-CB 3.82Å; F261-A295 HydrophobicContact CD1-CB 4.25Å; F261-A295 HydrophobicContact CD2-CB 4.37Å; F261-A295 HydrophobicContact CG-CB 3.87Å
262H92.6Very high86.1Confident1 Ų136.5 Ų36.51%0.00520%0.204CC..Hα-helixtrans-66.5-39.4-178.9-75.175.2000112.1Y118 L203 F207 F258 L259 R265 T266Y118-H262 AromaticContact CE1-NE2 3.66Å; L203-H262 HydrophobicContact CD1-CB 3.92Å; F207-H262 VanDerWaalsContact CB-CD2 3.5Å; F207-H262 WeakPolarHBondContact CB-CD2 3.12Å; F207-H262 HydrophobicContact CD1-CB 4.12Å; F207-H262 AromaticContact CD1-CD2 3.96Å; F207-H262 HydrophobicContact CD2-CB 4.36Å; F207-H262 AromaticContact CD2-CD2 3.71Å; F207-H262 AromaticContact CD2-CE1 3.66Å; F207-H262 AromaticContact CD2-CG 3.66Å; F207-H262 AromaticContact CD2-ND1 3.63Å; F207-H262 AromaticContact CD2-NE2 3.75Å; F207-H262 HydrophobicContact CE1-CB 4.03Å; F207-H262 HydrophobicContact CE2-CB 4.28Å; F207-H262 AromaticContact CE2-CG 3.95Å; F207-H262 AromaticContact CE2-ND1 3.85Å; F207-H262 HydrophobicContact CG-CB 4.29Å; F207-H262 AromaticContact CG-CD2 3.43Å; F207-H262 VanDerWaalsContact CG-CD2 3.43Å; F207-H262 WeakPolarHBondContact CG-CD2 3.24Å; F207-H262 AromaticContact CG-CG 3.71Å; F207-H262 AromaticContact CG-NE2 3.77Å; F207-H262 HydrophobicContact CZ-CB 4.12Å; F258-H262 PolarHBondContact O-N 3.27Å; F258-H262 PolarHBondContact O-ND1 2.59Å; L259-H262 PolarHBondContact O-N 2.98Å; H262-R265 PolarHBondContact CD2-NH2 2.87Å; H262-T266 WeakPolarHBondContact O-CB 3.49Å; H262-T266 PolarHBondContact O-N 3.1Å; H262-T266 PolarHBondContact O-OG1 3.48Å
263V91.1Very high85.2Confident69 Ų6939.4 Ų39.442%0.41822%0.222SC..Hα-helixtrans-62-59.1174.7170.80000109.8L259 F261 R265 T266 L267L259-V263 HydrophobicContact CD1-CG2 3.83Å; L259-V263 HydrophobicContact CG-CG2 4.22Å; L259-V263 WeakPolarHBondContact O-CB 3.33Å; L259-V263 VanDerWaalsContact O-CG2 3.28Å; L259-V263 WeakPolarHBondContact O-CG2 3.22Å; L259-V263 PolarHBondContact O-N 2.86Å; F261-V263 PolarHBondContact O-N 2.78Å; V263-R265 VanDerWaalsContact C-N 3.32Å; V263-R265 PolarHBondContact O-N 3.31Å; V263-T266 WeakPolarHBondContact O-CB 3.28Å; V263-T266 PolarHBondContact O-N 3.33Å; V263-L267 HydrophobicContact CG1-CD1 3.88Å; V263-L267 HydrophobicContact CG1-CG 4.34Å; V263-L267 WeakPolarHBondContact O-CG 3.24Å; V263-L267 PolarHBondContact O-N 3.27Å
264T90.1Very high84.3Confident14 Ų1443.5 Ų43.59%0.08624%0.243CC..Hα-helixtrans-62.2-35.9-176.651.80000113.3P260 F261 L267 Y268 A287 T291P260-T264 WeakPolarHBondContact O-CB 3.44Å; P260-T264 WeakPolarHBondContact O-CG2 3.21Å; P260-T264 PolarHBondContact O-N 3.22Å; P260-T264 PolarHBondContact O-OG1 2.84Å; F261-T264 PolarHBondContact O-OG1 3.03Å; T264-L267 PolarHBondContact O-N 3Å; T264-Y268 VanDerWaalsContact O-CB 3.24Å; T264-Y268 WeakPolarHBondContact O-CB 3.32Å; T264-Y268 PolarHBondContact O-N 3.49Å; T264-A287 HydrophobicContact CG2-CB 3.69Å; T264-T291 HydrophobicContact CG2-CG2 3.8Å; T264-T291 PolarHBondContact OG1-OG1 2.97Å
265R90.1Very high83.4Confident5 Ų549.9 Ų49.92%0.01928%0.277CS..Hα-helixtrans-61.4-45.4172-177-178.569.5-177.3-3.8111.9Y118 F261 H262 V263 Y268 Y269 Y288Y118-R265 PolarHBondContact OH-NH1 3.02Å; Y118-R265 PolarHBondContact OH-NH2 3.44Å; F261-R265 WeakPolarHBondContact O-CB 3.25Å; F261-R265 PolarHBondContact O-N 2.95Å; H262-R265 PolarHBondContact CD2-NH2 2.87Å; V263-R265 VanDerWaalsContact C-N 3.32Å; V263-R265 PolarHBondContact O-N 3.31Å; R265-Y268 PolarHBondContact O-N 3.33Å; R265-Y269 HydrophobicContact CG-CD2 4.01Å; R265-Y269 HydrophobicContact CG-CE1 4.01Å; R265-Y269 HydrophobicContact CG-CE2 3.45Å; R265-Y269 VanDerWaalsContact CG-CE2 3.45Å; R265-Y269 VanDerWaalsContact CG-CZ 3.42Å; R265-Y269 VanDerWaalsContact O-CG 3.29Å; R265-Y269 PolarHBondContact O-N 2.94Å; R265-Y288 HydrophobicContact CB-CD2 4.07Å; R265-Y288 HydrophobicContact CB-CE2 3.84Å; R265-Y288 HydrophobicContact CG-CE2 3.98Å
266T87.9Confident83.1Confident43 Ų4350.4 Ų50.426%0.26427%0.272SS..Hα-helixtrans-64.7-44.3179.5-54.20000110.6L203 H262 V263 Y268 Y269 S270L203-T266 HydrophobicContact CD2-CG2 4.14Å; L203-T266 WeakPolarHBondContact CD2-OG1 3.22Å; H262-T266 WeakPolarHBondContact O-CB 3.49Å; H262-T266 PolarHBondContact O-N 3.1Å; H262-T266 PolarHBondContact O-OG1 3.48Å; V263-T266 WeakPolarHBondContact O-CB 3.28Å; V263-T266 PolarHBondContact O-N 3.33Å; T266-Y268 VanDerWaalsContact C-N 3.34Å; T266-Y268 PolarHBondContact O-N 3.39Å; T266-Y269 PolarHBondContact O-N 2.83Å; T266-S270 WeakPolarHBondContact O-CB 3.34Å; T266-S270 PolarHBondContact O-N 2.89Å; T266-S270 PolarHBondContact O-OG 3.09Å; T266-S270 VanDerWaalsContact O-OG 3.08Å
267L86.8Confident83.1Confident65 Ų6548.7 Ų48.734%0.3427%0.269SS..Hα-helixtrans-60.6-44.9174.8-59.1173.5000110.8V263 T264 Y269 S270 F271 I284V263-L267 HydrophobicContact CG1-CD1 3.88Å; V263-L267 HydrophobicContact CG1-CG 4.34Å; V263-L267 WeakPolarHBondContact O-CG 3.24Å; V263-L267 PolarHBondContact O-N 3.27Å; T264-L267 PolarHBondContact O-N 3Å; L267-Y269 VanDerWaalsContact C-N 3.34Å; L267-Y269 PolarHBondContact O-N 3.36Å; L267-S270 PolarHBondContact O-N 3.23Å; L267-F271 HydrophobicContact CB-CD2 3.85Å; L267-F271 HydrophobicContact CB-CE2 3.95Å; L267-F271 HydrophobicContact CD2-CD2 4.15Å; L267-F271 HydrophobicContact CD2-CE2 3.34Å; L267-F271 HydrophobicContact CD2-CZ 3.99Å; L267-F271 HydrophobicContact CG-CE2 4.16Å; L267-F271 WeakPolarHBondContact O-CB 3.28Å; L267-F271 WeakPolarHBondContact O-CD2 3.35Å; L267-F271 WeakPolarHBondContact O-CG 3.01Å; L267-F271 PolarHBondContact O-N 2.87Å; L267-I284 HydrophobicContact CB-CG2 4Å
268Y85.5Confident82.8Confident56 Ų5651.3 Ų51.322%0.2229%0.287CS..Hα-helixtrans-61.3-39.5178.8-177.9-102.6000112.6T264 R265 T266 I284 N285 Y288T264-Y268 VanDerWaalsContact O-CB 3.24Å; T264-Y268 WeakPolarHBondContact O-CB 3.32Å; T264-Y268 PolarHBondContact O-N 3.49Å; R265-Y268 PolarHBondContact O-N 3.33Å; T266-Y268 VanDerWaalsContact C-N 3.34Å; T266-Y268 PolarHBondContact O-N 3.39Å; Y268-I284 HydrophobicContact CD2-CG2 4.41Å; Y268-N285 HydrophobicContact CE2-CB 4.28Å; Y268-N285 WeakPolarHBondContact CE2-OD1 3.14Å; Y268-Y288 HydrophobicContact CD1-CD1 4.06Å; Y268-Y288 HydrophobicContact CD1-CE1 4.14Å; Y268-Y288 HydrophobicContact CD1-CG 4.42Å; Y268-Y288 HydrophobicContact CD2-CD1 4.3Å; Y268-Y288 HydrophobicContact CE1-CD1 4.35Å; Y268-Y288 HydrophobicContact CE1-CE1 4.25Å; Y268-Y288 HydrophobicContact CG-CD1 4.07Å; Y268-Y288 HydrophobicContact CG-CG 4.14Å
269Y84.6Confident82.6Confident9 Ų958.7 Ų58.74%0.03532%0.321CS..Hα-helixtrans-75.7-42.9178.9-67.3-5.7000113.1T186 F192 F195 V196 R265 T266 L267T186-Y269 HydrophobicContact CG2-CE1 3.57Å; F192-Y269 HydrophobicContact CZ-CD1 4.34Å; F195-Y269 HydrophobicContact CE1-CE1 4.34Å; F195-Y269 AromaticContact CE1-CE2 3.81Å; F195-Y269 HydrophobicContact CE1-CE2 3.81Å; F195-Y269 AromaticContact CE1-CZ 3.64Å; F195-Y269 WeakPolarHBondContact CE1-OH 3.39Å; V196-Y269 HydrophobicContact CG2-CG 4.3Å; R265-Y269 HydrophobicContact CG-CD2 4.01Å; R265-Y269 HydrophobicContact CG-CE1 4.01Å; R265-Y269 HydrophobicContact CG-CE2 3.45Å; R265-Y269 VanDerWaalsContact CG-CE2 3.45Å; R265-Y269 VanDerWaalsContact CG-CZ 3.42Å; R265-Y269 VanDerWaalsContact O-CG 3.29Å; R265-Y269 PolarHBondContact O-N 2.94Å; T266-Y269 PolarHBondContact O-N 2.83Å; L267-Y269 VanDerWaalsContact C-N 3.34Å; L267-Y269 PolarHBondContact O-N 3.36Å
270S78.9Confident82.3Confident53 Ų5358.3 Ų58.337%0.37132%0.322SS..Hα-helixtrans-75.2-29.4-176.2-61.50000113.4T266 L267 S273T266-S270 WeakPolarHBondContact O-CB 3.34Å; T266-S270 PolarHBondContact O-N 2.89Å; T266-S270 PolarHBondContact O-OG 3.09Å; T266-S270 VanDerWaalsContact O-OG 3.08Å; L267-S270 PolarHBondContact O-N 3.23Å; S270-S273 PolarHBondContact O-OG 3.25Å
271F74.8Confident81.9Confident63 Ų6357.9 Ų57.928%0.27632%0.317SS..Hα-helixtrans-98-2.4-172.8-61.8-36.5000114.4L267 S273 L274 L276 L281 I284L267-F271 HydrophobicContact CB-CD2 3.85Å; L267-F271 HydrophobicContact CB-CE2 3.95Å; L267-F271 HydrophobicContact CD2-CD2 4.15Å; L267-F271 HydrophobicContact CD2-CE2 3.34Å; L267-F271 HydrophobicContact CD2-CZ 3.99Å; L267-F271 HydrophobicContact CG-CE2 4.16Å; L267-F271 WeakPolarHBondContact O-CB 3.28Å; L267-F271 WeakPolarHBondContact O-CD2 3.35Å; L267-F271 WeakPolarHBondContact O-CG 3.01Å; L267-F271 PolarHBondContact O-N 2.87Å; F271-S273 PolarHBondContact O-N 3.25Å; F271-L274 HydrophobicContact CD1-CD1 3.48Å; F271-L274 VanDerWaalsContact CD1-CD1 3.48Å; F271-L274 HydrophobicContact CD1-CG 4.27Å; F271-L274 HydrophobicContact CE1-CD1 3.79Å; F271-L274 PolarHBondContact O-N 3.35Å; F271-L276 HydrophobicContact CB-CD1 3.86Å; F271-L276 HydrophobicContact CD1-CD1 4.14Å; F271-L276 HydrophobicContact CD2-CD1 4.44Å; F271-L276 HydrophobicContact CG-CD1 3.92Å; F271-L281 WeakPolarHBondContact O-CD2 3.21Å; F271-I284 HydrophobicContact CB-CD1 4.21Å; F271-I284 HydrophobicContact CD2-CD1 3.61Å; F271-I284 HydrophobicContact CE2-CD1 4.4Å; F271-I284 HydrophobicContact CG-CD1 4.33Å
272R66.8Low81.5Confident82 Ų8259.8 Ų59.831%0.30933%0.327SS..THydrogen-bonded Turntrans-62.6-22172.6-162.772.6-179.5102.4-12.3112.8F192F192-R272 HydrophobicContact CE1-CB 4.23Å; F192-R272 HydrophobicContact CE1-CG 4.33Å; F192-R272 HydrophobicContact CZ-CB 4.49Å
273S63.3Low81.3Confident101 Ų10162.1 Ų62.171%0.70635%0.347SS*.THydrogen-bonded Turntrans-108.72.3-176.254.20000114.8S270 F271S270-S273 PolarHBondContact O-OG 3.25Å; F271-S273 PolarHBondContact O-N 3.25Å
274L66.5Low81.1Confident86 Ų8659.8 Ų59.845%0.4533%0.332SS..SBendtrans-102.4146.4178-63-173.5000111F271 L276F271-L274 HydrophobicContact CD1-CD1 3.48Å; F271-L274 VanDerWaalsContact CD1-CD1 3.48Å; F271-L274 HydrophobicContact CD1-CG 4.27Å; F271-L274 HydrophobicContact CE1-CD1 3.79Å; F271-L274 PolarHBondContact O-N 3.35Å; L274-L276 HydrophobicContact CB-CD1 4.45Å; L274-L276 HydrophobicContact CB-CG 4.1Å; L274-L276 PolarHBondContact O-N 3.43Å
275D68.2Low81Confident136 Ų13659.3 Ų59.373%0.72733%0.329SS*.  trans-76.766.3176.1-80.9-6.4000111.7R24R24-D275 IonicContact CZ-OD1 2.59Å; R24-D275 IonicContact NH1-OD1 3.87Å; R24-D275 PolarHBondContact NH1-OD1 2.67Å; R24-D275 IonicContact NH1-OD2 2.64Å; R24-D275 PolarHBondContact NH1-OD2 3.06Å
276L78.5Confident80.9Confident67 Ų6761.3 Ų61.335%0.35134%0.339SS..  trans-92.4160174.9-65.5176000111.7F271 L274 T280 L281F271-L276 HydrophobicContact CB-CD1 3.86Å; F271-L276 HydrophobicContact CD1-CD1 4.14Å; F271-L276 HydrophobicContact CD2-CD1 4.44Å; F271-L276 HydrophobicContact CG-CD1 3.92Å; L274-L276 HydrophobicContact CB-CD1 4.45Å; L274-L276 HydrophobicContact CB-CG 4.1Å; L274-L276 PolarHBondContact O-N 3.43Å; L276-T280 HydrophobicContact CD1-CG2 4.34Å; L276-L281 HydrophobicContact CB-CD2 4.42Å; L276-L281 HydrophobicContact CB-CG 4.2Å
277S84.2Confident81.1Confident69 Ų6961 Ų6148%0.48334%0.34SS..  trans-63145.3174.568.10000112.1H279 T280 L281S277-H279 PolarHBondContact O-N 2.86Å; S277-T280 PolarHBondContact O-N 3.36Å; S277-T280 PolarHBondContact OG-OG1 3.37Å; S277-T280 VanDerWaalsContact OG-OG1 3.05Å; S277-L281 PolarHBondContact O-N 3.2Å; S277-L281 VanDerWaalsContact O-N 3.12Å
278C83.4Confident81.3Confident58 Ų5858.2 Ų58.239%0.39233%0.325SS..Hα-helixtrans-58.8-31.7179.7-67.40000113.1C25 N282C25-C278 HydrophobicContact CB-CB 3.69Å; C25-C278 WeakPolarHBondContact CB-SG 3.43Å; C25-C278 WeakPolarHBondContact SG-CA 3.45Å; C25-C278 WeakPolarHBondContact SG-CB 3.17Å; C25-C278 CovalentContact SG-SG 2.04Å; C25-C278 PolarHBondContact SG-SG 3.33Å; C278-N282 VanDerWaalsContact O-CB 3.29Å; C278-N282 WeakPolarHBondContact O-CB 3.35Å; C278-N282 PolarHBondContact O-N 3.11Å
279H85.2Confident81.5Confident155 Ų15556.3 Ų56.372%0.71832%0.318SS*.Hα-helixtrans-61.6-46.1175.2-175.1-85.8000111.8S277 N282 A283S277-H279 PolarHBondContact O-N 2.86Å; H279-N282 PolarHBondContact O-N 3.27Å; H279-A283 WeakPolarHBondContact O-CB 3.34Å; H279-A283 PolarHBondContact O-N 3.34Å
280T85.3Confident81.8Confident58 Ų5859.5 Ų59.536%0.35634%0.335SS..Hα-helixtrans-66-44.5179.1-59.80000111.4L276 S277 N282 A283 I284L276-T280 HydrophobicContact CD1-CG2 4.34Å; S277-T280 PolarHBondContact O-N 3.36Å; S277-T280 PolarHBondContact OG-OG1 3.37Å; S277-T280 VanDerWaalsContact OG-OG1 3.05Å; T280-N282 VanDerWaalsContact C-N 3.31Å; T280-N282 PolarHBondContact O-N 3.37Å; T280-A283 PolarHBondContact O-N 3.45Å; T280-I284 HydrophobicContact CG2-CD1 3.92Å; T280-I284 WeakPolarHBondContact O-CD1 3.42Å; T280-I284 WeakPolarHBondContact O-CG1 3.4Å; T280-I284 PolarHBondContact O-N 3.19Å
281L83.4Confident82.5Confident25 Ų2557.6 Ų57.613%0.13132%0.321CS..Hα-helixtrans-61.3-40.6176.4-70.2170.2000111.8F27 F271 L276 S277 I284 N285F27-L281 HydrophobicContact CE1-CB 3.74Å; F27-L281 HydrophobicContact CZ-CB 4.07Å; F271-L281 WeakPolarHBondContact O-CD2 3.21Å; L276-L281 HydrophobicContact CB-CD2 4.42Å; L276-L281 HydrophobicContact CB-CG 4.2Å; S277-L281 PolarHBondContact O-N 3.2Å; S277-L281 VanDerWaalsContact O-N 3.12Å; L281-I284 PolarHBondContact O-N 3.19Å; L281-N285 WeakPolarHBondContact O-CB 3.26Å; L281-N285 PolarHBondContact O-N 3.02Å
282N85.4Confident83.3Confident41 Ų4154.9 Ų54.922%0.21931%0.309CS..Hα-helixtrans-66.2-41.3176.8-171.256.8000111.8F27 N28 C278 H279 T280 I284 N285 M286F27-N282 HydrophobicContact CD1-CB 3.9Å; F27-N282 HydrophobicContact CE1-CB 4.31Å; N28-N282 PolarHBondContact N-OD1 3.32Å; C278-N282 VanDerWaalsContact O-CB 3.29Å; C278-N282 WeakPolarHBondContact O-CB 3.35Å; C278-N282 PolarHBondContact O-N 3.11Å; H279-N282 PolarHBondContact O-N 3.27Å; T280-N282 VanDerWaalsContact C-N 3.31Å; T280-N282 PolarHBondContact O-N 3.37Å; N282-I284 PolarHBondContact O-N 3.44Å; N282-N285 PolarHBondContact O-N 2.85Å; N282-M286 WeakPolarHBondContact O-CB 3.22Å; N282-M286 WeakPolarHBondContact O-CG 3.23Å; N282-M286 PolarHBondContact O-N 2.96Å
283A87.3Confident84.5Confident50 Ų5051.4 Ų51.441%0.41330%0.297SS..Hα-helixtrans-61.8-41.6175.300000112.2H279 T280 M286 A287H279-A283 WeakPolarHBondContact O-CB 3.34Å; H279-A283 PolarHBondContact O-N 3.34Å; T280-A283 PolarHBondContact O-N 3.45Å; A283-M286 WeakPolarHBondContact O-CB 3.33Å; A283-M286 PolarHBondContact O-N 3.21Å; A283-A287 VanDerWaalsContact O-CB 3.3Å; A283-A287 WeakPolarHBondContact O-CB 3.34Å; A283-A287 PolarHBondContact O-N 2.61Å
284I87.4Confident85.9Confident20 Ų2049.9 Ų49.910%0.10328%0.281CS..Hα-helixtrans-65-44.9176.1-66.8156.7000111L267 Y268 F271 T280 L281 N282 A287 Y288L267-I284 HydrophobicContact CB-CG2 4Å; Y268-I284 HydrophobicContact CD2-CG2 4.41Å; F271-I284 HydrophobicContact CB-CD1 4.21Å; F271-I284 HydrophobicContact CD2-CD1 3.61Å; F271-I284 HydrophobicContact CE2-CD1 4.4Å; F271-I284 HydrophobicContact CG-CD1 4.33Å; T280-I284 HydrophobicContact CG2-CD1 3.92Å; T280-I284 WeakPolarHBondContact O-CD1 3.42Å; T280-I284 WeakPolarHBondContact O-CG1 3.4Å; T280-I284 PolarHBondContact O-N 3.19Å; L281-I284 PolarHBondContact O-N 3.19Å; N282-I284 PolarHBondContact O-N 3.44Å; I284-A287 PolarHBondContact O-N 3.02Å; I284-Y288 WeakPolarHBondContact O-CB 3.21Å; I284-Y288 PolarHBondContact O-N 2.67Å
285N86.6Confident87.1Confident4 Ų445.9 Ų45.92%0.02126%0.26CS..Hα-helixtrans-60.9-44.6177.2-176.648.9000111.8F27 E29 Y268 L281 N282 K289F27-N285 HydrophobicContact CD1-CB 4.4Å; E29-N285 PolarHBondContact OE1-ND2 3.43Å; Y268-N285 HydrophobicContact CE2-CB 4.28Å; Y268-N285 WeakPolarHBondContact CE2-OD1 3.14Å; L281-N285 WeakPolarHBondContact O-CB 3.26Å; L281-N285 PolarHBondContact O-N 3.02Å; N282-N285 PolarHBondContact O-N 2.85Å; N285-K289 PolarHBondContact ND2-NZ 3.24Å; N285-K289 WeakPolarHBondContact O-CG 3.21Å; N285-K289 PolarHBondContact O-N 3.39Å; N285-K289 VanDerWaalsContact O-N 3.14Å
286M89.6Confident88.2Confident47 Ų4739.4 Ų39.423%0.23223%0.225CC..Hα-helixtrans-57.2-54.1172.7-83.9-100.9168.100111.6N28 F31 N282 A283 Y288 K289 I290N28-M286 WeakPolarHBondContact O-CE 3.34Å; F31-M286 HydrophobicContact CD1-CE 3.14Å; F31-M286 HydrophobicContact CD1-SD 3.8Å; F31-M286 HydrophobicContact CD2-SD 4.5Å; F31-M286 HydrophobicContact CE1-CE 3.11Å; F31-M286 HydrophobicContact CE1-CG 4.1Å; F31-M286 HydrophobicContact CE1-SD 3.37Å; F31-M286 WeakPolarHBondContact CE1-SD 3.39Å; F31-M286 HydrophobicContact CE2-SD 4.12Å; F31-M286 HydrophobicContact CG-CE 4.02Å; F31-M286 HydrophobicContact CG-SD 4.34Å; F31-M286 HydrophobicContact CZ-CE 3.94Å; F31-M286 HydrophobicContact CZ-CG 4.22Å; F31-M286 HydrophobicContact CZ-SD 3.54Å; F31-M286 VanDerWaalsContact CZ-SD 3.54Å; N282-M286 WeakPolarHBondContact O-CB 3.22Å; N282-M286 WeakPolarHBondContact O-CG 3.23Å; N282-M286 PolarHBondContact O-N 2.96Å; A283-M286 WeakPolarHBondContact O-CB 3.33Å; A283-M286 PolarHBondContact O-N 3.21Å; M286-Y288 VanDerWaalsContact C-N 3.33Å; M286-Y288 PolarHBondContact O-N 3.26Å; M286-K289 PolarHBondContact O-N 3.13Å; M286-K289 VanDerWaalsContact O-N 3.11Å; M286-I290 VanDerWaalsContact O-CG1 3.32Å; M286-I290 WeakPolarHBondContact O-CG1 3.27Å; M286-I290 PolarHBondContact O-N 2.95Å
287A91.3Very high88.9Confident35 Ų3537.5 Ų37.529%0.28922%0.22SC..Hα-helixtrans-59.2-43.9-178.600000111.7T264 A283 I284 K289 I290 T291T264-A287 HydrophobicContact CG2-CB 3.69Å; A283-A287 VanDerWaalsContact O-CB 3.3Å; A283-A287 WeakPolarHBondContact O-CB 3.34Å; A283-A287 PolarHBondContact O-N 2.61Å; I284-A287 PolarHBondContact O-N 3.02Å; A287-K289 VanDerWaalsContact C-N 3.32Å; A287-K289 PolarHBondContact O-N 3.4Å; A287-I290 PolarHBondContact O-N 3.05Å; A287-T291 VanDerWaalsContact O-CG2 3.29Å; A287-T291 WeakPolarHBondContact O-CG2 3.5Å; A287-T291 PolarHBondContact O-N 2.71Å; A287-T291 PolarHBondContact O-OG1 3.46Å; A287-T291 VanDerWaalsContact O-OG1 3.05Å
288Y90.5Very high89.1Confident7 Ų734.2 Ų34.23%0.02720%0.197CC..Hα-helixtrans-58.8-41.1175.8173.5-114.9000112.6F261 R265 Y268 I284 M286 T291 R292F261-Y288 AromaticContact CE2-CE2 3.86Å; F261-Y288 HydrophobicContact CE2-CE2 3.86Å; R265-Y288 HydrophobicContact CB-CD2 4.07Å; R265-Y288 HydrophobicContact CB-CE2 3.84Å; R265-Y288 HydrophobicContact CG-CE2 3.98Å; Y268-Y288 HydrophobicContact CD1-CD1 4.06Å; Y268-Y288 HydrophobicContact CD1-CE1 4.14Å; Y268-Y288 HydrophobicContact CD1-CG 4.42Å; Y268-Y288 HydrophobicContact CD2-CD1 4.3Å; Y268-Y288 HydrophobicContact CE1-CD1 4.35Å; Y268-Y288 HydrophobicContact CE1-CE1 4.25Å; Y268-Y288 HydrophobicContact CG-CD1 4.07Å; Y268-Y288 HydrophobicContact CG-CG 4.14Å; I284-Y288 WeakPolarHBondContact O-CB 3.21Å; I284-Y288 PolarHBondContact O-N 2.67Å; M286-Y288 VanDerWaalsContact C-N 3.33Å; M286-Y288 PolarHBondContact O-N 3.26Å; Y288-T291 PolarHBondContact O-OG1 3.14Å; Y288-T291 VanDerWaalsContact O-OG1 3.13Å; Y288-R292 HydrophobicContact CE2-CG 4.3Å; Y288-R292 VanDerWaalsContact O-CG 3.29Å; Y288-R292 WeakPolarHBondContact O-CG 3.09Å; Y288-R292 PolarHBondContact O-N 3.11Å
289K90.7Very high89.4Confident17 Ų1731.5 Ų31.57%0.07418%0.178CC..Hα-helixtrans-70.5-37177.5-73.4171.8-178.4167.30112.8E29 F31 K32 N285 M286 A287 P293E29-K289 VanDerWaalsContact CG-NZ 3.28Å; E29-K289 IonicContact OE1-NZ 3.1Å; E29-K289 PolarHBondContact OE1-NZ 3.45Å; E29-K289 IonicContact OE2-NZ 2.97Å; E29-K289 PolarHBondContact OE2-NZ 2.94Å; F31-K289 HydrophobicContact CE1-CD 4.38Å; F31-K289 HydrophobicContact CE2-CB 4.31Å; F31-K289 HydrophobicContact CZ-CB 3.92Å; F31-K289 HydrophobicContact CZ-CD 3.97Å; K32-K289 HydrophobicContact CB-CD 4.31Å; K32-K289 HydrophobicContact CD-CD 4.34Å; N285-K289 PolarHBondContact ND2-NZ 3.24Å; N285-K289 WeakPolarHBondContact O-CG 3.21Å; N285-K289 PolarHBondContact O-N 3.39Å; N285-K289 VanDerWaalsContact O-N 3.14Å; M286-K289 PolarHBondContact O-N 3.13Å; M286-K289 VanDerWaalsContact O-N 3.11Å; A287-K289 VanDerWaalsContact C-N 3.32Å; A287-K289 PolarHBondContact O-N 3.4Å; K289-P293 WeakPolarHBondContact O-CD 3.45Å
290I91.3Very high89.5Confident75 Ų7524.8 Ų24.839%0.38515%0.149SC..Hα-helixtrans-68.8-41.1178.7-67.7166.6000111F31 L35 M286 A287 R292 P293 L294F31-I290 HydrophobicContact CE2-CG1 3.98Å; L35-I290 HydrophobicContact CD2-CB 4.46Å; L35-I290 HydrophobicContact CD2-CG1 3.8Å; M286-I290 VanDerWaalsContact O-CG1 3.32Å; M286-I290 WeakPolarHBondContact O-CG1 3.27Å; M286-I290 PolarHBondContact O-N 2.95Å; A287-I290 PolarHBondContact O-N 3.05Å; I290-R292 VanDerWaalsContact C-N 3.35Å; I290-R292 PolarHBondContact O-N 3.4Å; I290-P293 WeakPolarHBondContact O-CD 3Å; I290-L294 HydrophobicContact CG2-CD1 4.32Å; I290-L294 WeakPolarHBondContact O-CD1 3.41Å
291T93.3Very high89.4Confident13 Ų1324.7 Ų24.78%0.0815%0.146CC..Hα-helixtrans-75-20-176.4570000114.1P260 T264 A287 Y288 L294 A295P260-T291 HydrophobicContact CB-CG2 3.64Å; T264-T291 HydrophobicContact CG2-CG2 3.8Å; T264-T291 PolarHBondContact OG1-OG1 2.97Å; A287-T291 VanDerWaalsContact O-CG2 3.29Å; A287-T291 WeakPolarHBondContact O-CG2 3.5Å; A287-T291 PolarHBondContact O-N 2.71Å; A287-T291 PolarHBondContact O-OG1 3.46Å; A287-T291 VanDerWaalsContact O-OG1 3.05Å; Y288-T291 PolarHBondContact O-OG1 3.14Å; Y288-T291 VanDerWaalsContact O-OG1 3.13Å; T291-L294 WeakPolarHBondContact O-CB 3.33Å; T291-L294 PolarHBondContact O-N 3.47Å; T291-L294 VanDerWaalsContact O-N 3.14Å; T291-A295 PolarHBondContact O-N 2.68Å
292R91.2Very high89.1Confident6 Ų623.6 Ų23.62%0.02314%0.14CC..Hα-helixtrans-60.1-49.5177.3-81.9172.274.6-120-0.6113.2Y40 Y93 D185 F261 Y288 I290 L294 A295 S296Y40-R292 VanDerWaalsContact OH-CZ 3.23Å; Y40-R292 PolarHBondContact OH-NH1 3.22Å; Y40-R292 PolarHBondContact OH-NH2 3.33Å; Y93-R292 PolarHBondContact OH-NH1 3.39Å; Y93-R292 PolarHBondContact OH-NH2 2.99Å; D185-R292 IonicContact OD1-CZ 2.73Å; D185-R292 IonicContact OD1-NE 2.68Å; D185-R292 IonicContact OD1-NH2 2.74Å; D185-R292 PolarHBondContact OD1-NH2 2.9Å; F261-R292 HydrophobicContact CD2-CG 3.89Å; F261-R292 HydrophobicContact CE2-CG 3.63Å; Y288-R292 HydrophobicContact CE2-CG 4.3Å; Y288-R292 VanDerWaalsContact O-CG 3.29Å; Y288-R292 WeakPolarHBondContact O-CG 3.09Å; Y288-R292 PolarHBondContact O-N 3.11Å; I290-R292 VanDerWaalsContact C-N 3.35Å; I290-R292 PolarHBondContact O-N 3.4Å; R292-L294 VanDerWaalsContact C-N 3.28Å; R292-L294 PolarHBondContact O-N 2.86Å; R292-A295 PolarHBondContact O-N 2.95Å; R292-S296 PolarHBondContact O-N 3.5Å; R292-S296 VanDerWaalsContact O-N 3.16Å; R292-S296 PolarHBondContact O-OG 3.05Å
293P92.2Very high88.4Confident10 Ų1022 Ų227%0.06513%0.132CC..Hα-helixtrans-56.8-37.2169-30.935.4000114.5L36 S39 Y40 K289 I290 A295 S296 A297L36-P293 HydrophobicContact CD2-CG 3.54Å; S39-P293 WeakPolarHBondContact OG-CB 3.44Å; S39-P293 WeakPolarHBondContact OG-CG 3.38Å; Y40-P293 HydrophobicContact CE1-CG 4.38Å; K289-P293 WeakPolarHBondContact O-CD 3.45Å; I290-P293 WeakPolarHBondContact O-CD 3Å; P293-A295 PolarHBondContact O-N 3.33Å; P293-S296 CarbonylContact O-C 3.57Å; P293-S296 WeakPolarHBondContact O-CA 3.35Å; P293-S296 WeakPolarHBondContact O-CB 3.4Å; P293-S296 PolarHBondContact O-N 3.47Å; P293-A297 PolarHBondContact O-N 3.32Å
294L91.7Very high87.4Confident69 Ų6922.3 Ų22.336%0.36113%0.128SC..Hα-helixtrans-63.4-42.4177.8-79.279.5000111.1L256 C257 I290 T291 R292 S296 A297L256-L294 WeakPolarHBondContact O-CD2 3.43Å; C257-L294 WeakPolarHBondContact CB-O 3.29Å; C257-L294 PolarHBondContact SG-O 3.02Å; I290-L294 HydrophobicContact CG2-CD1 4.32Å; I290-L294 WeakPolarHBondContact O-CD1 3.41Å; T291-L294 WeakPolarHBondContact O-CB 3.33Å; T291-L294 PolarHBondContact O-N 3.47Å; T291-L294 VanDerWaalsContact O-N 3.14Å; R292-L294 VanDerWaalsContact C-N 3.28Å; R292-L294 PolarHBondContact O-N 2.86Å; L294-S296 PolarHBondContact O-N 2.94Å; L294-A297 WeakPolarHBondContact O-CB 3.24Å; L294-A297 PolarHBondContact O-N 3.3Å
295A92.5Very high86.3Confident1 Ų123.2 Ų23.21%0.00813%0.133CC..Hα-helixtrans-60.1-36172.600000112.2F113 L117 C257 F261 T291 R292 P293 N298F113-A295 HydrophobicContact CE2-CB 4.36Å; F113-A295 HydrophobicContact CZ-CB 4.33Å; L117-A295 HydrophobicContact CD1-CB 4.22Å; C257-A295 WeakPolarHBondContact O-CA 3.39Å; F261-A295 HydrophobicContact CB-CB 3.82Å; F261-A295 HydrophobicContact CD1-CB 4.25Å; F261-A295 HydrophobicContact CD2-CB 4.37Å; F261-A295 HydrophobicContact CG-CB 3.87Å; T291-A295 PolarHBondContact O-N 2.68Å; R292-A295 PolarHBondContact O-N 2.95Å; P293-A295 PolarHBondContact O-N 3.33Å; A295-N298 VanDerWaalsContact O-CB 3.23Å; A295-N298 WeakPolarHBondContact O-CB 3.34Å; A295-N298 PolarHBondContact O-N 3.37Å
296S92.3Very high85.2Confident0 Ų024.6 Ų24.60%014%0.138CC..Hα-helixtrans-72.4-32.1178.4-540000112.8Y40 V43 Y82 R292 P293 L294 N298 S299Y40-S296 WeakPolarHBondContact CE1-OG 3.47Å; V43-S296 VanDerWaalsContact CG1-O 3.3Å; V43-S296 WeakPolarHBondContact CG1-O 3.31Å; Y82-S296 WeakPolarHBondContact OH-CB 3.44Å; Y82-S296 PolarHBondContact OH-OG 3.37Å; R292-S296 PolarHBondContact O-N 3.5Å; R292-S296 VanDerWaalsContact O-N 3.16Å; R292-S296 PolarHBondContact O-OG 3.05Å; P293-S296 CarbonylContact O-C 3.57Å; P293-S296 WeakPolarHBondContact O-CA 3.35Å; P293-S296 WeakPolarHBondContact O-CB 3.4Å; P293-S296 PolarHBondContact O-N 3.47Å; L294-S296 PolarHBondContact O-N 2.94Å; S296-N298 PolarHBondContact O-N 2.91Å; S296-N298 VanDerWaalsContact O-N 3.15Å; S296-S299 PolarHBondContact O-N 2.93Å
297A91.2Very high84Confident28 Ų2825.1 Ų25.123%0.23114%0.139CC..Hα-helixtrans-62.8-19177.200000112.8V43 P293 L294 S299 C300 L301V43-A297 HydrophobicContact CG2-CB 4.43Å; P293-A297 PolarHBondContact O-N 3.32Å; L294-A297 WeakPolarHBondContact O-CB 3.24Å; L294-A297 PolarHBondContact O-N 3.3Å; A297-S299 PolarHBondContact O-N 3.21Å; A297-C300 PolarHBondContact O-N 2.99Å; A297-L301 WeakPolarHBondContact O-CG 3.2Å; A297-L301 PolarHBondContact O-N 3.08Å
298N89.5Confident82.5Confident0 Ų028.5 Ų28.50%015%0.152CC..Hα-helixtrans-47.4-44170.3178.874.4000112.1S120 V253 C257 F258 A295 S296 C300 L301 D302S120-N298 VanDerWaalsContact CB-ND2 3.33Å; S120-N298 WeakPolarHBondContact CB-ND2 3.21Å; S120-N298 PolarHBondContact OG-ND2 3.31Å; V253-N298 WeakPolarHBondContact CG1-OD1 3.33Å; C257-N298 HydrophobicContact CB-CB 4.19Å; F258-N298 HydrophobicContact CE1-CB 3.78Å; F258-N298 HydrophobicContact CZ-CB 4.1Å; F258-N298 WeakPolarHBondContact CZ-OD1 3.41Å; A295-N298 VanDerWaalsContact O-CB 3.23Å; A295-N298 WeakPolarHBondContact O-CB 3.34Å; A295-N298 PolarHBondContact O-N 3.37Å; S296-N298 PolarHBondContact O-N 2.91Å; S296-N298 VanDerWaalsContact O-N 3.15Å; N298-C300 PolarHBondContact O-N 2.74Å; N298-C300 VanDerWaalsContact O-N 3.1Å; N298-L301 PolarHBondContact O-N 3.11Å; N298-L301 VanDerWaalsContact O-N 3.07Å; N298-D302 PolarHBondContact ND2-OD2 3.07Å; N298-D302 PolarHBondContact O-N 3.2Å; N298-D302 PolarHBondContact OD1-OD2 2.75Å
299S89.3Confident80.6Confident0 Ų029 Ų290%016%0.158CC..Hα-helixtrans-63-19.1-178.6-60.90000114.5N51 D79 N116 S296 A297N51-S299 PolarHBondContact ND2-O 3.32Å; D79-S299 VanDerWaalsContact CG-CA 3.48Å; D79-S299 VanDerWaalsContact OD1-CA 3.32Å; D79-S299 WeakPolarHBondContact OD1-CA 3.5Å; D79-S299 VanDerWaalsContact OD1-CB 3.3Å; D79-S299 WeakPolarHBondContact OD1-CB 3.35Å; D79-S299 PolarHBondContact OD1-OG 2.73Å; N116-S299 PolarHBondContact OD1-OG 3.2Å; S296-S299 PolarHBondContact O-N 2.93Å; A297-S299 PolarHBondContact O-N 3.21Å
300C87.6Confident78.9Confident15 Ų1529.3 Ų29.310%0.10117%0.165CC..Hα-helixtrans-95-36.4173.5-58.80000111.7G47 L50 A297 N298 V304G47-C300 PolarHBondContact N-SG 2.68Å; G47-C300 VanDerWaalsContact N-SG 3.44Å; L50-C300 HydrophobicContact CD1-CB 4.46Å; A297-C300 PolarHBondContact O-N 2.99Å; N298-C300 PolarHBondContact O-N 2.74Å; N298-C300 VanDerWaalsContact O-N 3.1Å; C300-V304 WeakPolarHBondContact O-CG2 3.32Å
301L82.3Confident76.9Confident56 Ų5630.8 Ų30.829%0.29317%0.17SC..Hα-helixtrans-72.5-35-175.3-70173.8000112.3C257 A297 N298 V304 L305C257-L301 WeakPolarHBondContact SG-CD1 3.44Å; A297-L301 WeakPolarHBondContact O-CG 3.2Å; A297-L301 PolarHBondContact O-N 3.08Å; N298-L301 PolarHBondContact O-N 3.11Å; N298-L301 VanDerWaalsContact O-N 3.07Å; L301-V304 PolarHBondContact O-N 3.48Å; L301-L305 HydrophobicContact CB-CD1 4Å; L301-L305 WeakPolarHBondContact O-CB 3.31Å; L301-L305 WeakPolarHBondContact O-CG 3.34Å; L301-L305 PolarHBondContact O-N 2.9Å
302D77.4Confident74.9Confident1 Ų137.5 Ų37.51%0.00520%0.195CC..Hα-helixtrans-55.1-60.1-178.7-83.2-31.4000111.3L75 N298 V304 L305 Y306L75-D302 HydrophobicContact CD2-CB 3.88Å; L75-D302 HydrophobicContact CG-CB 4.37Å; N298-D302 PolarHBondContact ND2-OD2 3.07Å; N298-D302 PolarHBondContact O-N 3.2Å; N298-D302 PolarHBondContact OD1-OD2 2.75Å; D302-V304 PolarHBondContact O-N 3.33Å; D302-L305 PolarHBondContact O-N 3.34Å; D302-Y306 VanDerWaalsContact C-CD2 3.46Å; D302-Y306 HydrophobicContact CB-CD2 4.44Å; D302-Y306 HydrophobicContact CB-CE2 4.04Å; D302-Y306 WeakPolarHBondContact O-CD2 3.43Å; D302-Y306 WeakPolarHBondContact O-CE2 3.33Å; D302-Y306 PolarHBondContact O-N 3.44Å
303P71.8Confident72.8Confident9 Ų939 Ų396%0.05820%0.203CC..Hα-helixtrans-54.6-53.1174.8-25.733.6000112.9L50 N51 L305 Y306 F307L50-P303 HydrophobicContact CB-CB 4.22Å; L50-P303 HydrophobicContact CB-CG 4.31Å; N51-P303 VanDerWaalsContact OD1-CG 3.26Å; N51-P303 WeakPolarHBondContact OD1-CG 3.44Å; P303-L305 VanDerWaalsContact C-N 3.28Å; P303-L305 PolarHBondContact O-N 3.37Å; P303-Y306 CarbonylContact O-C 3.59Å; P303-Y306 PolarHBondContact O-N 2.88Å; P303-F307 HydrophobicContact CB-CD2 4.11Å; P303-F307 HydrophobicContact CB-CE2 4.21Å; P303-F307 WeakPolarHBondContact O-CB 3.18Å; P303-F307 WeakPolarHBondContact O-CD2 3.33Å; P303-F307 PolarHBondContact O-N 3.45Å
304V66.8Low70.7Confident56 Ų5642.8 Ų42.834%0.33923%0.225SC..Hα-helixtrans-55.3-46-175.5171.80000110.9L50 C300 L301 D302 F307 L308L50-V304 HydrophobicContact CD1-CG2 3.75Å; L50-V304 HydrophobicContact CD2-CG2 4.42Å; C300-V304 WeakPolarHBondContact O-CG2 3.32Å; L301-V304 PolarHBondContact O-N 3.48Å; D302-V304 PolarHBondContact O-N 3.33Å; V304-F307 PolarHBondContact O-N 3.48Å; V304-L308 HydrophobicContact CG1-CD1 3.77Å; V304-L308 HydrophobicContact CG1-CG 4.48Å; V304-L308 VanDerWaalsContact O-CB 3.31Å; V304-L308 WeakPolarHBondContact O-CB 3.08Å; V304-L308 WeakPolarHBondContact O-CD1 3.37Å; V304-L308 WeakPolarHBondContact O-CG 3.3Å; V304-L308 PolarHBondContact O-N 2.98Å
305L64.2Low68.6Low38 Ų3845.5 Ų45.520%0.19923%0.231CC..Hα-helixtrans-69.7-37-179.6-64.1172.1000111.3I249 V253 L301 D302 P303 A309I249-L305 HydrophobicContact CB-CB 4.36Å; I249-L305 HydrophobicContact CD1-CB 4.09Å; I249-L305 VanDerWaalsContact CD1-O 3.28Å; I249-L305 WeakPolarHBondContact CD1-O 3.43Å; I249-L305 HydrophobicContact CG1-CB 4.02Å; I249-L305 HydrophobicContact CG1-CD2 4.3Å; I249-L305 HydrophobicContact CG2-CB 3.52Å; I249-L305 HydrophobicContact CG2-CD1 3.89Å; I249-L305 HydrophobicContact CG2-CG 4.25Å; V253-L305 HydrophobicContact CG2-CD1 3.5Å; L301-L305 HydrophobicContact CB-CD1 4Å; L301-L305 WeakPolarHBondContact O-CB 3.31Å; L301-L305 WeakPolarHBondContact O-CG 3.34Å; L301-L305 PolarHBondContact O-N 2.9Å; D302-L305 PolarHBondContact O-N 3.34Å; P303-L305 VanDerWaalsContact C-N 3.28Å; P303-L305 PolarHBondContact O-N 3.37Å; L305-A309 WeakPolarHBondContact O-CA 3.41Å; L305-A309 WeakPolarHBondContact O-CB 3.3Å; L305-A309 PolarHBondContact O-N 2.88Å
306Y63.7Low66.5Low33 Ų3349.4 Ų49.413%0.12925%0.248CC..Hα-helixtrans-70.7-38174.3-68.8-57.6000114.1M72 L75 L124 I127 D302 P303 A309 G310M72-Y306 HydrophobicContact CG-CD2 4.32Å; M72-Y306 HydrophobicContact CG-CE1 4.49Å; M72-Y306 HydrophobicContact CG-CE2 4.38Å; M72-Y306 HydrophobicContact CG-CG 4.45Å; M72-Y306 HydrophobicContact SD-CD1 3.8Å; M72-Y306 HydrophobicContact SD-CD2 4.23Å; M72-Y306 HydrophobicContact SD-CE1 4.27Å; M72-Y306 HydrophobicContact SD-CG 3.8Å; L75-Y306 HydrophobicContact CD2-CE2 3.69Å; L124-Y306 WeakPolarHBondContact CD2-OH 2.82Å; I127-Y306 WeakPolarHBondContact CD1-OH 3.4Å; D302-Y306 VanDerWaalsContact C-CD2 3.46Å; D302-Y306 HydrophobicContact CB-CD2 4.44Å; D302-Y306 HydrophobicContact CB-CE2 4.04Å; D302-Y306 WeakPolarHBondContact O-CD2 3.43Å; D302-Y306 WeakPolarHBondContact O-CE2 3.33Å; D302-Y306 PolarHBondContact O-N 3.44Å; P303-Y306 CarbonylContact O-C 3.59Å; P303-Y306 PolarHBondContact O-N 2.88Å; Y306-A309 PolarHBondContact O-N 3.41Å; Y306-G310 WeakPolarHBondContact O-CA 3.32Å; Y306-G310 PolarHBondContact O-N 3.21Å
307F63.4Low64.5Low58 Ų5852.8 Ų52.825%0.25428%0.276SS..Hα-helixtrans-65.5-45.7176.2-89.5-81000110.9I57 P303 V304 L313I57-F307 HydrophobicContact CD1-CZ 4.28Å; P303-F307 HydrophobicContact CB-CD2 4.11Å; P303-F307 HydrophobicContact CB-CE2 4.21Å; P303-F307 WeakPolarHBondContact O-CB 3.18Å; P303-F307 WeakPolarHBondContact O-CD2 3.33Å; P303-F307 PolarHBondContact O-N 3.45Å; V304-F307 PolarHBondContact O-N 3.48Å; F307-L313 HydrophobicContact CD1-CB 3.64Å; F307-L313 HydrophobicContact CD1-CD2 3.9Å; F307-L313 HydrophobicContact CD1-CG 4.36Å; F307-L313 HydrophobicContact CE1-CB 3.52Å; F307-L313 HydrophobicContact CE1-CD2 3.05Å; F307-L313 HydrophobicContact CE1-CG 3.87Å; F307-L313 HydrophobicContact CE2-CD2 4.14Å; F307-L313 HydrophobicContact CZ-CB 4.49Å; F307-L313 HydrophobicContact CZ-CD2 3.18Å; F307-L313 HydrophobicContact CZ-CG 4.39Å
308L59.7Low62.5Low107 Ų10760.8 Ų60.856%0.5630%0.3SS*.Hα-helixtrans-61.2-50171.7-68.2170.2000108.5R245 V304 G310R245-L308 PolarHBondContact NH1-O 3.41Å; R245-L308 PolarHBondContact NH2-O 2.63Å; V304-L308 HydrophobicContact CG1-CD1 3.77Å; V304-L308 HydrophobicContact CG1-CG 4.48Å; V304-L308 VanDerWaalsContact O-CB 3.31Å; V304-L308 WeakPolarHBondContact O-CB 3.08Å; V304-L308 WeakPolarHBondContact O-CD1 3.37Å; V304-L308 WeakPolarHBondContact O-CG 3.3Å; V304-L308 PolarHBondContact O-N 2.98Å; L308-G310 PolarHBondContact O-N 3.49Å
309A50.3Low60.6Low18 Ų1866.1 Ų66.115%0.14933%0.328CS..Hα-helixtrans-56.4-42.2-178.400000115.2R245 I249 L305 Y306R245-A309 HydrophobicContact CG-CB 4.38Å; R245-A309 VanDerWaalsContact NH1-CA 3.3Å; R245-A309 PolarHBondContact NH1-O 2.96Å; R245-A309 VanDerWaalsContact NH1-O 3.17Å; I249-A309 HydrophobicContact CD1-CB 3.48Å; I249-A309 VanDerWaalsContact CD1-CB 3.48Å; L305-A309 WeakPolarHBondContact O-CA 3.41Å; L305-A309 WeakPolarHBondContact O-CB 3.3Å; L305-A309 PolarHBondContact O-N 2.88Å; Y306-A309 PolarHBondContact O-N 3.41Å
310G55.6Low58.6Low22 Ų2268.9 Ų68.923%0.22735%0.351CS..  trans-104.6100-168.900000111.4Y306 L308 R312 L313Y306-G310 WeakPolarHBondContact O-CA 3.32Å; Y306-G310 PolarHBondContact O-N 3.21Å; L308-G310 PolarHBondContact O-N 3.49Å; G310-R312 PolarHBondContact O-N 3.48Å; G310-L313 PolarHBondContact O-N 2.98Å
311Q49.5Very low56.4Low106 Ų10675.7 Ų75.750%0.49538%0.379SS..THydrogen-bonded Turntrans-59.525162.1-63.7-178.7-28.600114.2R315Q311-R315 PolarHBondContact O-NE 3.38Å; Q311-R315 PolarHBondContact O-NH2 2.93Å; Q311-R315 VanDerWaalsContact O-NH2 3.1Å
312R50.5Low54.8Low155 Ų15577.7 Ų77.759%0.58540%0.395SS*.THydrogen-bonded Turntrans-107.2-40.8175.8-77.5-171.3-170.3-144.60.3112.5G310 R315 F316G310-R312 PolarHBondContact O-N 3.48Å; R312-R315 WeakPolarHBondContact O-CB 3.48Å; R312-R315 PolarHBondContact O-N 3.4Å; R312-F316 WeakPolarHBondContact O-CD2 3.47Å; R312-F316 PolarHBondContact O-N 3.42Å
313L46.6Very low53.3Low37 Ų3783.3 Ų83.319%0.19443%0.432CS..Hα-helixtrans-73.9-33.5177.2-96.990000113.2I57 F307 G310 R315 F316 A317I57-L313 HydrophobicContact CB-CD2 4.38Å; I57-L313 HydrophobicContact CD1-CD2 3.69Å; I57-L313 HydrophobicContact CG2-CD2 3.83Å; I57-L313 HydrophobicContact CG2-CG 4.29Å; F307-L313 HydrophobicContact CD1-CB 3.64Å; F307-L313 HydrophobicContact CD1-CD2 3.9Å; F307-L313 HydrophobicContact CD1-CG 4.36Å; F307-L313 HydrophobicContact CE1-CB 3.52Å; F307-L313 HydrophobicContact CE1-CD2 3.05Å; F307-L313 HydrophobicContact CE1-CG 3.87Å; F307-L313 HydrophobicContact CE2-CD2 4.14Å; F307-L313 HydrophobicContact CZ-CB 4.49Å; F307-L313 HydrophobicContact CZ-CD2 3.18Å; F307-L313 HydrophobicContact CZ-CG 4.39Å; G310-L313 PolarHBondContact O-N 2.98Å; L313-R315 PolarHBondContact O-N 2.95Å; L313-F316 PolarHBondContact O-N 3.15Å; L313-F316 VanDerWaalsContact O-N 3.08Å; L313-A317 PolarHBondContact O-N 3.12Å
314V49.3Very low52.2Low89 Ų8988.9 Ų88.954%0.53947%0.466SS..Hα-helixtrans-59.7-32.8170.9178.70000111.7R318V314-R318 VanDerWaalsContact O-CB 3.3Å; V314-R318 WeakPolarHBondContact O-CB 3.39Å; V314-R318 PolarHBondContact O-N 3.03Å
315R47.7Very low51.2Low126 Ų12693.2 Ų93.248%0.47549%0.487SS..Hα-helixtrans-67.6-45.3172.5-90.1-175.9-82.1-179.8-8.2111.6Q311 R312 L313 A317 R318 D319Q311-R315 PolarHBondContact O-NE 3.38Å; Q311-R315 PolarHBondContact O-NH2 2.93Å; Q311-R315 VanDerWaalsContact O-NH2 3.1Å; R312-R315 WeakPolarHBondContact O-CB 3.48Å; R312-R315 PolarHBondContact O-N 3.4Å; L313-R315 PolarHBondContact O-N 2.95Å; R315-A317 VanDerWaalsContact C-N 3.34Å; R315-A317 PolarHBondContact O-N 2.87Å; R315-R318 CarbonylContact O-C 3.56Å; R315-R318 WeakPolarHBondContact O-CB 3.29Å; R315-R318 PolarHBondContact O-N 3.26Å; R315-R318 VanDerWaalsContact O-N 3.11Å; R315-D319 WeakPolarHBondContact O-CB 3.07Å; R315-D319 PolarHBondContact O-N 2.64Å
316F49.2Very low50.7Low83 Ų8396.9 Ų96.936%0.36451%0.513SS..Hα-helixtrans-65.3-32.3176.3-67-60.2000114.1R312 L313 D319 A320R312-F316 WeakPolarHBondContact O-CD2 3.47Å; R312-F316 PolarHBondContact O-N 3.42Å; L313-F316 PolarHBondContact O-N 3.15Å; L313-F316 VanDerWaalsContact O-N 3.08Å; F316-D319 CarbonylContact O-C 3.6Å; F316-A320 PolarHBondContact O-N 3.21Å
317A49.4Very low49.6Very low71 Ų71100.6 Ų100.659%0.58754%0.544SS*.Hα-helixtrans-71.7-32.617200000112L313 R315 A320L313-A317 PolarHBondContact O-N 3.12Å; R315-A317 VanDerWaalsContact C-N 3.34Å; R315-A317 PolarHBondContact O-N 2.87Å; A317-A320 WeakPolarHBondContact O-CB 3.04Å; A317-A320 PolarHBondContact O-N 2.04Å
318R48.5Very low48.8Very low197 Ų197103.1 Ų103.174%0.74357%0.566SS**Hα-helixtrans-72.3-35.7173-162.9-178.9-109.4178.1-5.8111.9V314 R315 A320 K321V314-R318 VanDerWaalsContact O-CB 3.3Å; V314-R318 WeakPolarHBondContact O-CB 3.39Å; V314-R318 PolarHBondContact O-N 3.03Å; R315-R318 CarbonylContact O-C 3.56Å; R315-R318 WeakPolarHBondContact O-CB 3.29Å; R315-R318 PolarHBondContact O-N 3.26Å; R315-R318 VanDerWaalsContact O-N 3.11Å; R318-A320 PolarHBondContact O-N 3.05Å; R318-K321 WeakPolarHBondContact O-CB 3.34Å; R318-K321 PolarHBondContact O-N 3.07Å
319D50.6Low48.3Very low112 Ų112102.9 Ų102.960%0.59958%0.58SS**THydrogen-bonded Turntrans-77.4-3.3172.2-59.6-25.7000112.6R315 F316 K321R315-D319 WeakPolarHBondContact O-CB 3.07Å; R315-D319 PolarHBondContact O-N 2.64Å; F316-D319 CarbonylContact O-C 3.6Å; D319-K321 VanDerWaalsContact C-N 3.31Å
320A47.7Very low47.6Very low57 Ų57108.3 Ų108.347%0.47161%0.611SS.*THydrogen-bonded Turntrans-87.1-216900000112.3F316 A317 R318F316-A320 PolarHBondContact O-N 3.21Å; A317-A320 WeakPolarHBondContact O-CB 3.04Å; A317-A320 PolarHBondContact O-N 2.04Å; R318-A320 PolarHBondContact O-N 3.05Å
321K41.1Very low47Very low159 Ų159112.7 Ų112.769%0.69164%0.635SS**SBendtrans-66.1122.7162.7-163.2177-174.7-172.90107.1R318 D319R318-K321 WeakPolarHBondContact O-CB 3.34Å; R318-K321 PolarHBondContact O-N 3.07Å; D319-K321 VanDerWaalsContact C-N 3.31Å
322P47.9Very low46.8Very low98 Ų98112.5 Ų112.564%0.63665%0.652SS**PPolyproline II helixtrans-57.7146.9177.223-30.9000109.3T324P322-T324 PolarHBondContact O-N 3.19Å; P322-T324 VanDerWaalsContact O-N 3.08Å
323P45.6Very low46.3Very low118 Ų118115.3 Ų115.377%0.76666%0.663SS**PPolyproline II helixtrans-57.1119.8171.224.2-29.9000107.3D325P323-D325 PolarHBondContact O-N 3.13Å
324T50Low46.1Very low126 Ų126124.2 Ų124.277%0.77369%0.694SS**PPolyproline II helixtrans-59.2123.3162.4-330000105.9P322P322-T324 PolarHBondContact O-N 3.19Å; P322-T324 VanDerWaalsContact O-N 3.08Å
325D45.1Very low45.7Very low148 Ų148130.2 Ų130.279%0.79171%0.707SS**PPolyproline II helixtrans-47.7136.6-174.9-88.8-38.2000112P323 S327P323-D325 PolarHBondContact O-N 3.13Å; D325-S327 PolarHBondContact O-N 3.22Å
326P52.8Low45.3Very low115 Ų115131.5 Ų131.575%0.74772%0.722SS**  trans-69.1114.7163.928.3-27.7000108
327S42.1Very low44.7Very low110 Ų110130.7 Ų130.777%0.76974%0.737SS**  trans-45138.1166.9-178.20000110.4D325 A329D325-S327 PolarHBondContact O-N 3.22Å; S327-A329 PolarHBondContact O-N 3.36Å
328P46.5Very low44.2Very low112 Ų112136 Ų13673%0.72776%0.755SS**  trans-64.5135.4-169.823.9-32.6000112.1
329A48.1Very low43.6Very low102 Ų102138.5 Ų138.584%0.84376%0.764SS**  trans-58.3139.3171.400000111.5S327S327-A329 PolarHBondContact O-N 3.36Å
330T36.3Very low42.9Very low131 Ų131144.3 Ų144.380%0.80478%0.778SS**  trans-121.9156.3163.2-3.30000108.6
331P43.3Very low42.1Very low114 Ų114146.3 Ų146.374%0.7479%0.788SS**  -102.5159.1-115.7517.8000112.8R333P331-R333 PolarHBondContact O-N 2.81Å; P331-R333 VanDerWaalsContact O-N 3.14Å
332A44.5Very low41.7Very low103 Ų103145 Ų14585%0.85179%0.789SS**  trans-55.2114.1170.900000111.5R334A332-R334 PolarHBondContact O-N 3.23Å
333R41Very low41Very low214 Ų214150.6 Ų150.681%0.80880%0.798SS**  trans-82.299.2170.4-146175.4-172-169.62.1108.5P331 R335P331-R333 PolarHBondContact O-N 2.81Å; P331-R333 VanDerWaalsContact O-N 3.14Å; R333-R335 PolarHBondContact O-N 2.91Å
334R42.4Very low40.3Very low224 Ų224150.3 Ų150.385%0.84579%0.794SS**  trans-54.1121.5162.3-83.9-177.8-176.6-172.71.2108.6A332A332-R334 PolarHBondContact O-N 3.23Å
335R40.3Very low39.5Very low214 Ų214150.6 Ų150.681%0.80879%0.791SS**  trans-109.6110.5151.2-77-172.5-154.4-111.34.7107.6R333R333-R335 PolarHBondContact O-N 2.91Å
336L39.8Very low38.8Very low154 Ų154151 Ų15181%0.80679%0.789SS**  trans-76.9141.3162.7-96.8105000109.4
337G36.4Very low37.9Very low66 Ų66153 Ų15368%0.6879%0.789SS**  trans89.9106.9143.900000117.2
338L37.8Very low37.3Very low183 Ų183159 Ų15996%0.95880%0.795SS**  -178.4115.9103-94.1154.7000110.1
339R35.9Very low36.5Very low248 Ų248159.9 Ų159.994%0.93679%0.792SS**  trans-81.6122.4169.6-165.7-178.8-169.8-167.82.9106.6
340R35.7Very low35.7Very low234 Ų234162.4 Ų162.488%0.88379%0.786SS**  trans-130.2122161.2-162.4171.5-178165.50.4109
341S32.4Very low35.4Very low99 Ų99164.2 Ų164.269%0.69279%0.791SS**  trans-85.8137.5175.4173.10000109.4
342D32.1Very low34.8Very low132 Ų132164 Ų16471%0.70679%0.788SS**  trans-163.3116.6140.6-94-35.2000106
343R33.2Very low34.1Very low216 Ų216167.4 Ų167.482%0.81579%0.79SS**  60.7113.787.1-147.7177.4-173.6174.41.4108.8
344T30.7Very low33.4Very low111 Ų111160.8 Ų160.868%0.68179%0.789SS**  cis-176.6138.842.9-110000104.1
345D32.8Very low32.7Very low133 Ų133155.2 Ų155.271%0.71179%0.785SS**  -177.9122.796.1-93-30.7000106.6
346M31.6Very low32.1Very low155 Ų155149.4 Ų149.476%0.76478%0.777SS**  62.3106.796.4-147.2162.873.600109.7
347Q32.5Very low31.7Very low159 Ų159149.9 Ų149.974%0.74378%0.775SS**  cis-172.1126.445.5-147.2155.2-23.100110.2
348R30.3Very low31.5Very low234 Ų234153.3 Ų153.388%0.88378%0.777SS**  trans51.899.9136-160.3169.4-84.8176.4-7.9120.5
349I29.5Very low31.2Very low132 Ų132147.5 Ų147.568%0.67775%0.752SS**  trans-46.8148.1144.5-75.1172000114.2
350E32Very low31.1Very low155 Ų155145.7 Ų145.772%0.72475%0.745SS**  trans58.7129.5153.1-69.5156.717100120.2
351D28.4Very low30.9Very low169 Ų169144.6 Ų144.690%0.90474%0.741SS**  -150133.7109.3-95.8-31.3000111.8
352V31.9Very low30.9Very low110 Ų110144.9 Ų144.967%0.66774%0.739SS**  trans-89150.5167.7173.40000107
353L29.8Very low30.9Very low173 Ų173146.5 Ų146.591%0.90674%0.742SS**  trans82.1128.9160.3-85.5144.7000119.7
354G26.9Very low30.8Very low76 Ų76140.5 Ų140.578%0.78473%0.734SS**  trans102.3134.9161.500000112.7
355S26.3Very low31Very low107 Ų107141.5 Ų141.575%0.74874%0.74SS**  cis-178.9148.6-0.31790000104.6
356S28.3Very low31.7Very low92 Ų92140.4 Ų140.464%0.64374%0.74SS**  trans61.7152.1153.9-79.60000117.4
357E32Very low31.7Very low163 Ų163137.9 Ų137.976%0.76274%0.744SS**  cis-173.1167.2-9-116.2167.7117.200103.8
358D31Very low31.6Very low138 Ų138133.4 Ų133.474%0.73874%0.74SS**  trans73.3140.7155.2-112.3-5.7000116.9
359S31.3Very low31.5Very low62 Ų62126.7 Ų126.743%0.43473%0.729SS.*  cis-167.6151.49.2-147.70000107.2
360R33.6Very low31.8Very low209 Ų209128.2 Ų128.279%0.78973%0.734SS**  trans58.4133.3142-75.9172.3-129-179.40.6117.6
361R32.3Very low31.9Very low211 Ų211126.4 Ų126.480%0.79673%0.729SS**  cis-171.5133.536.3-123.7-178.2-178.8164-1.7105.4
362T32.1Very low32.1Very low105 Ų105123 Ų12364%0.64471%0.714SS**  51.6128.8111.663.90000113.6
363E32.6Very low32.3Very low166 Ų166126.1 Ų126.178%0.77672%0.719SS**  cis-174.4140.540.3-136.1163.1147.400109.8
364S31.7Very low32.6Very low91 Ų91123.4 Ų123.464%0.63671%0.705SS**  trans64.496.913366.50000121.2
365T33.9Very low33.1Very low131 Ų131126.6 Ų126.680%0.80470%0.703SS**  -0.8163.9101.2-1.90000116.5
366P47Very low33.6Very low110 Ų110132.2 Ų132.271%0.71471%0.708SS**  cis-149.7-176.91438.9-16.2000117.6
367A32.7Very low34.2Very low102 Ų102139.5 Ų139.584%0.84374%0.738SS**  trans64.1143.3142.200000118.2
368G29.9Very low34.3Very low65 Ų65138.3 Ų138.367%0.6774%0.737SS**  cis-166.6167.511.700000108
369S29.2Very low34.4Very low94 Ų94138.3 Ų138.366%0.65774%0.737SS**  101.2126.6111.1-165.70000111.8
370E34.6Very low34.6Very low164 Ų164142.6 Ų142.677%0.76675%0.754SS**  trans67.7147.9147.5-79.4178.5121.800117.1
371N33.6Very low34.7Very low117 Ų117138.6 Ų138.663%0.62675%0.751SS**  cis-166.8154.65.6-141.5-18.5000108.4
372T34.3Very low34.8Very low98 Ų98134.1 Ų134.160%0.60175%0.749SS**  trans50.8138.2142.433.90000124.7
373K34.7Very low35Very low175 Ų175136.1 Ų136.176%0.76176%0.756SS**  trans75.8147.5133.7-73.8177177.9-179.70116.9
374D37.7Very low35.2Very low115 Ų115133.9 Ų133.962%0.61575%0.754SS**  cis-171.6158.20-118-25.7000108.4
375I35.8Very low35.5Very low143 Ų143137.2 Ų137.273%0.73376%0.763SS**  trans76123.2135.3-65.5164.7000122
376R37.6Very low35.6Very low225 Ų225137.8 Ų137.885%0.84976%0.76SS**  trans-50.8151.3154.8-72.6173.2-179.8173.31.6114.3
377L40Very low34.6Very low245 Ų245140.3 Ų140.3100%1.28376%0.764SS**  -170.20106.3-102.1155.1000110.7

Retrieved 377 of 377 residues in 646.5 ms (Link to these results)

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