A0A3Q0KH25_SCHMA Loading...

Putative sugar transporter

AlphaFold DB , UniProt , Accession A0A3Q0KH25, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 252 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
1M44.2Very low44.1Very low217 Ų217142.2 Ų142.2100%1.06972%0.72SS**  0-4.30-96.6179.2-179.500115.6
2R37.6Very low46.1Very low219 Ų219142.8 Ų142.883%0.82673%0.725SS**  trans-83.9-14.3177.8-99.2-178174.1175.9-2.2116S4R2-S4 PolarHBondContact O-N 3.02Å
3V42.9Very low48.6Very low127 Ų127138.5 Ų138.577%0.7770%0.696SS**G310 helixtrans-83.8-8.8-171.9-179.80000113.6
4S52.3Low50.8Low85 Ų85129.9 Ų129.959%0.59465%0.654SS**G310 helixtrans-89.12.1180560000115.2R2R2-S4 PolarHBondContact O-N 3.02Å
5R42.2Very low53.3Low226 Ų226123 Ų12385%0.85363%0.626SS**G310 helixtrans-97.5-5.7-179.1-75.1-171.6165.1175.4-5115.3
6S39.5Very low55.5Low98 Ų98115.4 Ų115.469%0.68559%0.587SS**SBendtrans-95.511.7177.662.70000114.2
7V41.3Very low57.6Low86 Ų86108.7 Ų108.752%0.52155%0.553SS.*  trans-106.385.9169.5-174.90000107.4N9 S10V7-N9 PolarHBondContact O-N 2.87Å; V7-S10 WeakPolarHBondContact O-CB 3.05Å; V7-S10 PolarHBondContact O-N 3.04Å; V7-S10 PolarHBondContact O-OG 3.17Å
8Q42.8Very low59.6Low188 Ų188102.7 Ų102.788%0.87952%0.523SS*.THydrogen-bonded Turntrans-68.810.7-170.9-140.8158.6-22.900114.6
9N42.6Very low61.3Low162 Ų16297.3 Ų97.387%0.86650%0.495SS*.THydrogen-bonded Turntrans-146.924.5173.8-82.8-31000111.1V7 E11V7-N9 PolarHBondContact O-N 2.87Å; N9-E11 PolarHBondContact O-N 3.1Å; N9-E11 VanDerWaalsContact O-N 3.09Å
10S47.3Very low63Low54 Ų5492.8 Ų92.838%0.37847%0.473SS..  trans-62115.4-171.458.70000111.3V7 L12V7-S10 WeakPolarHBondContact O-CB 3.05Å; V7-S10 PolarHBondContact O-N 3.04Å; V7-S10 PolarHBondContact O-OG 3.17Å; S10-L12 PolarHBondContact O-N 3.34Å
11E52Low64.5Low102 Ų10289 Ų8948%0.47746%0.455SS..  trans-34.799.4166.7-54.6-179.2159.800110.6N9 Y13 Y212 G213N9-E11 PolarHBondContact O-N 3.1Å; N9-E11 VanDerWaalsContact O-N 3.09Å; E11-Y13 PolarHBondContact O-N 3.02Å; E11-Y212 HydrophobicContact CB-CE1 3.96Å; E11-Y212 HydrophobicContact CG-CE1 4.29Å; E11-G213 VanDerWaalsContact CB-CA 3.49Å; E11-G213 WeakPolarHBondContact OE2-CA 3.17Å
12L67.9Low66.9Low149 Ų14978.7 Ų78.778%0.7840%0.404SS*.  trans-72.198.6-179.7-68.4169000107S10S10-L12 PolarHBondContact O-N 3.34Å
13Y78.4Confident69.6Low88 Ų8868.8 Ų68.835%0.34537%0.367SS..  trans-53.2148.2170.566.5-90.7000109.7E11 V18 V218E11-Y13 PolarHBondContact O-N 3.02Å; Y13-V18 HydrophobicContact CD2-CG2 3.47Å; Y13-V18 VanDerWaalsContact CD2-CG2 3.47Å; Y13-V18 HydrophobicContact CE2-CG2 3.78Å; Y13-V18 HydrophobicContact CG-CG2 4.45Å; Y13-V218 HydrophobicContact CD1-CG2 3.63Å; Y13-V218 HydrophobicContact CD2-CG1 4.41Å; Y13-V218 HydrophobicContact CE1-CG2 4.05Å; Y13-V218 HydrophobicContact CG-CG1 4.32Å; Y13-V218 HydrophobicContact CG-CG2 4Å
14S80.5Confident72.1Confident17 Ų1767.5 Ų67.512%0.11935%0.351CS..  trans-76.9129.2174.3166.10000110.2S16 T17 V18 D201S14-S16 VanDerWaalsContact C-N 3.26Å; S14-S16 PolarHBondContact O-N 3.39Å; S14-S16 PolarHBondContact OG-N 3.01Å; S14-S16 PolarHBondContact OG-OG 3.22Å; S14-T17 PolarHBondContact O-N 3.02Å; S14-T17 PolarHBondContact O-OG1 3.44Å; S14-V18 PolarHBondContact O-N 3.47Å; S14-D201 VanDerWaalsContact OG-CG 3.23Å; S14-D201 PolarHBondContact OG-OD2 2.96Å
15A87Confident74.2Confident27 Ų2765.2 Ų65.222%0.22333%0.332CS..Hα-helixtrans-60.3-37.6173.700000112.4T17 V18 V19 Y77A15-T17 VanDerWaalsContact C-N 3.34Å; A15-T17 PolarHBondContact O-N 3.39Å; A15-V18 PolarHBondContact O-N 3.4Å; A15-V19 WeakPolarHBondContact O-CG2 3.45Å; A15-V19 PolarHBondContact O-N 3.05Å; A15-Y77 HydrophobicContact CB-CD1 4.04Å; A15-Y77 HydrophobicContact CB-CD2 3.94Å; A15-Y77 HydrophobicContact CB-CG 3.53Å
16S88.7Confident76.6Confident2 Ų255.7 Ų55.71%0.01430%0.297CS..Hα-helixtrans-66.7-37-176.664.20000111.7S14 V19 V20 N74 V197 D201S14-S16 VanDerWaalsContact C-N 3.26Å; S14-S16 PolarHBondContact O-N 3.39Å; S14-S16 PolarHBondContact OG-N 3.01Å; S14-S16 PolarHBondContact OG-OG 3.22Å; S16-V19 PolarHBondContact O-N 2.93Å; S16-V20 WeakPolarHBondContact O-CG2 3.36Å; S16-V20 PolarHBondContact O-N 3.49Å; S16-V20 VanDerWaalsContact O-N 3.09Å; S16-N74 VanDerWaalsContact CA-OD1 3.28Å; S16-N74 WeakPolarHBondContact CA-OD1 3.33Å; S16-N74 WeakPolarHBondContact CB-OD1 3.21Å; S16-V197 WeakPolarHBondContact OG-CG2 3.31Å; S16-D201 PolarHBondContact OG-OD2 2.93Å
17T92Very high79.3Confident1 Ų152 Ų521%0.00627%0.269CS..Hα-helixtrans-69-38175.960.40000111.8S14 A15 V19 V20 C21 V197 V205 F210 Y214S14-T17 PolarHBondContact O-N 3.02Å; S14-T17 PolarHBondContact O-OG1 3.44Å; A15-T17 VanDerWaalsContact C-N 3.34Å; A15-T17 PolarHBondContact O-N 3.39Å; T17-V19 PolarHBondContact O-N 3.4Å; T17-V20 PolarHBondContact O-N 3.22Å; T17-C21 PolarHBondContact O-N 3.45Å; T17-C21 PolarHBondContact O-SG 2.97Å; T17-V197 HydrophobicContact CG2-CG1 3.92Å; T17-V197 HydrophobicContact CG2-CG2 4.08Å; T17-V205 HydrophobicContact CG2-CG2 4.05Å; T17-F210 HydrophobicContact CG2-CD1 4.43Å; T17-F210 HydrophobicContact CG2-CD2 3.88Å; T17-F210 HydrophobicContact CG2-CE1 4.26Å; T17-F210 HydrophobicContact CG2-CE2 3.69Å; T17-F210 HydrophobicContact CG2-CG 4.26Å; T17-F210 HydrophobicContact CG2-CZ 3.89Å; T17-Y214 WeakPolarHBondContact CB-OH 3.43Å; T17-Y214 PolarHBondContact O-OH 3.01Å; T17-Y214 PolarHBondContact OG1-OH 3.11Å; T17-Y214 VanDerWaalsContact OG1-OH 3.11Å
18V92.5Very high81.8Confident0 Ų051.9 Ų51.90%027%0.265CS..Hα-helixtrans-62.2-43.2174.61730000111.2Y13 S14 A15 V20 C21 S22 Y77 Y214 V218 V221 V222Y13-V18 HydrophobicContact CD2-CG2 3.47Å; Y13-V18 VanDerWaalsContact CD2-CG2 3.47Å; Y13-V18 HydrophobicContact CE2-CG2 3.78Å; Y13-V18 HydrophobicContact CG-CG2 4.45Å; S14-V18 PolarHBondContact O-N 3.47Å; A15-V18 PolarHBondContact O-N 3.4Å; V18-V20 PolarHBondContact O-N 3.14Å; V18-C21 PolarHBondContact O-N 2.88Å; V18-S22 WeakPolarHBondContact O-CB 3.3Å; V18-S22 PolarHBondContact O-N 2.82Å; V18-Y77 HydrophobicContact CG1-CE2 4.47Å; V18-Y77 WeakPolarHBondContact CG1-OH 3.24Å; V18-Y214 WeakPolarHBondContact CA-OH 3.45Å; V18-Y214 HydrophobicContact CG2-CE2 4.39Å; V18-Y214 PolarHBondContact N-OH 3.35Å; V18-Y214 VanDerWaalsContact N-OH 3.1Å; V18-V218 HydrophobicContact CG2-CG1 3.67Å; V18-V221 HydrophobicContact CG1-CG1 4.47Å; V18-V222 HydrophobicContact CB-CG2 4.46Å; V18-V222 HydrophobicContact CG1-CG2 3.81Å
19V93Very high84.3Confident0 Ų044.8 Ų44.80%023%0.233CC..Hα-helixtrans-58-50.8174.5175.40000110.2A15 S16 T17 C21 S22 E23 I70 N73 Y77A15-V19 WeakPolarHBondContact O-CG2 3.45Å; A15-V19 PolarHBondContact O-N 3.05Å; S16-V19 PolarHBondContact O-N 2.93Å; T17-V19 PolarHBondContact O-N 3.4Å; V19-C21 PolarHBondContact O-N 2.94Å; V19-S22 PolarHBondContact O-N 3.06Å; V19-S22 VanDerWaalsContact O-N 3.13Å; V19-S22 PolarHBondContact O-OG 3.07Å; V19-E23 HydrophobicContact CG1-CG 4.35Å; V19-E23 WeakPolarHBondContact O-CG 3.34Å; V19-E23 PolarHBondContact O-N 3.42Å; V19-I70 HydrophobicContact CG1-CD1 3.86Å; V19-N73 HydrophobicContact CG1-CB 4.03Å; V19-N73 HydrophobicContact CG2-CB 3.72Å; V19-Y77 HydrophobicContact CG2-CD2 3.76Å; V19-Y77 HydrophobicContact CG2-CE2 3.53Å
20V94.8Very high86.7Confident8 Ų837 Ų375%0.04819%0.192CC..Hα-helixtrans-58.3-46178.3172.40000112S16 T17 V18 S22 E23 F24 G193 L194 V197 F210S16-V20 WeakPolarHBondContact O-CG2 3.36Å; S16-V20 PolarHBondContact O-N 3.49Å; S16-V20 VanDerWaalsContact O-N 3.09Å; T17-V20 PolarHBondContact O-N 3.22Å; V18-V20 PolarHBondContact O-N 3.14Å; V20-S22 VanDerWaalsContact C-N 3.3Å; V20-S22 PolarHBondContact O-N 3.15Å; V20-E23 PolarHBondContact O-N 2.87Å; V20-F24 WeakPolarHBondContact O-CB 3.32Å; V20-F24 PolarHBondContact O-N 3.35Å; V20-G193 WeakPolarHBondContact CG2-O 3.33Å; V20-L194 HydrophobicContact CG1-CD2 3.78Å; V20-L194 HydrophobicContact CG1-CG 3.92Å; V20-L194 HydrophobicContact CG2-CD2 4.48Å; V20-L194 HydrophobicContact CG2-CG 4.45Å; V20-V197 HydrophobicContact CG2-CG2 3.78Å; V20-F210 HydrophobicContact CB-CZ 4.3Å; V20-F210 HydrophobicContact CG1-CZ 4.13Å
21C95.2Very high88.9Confident14 Ų1436.2 Ų36.210%0.09519%0.185CC..Hα-helixtrans-60.4-41176.9-69.60000111.8T17 V18 V19 F24 L25 Y214 V222T17-C21 PolarHBondContact O-N 3.45Å; T17-C21 PolarHBondContact O-SG 2.97Å; V18-C21 PolarHBondContact O-N 2.88Å; V19-C21 PolarHBondContact O-N 2.94Å; C21-F24 PolarHBondContact O-N 3.18Å; C21-L25 WeakPolarHBondContact O-CB 3.47Å; C21-L25 PolarHBondContact O-N 3.43Å; C21-Y214 PolarHBondContact SG-OH 2.93Å; C21-Y214 VanDerWaalsContact SG-OH 3.41Å; C21-V222 HydrophobicContact CB-CG1 3.78Å; C21-V222 HydrophobicContact CB-CG2 4.01Å
22S93.7Very high90.9Very high0 Ų036.5 Ų36.50%019%0.188CC..Hα-helixtrans-67.2-39.4178.778.70000112.1V18 V19 V20 L25 K26 Q225V18-S22 WeakPolarHBondContact O-CB 3.3Å; V18-S22 PolarHBondContact O-N 2.82Å; V19-S22 PolarHBondContact O-N 3.06Å; V19-S22 VanDerWaalsContact O-N 3.13Å; V19-S22 PolarHBondContact O-OG 3.07Å; V20-S22 VanDerWaalsContact C-N 3.3Å; V20-S22 PolarHBondContact O-N 3.15Å; S22-L25 PolarHBondContact O-N 3.49Å; S22-K26 WeakPolarHBondContact O-CB 3.25Å; S22-K26 WeakPolarHBondContact O-CE 3.45Å; S22-K26 WeakPolarHBondContact O-CG 3.45Å; S22-K26 PolarHBondContact O-N 3.42Å; S22-Q225 PolarHBondContact OG-OE1 2.92Å
23E94.4Very high92Very high10 Ų1032 Ų325%0.04717%0.165CC..Hα-helixtrans-68.6-40.9175.9-66.3-60.2153.200111.5V19 V20 K26 L27 I70 V190V19-E23 HydrophobicContact CG1-CG 4.35Å; V19-E23 WeakPolarHBondContact O-CG 3.34Å; V19-E23 PolarHBondContact O-N 3.42Å; V20-E23 PolarHBondContact O-N 2.87Å; E23-K26 PolarHBondContact O-N 3.34Å; E23-K26 IonicContact OE1-NZ 2.83Å; E23-K26 PolarHBondContact OE1-NZ 2.8Å; E23-K26 VanDerWaalsContact OE2-CE 3.29Å; E23-K26 WeakPolarHBondContact OE2-CE 3.5Å; E23-K26 IonicContact OE2-NZ 3.39Å; E23-K26 PolarHBondContact OE2-NZ 3.44Å; E23-L27 WeakPolarHBondContact O-CB 2.97Å; E23-L27 PolarHBondContact O-N 3.05Å; E23-I70 HydrophobicContact CG-CD1 3.68Å; E23-V190 HydrophobicContact CB-CG2 3.93Å
24F96Very high92.7Very high100 Ų10028 Ų2844%0.43915%0.149SC..Hα-helixtrans-63.6-42.1175.3-177.6-105000111.6V20 C21 L27 L28 V190V20-F24 WeakPolarHBondContact O-CB 3.32Å; V20-F24 PolarHBondContact O-N 3.35Å; C21-F24 PolarHBondContact O-N 3.18Å; F24-L27 HydrophobicContact CD2-CD2 4.49Å; F24-L27 WeakPolarHBondContact O-CB 3.44Å; F24-L27 PolarHBondContact O-N 3.24Å; F24-L28 HydrophobicContact CD1-CD1 3.99Å; F24-L28 HydrophobicContact CD1-CG 4.42Å; F24-L28 HydrophobicContact CE1-CD1 3.44Å; F24-L28 VanDerWaalsContact CE1-CD1 3.44Å; F24-L28 HydrophobicContact CE1-CG 4.03Å; F24-L28 HydrophobicContact CZ-CD1 3.87Å; F24-L28 HydrophobicContact CZ-CD2 4.22Å; F24-L28 HydrophobicContact CZ-CG 4.08Å; F24-L28 WeakPolarHBondContact O-CG 3.46Å; F24-L28 PolarHBondContact O-N 3.08Å; F24-V190 HydrophobicContact CB-CG2 3.94Å; F24-V190 HydrophobicContact CD2-CG2 4.4Å
25L95.6Very high93.2Very high38 Ų3830.4 Ų30.420%0.19916%0.157CC..Hα-helixtrans-64.8-43.2176-161.4154.4000111C21 S22 L27 L28 L29 V222 I223 A226C21-L25 WeakPolarHBondContact O-CB 3.47Å; C21-L25 PolarHBondContact O-N 3.43Å; S22-L25 PolarHBondContact O-N 3.49Å; L25-L27 VanDerWaalsContact C-N 3.32Å; L25-L27 PolarHBondContact O-N 3.46Å; L25-L28 PolarHBondContact O-N 3.05Å; L25-L29 HydrophobicContact CD2-CD1 3.34Å; L25-L29 HydrophobicContact CD2-CG 3.74Å; L25-L29 WeakPolarHBondContact O-CB 3.43Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 3.33Å; L25-V222 HydrophobicContact CD1-CG1 4.31Å; L25-I223 HydrophobicContact CD1-CG1 4.02Å; L25-A226 HydrophobicContact CB-CB 4Å; L25-A226 HydrophobicContact CD2-CB 3.5Å; L25-A226 VanDerWaalsContact CD2-CB 3.5Å; L25-A226 HydrophobicContact CG-CB 4.23Å
26K93.6Very high93.4Very high26 Ų2638.6 Ų38.611%0.11318%0.184CC..Hα-helixtrans-59.7-41.3173.2-78.1-174.6-77.1154.20112.5S22 E23 L29 S30 A226 L230S22-K26 WeakPolarHBondContact O-CB 3.25Å; S22-K26 WeakPolarHBondContact O-CE 3.45Å; S22-K26 WeakPolarHBondContact O-CG 3.45Å; S22-K26 PolarHBondContact O-N 3.42Å; E23-K26 PolarHBondContact O-N 3.34Å; E23-K26 IonicContact OE1-NZ 2.83Å; E23-K26 PolarHBondContact OE1-NZ 2.8Å; E23-K26 VanDerWaalsContact OE2-CE 3.29Å; E23-K26 WeakPolarHBondContact OE2-CE 3.5Å; E23-K26 IonicContact OE2-NZ 3.39Å; E23-K26 PolarHBondContact OE2-NZ 3.44Å; K26-L29 PolarHBondContact O-N 3.2Å; K26-S30 VanDerWaalsContact O-CB 3.24Å; K26-S30 WeakPolarHBondContact O-CB 3.46Å; K26-S30 PolarHBondContact O-N 3.12Å; K26-S30 PolarHBondContact O-OG 3.41Å; K26-A226 VanDerWaalsContact CG-CA 3.5Å; K26-A226 HydrophobicContact CG-CB 3.7Å; K26-A226 WeakPolarHBondContact CG-O 3.4Å; K26-L230 HydrophobicContact CG-CG 4.33Å
27L94.9Very high93.4Very high19 Ų1942.3 Ų42.310%0.09920%0.201CC..Hα-helixtrans-60.2-49.3175.9174.467000110.8E23 F24 L25 S30 T31 L183 L187 V190E23-L27 WeakPolarHBondContact O-CB 2.97Å; E23-L27 PolarHBondContact O-N 3.05Å; F24-L27 HydrophobicContact CD2-CD2 4.49Å; F24-L27 WeakPolarHBondContact O-CB 3.44Å; F24-L27 PolarHBondContact O-N 3.24Å; L25-L27 VanDerWaalsContact C-N 3.32Å; L25-L27 PolarHBondContact O-N 3.46Å; L27-S30 PolarHBondContact O-N 3.47Å; L27-T31 WeakPolarHBondContact O-CB 3.34Å; L27-T31 PolarHBondContact O-N 2.91Å; L27-T31 PolarHBondContact O-OG1 2.65Å; L27-L183 HydrophobicContact CD1-CG 4.04Å; L27-L183 WeakPolarHBondContact CD1-O 3.38Å; L27-L187 HydrophobicContact CD1-CB 4.41Å; L27-L187 HydrophobicContact CD1-CD2 3.73Å; L27-L187 HydrophobicContact CD1-CG 3.64Å; L27-L187 HydrophobicContact CD2-CD2 4.01Å; L27-L187 HydrophobicContact CG-CD2 4.49Å; L27-V190 HydrophobicContact CD2-CG2 4.4Å
28L95.5Very high93.2Very high84 Ų8445.4 Ų45.444%0.4422%0.215SC..Hα-helixtrans-60.7-49.4177.8-73-179.2000111.6F24 L25 S30 T31 I32F24-L28 HydrophobicContact CD1-CD1 3.99Å; F24-L28 HydrophobicContact CD1-CG 4.42Å; F24-L28 HydrophobicContact CE1-CD1 3.44Å; F24-L28 VanDerWaalsContact CE1-CD1 3.44Å; F24-L28 HydrophobicContact CE1-CG 4.03Å; F24-L28 HydrophobicContact CZ-CD1 3.87Å; F24-L28 HydrophobicContact CZ-CD2 4.22Å; F24-L28 HydrophobicContact CZ-CG 4.08Å; F24-L28 WeakPolarHBondContact O-CG 3.46Å; F24-L28 PolarHBondContact O-N 3.08Å; L25-L28 PolarHBondContact O-N 3.05Å; L28-S30 PolarHBondContact O-N 2.84Å; L28-T31 WeakPolarHBondContact O-CB 3.37Å; L28-T31 PolarHBondContact O-N 2.89Å; L28-I32 WeakPolarHBondContact O-CG1 3.23Å; L28-I32 PolarHBondContact O-N 2.68Å
29L94.4Very high92.8Very high39 Ų3948.5 Ų48.520%0.20425%0.247CC..Hα-helixtrans-61.7-44.1178.8-72.7-177.8000112L25 K26 T31 I32 L33 F227 L230L25-L29 HydrophobicContact CD2-CD1 3.34Å; L25-L29 HydrophobicContact CD2-CG 3.74Å; L25-L29 WeakPolarHBondContact O-CB 3.43Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 3.33Å; K26-L29 PolarHBondContact O-N 3.2Å; L29-T31 VanDerWaalsContact C-N 3.28Å; L29-T31 PolarHBondContact O-N 3.16Å; L29-I32 PolarHBondContact O-N 3.41Å; L29-L33 WeakPolarHBondContact O-CB 3.35Å; L29-L33 VanDerWaalsContact O-CG 3.27Å; L29-L33 WeakPolarHBondContact O-CG 3.38Å; L29-L33 PolarHBondContact O-N 2.92Å; L29-F227 HydrophobicContact CD1-CD2 4.38Å; L29-F227 HydrophobicContact CD1-CE1 4.21Å; L29-F227 HydrophobicContact CD1-CE2 3.99Å; L29-F227 HydrophobicContact CD1-CZ 3.91Å; L29-L230 HydrophobicContact CB-CD1 3.59Å; L29-L230 HydrophobicContact CD1-CD1 3.5Å; L29-L230 HydrophobicContact CG-CD1 4.22Å
30S93Very high92.6Very high0 Ų053 Ų530%027%0.269CS..Hα-helixtrans-62.8-38.9177.6-57.70000111.3K26 L27 L28 L33 I34 N182K26-S30 VanDerWaalsContact O-CB 3.24Å; K26-S30 WeakPolarHBondContact O-CB 3.46Å; K26-S30 PolarHBondContact O-N 3.12Å; K26-S30 PolarHBondContact O-OG 3.41Å; L27-S30 PolarHBondContact O-N 3.47Å; L28-S30 PolarHBondContact O-N 2.84Å; S30-L33 PolarHBondContact O-N 3.31Å; S30-I34 WeakPolarHBondContact O-CD1 3.32Å; S30-I34 VanDerWaalsContact O-CG1 3.25Å; S30-I34 WeakPolarHBondContact O-CG1 3.4Å; S30-I34 PolarHBondContact O-N 3.01Å; S30-N182 VanDerWaalsContact OG-CB 3.27Å; S30-N182 WeakPolarHBondContact OG-CB 3.35Å
31T93.5Very high92.3Very high37 Ų3758.1 Ų58.123%0.22730%0.295CS..Hα-helixtrans-61.7-52.2174.6-560000110.5L27 L28 L29 L33 I34 F35 L183L27-T31 WeakPolarHBondContact O-CB 3.34Å; L27-T31 PolarHBondContact O-N 2.91Å; L27-T31 PolarHBondContact O-OG1 2.65Å; L28-T31 WeakPolarHBondContact O-CB 3.37Å; L28-T31 PolarHBondContact O-N 2.89Å; L29-T31 VanDerWaalsContact C-N 3.28Å; L29-T31 PolarHBondContact O-N 3.16Å; T31-L33 VanDerWaalsContact C-N 3.28Å; T31-L33 PolarHBondContact O-N 2.87Å; T31-I34 PolarHBondContact O-N 3.23Å; T31-I34 VanDerWaalsContact O-N 3.12Å; T31-F35 HydrophobicContact CG2-CD2 3.89Å; T31-F35 HydrophobicContact CG2-CE2 3.65Å; T31-F35 VanDerWaalsContact O-CD2 3.22Å; T31-F35 WeakPolarHBondContact O-CD2 3.49Å; T31-F35 PolarHBondContact O-N 3.36Å; T31-F35 VanDerWaalsContact O-N 3.08Å; T31-L183 WeakPolarHBondContact OG1-CD1 3.26Å
32I93.9Very high92Very high108 Ų10866.1 Ų66.155%0.55433%0.327SS*.Hα-helixtrans-56.7-42.9177.8-67.4164.9000111.2L28 L29 I34 F35 Y36L28-I32 WeakPolarHBondContact O-CG1 3.23Å; L28-I32 PolarHBondContact O-N 2.68Å; L29-I32 PolarHBondContact O-N 3.41Å; I32-I34 PolarHBondContact O-N 3.18Å; I32-F35 PolarHBondContact O-N 3.09Å; I32-Y36 WeakPolarHBondContact O-CB 3.21Å; I32-Y36 PolarHBondContact O-N 3.44Å
33L91.6Very high91.8Very high55 Ų5573 Ų7329%0.28835%0.354SS..Hα-helixtrans-67.1-32.8179.2-71.7171.9000113.1L29 S30 T31 Y36 Q37 W179L29-L33 WeakPolarHBondContact O-CB 3.35Å; L29-L33 VanDerWaalsContact O-CG 3.27Å; L29-L33 WeakPolarHBondContact O-CG 3.38Å; L29-L33 PolarHBondContact O-N 2.92Å; S30-L33 PolarHBondContact O-N 3.31Å; T31-L33 VanDerWaalsContact C-N 3.28Å; T31-L33 PolarHBondContact O-N 2.87Å; L33-Y36 PolarHBondContact O-N 3.39Å; L33-Q37 VanDerWaalsContact O-CB 3.28Å; L33-Q37 WeakPolarHBondContact O-CB 3.04Å; L33-Q37 PolarHBondContact O-N 3.26Å; L33-W179 HydrophobicContact CB-CD2 4.07Å; L33-W179 HydrophobicContact CB-CE3 4.37Å; L33-W179 HydrophobicContact CB-CG 4.15Å; L33-W179 HydrophobicContact CD1-CD2 3.96Å; L33-W179 HydrophobicContact CD1-CE3 3.51Å; L33-W179 HydrophobicContact CD1-CH2 3.78Å; L33-W179 HydrophobicContact CD1-CZ2 4.19Å; L33-W179 HydrophobicContact CD1-CZ3 3.43Å; L33-W179 VanDerWaalsContact CD1-CZ3 3.43Å
34I91.8Very high91.6Very high3 Ų372.5 Ų72.52%0.01535%0.351CS..Hα-helixtrans-66.2-46.5172.2-68.7160.2000110.2S30 T31 I32 Y36 Q37 E38 I48 W179 M180 L183S30-I34 WeakPolarHBondContact O-CD1 3.32Å; S30-I34 VanDerWaalsContact O-CG1 3.25Å; S30-I34 WeakPolarHBondContact O-CG1 3.4Å; S30-I34 PolarHBondContact O-N 3.01Å; T31-I34 PolarHBondContact O-N 3.23Å; T31-I34 VanDerWaalsContact O-N 3.12Å; I32-I34 PolarHBondContact O-N 3.18Å; I34-Y36 VanDerWaalsContact C-N 3.27Å; I34-Y36 PolarHBondContact O-N 3.01Å; I34-Q37 PolarHBondContact O-N 3.45Å; I34-E38 HydrophobicContact CG2-CG 4.24Å; I34-E38 WeakPolarHBondContact O-CB 3.29Å; I34-E38 WeakPolarHBondContact O-CG 3.28Å; I34-E38 PolarHBondContact O-N 2.85Å; I34-I48 HydrophobicContact CG2-CD1 4.21Å; I34-I48 HydrophobicContact CG2-CG1 4.23Å; I34-W179 HydrophobicContact CD1-CB 4.36Å; I34-W179 HydrophobicContact CG1-CB 3.7Å; I34-M180 HydrophobicContact CD1-CB 4.33Å; I34-M180 HydrophobicContact CD1-CE 4.19Å; I34-M180 HydrophobicContact CD1-SD 4.1Å; I34-M180 HydrophobicContact CG2-CE 4.32Å; I34-L183 HydrophobicContact CD1-CB 3.91Å; I34-L183 HydrophobicContact CD1-CD1 3.48Å; I34-L183 VanDerWaalsContact CD1-CD1 3.48Å; I34-L183 HydrophobicContact CD1-CG 4.3Å
35F92.7Very high91.3Very high67 Ų6772.3 Ų72.329%0.29435%0.354SS..Hα-helixtrans-60.3-38.5176.5-81.3-78.8000112.3T31 I32 G39 I41 S44 I45 I48T31-F35 HydrophobicContact CG2-CD2 3.89Å; T31-F35 HydrophobicContact CG2-CE2 3.65Å; T31-F35 VanDerWaalsContact O-CD2 3.22Å; T31-F35 WeakPolarHBondContact O-CD2 3.49Å; T31-F35 PolarHBondContact O-N 3.36Å; T31-F35 VanDerWaalsContact O-N 3.08Å; I32-F35 PolarHBondContact O-N 3.09Å; F35-G39 PolarHBondContact O-N 2.86Å; F35-I41 HydrophobicContact CD1-CG1 4.26Å; F35-I41 HydrophobicContact CE1-CB 4.31Å; F35-I41 HydrophobicContact CE1-CG1 4.38Å; F35-I41 HydrophobicContact CE1-CG2 3.99Å; F35-S44 VanDerWaalsContact CD1-CB 3.41Å; F35-S44 WeakPolarHBondContact CD1-OG 3.46Å; F35-S44 VanDerWaalsContact CE1-CB 3.45Å; F35-I45 HydrophobicContact CE1-CG1 4.09Å; F35-I45 HydrophobicContact CZ-CG1 3.94Å; F35-I48 HydrophobicContact CE2-CD1 4.28Å
36Y90.8Very high91.1Very high199 Ų19973.3 Ų73.378%0.7836%0.364SS*.Hα-helixtrans-68.6-42.4174.9-173.9-99.4000112.4I32 L33 I34I32-Y36 WeakPolarHBondContact O-CB 3.21Å; I32-Y36 PolarHBondContact O-N 3.44Å; L33-Y36 PolarHBondContact O-N 3.39Å; I34-Y36 VanDerWaalsContact C-N 3.27Å; I34-Y36 PolarHBondContact O-N 3.01Å
37Q88.1Confident90.8Very high80 Ų8073.8 Ų73.837%0.37437%0.371SS..Hα-helixtrans-68.6-40.9-178.5-171.2-178.7-67.200112.6L33 I34 W179 R237L33-Q37 VanDerWaalsContact O-CB 3.28Å; L33-Q37 WeakPolarHBondContact O-CB 3.04Å; L33-Q37 PolarHBondContact O-N 3.26Å; I34-Q37 PolarHBondContact O-N 3.45Å; Q37-W179 VanDerWaalsContact OE1-NE1 3.17Å; Q37-R237 VanDerWaalsContact OE1-NH1 3.16Å
38E87.3Confident90.6Very high66 Ų6674.2 Ų74.231%0.30837%0.372SS..Hα-helixtrans-81.2-20.6-177.6-66.5-67.3162.200112.7I34 Q40 S44I34-E38 HydrophobicContact CG2-CG 4.24Å; I34-E38 WeakPolarHBondContact O-CB 3.29Å; I34-E38 WeakPolarHBondContact O-CG 3.28Å; I34-E38 PolarHBondContact O-N 2.85Å; E38-Q40 PolarHBondContact O-N 3.21Å; E38-S44 WeakPolarHBondContact CB-OG 3.33Å
39G84.9Confident90.4Very high65 Ų6576.3 Ų76.367%0.6738%0.375SS*.  trans68.1-23.5177.100000115.6F35F35-G39 PolarHBondContact O-N 2.86Å
40Q88.3Confident90.2Very high96 Ų9678 Ų7845%0.44939%0.385SS..  trans-116.5126177.1-64-175.40.700111.1E38 K42 R43 S44E38-Q40 PolarHBondContact O-N 3.21Å; Q40-K42 VanDerWaalsContact C-N 3.33Å; Q40-K42 PolarHBondContact O-N 3.41Å; Q40-R43 HydrophobicContact CB-CB 4.14Å; Q40-R43 HydrophobicContact CB-CG 4.01Å; Q40-R43 PolarHBondContact O-N 3.17Å; Q40-R43 VanDerWaalsContact O-N 3.17Å; Q40-R43 VanDerWaalsContact OE1-CZ 3.28Å; Q40-S44 PolarHBondContact O-N 2.94Å; Q40-S44 PolarHBondContact O-OG 3.26Å
41I89.1Confident89.9Confident115 Ų11578.9 Ų78.959%0.5939%0.389SS*.Hα-helixtrans-56-46179.8-66.4168.6000111.3F35 R43 S44 I45F35-I41 HydrophobicContact CD1-CG1 4.26Å; F35-I41 HydrophobicContact CE1-CB 4.31Å; F35-I41 HydrophobicContact CE1-CG1 4.38Å; F35-I41 HydrophobicContact CE1-CG2 3.99Å; I41-R43 PolarHBondContact O-N 2.86Å; I41-S44 WeakPolarHBondContact O-CB 3.43Å; I41-S44 PolarHBondContact O-N 3.2Å; I41-I45 HydrophobicContact CG2-CD1 3.72Å; I41-I45 HydrophobicContact CG2-CG1 4.42Å; I41-I45 WeakPolarHBondContact O-CG1 3.33Å; I41-I45 PolarHBondContact O-N 2.93Å
42K89.8Confident89.7Confident181 Ų18179.2 Ų79.279%0.78739%0.389SS*.Hα-helixtrans-61.3-41.6179.9-68.4-174.4178.9-178.30112.4Q40 S46Q40-K42 VanDerWaalsContact C-N 3.33Å; Q40-K42 PolarHBondContact O-N 3.41Å; K42-S46 VanDerWaalsContact O-CB 3.3Å; K42-S46 WeakPolarHBondContact O-CB 3.27Å; K42-S46 PolarHBondContact O-N 3.3Å
43R89.1Confident89.4Confident145 Ų14578.6 Ų78.655%0.54739%0.386SS..Hα-helixtrans-67.8-41.6176.7-66.8-174.1-176.7167.72111.5Q40 I41 S46 S47Q40-R43 HydrophobicContact CB-CB 4.14Å; Q40-R43 HydrophobicContact CB-CG 4.01Å; Q40-R43 PolarHBondContact O-N 3.17Å; Q40-R43 VanDerWaalsContact O-N 3.17Å; Q40-R43 VanDerWaalsContact OE1-CZ 3.28Å; I41-R43 PolarHBondContact O-N 2.86Å; R43-S46 PolarHBondContact O-N 3.48Å; R43-S47 VanDerWaalsContact O-CB 3.27Å; R43-S47 WeakPolarHBondContact O-CB 3.48Å; R43-S47 PolarHBondContact O-N 3.17Å
44S89.1Confident88.9Confident0 Ų080.3 Ų80.30%040%0.398CS..Hα-helixtrans-58.8-50.7176.5-51.60000111.3F35 E38 Q40 I41 S46 S47 I48F35-S44 VanDerWaalsContact CD1-CB 3.41Å; F35-S44 WeakPolarHBondContact CD1-OG 3.46Å; F35-S44 VanDerWaalsContact CE1-CB 3.45Å; E38-S44 WeakPolarHBondContact CB-OG 3.33Å; Q40-S44 PolarHBondContact O-N 2.94Å; Q40-S44 PolarHBondContact O-OG 3.26Å; I41-S44 WeakPolarHBondContact O-CB 3.43Å; I41-S44 PolarHBondContact O-N 3.2Å; S44-S46 PolarHBondContact O-N 3.36Å; S44-S47 PolarHBondContact O-N 2.91Å; S44-I48 WeakPolarHBondContact O-CB 3.41Å; S44-I48 VanDerWaalsContact O-CG1 3.24Å; S44-I48 WeakPolarHBondContact O-CG1 3.17Å; S44-I48 PolarHBondContact O-N 2.85Å
45I90.8Very high88.7Confident96 Ų9684.1 Ų84.149%0.49242%0.416SS..Hα-helixtrans-63.6-42.4178.4-65.9170.3000110.7F35 I41 I48 Y49F35-I45 HydrophobicContact CE1-CG1 4.09Å; F35-I45 HydrophobicContact CZ-CG1 3.94Å; I41-I45 HydrophobicContact CG2-CD1 3.72Å; I41-I45 HydrophobicContact CG2-CG1 4.42Å; I41-I45 WeakPolarHBondContact O-CG1 3.33Å; I41-I45 PolarHBondContact O-N 2.93Å; I45-I48 PolarHBondContact O-N 3.33Å; I45-Y49 VanDerWaalsContact O-CB 3.27Å; I45-Y49 WeakPolarHBondContact O-CB 3.5Å; I45-Y49 PolarHBondContact O-N 3.13Å
46S90.2Very high88.4Confident58 Ų5887.3 Ų87.341%0.40643%0.427SS..Hα-helixtrans-64.4-40.6177.5-179.50000112.4K42 R43 S44 Y49 N50K42-S46 VanDerWaalsContact O-CB 3.3Å; K42-S46 WeakPolarHBondContact O-CB 3.27Å; K42-S46 PolarHBondContact O-N 3.3Å; R43-S46 PolarHBondContact O-N 3.48Å; S44-S46 PolarHBondContact O-N 3.36Å; S46-Y49 PolarHBondContact O-N 3.41Å; S46-N50 WeakPolarHBondContact O-CB 3.36Å; S46-N50 PolarHBondContact O-N 3.22Å; S46-N50 PolarHBondContact O-ND2 3.44Å
47S88.4Confident88.3Confident37 Ų3782 Ų8226%0.25941%0.412SS..Hα-helixtrans-63.7-45.7176-1750000111.2R43 S44 N50 Q51 M180R43-S47 VanDerWaalsContact O-CB 3.27Å; R43-S47 WeakPolarHBondContact O-CB 3.48Å; R43-S47 PolarHBondContact O-N 3.17Å; S44-S47 PolarHBondContact O-N 2.91Å; S47-N50 PolarHBondContact O-N 3.01Å; S47-Q51 WeakPolarHBondContact O-CB 3.43Å; S47-Q51 PolarHBondContact O-N 3.25Å; S47-M180 WeakPolarHBondContact OG-CE 3.46Å
48I90.6Very high88.3Confident27 Ų2779.3 Ų79.314%0.13840%0.4CS..Hα-helixtrans-60.8-48.6174.6-70.4171.8000110.3I34 F35 S44 I45 N50 Q51 I52 M180 L183I34-I48 HydrophobicContact CG2-CD1 4.21Å; I34-I48 HydrophobicContact CG2-CG1 4.23Å; F35-I48 HydrophobicContact CE2-CD1 4.28Å; S44-I48 WeakPolarHBondContact O-CB 3.41Å; S44-I48 VanDerWaalsContact O-CG1 3.24Å; S44-I48 WeakPolarHBondContact O-CG1 3.17Å; S44-I48 PolarHBondContact O-N 2.85Å; I45-I48 PolarHBondContact O-N 3.33Å; I48-N50 PolarHBondContact O-N 3.19Å; I48-Q51 PolarHBondContact O-N 3.32Å; I48-I52 HydrophobicContact CG2-CD1 3.36Å; I48-I52 HydrophobicContact CG2-CG1 4.19Å; I48-I52 VanDerWaalsContact O-CB 3.3Å; I48-I52 WeakPolarHBondContact O-CB 3.36Å; I48-I52 WeakPolarHBondContact O-CG1 3.42Å; I48-I52 PolarHBondContact O-N 2.83Å; I48-M180 HydrophobicContact CB-CE 4.41Å; I48-M180 HydrophobicContact CG1-CE 3.77Å; I48-M180 HydrophobicContact CG1-SD 4.11Å; I48-L183 HydrophobicContact CD1-CD1 4Å; I48-L183 HydrophobicContact CG1-CD1 4.22Å
49Y91.2Very high88.5Confident128 Ų12877.2 Ų77.250%0.50239%0.391SS..Hα-helixtrans-59.4-47.6178.7180-88.9000112I45 S46 Q51 I52 I53 V54I45-Y49 VanDerWaalsContact O-CB 3.27Å; I45-Y49 WeakPolarHBondContact O-CB 3.5Å; I45-Y49 PolarHBondContact O-N 3.13Å; S46-Y49 PolarHBondContact O-N 3.41Å; Y49-Q51 PolarHBondContact O-N 3.41Å; Y49-I52 PolarHBondContact O-N 2.97Å; Y49-I53 HydrophobicContact CD2-CD1 3.5Å; Y49-I53 HydrophobicContact CD2-CG1 4.44Å; Y49-I53 HydrophobicContact CE2-CB 4.28Å; Y49-I53 HydrophobicContact CE2-CD1 3.31Å; Y49-I53 HydrophobicContact CE2-CG1 4.33Å; Y49-I53 HydrophobicContact CE2-CG2 4.33Å; Y49-I53 HydrophobicContact CG-CD1 4.43Å; Y49-I53 WeakPolarHBondContact O-CB 3.49Å; Y49-I53 PolarHBondContact O-N 3.07Å; Y49-V54 HydrophobicContact CD1-CG2 4.5Å; Y49-V54 HydrophobicContact CE1-CG2 4.24Å
50N89.3Confident88.8Confident76 Ų7678.9 Ų78.941%0.40638%0.383SS..Iπ-helixtrans-62.1-44.5179.1-72.1-20.5000111.3S46 S47 I48 V54 Q55S46-N50 WeakPolarHBondContact O-CB 3.36Å; S46-N50 PolarHBondContact O-N 3.22Å; S46-N50 PolarHBondContact O-ND2 3.44Å; S47-N50 PolarHBondContact O-N 3.01Å; I48-N50 PolarHBondContact O-N 3.19Å; N50-V54 WeakPolarHBondContact O-CA 3.31Å; N50-V54 VanDerWaalsContact O-CB 3.22Å; N50-V54 WeakPolarHBondContact O-CB 3.48Å; N50-V54 PolarHBondContact O-N 3.34Å; N50-Q55 PolarHBondContact O-N 2.85Å
51Q87.9Confident89Confident17 Ų1778.3 Ų78.38%0.07938%0.381CS..Iπ-helixtrans-74-30.5-177.4-17365.66500113.4S47 I48 Y49 Q55 D58 T176 M180 Q184S47-Q51 WeakPolarHBondContact O-CB 3.43Å; S47-Q51 PolarHBondContact O-N 3.25Å; I48-Q51 PolarHBondContact O-N 3.32Å; Y49-Q51 PolarHBondContact O-N 3.41Å; Q51-Q55 VanDerWaalsContact OE1-OE1 3.04Å; Q51-D58 PolarHBondContact NE2-OD2 3.47Å; Q51-D58 VanDerWaalsContact NE2-OD2 3.16Å; Q51-T176 HydrophobicContact CG-CG2 4.09Å; Q51-T176 PolarHBondContact OE1-OG1 3.28Å; Q51-M180 HydrophobicContact CB-CE 4.38Å; Q51-M180 HydrophobicContact CB-CG 3.92Å; Q51-M180 HydrophobicContact CB-SD 3.89Å; Q51-M180 HydrophobicContact CG-CG 3.48Å; Q51-M180 VanDerWaalsContact CG-CG 3.48Å; Q51-M180 HydrophobicContact CG-SD 4.02Å; Q51-Q184 PolarHBondContact O-NE2 3.44Å
52I89Confident89.2Confident45 Ų4572.8 Ų72.823%0.23135%0.353CS..Iπ-helixtrans-83.8-53.1180-64.1176.7000111.4I48 Y49 M59 L183 L187I48-I52 HydrophobicContact CG2-CD1 3.36Å; I48-I52 HydrophobicContact CG2-CG1 4.19Å; I48-I52 VanDerWaalsContact O-CB 3.3Å; I48-I52 WeakPolarHBondContact O-CB 3.36Å; I48-I52 WeakPolarHBondContact O-CG1 3.42Å; I48-I52 PolarHBondContact O-N 2.83Å; Y49-I52 PolarHBondContact O-N 2.97Å; I52-M59 HydrophobicContact CB-CE 3.81Å; I52-M59 HydrophobicContact CD1-CE 4.41Å; I52-M59 HydrophobicContact CG1-CE 3.52Å; I52-M59 HydrophobicContact CG2-CE 3.68Å; I52-L183 HydrophobicContact CD1-CD2 4Å; I52-L183 HydrophobicContact CG1-CD2 4.43Å; I52-L187 HydrophobicContact CD1-CD1 3.32Å; I52-L187 HydrophobicContact CG1-CD1 4.11Å
53I86.7Confident89.5Confident95 Ų9567.7 Ų67.749%0.48733%0.333SS..Iπ-helixtrans-94.8-43.6-166.7-67172.3000110.9Y49Y49-I53 HydrophobicContact CD2-CD1 3.5Å; Y49-I53 HydrophobicContact CD2-CG1 4.44Å; Y49-I53 HydrophobicContact CE2-CB 4.28Å; Y49-I53 HydrophobicContact CE2-CD1 3.31Å; Y49-I53 HydrophobicContact CE2-CG1 4.33Å; Y49-I53 HydrophobicContact CE2-CG2 4.33Å; Y49-I53 HydrophobicContact CG-CD1 4.43Å; Y49-I53 WeakPolarHBondContact O-CB 3.49Å; Y49-I53 PolarHBondContact O-N 3.07Å
54V82.9Confident89.8Confident91 Ų9164.3 Ų64.355%0.55233%0.325SS*.Iπ-helixtrans-74.8-41.3-179.3-1770000110.3Y49 N50 Y56Y49-V54 HydrophobicContact CD1-CG2 4.5Å; Y49-V54 HydrophobicContact CE1-CG2 4.24Å; N50-V54 WeakPolarHBondContact O-CA 3.31Å; N50-V54 VanDerWaalsContact O-CB 3.22Å; N50-V54 WeakPolarHBondContact O-CB 3.48Å; N50-V54 PolarHBondContact O-N 3.34Å; V54-Y56 VanDerWaalsContact C-N 3.33Å; V54-Y56 PolarHBondContact O-N 3.21Å
55Q86.2Confident90Very high82 Ų8264.3 Ų64.338%0.38333%0.325SS..THydrogen-bonded Turntrans-93.453.2177-61.8-170.8-10.100112.5N50 Q51 N57 D58 M59N50-Q55 PolarHBondContact O-N 2.85Å; Q51-Q55 VanDerWaalsContact OE1-OE1 3.04Å; Q55-N57 PolarHBondContact O-N 3.46Å; Q55-D58 HydrophobicContact CB-CB 4.32Å; Q55-D58 WeakPolarHBondContact O-CB 3.5Å; Q55-D58 PolarHBondContact O-N 3.41Å; Q55-D58 VanDerWaalsContact O-N 3.13Å; Q55-D58 PolarHBondContact OE1-OD2 3.27Å; Q55-M59 PolarHBondContact O-N 3.25Å
56Y87.6Confident90.2Very high134 Ų13459.9 Ų59.953%0.52530%0.303SS..Hα-helixtrans-60.8-29.3-179.678.8-87.9000113.2V54 D58 M59 I60V54-Y56 VanDerWaalsContact C-N 3.33Å; V54-Y56 PolarHBondContact O-N 3.21Å; Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 2.97Å; Y56-M59 WeakPolarHBondContact O-CB 3.34Å; Y56-M59 PolarHBondContact O-N 3.4Å; Y56-M59 VanDerWaalsContact O-N 3.14Å; Y56-I60 HydrophobicContact CD2-CD1 3.76Å; Y56-I60 HydrophobicContact CE2-CD1 4.05Å; Y56-I60 WeakPolarHBondContact O-CG1 3.48Å; Y56-I60 PolarHBondContact O-N 3.48Å
57N88Confident90.5Very high88 Ų8859.5 Ų59.547%0.47130%0.298SS..Hα-helixtrans-61.4-41.5175.9-74.9-30.8000111.8Q55 M59 I60 Q61Q55-N57 PolarHBondContact O-N 3.46Å; N57-M59 VanDerWaalsContact C-N 3.28Å; N57-M59 PolarHBondContact O-N 3.13Å; N57-I60 PolarHBondContact O-N 3.31Å; N57-Q61 WeakPolarHBondContact O-CG 3.27Å; N57-Q61 PolarHBondContact O-N 3.09Å
58D88.2Confident90.9Very high23 Ų2359.6 Ų59.612%0.12330%0.296CS..Hα-helixtrans-61.8-39.8174.5-76.923.8000110.8Q51 Q55 Y56 Q61 I62 R181Q51-D58 PolarHBondContact NE2-OD2 3.47Å; Q51-D58 VanDerWaalsContact NE2-OD2 3.16Å; Q55-D58 HydrophobicContact CB-CB 4.32Å; Q55-D58 WeakPolarHBondContact O-CB 3.5Å; Q55-D58 PolarHBondContact O-N 3.41Å; Q55-D58 VanDerWaalsContact O-N 3.13Å; Q55-D58 PolarHBondContact OE1-OD2 3.27Å; Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 2.97Å; D58-Q61 PolarHBondContact O-N 3.47Å; D58-I62 WeakPolarHBondContact O-CB 3.4Å; D58-I62 WeakPolarHBondContact O-CG1 3.21Å; D58-I62 PolarHBondContact O-N 2.94Å; D58-R181 IonicContact OD2-CZ 2.72Å; D58-R181 IonicContact OD2-NH1 2.86Å; D58-R181 PolarHBondContact OD2-NH1 2.9Å; D58-R181 IonicContact OD2-NH2 2.68Å; D58-R181 PolarHBondContact OD2-NH2 3.46Å
59M91Very high91Very high22 Ų2260.8 Ų60.811%0.10830%0.299CS..Hα-helixtrans-63.4-42.7177.3-78.8-62.8-149.100112.6I52 Q55 Y56 N57 Q61 I62 L63 Q184 L187 L188I52-M59 HydrophobicContact CB-CE 3.81Å; I52-M59 HydrophobicContact CD1-CE 4.41Å; I52-M59 HydrophobicContact CG1-CE 3.52Å; I52-M59 HydrophobicContact CG2-CE 3.68Å; Q55-M59 PolarHBondContact O-N 3.25Å; Y56-M59 WeakPolarHBondContact O-CB 3.34Å; Y56-M59 PolarHBondContact O-N 3.4Å; Y56-M59 VanDerWaalsContact O-N 3.14Å; N57-M59 VanDerWaalsContact C-N 3.28Å; N57-M59 PolarHBondContact O-N 3.13Å; M59-Q61 VanDerWaalsContact C-N 3.31Å; M59-Q61 PolarHBondContact O-N 3.23Å; M59-I62 PolarHBondContact O-N 2.83Å; M59-L63 PolarHBondContact O-N 3.49Å; M59-Q184 HydrophobicContact CE-CB 4.06Å; M59-Q184 HydrophobicContact CE-CG 3.64Å; M59-Q184 HydrophobicContact SD-CB 3.79Å; M59-Q184 HydrophobicContact SD-CG 3.72Å; M59-L187 HydrophobicContact CE-CD1 4.37Å; M59-L188 WeakPolarHBondContact O-CD1 3.23Å; M59-L188 HydrophobicContact SD-CD1 4.07Å; M59-L188 HydrophobicContact SD-CG 4.43Å
60I92.3Very high91.2Very high101 Ų10155 Ų5552%0.51828%0.276SS..Hα-helixtrans-63.1-40.6176-65.7169.9000110.4Y56 N57 L63Y56-I60 HydrophobicContact CD2-CD1 3.76Å; Y56-I60 HydrophobicContact CE2-CD1 4.05Å; Y56-I60 WeakPolarHBondContact O-CG1 3.48Å; Y56-I60 PolarHBondContact O-N 3.48Å; N57-I60 PolarHBondContact O-N 3.31Å; I60-L63 VanDerWaalsContact O-CB 3.29Å; I60-L63 WeakPolarHBondContact O-CB 3.34Å; I60-L63 PolarHBondContact O-N 3.26Å
61Q92.6Very high91.4Very high83 Ų8354.4 Ų54.439%0.38828%0.275SS..Hα-helixtrans-65.8-41.1175.9-69.9-179.6-7.400111.7N57 D58 M59 L63 I64 P65 Y166 I170N57-Q61 WeakPolarHBondContact O-CG 3.27Å; N57-Q61 PolarHBondContact O-N 3.09Å; D58-Q61 PolarHBondContact O-N 3.47Å; M59-Q61 VanDerWaalsContact C-N 3.31Å; M59-Q61 PolarHBondContact O-N 3.23Å; Q61-L63 VanDerWaalsContact C-N 3.28Å; Q61-L63 PolarHBondContact O-N 3.44Å; Q61-I64 PolarHBondContact O-N 3.36Å; Q61-P65 WeakPolarHBondContact O-CD 3.48Å; Q61-Y166 WeakPolarHBondContact O-CE1 3.3Å; Q61-I170 HydrophobicContact CB-CD1 3.74Å; Q61-I170 HydrophobicContact CB-CG1 4.16Å
62I93.3Very high91.8Very high0 Ų054 Ų540%027%0.273CS..Hα-helixtrans-71.5-21.5179.1-68.5169000112.6D58 M59 I64 P65 S66 I170 Q184 L185 L188D58-I62 WeakPolarHBondContact O-CB 3.4Å; D58-I62 WeakPolarHBondContact O-CG1 3.21Å; D58-I62 PolarHBondContact O-N 2.94Å; M59-I62 PolarHBondContact O-N 2.83Å; I62-I64 PolarHBondContact O-N 3Å; I62-P65 WeakPolarHBondContact O-CD 3.17Å; I62-P65 VanDerWaalsContact O-CG 3.28Å; I62-P65 WeakPolarHBondContact O-CG 3.29Å; I62-S66 VanDerWaalsContact O-CB 3.23Å; I62-S66 WeakPolarHBondContact O-CB 3.49Å; I62-S66 PolarHBondContact O-N 3.48Å; I62-I170 HydrophobicContact CG1-CD1 4.27Å; I62-I170 HydrophobicContact CG1-CG2 4.46Å; I62-Q184 HydrophobicContact CD1-CB 3.97Å; I62-Q184 HydrophobicContact CD1-CG 4.38Å; I62-Q184 HydrophobicContact CG2-CB 4.19Å; I62-L185 HydrophobicContact CG2-CD2 3.66Å; I62-L185 HydrophobicContact CG2-CG 3.98Å; I62-L188 HydrophobicContact CB-CD1 4.33Å; I62-L188 HydrophobicContact CG2-CD1 4.1Å
63L95.1Very high91.9Very high73 Ų7352.8 Ų52.838%0.38227%0.268SS..Hα-helixtrans-56.7-39.6174.3-175.266.4000112.3M59 I60 Q61 T67 L188 I192M59-L63 PolarHBondContact O-N 3.49Å; I60-L63 VanDerWaalsContact O-CB 3.29Å; I60-L63 WeakPolarHBondContact O-CB 3.34Å; I60-L63 PolarHBondContact O-N 3.26Å; Q61-L63 VanDerWaalsContact C-N 3.28Å; Q61-L63 PolarHBondContact O-N 3.44Å; L63-T67 WeakPolarHBondContact O-CB 3.48Å; L63-T67 PolarHBondContact O-N 2.95Å; L63-T67 PolarHBondContact O-OG1 3.14Å; L63-L188 HydrophobicContact CB-CD1 4.13Å; L63-L188 HydrophobicContact CD1-CB 4.38Å; L63-L188 HydrophobicContact CD1-CD1 4.29Å; L63-L188 HydrophobicContact CD1-CD2 4.2Å; L63-I192 HydrophobicContact CD1-CD1 3.57Å
64I94.8Very high92.2Very high74 Ų7450 Ų5038%0.37925%0.254SS..Hα-helixtrans-61.7-59.8179.8-61.2168.4000111.4Q61 I62 S66 T67 L68 F162 Y166Q61-I64 PolarHBondContact O-N 3.36Å; I62-I64 PolarHBondContact O-N 3Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 3.27Å; I64-T67 PolarHBondContact O-N 2.99Å; I64-L68 HydrophobicContact CG2-CD1 4.18Å; I64-L68 WeakPolarHBondContact O-CG 3.37Å; I64-L68 PolarHBondContact O-N 2.98Å; I64-F162 HydrophobicContact CG2-CE1 4.29Å; I64-Y166 HydrophobicContact CB-CE1 4.18Å; I64-Y166 HydrophobicContact CD1-CE1 4.27Å; I64-Y166 HydrophobicContact CG2-CE1 4.42Å
65P94.5Very high92.7Very high0 Ų047.7 Ų47.70%024%0.238CC..Hα-helixtrans-64.7-35.8178.525.7-33.4000111.8Q61 I62 T67 L68 Y69 A163 Y166 L167 I170Q61-P65 WeakPolarHBondContact O-CD 3.48Å; I62-P65 WeakPolarHBondContact O-CD 3.17Å; I62-P65 VanDerWaalsContact O-CG 3.28Å; I62-P65 WeakPolarHBondContact O-CG 3.29Å; P65-T67 PolarHBondContact O-N 3.4Å; P65-L68 PolarHBondContact O-N 2.93Å; P65-Y69 HydrophobicContact CB-CD2 4.3Å; P65-Y69 HydrophobicContact CB-CE2 4.12Å; P65-Y69 WeakPolarHBondContact O-CB 3.49Å; P65-Y69 WeakPolarHBondContact O-CD2 3.43Å; P65-Y69 PolarHBondContact O-N 3.36Å; P65-A163 HydrophobicContact CB-CB 4.18Å; P65-Y166 HydrophobicContact CG-CD1 4.12Å; P65-L167 HydrophobicContact CB-CB 4.37Å; P65-L167 HydrophobicContact CB-CD1 4.46Å; P65-L167 HydrophobicContact CG-CD1 4.07Å; P65-I170 HydrophobicContact CG-CD1 4.46Å
66S95Very high93Very high4 Ų444.4 Ų44.43%0.02822%0.223CC..Hα-helixtrans-57.7-49.5175.9-175.80000111.3I62 I64 L68 Y69 I70 L185 G189I62-S66 VanDerWaalsContact O-CB 3.23Å; I62-S66 WeakPolarHBondContact O-CB 3.49Å; I62-S66 PolarHBondContact O-N 3.48Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 3.27Å; S66-L68 PolarHBondContact O-N 3.16Å; S66-Y69 PolarHBondContact O-N 3.41Å; S66-I70 WeakPolarHBondContact O-CG1 3.44Å; S66-I70 PolarHBondContact O-N 3.11Å; S66-L185 PolarHBondContact OG-O 2.75Å; S66-L185 VanDerWaalsContact OG-O 3.05Å; S66-G189 VanDerWaalsContact OG-CA 3.25Å; S66-G189 WeakPolarHBondContact OG-CA 3.35Å; S66-G189 PolarHBondContact OG-N 2.83Å; S66-G189 VanDerWaalsContact OG-N 3.08Å
67T96Very high93.1Very high50 Ų5039.7 Ų39.731%0.30721%0.205SC..Hα-helixtrans-60.6-46.2177.5-54.60000111.5L63 I64 P65 Y69 I70 V71 I192L63-T67 WeakPolarHBondContact O-CB 3.48Å; L63-T67 PolarHBondContact O-N 2.95Å; L63-T67 PolarHBondContact O-OG1 3.14Å; I64-T67 PolarHBondContact O-N 2.99Å; P65-T67 PolarHBondContact O-N 3.4Å; T67-Y69 VanDerWaalsContact C-N 3.32Å; T67-Y69 PolarHBondContact O-N 3.03Å; T67-I70 PolarHBondContact O-N 3.19Å; T67-V71 WeakPolarHBondContact O-CG2 3.28Å; T67-V71 PolarHBondContact O-N 3.47Å; T67-I192 HydrophobicContact CG2-CG2 4.24Å; T67-I192 VanDerWaalsContact OG1-CD1 3.27Å; T67-I192 WeakPolarHBondContact OG1-CD1 3.42Å
68L95.9Very high93.2Very high39 Ų3939.9 Ų39.920%0.20420%0.201CC..Hα-helixtrans-64.1-36178.5-69.5176.1000112.3I64 P65 S66 V71 Q72 T159 F162 A163I64-L68 HydrophobicContact CG2-CD1 4.18Å; I64-L68 WeakPolarHBondContact O-CG 3.37Å; I64-L68 PolarHBondContact O-N 2.98Å; P65-L68 PolarHBondContact O-N 2.93Å; S66-L68 PolarHBondContact O-N 3.16Å; L68-V71 PolarHBondContact O-N 3.34Å; L68-Q72 WeakPolarHBondContact O-CB 3.37Å; L68-Q72 PolarHBondContact O-N 2.96Å; L68-T159 HydrophobicContact CD2-CG2 4.14Å; L68-F162 HydrophobicContact CD1-CD1 3.43Å; L68-F162 VanDerWaalsContact CD1-CD1 3.43Å; L68-F162 HydrophobicContact CD1-CE1 3.78Å; L68-A163 HydrophobicContact CB-CB 3.82Å; L68-A163 HydrophobicContact CD1-CB 4.17Å
69Y94.1Very high93.3Very high51 Ų5138.8 Ų38.820%0.220%0.195CC..Hα-helixtrans-65.8-35.9173.8-78.8-55.5000112.5P65 S66 T67 Q72 N73 A163 G164 L167 L185P65-Y69 HydrophobicContact CB-CD2 4.3Å; P65-Y69 HydrophobicContact CB-CE2 4.12Å; P65-Y69 WeakPolarHBondContact O-CB 3.49Å; P65-Y69 WeakPolarHBondContact O-CD2 3.43Å; P65-Y69 PolarHBondContact O-N 3.36Å; S66-Y69 PolarHBondContact O-N 3.41Å; T67-Y69 VanDerWaalsContact C-N 3.32Å; T67-Y69 PolarHBondContact O-N 3.03Å; Y69-Q72 VanDerWaalsContact CD1-CD 3.49Å; Y69-Q72 HydrophobicContact CD1-CG 4.5Å; Y69-Q72 WeakPolarHBondContact O-CG 3.27Å; Y69-N73 VanDerWaalsContact O-CB 3.29Å; Y69-N73 WeakPolarHBondContact O-CB 3.27Å; Y69-N73 PolarHBondContact O-N 3.33Å; Y69-N73 VanDerWaalsContact O-N 3.12Å; Y69-N73 PolarHBondContact O-ND2 2.87Å; Y69-N73 VanDerWaalsContact O-ND2 3.08Å; Y69-A163 HydrophobicContact CD1-CB 4.5Å; Y69-A163 HydrophobicContact CD2-CB 4.42Å; Y69-A163 HydrophobicContact CE1-CB 4.2Å; Y69-A163 HydrophobicContact CE2-CB 4.13Å; Y69-G164 VanDerWaalsContact OH-CA 3.23Å; Y69-G164 WeakPolarHBondContact OH-CA 3.39Å; Y69-G164 PolarHBondContact OH-N 2.64Å; Y69-L167 HydrophobicContact CE2-CD2 4.24Å; Y69-L185 HydrophobicContact CD2-CD2 4.31Å
70I94.5Very high93.1Very high6 Ų641.8 Ų41.83%0.03121%0.211CC..Hα-helixtrans-67.1-47.5172.8-62.1-59.7000110.8V19 E23 S66 T67 N73 N74 G189 I192V19-I70 HydrophobicContact CG1-CD1 3.86Å; E23-I70 HydrophobicContact CG-CD1 3.68Å; S66-I70 WeakPolarHBondContact O-CG1 3.44Å; S66-I70 PolarHBondContact O-N 3.11Å; T67-I70 PolarHBondContact O-N 3.19Å; I70-N73 PolarHBondContact O-N 3.41Å; I70-N74 PolarHBondContact O-N 3.21Å; I70-N74 VanDerWaalsContact O-N 3.14Å; I70-N74 PolarHBondContact O-ND2 2.9Å; I70-G189 WeakPolarHBondContact CD1-O 3.38Å; I70-I192 HydrophobicContact CB-CG2 4.23Å; I70-I192 HydrophobicContact CG1-CB 4.42Å; I70-I192 HydrophobicContact CG1-CG2 4.12Å; I70-I192 HydrophobicContact CG2-CG2 4.29Å
71V94.4Very high92.8Very high64 Ų6441.2 Ų41.239%0.38822%0.216SC..Hα-helixtrans-62.2-49-179.9171.90000110.7T67 L68 N73 N74 L75T67-V71 WeakPolarHBondContact O-CG2 3.28Å; T67-V71 PolarHBondContact O-N 3.47Å; L68-V71 PolarHBondContact O-N 3.34Å; V71-N73 VanDerWaalsContact C-N 3.27Å; V71-N73 PolarHBondContact O-N 3.09Å; V71-N74 PolarHBondContact O-N 3.3Å; V71-L75 HydrophobicContact CG1-CD1 3.91Å; V71-L75 HydrophobicContact CG1-CG 4.33Å; V71-L75 WeakPolarHBondContact O-CG 3.4Å; V71-L75 PolarHBondContact O-N 3.26Å
72Q94.9Very high92.4Very high8 Ų840 Ų404%0.03721%0.21CC..Hα-helixtrans-59.1-41.7178.787.9-179.839.700110.2L68 Y69 N74 L75 L76 A156 S160L68-Q72 WeakPolarHBondContact O-CB 3.37Å; L68-Q72 PolarHBondContact O-N 2.96Å; Y69-Q72 VanDerWaalsContact CD1-CD 3.49Å; Y69-Q72 HydrophobicContact CD1-CG 4.5Å; Y69-Q72 WeakPolarHBondContact O-CG 3.27Å; Q72-N74 VanDerWaalsContact C-N 3.34Å; Q72-N74 PolarHBondContact O-N 3.16Å; Q72-L75 CarbonylContact O-C 3.4Å; Q72-L75 PolarHBondContact O-N 2.95Å; Q72-L76 VanDerWaalsContact O-CG 3.26Å; Q72-L76 WeakPolarHBondContact O-CG 3.42Å; Q72-L76 PolarHBondContact O-N 3Å; Q72-A156 HydrophobicContact CB-CB 4.38Å; Q72-S160 PolarHBondContact NE2-OG 3.12Å; Q72-S160 PolarHBondContact OE1-OG 3.42Å
73N92.9Very high92Very high20 Ų2040.6 Ų40.611%0.10721%0.213CC..Hα-helixtrans-65.9-42.2-174.7-76.5-20.8000109.9V19 Y69 I70 V71 L76 Y77V19-N73 HydrophobicContact CG1-CB 4.03Å; V19-N73 HydrophobicContact CG2-CB 3.72Å; Y69-N73 VanDerWaalsContact O-CB 3.29Å; Y69-N73 WeakPolarHBondContact O-CB 3.27Å; Y69-N73 PolarHBondContact O-N 3.33Å; Y69-N73 VanDerWaalsContact O-N 3.12Å; Y69-N73 PolarHBondContact O-ND2 2.87Å; Y69-N73 VanDerWaalsContact O-ND2 3.08Å; I70-N73 PolarHBondContact O-N 3.41Å; V71-N73 VanDerWaalsContact C-N 3.27Å; V71-N73 PolarHBondContact O-N 3.09Å; N73-L76 PolarHBondContact O-N 3.03Å; N73-Y77 WeakPolarHBondContact O-CD2 3.25Å; N73-Y77 PolarHBondContact O-N 3.44Å
74N92.1Very high91.4Very high36 Ų3638.9 Ų38.919%0.19320%0.204CC..Hα-helixtrans-63.5-41.9173.2-75.5-72.7000112.2S16 I70 V71 Q72 L76 Y77 F78S16-N74 VanDerWaalsContact CA-OD1 3.28Å; S16-N74 WeakPolarHBondContact CA-OD1 3.33Å; S16-N74 WeakPolarHBondContact CB-OD1 3.21Å; I70-N74 PolarHBondContact O-N 3.21Å; I70-N74 VanDerWaalsContact O-N 3.14Å; I70-N74 PolarHBondContact O-ND2 2.9Å; V71-N74 PolarHBondContact O-N 3.3Å; Q72-N74 VanDerWaalsContact C-N 3.34Å; Q72-N74 PolarHBondContact O-N 3.16Å; N74-L76 VanDerWaalsContact C-N 3.32Å; N74-L76 PolarHBondContact O-N 2.84Å; N74-Y77 PolarHBondContact O-N 3.22Å; N74-F78 WeakPolarHBondContact O-CB 3.24Å; N74-F78 PolarHBondContact O-N 2.85Å
75L93.2Very high90.9Very high44 Ų4438.5 Ų38.523%0.2321%0.212CC..Hα-helixtrans-62.7-36.9174.9-71.7173.7000112.4V71 Q72 F78 A79 A152 L155 A156V71-L75 HydrophobicContact CG1-CD1 3.91Å; V71-L75 HydrophobicContact CG1-CG 4.33Å; V71-L75 WeakPolarHBondContact O-CG 3.4Å; V71-L75 PolarHBondContact O-N 3.26Å; Q72-L75 CarbonylContact O-C 3.4Å; Q72-L75 PolarHBondContact O-N 2.95Å; L75-F78 PolarHBondContact O-N 3.43Å; L75-A79 WeakPolarHBondContact O-CB 3.43Å; L75-A79 PolarHBondContact O-N 3.41Å; L75-A152 HydrophobicContact CD2-CB 4.31Å; L75-L155 HydrophobicContact CD1-CB 4.04Å; L75-A156 HydrophobicContact CB-CB 3.8Å; L75-A156 HydrophobicContact CD1-CB 4.4Å
76L92.6Very high90.4Very high13 Ų1339.5 Ų39.57%0.06822%0.218CC..Hα-helixtrans-66.9-43.3175.6-69.3174.5000111.4Q72 N73 N74 F78 A79 I80 Y88 Y92 I153 A156Q72-L76 VanDerWaalsContact O-CG 3.26Å; Q72-L76 WeakPolarHBondContact O-CG 3.42Å; Q72-L76 PolarHBondContact O-N 3Å; N73-L76 PolarHBondContact O-N 3.03Å; N74-L76 VanDerWaalsContact C-N 3.32Å; N74-L76 PolarHBondContact O-N 2.84Å; L76-F78 VanDerWaalsContact C-N 3.31Å; L76-F78 PolarHBondContact O-N 3.23Å; L76-A79 PolarHBondContact O-N 2.93Å; L76-I80 VanDerWaalsContact O-CG1 3.31Å; L76-I80 WeakPolarHBondContact O-CG1 3.45Å; L76-I80 PolarHBondContact O-N 3.4Å; L76-Y88 HydrophobicContact CB-CE2 4.46Å; L76-Y88 HydrophobicContact CD2-CE2 4.04Å; L76-Y92 HydrophobicContact CD1-CD2 4.45Å; L76-Y92 HydrophobicContact CD1-CE2 3.66Å; L76-Y92 HydrophobicContact CD2-CD2 3.54Å; L76-Y92 HydrophobicContact CD2-CE2 3.55Å; L76-Y92 HydrophobicContact CG-CE2 4.26Å; L76-I153 HydrophobicContact CD2-CG1 4.13Å; L76-A156 HydrophobicContact CD2-CB 3.6Å; L76-A156 HydrophobicContact CG-CB 3.86Å
77Y90.6Very high89.9Confident35 Ų3541.2 Ų41.214%0.13723%0.227CC..Hα-helixtrans-61.4-41.4173.2-81.8-70.4000112A15 V18 V19 N73 N74 A79 I80 S81 Q225A15-Y77 HydrophobicContact CB-CD1 4.04Å; A15-Y77 HydrophobicContact CB-CD2 3.94Å; A15-Y77 HydrophobicContact CB-CG 3.53Å; V18-Y77 HydrophobicContact CG1-CE2 4.47Å; V18-Y77 WeakPolarHBondContact CG1-OH 3.24Å; V19-Y77 HydrophobicContact CG2-CD2 3.76Å; V19-Y77 HydrophobicContact CG2-CE2 3.53Å; N73-Y77 WeakPolarHBondContact O-CD2 3.25Å; N73-Y77 PolarHBondContact O-N 3.44Å; N74-Y77 PolarHBondContact O-N 3.22Å; Y77-A79 VanDerWaalsContact C-N 3.33Å; Y77-I80 PolarHBondContact O-N 2.78Å; Y77-S81 PolarHBondContact O-N 3.49Å; Y77-Q225 PolarHBondContact OH-OE1 3.31Å
78F89.6Confident89.5Confident91 Ų9140.4 Ų40.440%0.39922%0.219SC..Hα-helixtrans-63.6-38.4174.3-175.9-87.9000112.1N74 L75 L76 S81 H82 A152N74-F78 WeakPolarHBondContact O-CB 3.24Å; N74-F78 PolarHBondContact O-N 2.85Å; L75-F78 PolarHBondContact O-N 3.43Å; L76-F78 VanDerWaalsContact C-N 3.31Å; L76-F78 PolarHBondContact O-N 3.23Å; F78-S81 PolarHBondContact O-N 3.46Å; F78-S81 PolarHBondContact O-OG 2.87Å; F78-H82 AromaticContact CD1-ND1 3.92Å; F78-H82 AromaticContact CD2-CE1 3.87Å; F78-H82 AromaticContact CE1-CE1 3.72Å; F78-H82 AromaticContact CE1-ND1 3.72Å; F78-H82 AromaticContact CE2-CE1 3.35Å; F78-H82 WeakPolarHBondContact CE2-CE1 3.3Å; F78-H82 AromaticContact CZ-CE1 3.27Å; F78-H82 WeakPolarHBondContact CZ-CE1 3.33Å; F78-H82 AromaticContact CZ-ND1 3.77Å; F78-H82 AromaticContact CZ-NE2 3.75Å; F78-H82 PolarHBondContact O-N 3.41Å; F78-H82 PolarHBondContact O-ND1 2.74Å; F78-A152 HydrophobicContact CD1-CB 3.64Å; F78-A152 HydrophobicContact CE1-CB 4.24Å
79A89.6Confident89Confident0 Ų042.3 Ų42.30%023%0.227CC..Hα-helixtrans-66.3-42175.500000111.9L75 L76 Y77 S81 H82 L83 Y88 A152 I153L75-A79 WeakPolarHBondContact O-CB 3.43Å; L75-A79 PolarHBondContact O-N 3.41Å; L76-A79 PolarHBondContact O-N 2.93Å; Y77-A79 VanDerWaalsContact C-N 3.33Å; A79-S81 PolarHBondContact O-N 3.33Å; A79-H82 PolarHBondContact O-N 2.8Å; A79-H82 VanDerWaalsContact O-N 3.15Å; A79-L83 HydrophobicContact CB-CD1 4.17Å; A79-L83 VanDerWaalsContact O-CB 3.23Å; A79-L83 WeakPolarHBondContact O-CB 3.49Å; A79-L83 VanDerWaalsContact O-CG 3.29Å; A79-L83 WeakPolarHBondContact O-CG 3.47Å; A79-L83 PolarHBondContact O-N 3.25Å; A79-Y88 HydrophobicContact CB-CD2 4.14Å; A79-Y88 HydrophobicContact CB-CE2 4.24Å; A79-A152 HydrophobicContact CB-CB 4.31Å; A79-I153 HydrophobicContact CB-CB 3.8Å; A79-I153 HydrophobicContact CB-CG1 4.4Å
80I87.9Confident88.7Confident86 Ų8641.5 Ų41.544%0.44123%0.225SC..Hα-helixtrans-62.6-30.5177.9-67.9168.3000111.9L76 Y77 H82 Y88L76-I80 VanDerWaalsContact O-CG1 3.31Å; L76-I80 WeakPolarHBondContact O-CG1 3.45Å; L76-I80 PolarHBondContact O-N 3.4Å; Y77-I80 PolarHBondContact O-N 2.78Å; I80-H82 VanDerWaalsContact C-N 3.34Å; I80-Y88 HydrophobicContact CB-CD2 4.49Å; I80-Y88 HydrophobicContact CD1-CD2 4.44Å; I80-Y88 HydrophobicContact CD1-CE1 4.1Å; I80-Y88 HydrophobicContact CD1-CE2 3.89Å; I80-Y88 HydrophobicContact CG1-CD1 4.17Å; I80-Y88 HydrophobicContact CG1-CD2 3.45Å; I80-Y88 VanDerWaalsContact CG1-CD2 3.45Å; I80-Y88 HydrophobicContact CG1-CE1 4.03Å; I80-Y88 HydrophobicContact CG1-CE2 3.3Å; I80-Y88 HydrophobicContact CG1-CG 3.91Å
81S85.8Confident88.4Confident88 Ų8843 Ų4362%0.61523%0.233SC*.Hα-helixtrans-76.7-20.417863.50000113.8Y77 F78 A79Y77-S81 PolarHBondContact O-N 3.49Å; F78-S81 PolarHBondContact O-N 3.46Å; F78-S81 PolarHBondContact O-OG 2.87Å; A79-S81 PolarHBondContact O-N 3.33Å
82H83.4Confident88.2Confident59 Ų5942.7 Ų42.727%0.27323%0.226SC..Hα-helixtrans-109.3-21.7-177.5-68.281.1000114.1F78 A79 I80 S145F78-H82 AromaticContact CD1-ND1 3.92Å; F78-H82 AromaticContact CD2-CE1 3.87Å; F78-H82 AromaticContact CE1-CE1 3.72Å; F78-H82 AromaticContact CE1-ND1 3.72Å; F78-H82 AromaticContact CE2-CE1 3.35Å; F78-H82 WeakPolarHBondContact CE2-CE1 3.3Å; F78-H82 AromaticContact CZ-CE1 3.27Å; F78-H82 WeakPolarHBondContact CZ-CE1 3.33Å; F78-H82 AromaticContact CZ-ND1 3.77Å; F78-H82 AromaticContact CZ-NE2 3.75Å; F78-H82 PolarHBondContact O-N 3.41Å; F78-H82 PolarHBondContact O-ND1 2.74Å; A79-H82 PolarHBondContact O-N 2.8Å; A79-H82 VanDerWaalsContact O-N 3.15Å; I80-H82 VanDerWaalsContact C-N 3.34Å; H82-S145 WeakPolarHBondContact CB-O 3.42Å; H82-S145 PolarHBondContact CD2-OG 2.96Å
83L84.6Confident87.9Confident11 Ų1143.1 Ų43.16%0.05823%0.227CC..SBendtrans-104.9147.7179.4-58.6-179.4000110.7A79 L91 N146 I153A79-L83 HydrophobicContact CB-CD1 4.17Å; A79-L83 VanDerWaalsContact O-CB 3.23Å; A79-L83 WeakPolarHBondContact O-CB 3.49Å; A79-L83 VanDerWaalsContact O-CG 3.29Å; A79-L83 WeakPolarHBondContact O-CG 3.47Å; A79-L83 PolarHBondContact O-N 3.25Å; L83-L91 HydrophobicContact CD1-CD1 3.99Å; L83-N146 WeakPolarHBondContact CD2-OD1 3.25Å; L83-I153 HydrophobicContact CD1-CB 4.28Å; L83-I153 HydrophobicContact CD1-CD1 4.24Å; L83-I153 HydrophobicContact CD1-CG2 3.93Å
84N84.1Confident87.6Confident37 Ų3743.5 Ų43.520%0.19823%0.232CC..  trans-67.4155.8164.774.43.1000109.9V86 L87 Y88 S137N84-V86 PolarHBondContact O-N 3Å; N84-V86 VanDerWaalsContact O-N 3.1Å; N84-L87 PolarHBondContact O-N 2.93Å; N84-L87 WeakPolarHBondContact OD1-CA 3.33Å; N84-L87 WeakPolarHBondContact OD1-CB 3.22Å; N84-L87 WeakPolarHBondContact OD1-CG 3.36Å; N84-L87 PolarHBondContact OD1-N 3.24Å; N84-Y88 WeakPolarHBondContact O-CB 3.35Å; N84-Y88 PolarHBondContact O-N 3.41Å; N84-S137 WeakPolarHBondContact ND2-CB 3.18Å; N84-S137 PolarHBondContact ND2-OG 3.47Å
85A83.7Confident87.6Confident66 Ų6644.2 Ų44.255%0.54523%0.233SC..Hα-helixtrans-58.6-29-176.300000113.3Q89A85-Q89 WeakPolarHBondContact O-CB 3.4Å; A85-Q89 PolarHBondContact O-N 3.47Å
86V84.6Confident87.5Confident21 Ų2145 Ų4513%0.12724%0.237CC..Hα-helixtrans-72.5-53.2-178-173.90000110.9N84 Y88 Q89 I90 Q130 S133 L134N84-V86 PolarHBondContact O-N 3Å; N84-V86 VanDerWaalsContact O-N 3.1Å; V86-Y88 VanDerWaalsContact C-N 3.31Å; V86-Y88 PolarHBondContact O-N 3.43Å; V86-Q89 PolarHBondContact O-N 3.12Å; V86-I90 HydrophobicContact CG1-CD1 4.35Å; V86-I90 WeakPolarHBondContact O-CG1 3.47Å; V86-I90 PolarHBondContact O-N 2.85Å; V86-I90 VanDerWaalsContact O-N 3.07Å; V86-Q130 HydrophobicContact CG1-CB 3.9Å; V86-S133 VanDerWaalsContact CG2-CB 3.42Å; V86-L134 HydrophobicContact CG1-CD1 3.43Å; V86-L134 VanDerWaalsContact CG1-CD1 3.43Å; V86-L134 HydrophobicContact CG1-CG 4.14Å
87L84.5Confident87.4Confident41 Ų4147.2 Ų47.222%0.21525%0.246CC..Hα-helixtrans-63.6-39.9176.1-67.8174.2000110.6N84 Q89 I90 L91 L134N84-L87 PolarHBondContact O-N 2.93Å; N84-L87 WeakPolarHBondContact OD1-CA 3.33Å; N84-L87 WeakPolarHBondContact OD1-CB 3.22Å; N84-L87 WeakPolarHBondContact OD1-CG 3.36Å; N84-L87 PolarHBondContact OD1-N 3.24Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; L87-Q89 PolarHBondContact O-N 3.41Å; L87-I90 PolarHBondContact O-N 2.93Å; L87-L91 VanDerWaalsContact O-CB 3.26Å; L87-L91 WeakPolarHBondContact O-CB 3.35Å; L87-L91 VanDerWaalsContact O-CG 3.27Å; L87-L91 WeakPolarHBondContact O-CG 3.43Å; L87-L91 PolarHBondContact O-N 2.97Å; L87-L134 HydrophobicContact CD2-CD2 4.08Å
88Y86.9Confident87.5Confident33 Ų3346.6 Ų46.613%0.12925%0.246CC..Hα-helixtrans-54.7-49.3172.8174-91.1000111.4L76 A79 I80 N84 V86 I90 L91 Y92 I153L76-Y88 HydrophobicContact CB-CE2 4.46Å; L76-Y88 HydrophobicContact CD2-CE2 4.04Å; A79-Y88 HydrophobicContact CB-CD2 4.14Å; A79-Y88 HydrophobicContact CB-CE2 4.24Å; I80-Y88 HydrophobicContact CB-CD2 4.49Å; I80-Y88 HydrophobicContact CD1-CD2 4.44Å; I80-Y88 HydrophobicContact CD1-CE1 4.1Å; I80-Y88 HydrophobicContact CD1-CE2 3.89Å; I80-Y88 HydrophobicContact CG1-CD1 4.17Å; I80-Y88 HydrophobicContact CG1-CD2 3.45Å; I80-Y88 VanDerWaalsContact CG1-CD2 3.45Å; I80-Y88 HydrophobicContact CG1-CE1 4.03Å; I80-Y88 HydrophobicContact CG1-CE2 3.3Å; I80-Y88 HydrophobicContact CG1-CG 3.91Å; N84-Y88 WeakPolarHBondContact O-CB 3.35Å; N84-Y88 PolarHBondContact O-N 3.41Å; V86-Y88 VanDerWaalsContact C-N 3.31Å; V86-Y88 PolarHBondContact O-N 3.43Å; Y88-I90 PolarHBondContact O-N 3.48Å; Y88-L91 PolarHBondContact O-N 2.89Å; Y88-Y92 VanDerWaalsContact O-CB 3.23Å; Y88-Y92 WeakPolarHBondContact O-CB 3.33Å; Y88-Y92 PolarHBondContact O-N 3.27Å; Y88-I153 HydrophobicContact CD2-CD1 3.35Å; Y88-I153 HydrophobicContact CD2-CG1 4.45Å; Y88-I153 HydrophobicContact CE2-CD1 3.6Å; Y88-I153 HydrophobicContact CE2-CG1 4.37Å; Y88-I153 HydrophobicContact CG-CD1 3.97Å; Y88-I153 WeakPolarHBondContact O-CD1 3.23Å
89Q85.8Confident87.6Confident78 Ų7844.2 Ų44.236%0.36424%0.239SC..Hα-helixtrans-64.4-42.9-178.3-171.864.531.900112.4A85 V86 L87 Q93A85-Q89 WeakPolarHBondContact O-CB 3.4Å; A85-Q89 PolarHBondContact O-N 3.47Å; V86-Q89 PolarHBondContact O-N 3.12Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; L87-Q89 PolarHBondContact O-N 3.41Å; Q89-Q93 PolarHBondContact O-N 3.28Å
90I86.6Confident87.7Confident34 Ų3444.5 Ų44.517%0.17424%0.241CC..Hα-helixtrans-65.1-45.9177.7-66.8170.9000110.6V86 L87 Y88 Q93 I127 Q130 L134V86-I90 HydrophobicContact CG1-CD1 4.35Å; V86-I90 WeakPolarHBondContact O-CG1 3.47Å; V86-I90 PolarHBondContact O-N 2.85Å; V86-I90 VanDerWaalsContact O-N 3.07Å; L87-I90 PolarHBondContact O-N 2.93Å; Y88-I90 PolarHBondContact O-N 3.48Å; I90-Q93 VanDerWaalsContact O-CB 3.25Å; I90-Q93 WeakPolarHBondContact O-CB 3.45Å; I90-Q93 PolarHBondContact O-N 2.92Å; I90-I127 HydrophobicContact CG2-CG1 3.95Å; I90-Q130 HydrophobicContact CD1-CB 3.75Å; I90-Q130 HydrophobicContact CG1-CB 3.88Å; I90-Q130 HydrophobicContact CG1-CG 4.18Å; I90-L134 HydrophobicContact CD1-CD1 3.6Å
91L88.2Confident87.9Confident37 Ų3745 Ų4519%0.19424%0.243CC..Hα-helixtrans-71.3-32.3-178.8-70.1172.1000111.7L83 L87 Y88 Q93 S94 L150 I153L83-L91 HydrophobicContact CD1-CD1 3.99Å; L87-L91 VanDerWaalsContact O-CB 3.26Å; L87-L91 WeakPolarHBondContact O-CB 3.35Å; L87-L91 VanDerWaalsContact O-CG 3.27Å; L87-L91 WeakPolarHBondContact O-CG 3.43Å; L87-L91 PolarHBondContact O-N 2.97Å; Y88-L91 PolarHBondContact O-N 2.89Å; L91-Q93 PolarHBondContact O-N 3.08Å; L91-S94 WeakPolarHBondContact O-CB 3.12Å; L91-S94 PolarHBondContact O-N 3.32Å; L91-S94 VanDerWaalsContact O-N 3.09Å; L91-S94 PolarHBondContact O-OG 3.31Å; L91-L150 HydrophobicContact CD1-CB 4.4Å; L91-L150 HydrophobicContact CD1-CD1 4.26Å; L91-L150 HydrophobicContact CD1-CG 4.15Å; L91-I153 HydrophobicContact CB-CD1 3.87Å; L91-I153 HydrophobicContact CB-CG1 4.39Å; L91-I153 HydrophobicContact CB-CG2 3.62Å; L91-I153 HydrophobicContact CD1-CG2 3.86Å; L91-I153 HydrophobicContact CG-CG2 4.32Å
92Y89.8Confident88.3Confident59 Ų5942.9 Ų42.923%0.23122%0.223CC..Hα-helixtrans-63.6-29.6174.9-169.8-116.3000112.2L76 Y88 S94 K95L76-Y92 HydrophobicContact CD1-CD2 4.45Å; L76-Y92 HydrophobicContact CD1-CE2 3.66Å; L76-Y92 HydrophobicContact CD2-CD2 3.54Å; L76-Y92 HydrophobicContact CD2-CE2 3.55Å; L76-Y92 HydrophobicContact CG-CE2 4.26Å; Y88-Y92 VanDerWaalsContact O-CB 3.23Å; Y88-Y92 WeakPolarHBondContact O-CB 3.33Å; Y88-Y92 PolarHBondContact O-N 3.27Å; Y92-S94 PolarHBondContact O-N 3.46Å; Y92-S94 VanDerWaalsContact O-N 3.16Å; Y92-K95 HydrophobicContact CE1-CD 4.32Å; Y92-K95 HydrophobicContact CE2-CD 3.95Å; Y92-K95 WeakPolarHBondContact O-CB 3.3Å; Y92-K95 PolarHBondContact O-N 2.78Å; Y92-K95 WeakPolarHBondContact OH-CD 3.45Å; Y92-K95 PolarHBondContact OH-NZ 2.69Å
93Q89.2Confident88.7Confident16 Ų1642.1 Ų42.18%0.07522%0.22CC..THydrogen-bonded Turntrans-60.8-22.9175.2-175.75242.700113Q89 I90 L91 K95 I96 I126Q89-Q93 PolarHBondContact O-N 3.28Å; I90-Q93 VanDerWaalsContact O-CB 3.25Å; I90-Q93 WeakPolarHBondContact O-CB 3.45Å; I90-Q93 PolarHBondContact O-N 2.92Å; L91-Q93 PolarHBondContact O-N 3.08Å; Q93-K95 PolarHBondContact O-N 2.9Å; Q93-K95 VanDerWaalsContact O-N 3.08Å; Q93-I96 PolarHBondContact O-N 3.34Å; Q93-I126 VanDerWaalsContact CD-CD1 3.48Å; Q93-I126 HydrophobicContact CG-CD1 3.93Å
94S87.8Confident89Confident28 Ų2844.1 Ų44.120%0.19623%0.23CC..Hα-helixtrans-54.5-26.1170.470.20000112.5L91 Y92 I96 F97 T98 S157L91-S94 WeakPolarHBondContact O-CB 3.12Å; L91-S94 PolarHBondContact O-N 3.32Å; L91-S94 VanDerWaalsContact O-N 3.09Å; L91-S94 PolarHBondContact O-OG 3.31Å; Y92-S94 PolarHBondContact O-N 3.46Å; Y92-S94 VanDerWaalsContact O-N 3.16Å; S94-I96 PolarHBondContact O-N 2.9Å; S94-F97 WeakPolarHBondContact O-CB 3.39Å; S94-F97 PolarHBondContact O-N 2.93Å; S94-F97 VanDerWaalsContact O-N 3.07Å; S94-T98 PolarHBondContact O-N 3.24Å; S94-S157 VanDerWaalsContact OG-CB 3.25Å; S94-S157 WeakPolarHBondContact OG-CB 3.23Å; S94-S157 PolarHBondContact OG-OG 3.37Å
95K91.9Very high89.4Confident51 Ų5148.1 Ų48.122%0.22225%0.251CS..Hα-helixtrans-56.1-35.1174.7178.1178.9164.2169.40113Y92 Q93 F97 T98 T99 S160Y92-K95 HydrophobicContact CE1-CD 4.32Å; Y92-K95 HydrophobicContact CE2-CD 3.95Å; Y92-K95 WeakPolarHBondContact O-CB 3.3Å; Y92-K95 PolarHBondContact O-N 2.78Å; Y92-K95 WeakPolarHBondContact OH-CD 3.45Å; Y92-K95 PolarHBondContact OH-NZ 2.69Å; Q93-K95 PolarHBondContact O-N 2.9Å; Q93-K95 VanDerWaalsContact O-N 3.08Å; K95-F97 VanDerWaalsContact C-N 3.33Å; K95-T98 VanDerWaalsContact CA-OG1 3.3Å; K95-T98 WeakPolarHBondContact CA-OG1 3.45Å; K95-T98 PolarHBondContact O-N 2.73Å; K95-T98 PolarHBondContact O-OG1 3.46Å; K95-T99 WeakPolarHBondContact O-CB 3.2Å; K95-T99 PolarHBondContact O-N 2.95Å; K95-T99 PolarHBondContact O-OG1 3.07Å; K95-S160 WeakPolarHBondContact CE-OG 3.42Å; K95-S160 PolarHBondContact NZ-OG 3.23Å
96I91.1Very high89.6Confident62 Ų6246.9 Ų46.932%0.31824%0.235SC..Hα-helixtrans-69.9-38.4-179.7-51.5-158.8000109.6Q93 S94 A100 L119 L122Q93-I96 PolarHBondContact O-N 3.34Å; S94-I96 PolarHBondContact O-N 2.9Å; I96-A100 WeakPolarHBondContact O-CB 3.08Å; I96-A100 PolarHBondContact O-N 2.9Å; I96-L119 HydrophobicContact CG2-CD2 3.45Å; I96-L119 VanDerWaalsContact CG2-CD2 3.45Å; I96-L122 HydrophobicContact CD1-CD2 4.21Å
97F90.6Very high89.7Confident58 Ų5847.7 Ų47.725%0.25424%0.238SC..Hα-helixtrans-66.1-43.3173.5-71-82.6000112.4S94 K95 A100 M101 L119 L120S94-F97 WeakPolarHBondContact O-CB 3.39Å; S94-F97 PolarHBondContact O-N 2.93Å; S94-F97 VanDerWaalsContact O-N 3.07Å; K95-F97 VanDerWaalsContact C-N 3.33Å; F97-A100 PolarHBondContact O-N 3.15Å; F97-M101 WeakPolarHBondContact O-CB 3.48Å; F97-M101 WeakPolarHBondContact O-CG 3.23Å; F97-M101 PolarHBondContact O-N 2.88Å; F97-L119 HydrophobicContact CE1-CB 4.47Å; F97-L120 HydrophobicContact CE1-CD2 4.07Å; F97-L120 HydrophobicContact CZ-CD2 4.13Å
98T91.8Very high89.7Confident22 Ų2251.7 Ų51.714%0.13526%0.26CS..Hα-helixtrans-64.7-42.6177.760.30000111.1S94 K95 A100 M101 F102 S157 V158S94-T98 PolarHBondContact O-N 3.24Å; K95-T98 VanDerWaalsContact CA-OG1 3.3Å; K95-T98 WeakPolarHBondContact CA-OG1 3.45Å; K95-T98 PolarHBondContact O-N 2.73Å; K95-T98 PolarHBondContact O-OG1 3.46Å; T98-A100 PolarHBondContact O-N 3.36Å; T98-M101 PolarHBondContact O-N 3.01Å; T98-F102 WeakPolarHBondContact O-CD2 3.22Å; T98-F102 PolarHBondContact O-N 3.09Å; T98-S157 PolarHBondContact OG1-O 3.32Å; T98-V158 HydrophobicContact CG2-CB 4.48Å; T98-V158 HydrophobicContact CG2-CG2 3.77Å
99T92.5Very high89.5Confident41 Ų4153.7 Ų53.725%0.25227%0.27SS..Hα-helixtrans-57.3-47.4172.5-540000111.1K95 M101 F102 M103 G161 V165K95-T99 WeakPolarHBondContact O-CB 3.2Å; K95-T99 PolarHBondContact O-N 2.95Å; K95-T99 PolarHBondContact O-OG1 3.07Å; T99-M101 PolarHBondContact O-N 3.36Å; T99-F102 PolarHBondContact O-N 3.16Å; T99-M103 VanDerWaalsContact O-CB 3.31Å; T99-M103 WeakPolarHBondContact O-CB 3.41Å; T99-M103 PolarHBondContact O-N 3.01Å; T99-G161 WeakPolarHBondContact OG1-CA 3Å; T99-V165 HydrophobicContact CG2-CG2 3.88Å; T99-V165 WeakPolarHBondContact O-CG2 3.25Å
100A91.8Very high89.2Confident6 Ų657.9 Ų57.95%0.0529%0.289CS..Hα-helixtrans-61.6-42.9178.800000112.3I96 F97 T98 M103 I104 L111 L119I96-A100 WeakPolarHBondContact O-CB 3.08Å; I96-A100 PolarHBondContact O-N 2.9Å; F97-A100 PolarHBondContact O-N 3.15Å; T98-A100 PolarHBondContact O-N 3.36Å; A100-M103 WeakPolarHBondContact O-CB 3.1Å; A100-M103 PolarHBondContact O-N 2.84Å; A100-I104 WeakPolarHBondContact O-CG1 3.28Å; A100-I104 PolarHBondContact O-N 3.49Å; A100-L111 HydrophobicContact CB-CD1 3.83Å; A100-L119 HydrophobicContact CB-CD1 3.71Å
101M91.3Very high88.9Confident96 Ų9657.5 Ų57.547%0.47329%0.288SS..Hα-helixtrans-61.6-48.5175.2-78.7-77.9139.300111.7F97 T98 T99 M103 I104 L105 W116F97-M101 WeakPolarHBondContact O-CB 3.48Å; F97-M101 WeakPolarHBondContact O-CG 3.23Å; F97-M101 PolarHBondContact O-N 2.88Å; T98-M101 PolarHBondContact O-N 3.01Å; T99-M101 PolarHBondContact O-N 3.36Å; M101-M103 VanDerWaalsContact C-N 3.3Å; M101-M103 PolarHBondContact O-N 3.08Å; M101-I104 PolarHBondContact O-N 3.33Å; M101-L105 WeakPolarHBondContact O-CG 3.29Å; M101-L105 PolarHBondContact O-N 2.91Å; M101-W116 HydrophobicContact CE-CH2 3.3Å; M101-W116 HydrophobicContact CE-CZ2 3.81Å; M101-W116 HydrophobicContact CE-CZ3 4.32Å
102F93.6Very high88.7Confident44 Ų4464.4 Ų64.419%0.19331%0.311CS..Hα-helixtrans-66.7-31.7177.4-75.6-60000112.8T98 T99 I104 L105 L106 V158 F162 V165T98-F102 WeakPolarHBondContact O-CD2 3.22Å; T98-F102 PolarHBondContact O-N 3.09Å; T99-F102 PolarHBondContact O-N 3.16Å; F102-I104 VanDerWaalsContact C-N 3.3Å; F102-I104 PolarHBondContact O-N 2.94Å; F102-L105 HydrophobicContact CD1-CD1 4.49Å; F102-L105 PolarHBondContact O-N 3.34Å; F102-L106 HydrophobicContact CB-CD1 4.34Å; F102-L106 HydrophobicContact CD1-CD1 4.31Å; F102-L106 WeakPolarHBondContact O-CB 3.21Å; F102-L106 PolarHBondContact O-N 2.92Å; F102-V158 HydrophobicContact CE2-CG1 4.01Å; F102-V158 WeakPolarHBondContact CE2-O 3.26Å; F102-V158 HydrophobicContact CZ-CG1 4.07Å; F102-F162 HydrophobicContact CD1-CB 4.43Å; F102-F162 AromaticContact CD1-CD2 3.94Å; F102-F162 HydrophobicContact CD1-CD2 3.94Å; F102-F162 HydrophobicContact CD2-CB 3.93Å; F102-F162 VanDerWaalsContact CD2-N 3.3Å; F102-F162 HydrophobicContact CE1-CB 4.29Å; F102-F162 AromaticContact CE1-CD2 3.8Å; F102-F162 HydrophobicContact CE1-CD2 3.8Å; F102-F162 HydrophobicContact CE2-CB 3.76Å; F102-F162 HydrophobicContact CG-CB 4.28Å; F102-F162 HydrophobicContact CG-CD2 4.49Å; F102-F162 HydrophobicContact CZ-CB 3.95Å; F102-F162 HydrophobicContact CZ-CD2 4.24Å; F102-V165 HydrophobicContact CB-CB 4.06Å; F102-V165 HydrophobicContact CB-CG1 4.36Å; F102-V165 HydrophobicContact CB-CG2 3.85Å
103M91.7Very high88.5Confident43 Ų4366.4 Ų66.421%0.21233%0.334CS..Hα-helixtrans-62-40.1175.3-171.8-140.3-8100111T99 A100 M101 L107 H109 L111 V165T99-M103 VanDerWaalsContact O-CB 3.31Å; T99-M103 WeakPolarHBondContact O-CB 3.41Å; T99-M103 PolarHBondContact O-N 3.01Å; A100-M103 WeakPolarHBondContact O-CB 3.1Å; A100-M103 PolarHBondContact O-N 2.84Å; M101-M103 VanDerWaalsContact C-N 3.3Å; M101-M103 PolarHBondContact O-N 3.08Å; M103-L107 HydrophobicContact CG-CD1 4.4Å; M103-L107 WeakPolarHBondContact O-CB 3.41Å; M103-L107 PolarHBondContact O-N 3.29Å; M103-H109 HydrophobicContact CG-CB 3.76Å; M103-H109 PolarHBondContact O-N 2.94Å; M103-H109 HydrophobicContact SD-CB 3.6Å; M103-H109 PolarHBondContact SD-ND1 3.31Å; M103-L111 HydrophobicContact CE-CD2 3.98Å; M103-L111 HydrophobicContact SD-CD2 3.69Å; M103-L111 HydrophobicContact SD-CG 4.2Å; M103-V165 HydrophobicContact CB-CG2 4.2Å
104I92.1Very high88.4Confident53 Ų5370 Ų7027%0.27236%0.357SS..Hα-helixtrans-67.6-46.7173-62.7165.8000110.3A100 M101 F102 N108 H109 L111 W116A100-I104 WeakPolarHBondContact O-CG1 3.28Å; A100-I104 PolarHBondContact O-N 3.49Å; M101-I104 PolarHBondContact O-N 3.33Å; F102-I104 VanDerWaalsContact C-N 3.3Å; F102-I104 PolarHBondContact O-N 2.94Å; I104-N108 WeakPolarHBondContact O-CA 3.43Å; I104-N108 PolarHBondContact O-N 3.48Å; I104-N108 VanDerWaalsContact O-N 3.13Å; I104-H109 WeakPolarHBondContact CG1-O 3.42Å; I104-L111 HydrophobicContact CD1-CD1 4.07Å; I104-L111 HydrophobicContact CD1-CG 4.38Å; I104-L111 HydrophobicContact CG1-CD1 4.33Å; I104-L111 HydrophobicContact CG1-CG 4.32Å; I104-W116 HydrophobicContact CD1-CZ2 3.65Å
105L91.1Very high88.4Confident121 Ų12172.3 Ų72.363%0.63437%0.365SS*.Hα-helixtrans-72.6-41.1-173.3-67.4171.7000114.8M101 F102M101-L105 WeakPolarHBondContact O-CG 3.29Å; M101-L105 PolarHBondContact O-N 2.91Å; F102-L105 HydrophobicContact CD1-CD1 4.49Å; F102-L105 PolarHBondContact O-N 3.34Å
106L89.1Confident88.3Confident41 Ų4173.3 Ų73.322%0.21537%0.367CS..Hα-helixtrans-95.9-31.7-171.8-70.5175.7000113.9F102 F162 V165 K169F102-L106 HydrophobicContact CB-CD1 4.34Å; F102-L106 HydrophobicContact CD1-CD1 4.31Å; F102-L106 WeakPolarHBondContact O-CB 3.21Å; F102-L106 PolarHBondContact O-N 2.92Å; L106-F162 HydrophobicContact CD1-CD2 3.79Å; L106-F162 HydrophobicContact CD1-CE2 3.75Å; L106-F162 HydrophobicContact CD2-CE2 4.31Å; L106-V165 HydrophobicContact CB-CG1 3.88Å; L106-V165 HydrophobicContact CD1-CB 4.33Å; L106-V165 HydrophobicContact CD1-CG1 4.01Å; L106-K169 PolarHBondContact O-NZ 3.39Å
107L87.4Confident88.3Confident37 Ų3777 Ų7719%0.19438%0.381CS..Hα-helixtrans-107.6-3.7-178.1-69.6172000112.7M103 H109 V165 E168 K169 K172M103-L107 HydrophobicContact CG-CD1 4.4Å; M103-L107 WeakPolarHBondContact O-CB 3.41Å; M103-L107 PolarHBondContact O-N 3.29Å; L107-H109 PolarHBondContact O-N 3.43Å; L107-H109 VanDerWaalsContact O-N 3.12Å; L107-V165 HydrophobicContact CD1-CG1 3.72Å; L107-V165 HydrophobicContact CG-CG1 3.9Å; L107-E168 HydrophobicContact CD1-CB 4.43Å; L107-E168 HydrophobicContact CD1-CG 4.24Å; L107-K169 HydrophobicContact CD2-CB 3.6Å; L107-K169 HydrophobicContact CD2-CD 4.29Å; L107-K169 HydrophobicContact CD2-CG 3.79Å; L107-K169 HydrophobicContact CG-CB 4.42Å; L107-K172 HydrophobicContact CD2-CD 4.37Å
108N84.4Confident88.4Confident126 Ų12677 Ų7767%0.67439%0.389SS*.  trans5132.7-174.4-65-43.9000112.6I104I104-N108 WeakPolarHBondContact O-CA 3.43Å; I104-N108 PolarHBondContact O-N 3.48Å; I104-N108 VanDerWaalsContact O-N 3.13Å
109H81.5Confident88.3Confident74 Ų7477.2 Ų77.234%0.34339%0.389SS..  trans-77.3132.1178.3-172.3-96000109.6M103 I104 L107M103-H109 HydrophobicContact CG-CB 3.76Å; M103-H109 PolarHBondContact O-N 2.94Å; M103-H109 HydrophobicContact SD-CB 3.6Å; M103-H109 PolarHBondContact SD-ND1 3.31Å; I104-H109 WeakPolarHBondContact CG1-O 3.42Å; L107-H109 PolarHBondContact O-N 3.43Å; L107-H109 VanDerWaalsContact O-N 3.12Å
110H79.6Confident88.3Confident166 Ų16679.7 Ų79.777%0.76940%0.4SS*.  trans-90.6109.6174.8-66-67.1000109.9R112H110-R112 PolarHBondContact O-N 3.14Å
111L80Confident88.3Confident26 Ų2684.4 Ų84.414%0.13642%0.424CS..  trans-75.1124171.3-68.7178000110.1A100 M103 I104 Q115 W116 L119A100-L111 HydrophobicContact CB-CD1 3.83Å; M103-L111 HydrophobicContact CE-CD2 3.98Å; M103-L111 HydrophobicContact SD-CD2 3.69Å; M103-L111 HydrophobicContact SD-CG 4.2Å; I104-L111 HydrophobicContact CD1-CD1 4.07Å; I104-L111 HydrophobicContact CD1-CG 4.38Å; I104-L111 HydrophobicContact CG1-CD1 4.33Å; I104-L111 HydrophobicContact CG1-CG 4.32Å; L111-Q115 VanDerWaalsContact CA-OE1 3.27Å; L111-Q115 HydrophobicContact CB-CB 4.49Å; L111-Q115 HydrophobicContact CD2-CB 4.33Å; L111-W116 HydrophobicContact CD1-CZ2 4.19Å; L111-L119 HydrophobicContact CD1-CD1 4.39Å
112R84.8Confident88.2Confident182 Ų18283.6 Ų83.669%0.68742%0.421SS*.  trans-64149.3174.3-169.5177.7-68-103.52.3109.6H110 T114 Q115 W116H110-R112 PolarHBondContact O-N 3.14Å; R112-T114 VanDerWaalsContact CD-OG1 3.3Å; R112-T114 WeakPolarHBondContact CD-OG1 3.46Å; R112-T114 WeakPolarHBondContact CG-OG1 3.22Å; R112-T114 PolarHBondContact O-N 3.46Å; R112-Q115 HydrophobicContact CB-CG 4.36Å; R112-Q115 WeakPolarHBondContact O-CA 3.47Å; R112-Q115 WeakPolarHBondContact O-CB 3.29Å; R112-Q115 PolarHBondContact O-N 3.22Å; R112-W116 PolarHBondContact O-N 3.41Å; R112-W116 VanDerWaalsContact O-N 3.15Å
113S84.5Confident88Confident101 Ų10182.3 Ų82.371%0.70642%0.418SS*.Hα-helixtrans-55.8-28.9177.2-530000113.2W116 F117S113-W116 PolarHBondContact O-N 3.29Å; S113-F117 WeakPolarHBondContact O-CB 3.46Å; S113-F117 PolarHBondContact O-N 2.86Å
114T87.2Confident87.9Confident93 Ų9383.7 Ų83.757%0.57143%0.429SS*.Hα-helixtrans-66.6-35.1172.955.90000112.8R112 F117 S118R112-T114 VanDerWaalsContact CD-OG1 3.3Å; R112-T114 WeakPolarHBondContact CD-OG1 3.46Å; R112-T114 WeakPolarHBondContact CG-OG1 3.22Å; R112-T114 PolarHBondContact O-N 3.46Å; T114-F117 PolarHBondContact O-N 3.13Å; T114-S118 WeakPolarHBondContact O-CB 3.38Å; T114-S118 PolarHBondContact O-N 3.27Å
115Q88.3Confident87.7Confident76 Ų7682.7 Ų82.736%0.35543%0.431SS..Hα-helixtrans-69.9-42.3175.3-66.5173.2-42.600110.3L111 R112 F117 S118 L119L111-Q115 VanDerWaalsContact CA-OE1 3.27Å; L111-Q115 HydrophobicContact CB-CB 4.49Å; L111-Q115 HydrophobicContact CD2-CB 4.33Å; R112-Q115 HydrophobicContact CB-CG 4.36Å; R112-Q115 WeakPolarHBondContact O-CA 3.47Å; R112-Q115 WeakPolarHBondContact O-CB 3.29Å; R112-Q115 PolarHBondContact O-N 3.22Å; Q115-F117 VanDerWaalsContact C-N 3.34Å; Q115-F117 PolarHBondContact O-N 3.45Å; Q115-S118 WeakPolarHBondContact CA-OG 3.5Å; Q115-S118 PolarHBondContact O-N 3.18Å; Q115-S118 VanDerWaalsContact O-N 3.16Å; Q115-S118 PolarHBondContact O-OG 3.24Å; Q115-L119 WeakPolarHBondContact O-CG 3.39Å; Q115-L119 PolarHBondContact O-N 3.47Å
116W90.6Very high87.5Confident72 Ų7278.7 Ų78.727%0.27341%0.41SS..Hα-helixtrans-56.6-47.1170.9-83.7109.2000112.6M101 I104 L111 R112 S113 S118 L119 L120M101-W116 HydrophobicContact CE-CH2 3.3Å; M101-W116 HydrophobicContact CE-CZ2 3.81Å; M101-W116 HydrophobicContact CE-CZ3 4.32Å; I104-W116 HydrophobicContact CD1-CZ2 3.65Å; L111-W116 HydrophobicContact CD1-CZ2 4.19Å; R112-W116 PolarHBondContact O-N 3.41Å; R112-W116 VanDerWaalsContact O-N 3.15Å; S113-W116 PolarHBondContact O-N 3.29Å; W116-S118 VanDerWaalsContact C-N 3.32Å; W116-S118 PolarHBondContact O-N 3.12Å; W116-L119 HydrophobicContact CE3-CD1 4.36Å; W116-L119 HydrophobicContact CZ3-CD1 4.42Å; W116-L119 PolarHBondContact O-N 2.88Å; W116-L120 PolarHBondContact O-N 3.03Å
117F91.1Very high87.4Confident138 Ų13879.7 Ų79.761%0.60542%0.415SS*.Hα-helixtrans-61.2-42.3175.6-176.1-103.8000111.6S113 T114 Q115 L119 L120 L121S113-F117 WeakPolarHBondContact O-CB 3.46Å; S113-F117 PolarHBondContact O-N 2.86Å; T114-F117 PolarHBondContact O-N 3.13Å; Q115-F117 VanDerWaalsContact C-N 3.34Å; Q115-F117 PolarHBondContact O-N 3.45Å; F117-L119 VanDerWaalsContact C-N 3.32Å; F117-L119 PolarHBondContact O-N 3.3Å; F117-L120 PolarHBondContact O-N 3.45Å; F117-L121 HydrophobicContact CE1-CD2 4.27Å; F117-L121 VanDerWaalsContact O-CB 3.26Å; F117-L121 WeakPolarHBondContact O-CB 3.41Å; F117-L121 PolarHBondContact O-N 3.33Å
118S91.4Very high87.4Confident60 Ų6083 Ų8342%0.4243%0.433SS..Hα-helixtrans-62.5-37176.674.90000113T114 Q115 W116 L121 L122T114-S118 WeakPolarHBondContact O-CB 3.38Å; T114-S118 PolarHBondContact O-N 3.27Å; Q115-S118 WeakPolarHBondContact CA-OG 3.5Å; Q115-S118 PolarHBondContact O-N 3.18Å; Q115-S118 VanDerWaalsContact O-N 3.16Å; Q115-S118 PolarHBondContact O-OG 3.24Å; W116-S118 VanDerWaalsContact C-N 3.32Å; W116-S118 PolarHBondContact O-N 3.12Å; S118-L121 PolarHBondContact O-N 3.09Å; S118-L122 VanDerWaalsContact O-CB 3.23Å; S118-L122 WeakPolarHBondContact O-CB 3.36Å; S118-L122 PolarHBondContact O-N 2.91Å
119L90.9Very high87.4Confident25 Ų2581.7 Ų81.713%0.13143%0.429CS..Hα-helixtrans-65.5-45.9175.9-70.9177.5000111.6I96 F97 A100 L111 Q115 W116 F117 L122 S123I96-L119 HydrophobicContact CG2-CD2 3.45Å; I96-L119 VanDerWaalsContact CG2-CD2 3.45Å; F97-L119 HydrophobicContact CE1-CB 4.47Å; A100-L119 HydrophobicContact CB-CD1 3.71Å; L111-L119 HydrophobicContact CD1-CD1 4.39Å; Q115-L119 WeakPolarHBondContact O-CG 3.39Å; Q115-L119 PolarHBondContact O-N 3.47Å; W116-L119 HydrophobicContact CE3-CD1 4.36Å; W116-L119 HydrophobicContact CZ3-CD1 4.42Å; W116-L119 PolarHBondContact O-N 2.88Å; F117-L119 VanDerWaalsContact C-N 3.32Å; F117-L119 PolarHBondContact O-N 3.3Å; L119-L122 PolarHBondContact O-N 3.03Å; L119-S123 WeakPolarHBondContact O-CB 3.3Å; L119-S123 PolarHBondContact O-N 2.86Å
120L91.6Very high87.4Confident94 Ų9480.5 Ų80.549%0.49242%0.423SS..Hα-helixtrans-62.4-47175.5-71173.9000110.9F97 W116 F117 L122 S123 T124F97-L120 HydrophobicContact CE1-CD2 4.07Å; F97-L120 HydrophobicContact CZ-CD2 4.13Å; W116-L120 PolarHBondContact O-N 3.03Å; F117-L120 PolarHBondContact O-N 3.45Å; L120-L122 VanDerWaalsContact C-N 3.34Å; L120-L122 PolarHBondContact O-N 2.92Å; L120-S123 PolarHBondContact O-N 3.19Å; L120-T124 WeakPolarHBondContact O-CB 3.27Å; L120-T124 PolarHBondContact O-N 3.48Å; L120-T124 PolarHBondContact O-OG1 3.27Å; L120-T124 VanDerWaalsContact O-OG1 3.07Å
121L93.1Very high87.2Confident105 Ų10576.8 Ų76.855%0.5541%0.409SS..Hα-helixtrans-59.6-43.8179-174.166.4000111.8F117 S118 T124 G125F117-L121 HydrophobicContact CE1-CD2 4.27Å; F117-L121 VanDerWaalsContact O-CB 3.26Å; F117-L121 WeakPolarHBondContact O-CB 3.41Å; F117-L121 PolarHBondContact O-N 3.33Å; S118-L121 PolarHBondContact O-N 3.09Å; L121-T124 PolarHBondContact O-N 3.46Å; L121-G125 PolarHBondContact O-N 3.44Å
122L89.3Confident87Confident78 Ų7880.4 Ų80.441%0.40843%0.434SS..Hα-helixtrans-63.2-46176.6-172.9163.6000110.8I96 S118 L119 L120 G125 I126I96-L122 HydrophobicContact CD1-CD2 4.21Å; S118-L122 VanDerWaalsContact O-CB 3.23Å; S118-L122 WeakPolarHBondContact O-CB 3.36Å; S118-L122 PolarHBondContact O-N 2.91Å; L119-L122 PolarHBondContact O-N 3.03Å; L120-L122 VanDerWaalsContact C-N 3.34Å; L120-L122 PolarHBondContact O-N 2.92Å; L122-G125 PolarHBondContact O-N 3.28Å; L122-I126 HydrophobicContact CD2-CD1 3.48Å; L122-I126 VanDerWaalsContact CD2-CD1 3.48Å; L122-I126 HydrophobicContact CD2-CG1 4.32Å; L122-I126 WeakPolarHBondContact O-CG1 3.15Å; L122-I126 PolarHBondContact O-N 2.9Å
123S87.6Confident86.4Confident18 Ų1874.2 Ų74.213%0.12642%0.418CS..Hα-helixtrans-60.8-46.2177.2-1720000112.1L119 L120 G125 I126 I127L119-S123 WeakPolarHBondContact O-CB 3.3Å; L119-S123 PolarHBondContact O-N 2.86Å; L120-S123 PolarHBondContact O-N 3.19Å; S123-G125 VanDerWaalsContact C-N 3.34Å; S123-I126 PolarHBondContact O-N 2.82Å; S123-I127 VanDerWaalsContact O-CG1 3.27Å; S123-I127 WeakPolarHBondContact O-CG1 3.42Å; S123-I127 PolarHBondContact O-N 3.38Å
124T89.7Confident85.7Confident72 Ų7272 Ų7244%0.44240%0.398SS..Hα-helixtrans-62.4-42.6176.3-59.70000110.9L120 L121 I126 I127 L128L120-T124 WeakPolarHBondContact O-CB 3.27Å; L120-T124 PolarHBondContact O-N 3.48Å; L120-T124 PolarHBondContact O-OG1 3.27Å; L120-T124 VanDerWaalsContact O-OG1 3.07Å; L121-T124 PolarHBondContact O-N 3.46Å; T124-I126 PolarHBondContact O-N 2.93Å; T124-I127 PolarHBondContact O-N 2.82Å; T124-L128 HydrophobicContact CG2-CD1 3.83Å; T124-L128 HydrophobicContact CG2-CG 4.1Å; T124-L128 WeakPolarHBondContact O-CB 3.5Å; T124-L128 VanDerWaalsContact O-CG 3.23Å; T124-L128 WeakPolarHBondContact O-CG 3.37Å; T124-L128 PolarHBondContact O-N 3.18Å
125G89.4Confident84.5Confident32 Ų3270.9 Ų70.933%0.3341%0.406SS..Hα-helixtrans-57.8-45.3175.700000112.9L121 L122 S123 L128 T129L121-G125 PolarHBondContact O-N 3.44Å; L122-G125 PolarHBondContact O-N 3.28Å; S123-G125 VanDerWaalsContact C-N 3.34Å; G125-L128 PolarHBondContact O-N 2.7Å; G125-T129 VanDerWaalsContact O-CG2 3.29Å; G125-T129 WeakPolarHBondContact O-CG2 3.25Å; G125-T129 PolarHBondContact O-N 3.44Å; G125-T129 PolarHBondContact O-OG1 3.33Å; G125-T129 VanDerWaalsContact O-OG1 3.11Å
126I86.2Confident83.1Confident36 Ų3674.9 Ų74.919%0.18542%0.424CS..Hα-helixtrans-66.2-43.8176.6-67.5172.2000111Q93 L122 S123 T124 L128 T129 Q130Q93-I126 VanDerWaalsContact CD-CD1 3.48Å; Q93-I126 HydrophobicContact CG-CD1 3.93Å; L122-I126 HydrophobicContact CD2-CD1 3.48Å; L122-I126 VanDerWaalsContact CD2-CD1 3.48Å; L122-I126 HydrophobicContact CD2-CG1 4.32Å; L122-I126 WeakPolarHBondContact O-CG1 3.15Å; L122-I126 PolarHBondContact O-N 2.9Å; S123-I126 PolarHBondContact O-N 2.82Å; T124-I126 PolarHBondContact O-N 2.93Å; I126-L128 PolarHBondContact O-N 2.84Å; I126-T129 WeakPolarHBondContact CA-OG1 3.39Å; I126-T129 PolarHBondContact O-N 3.5Å; I126-T129 PolarHBondContact O-OG1 2.95Å; I126-Q130 HydrophobicContact CG2-CG 4.43Å; I126-Q130 WeakPolarHBondContact O-CB 3.37Å; I126-Q130 WeakPolarHBondContact O-CG 3.37Å; I126-Q130 PolarHBondContact O-N 2.83Å
127I86.4Confident81.4Confident62 Ų6273.2 Ų73.232%0.31842%0.424SS..Hα-helixtrans-60.6-49.4177.6-68.1164000110.1I90 S123 T124 T129 Q130 L131I90-I127 HydrophobicContact CG2-CG1 3.95Å; S123-I127 VanDerWaalsContact O-CG1 3.27Å; S123-I127 WeakPolarHBondContact O-CG1 3.42Å; S123-I127 PolarHBondContact O-N 3.38Å; T124-I127 PolarHBondContact O-N 2.82Å; I127-T129 VanDerWaalsContact C-N 3.33Å; I127-T129 PolarHBondContact O-N 3.44Å; I127-Q130 CarbonylContact O-C 3.57Å; I127-Q130 PolarHBondContact O-N 2.85Å; I127-L131 HydrophobicContact CG2-CD2 4.26Å; I127-L131 HydrophobicContact CG2-CG 4.16Å; I127-L131 WeakPolarHBondContact O-CG 3.42Å; I127-L131 PolarHBondContact O-N 3Å
128L87.8Confident79.5Confident108 Ų10873.1 Ų73.157%0.56544%0.435SS*.Hα-helixtrans-58.6-42.1-179.6-74175.1000112.6T124 G125 I126 Q130 L131 P132T124-L128 HydrophobicContact CG2-CD1 3.83Å; T124-L128 HydrophobicContact CG2-CG 4.1Å; T124-L128 WeakPolarHBondContact O-CB 3.5Å; T124-L128 VanDerWaalsContact O-CG 3.23Å; T124-L128 WeakPolarHBondContact O-CG 3.37Å; T124-L128 PolarHBondContact O-N 3.18Å; G125-L128 PolarHBondContact O-N 2.7Å; I126-L128 PolarHBondContact O-N 2.84Å; L128-Q130 PolarHBondContact O-N 3.28Å; L128-L131 HydrophobicContact CD2-CD1 4.07Å; L128-P132 WeakPolarHBondContact O-CD 3.46Å
129T83.8Confident77.8Confident98 Ų9873.9 Ų73.960%0.60144%0.44SS*.Hα-helixtrans-67.5-23.4177.653.90000113G125 I126 I127G125-T129 VanDerWaalsContact O-CG2 3.29Å; G125-T129 WeakPolarHBondContact O-CG2 3.25Å; G125-T129 PolarHBondContact O-N 3.44Å; G125-T129 PolarHBondContact O-OG1 3.33Å; G125-T129 VanDerWaalsContact O-OG1 3.11Å; I126-T129 WeakPolarHBondContact CA-OG1 3.39Å; I126-T129 PolarHBondContact O-N 3.5Å; I126-T129 PolarHBondContact O-OG1 2.95Å; I127-T129 VanDerWaalsContact C-N 3.33Å; I127-T129 PolarHBondContact O-N 3.44Å
130Q81.6Confident75.8Confident48 Ų4878.1 Ų78.122%0.22447%0.472CS..Hα-helixtrans-97.9-22.6-177.5-63.4-63.64.200113.5V86 I90 I126 I127 L128 P132 S133 L134V86-Q130 HydrophobicContact CG1-CB 3.9Å; I90-Q130 HydrophobicContact CD1-CB 3.75Å; I90-Q130 HydrophobicContact CG1-CB 3.88Å; I90-Q130 HydrophobicContact CG1-CG 4.18Å; I126-Q130 HydrophobicContact CG2-CG 4.43Å; I126-Q130 WeakPolarHBondContact O-CB 3.37Å; I126-Q130 WeakPolarHBondContact O-CG 3.37Å; I126-Q130 PolarHBondContact O-N 2.83Å; I127-Q130 CarbonylContact O-C 3.57Å; I127-Q130 PolarHBondContact O-N 2.85Å; L128-Q130 PolarHBondContact O-N 3.28Å; Q130-P132 VanDerWaalsContact C-CD 3.44Å; Q130-S133 WeakPolarHBondContact O-CA 3.32Å; Q130-S133 VanDerWaalsContact O-CB 3.29Å; Q130-S133 WeakPolarHBondContact O-CB 3.48Å; Q130-S133 PolarHBondContact O-N 3.32Å; Q130-L134 VanDerWaalsContact O-CD1 3.28Å; Q130-L134 WeakPolarHBondContact O-CD1 3.39Å; Q130-L134 PolarHBondContact O-N 2.72Å
131L76Confident73.8Confident89 Ų8978.8 Ų78.847%0.46648%0.484SS..Hα-helixtrans-47.9-45.2179.1-79.2-179.1000115I127 L128 S133 L134I127-L131 HydrophobicContact CG2-CD2 4.26Å; I127-L131 HydrophobicContact CG2-CG 4.16Å; I127-L131 WeakPolarHBondContact O-CG 3.42Å; I127-L131 PolarHBondContact O-N 3Å; L128-L131 HydrophobicContact CD2-CD1 4.07Å; L131-S133 PolarHBondContact O-N 3.38Å; L131-S133 VanDerWaalsContact O-N 3.12Å; L131-L134 HydrophobicContact CD2-CD1 4.48Å; L131-L134 PolarHBondContact O-N 2.83Å
132P75.1Confident72.1Confident102 Ų10278.3 Ų78.366%0.66248%0.479SS*.Hα-helixtrans-58.8-27.3177.6-24.535.1000113.2L128 Q130L128-P132 WeakPolarHBondContact O-CD 3.46Å; Q130-P132 VanDerWaalsContact C-CD 3.44Å
133S73.4Confident70.6Confident51 Ų5180.7 Ų80.736%0.35749%0.487SS..Hα-helixtrans-84-14.7-179.9-50.90000113.3V86 Q130 L131V86-S133 VanDerWaalsContact CG2-CB 3.42Å; Q130-S133 WeakPolarHBondContact O-CA 3.32Å; Q130-S133 VanDerWaalsContact O-CB 3.29Å; Q130-S133 WeakPolarHBondContact O-CB 3.48Å; Q130-S133 PolarHBondContact O-N 3.32Å; L131-S133 PolarHBondContact O-N 3.38Å; L131-S133 VanDerWaalsContact O-N 3.12Å
134L68.3Low69.1Low54 Ų5486.3 Ų86.328%0.28351%0.511SS..Hα-helixtrans-73.3-29.4177.3-86.886.4000112.7V86 L87 I90 Q130 L131 Q136 S137V86-L134 HydrophobicContact CG1-CD1 3.43Å; V86-L134 VanDerWaalsContact CG1-CD1 3.43Å; V86-L134 HydrophobicContact CG1-CG 4.14Å; L87-L134 HydrophobicContact CD2-CD2 4.08Å; I90-L134 HydrophobicContact CD1-CD1 3.6Å; Q130-L134 VanDerWaalsContact O-CD1 3.28Å; Q130-L134 WeakPolarHBondContact O-CD1 3.39Å; Q130-L134 PolarHBondContact O-N 2.72Å; L131-L134 HydrophobicContact CD2-CD1 4.48Å; L131-L134 PolarHBondContact O-N 2.83Å; L134-Q136 PolarHBondContact O-N 2.91Å; L134-S137 PolarHBondContact O-N 3.29Å
135G63.9Low68.1Low71 Ų7185.3 Ų85.373%0.73251%0.506SS*.THydrogen-bonded Turntrans-62.9-2.4-172.300000116.2
136Q57.7Low67.5Low159 Ų15985.8 Ų85.874%0.74350%0.501SS*.THydrogen-bonded Turntrans-1072.5179.9-67.9177.134.900114L134L134-Q136 PolarHBondContact O-N 2.91Å
137S55.3Low67.5Low38 Ų3887.5 Ų87.527%0.26651%0.511SS..  trans-127.833.1-164.3-57.60000116.8N84 L134N84-S137 WeakPolarHBondContact ND2-CB 3.18Å; N84-S137 PolarHBondContact ND2-OG 3.47Å; L134-S137 PolarHBondContact O-N 3.29Å
138T52Low67.6Low136 Ų13691.9 Ų91.983%0.83452%0.524SS*.  trans-110.277.7174.655.80000111.7
139S54.5Low67.7Low76 Ų7686.7 Ų86.753%0.53150%0.497SS..  trans-108.1128.4160.3-63.30000109S141 E142S139-S141 VanDerWaalsContact C-N 3.26Å; S139-S141 PolarHBondContact O-N 2.94Å; S139-E142 WeakPolarHBondContact O-CB 3.29Å; S139-E142 PolarHBondContact O-N 2.95Å
140S48.8Very low68Low114 Ų11484.7 Ų84.780%0.79748%0.483SS*.G310 helixtrans-60.7-24.9-170.646.90000115.3E142 F143S140-E142 PolarHBondContact O-N 3.39Å; S140-F143 PolarHBondContact O-N 2.87Å
141S51.1Low68.6Low107 Ų10787.2 Ų87.275%0.74850%0.497SS*.G310 helixtrans-68.7-12.4174.546.40000113.8S139S139-S141 VanDerWaalsContact C-N 3.26Å; S139-S141 PolarHBondContact O-N 2.94Å
142E56.6Low69.4Low95 Ų9583.3 Ų83.344%0.44448%0.477SS..G310 helixtrans-83.1-15176.6-62.3-169.5151.500113.3S139 S140 H144 S145 N146S139-E142 WeakPolarHBondContact O-CB 3.29Å; S139-E142 PolarHBondContact O-N 2.95Å; S140-E142 PolarHBondContact O-N 3.39Å; E142-H144 PolarHBondContact O-N 3.36Å; E142-S145 PolarHBondContact O-N 2.96Å; E142-N146 WeakPolarHBondContact O-CB 3.27Å; E142-N146 PolarHBondContact O-N 2.81Å
143F57Low70.3Confident129 Ų12978.4 Ų78.457%0.56645%0.446SS*.Hα-helixtrans-59.9-45.7-168.9-168.9-100.4000114S140 N146 L147S140-F143 PolarHBondContact O-N 2.87Å; F143-N146 WeakPolarHBondContact O-CB 3.26Å; F143-N146 PolarHBondContact O-N 2.93Å; F143-L147 HydrophobicContact CD1-CD1 4.05Å; F143-L147 HydrophobicContact CD1-CG 4.29Å; F143-L147 HydrophobicContact CE1-CD1 3.71Å; F143-L147 HydrophobicContact CE1-CD2 4.3Å; F143-L147 HydrophobicContact CE1-CG 4.06Å; F143-L147 HydrophobicContact CZ-CD1 4.47Å; F143-L147 HydrophobicContact CZ-CD2 4.27Å; F143-L147 HydrophobicContact CZ-CG 4.48Å; F143-L147 WeakPolarHBondContact O-CG 3.33Å; F143-L147 PolarHBondContact O-N 2.85Å
144H57.3Low71.3Confident136 Ų13679.1 Ų79.163%0.6345%0.445SS*.Hα-helixtrans-67.9-43.9-179.7-7386.6000112.6E142 N146 L147 Y148E142-H144 PolarHBondContact O-N 3.36Å; H144-N146 VanDerWaalsContact C-N 3.25Å; H144-N146 PolarHBondContact O-N 3.27Å; H144-L147 PolarHBondContact O-N 2.83Å; H144-Y148 VanDerWaalsContact O-CD2 3.22Å; H144-Y148 WeakPolarHBondContact O-CD2 3.41Å; H144-Y148 PolarHBondContact O-N 3.17Å
145S67.6Low72.6Confident50 Ų5081.5 Ų81.535%0.3546%0.457SS..Hα-helixtrans-59.1-42.5173.3179.30000110.6H82 E142 L147 Y148 G149H82-S145 WeakPolarHBondContact CB-O 3.42Å; H82-S145 PolarHBondContact CD2-OG 2.96Å; E142-S145 PolarHBondContact O-N 2.96Å; S145-L147 VanDerWaalsContact C-N 3.33Å; S145-L147 PolarHBondContact O-N 3.48Å; S145-Y148 PolarHBondContact O-N 2.88Å; S145-G149 PolarHBondContact O-N 2.87Å; S145-G149 VanDerWaalsContact O-N 3.13Å
146N77.5Confident74.1Confident42 Ų4278.1 Ų78.123%0.22542%0.423CS..Hα-helixtrans-64.6-35.6179.6-161.13.9000111.8L83 E142 F143 H144 G149 L150L83-N146 WeakPolarHBondContact CD2-OD1 3.25Å; E142-N146 WeakPolarHBondContact O-CB 3.27Å; E142-N146 PolarHBondContact O-N 2.81Å; F143-N146 WeakPolarHBondContact O-CB 3.26Å; F143-N146 PolarHBondContact O-N 2.93Å; H144-N146 VanDerWaalsContact C-N 3.25Å; H144-N146 PolarHBondContact O-N 3.27Å; N146-G149 PolarHBondContact O-N 2.6Å; N146-L150 WeakPolarHBondContact O-CB 3.23Å; N146-L150 PolarHBondContact O-N 3.4Å
147L85.9Confident75.9Confident73 Ų7370.6 Ų70.638%0.38239%0.388SS..Hα-helixtrans-63.5-45.7175.3-72.9179.2000112.9F143 H144 S145 G149 L150 L151F143-L147 HydrophobicContact CD1-CD1 4.05Å; F143-L147 HydrophobicContact CD1-CG 4.29Å; F143-L147 HydrophobicContact CE1-CD1 3.71Å; F143-L147 HydrophobicContact CE1-CD2 4.3Å; F143-L147 HydrophobicContact CE1-CG 4.06Å; F143-L147 HydrophobicContact CZ-CD1 4.47Å; F143-L147 HydrophobicContact CZ-CD2 4.27Å; F143-L147 HydrophobicContact CZ-CG 4.48Å; F143-L147 WeakPolarHBondContact O-CG 3.33Å; F143-L147 PolarHBondContact O-N 2.85Å; H144-L147 PolarHBondContact O-N 2.83Å; S145-L147 VanDerWaalsContact C-N 3.33Å; S145-L147 PolarHBondContact O-N 3.48Å; L147-G149 VanDerWaalsContact C-N 3.34Å; L147-G149 PolarHBondContact O-N 3.09Å; L147-L150 PolarHBondContact O-N 3.35Å; L147-L151 WeakPolarHBondContact O-CG 3.16Å; L147-L151 PolarHBondContact O-N 3.44Å
148Y88.3Confident77.8Confident153 Ų15371.9 Ų71.960%0.639%0.394SS*.Hα-helixtrans-63.6-41.8176.8-68.6-67.5000111.6H144 S145 L150 L151 A152H144-Y148 VanDerWaalsContact O-CD2 3.22Å; H144-Y148 WeakPolarHBondContact O-CD2 3.41Å; H144-Y148 PolarHBondContact O-N 3.17Å; S145-Y148 PolarHBondContact O-N 2.88Å; Y148-L150 VanDerWaalsContact C-N 3.35Å; Y148-L151 PolarHBondContact O-N 3.41Å; Y148-A152 VanDerWaalsContact O-CB 3.31Å; Y148-A152 WeakPolarHBondContact O-CB 3.07Å; Y148-A152 PolarHBondContact O-N 2.75Å
149G89.7Confident79.9Confident0 Ų066.8 Ų66.80%036%0.362CS..Hα-helixtrans-61.6-41.4173.700000112.7S145 N146 L147 A152 I153S145-G149 PolarHBondContact O-N 2.87Å; S145-G149 VanDerWaalsContact O-N 3.13Å; N146-G149 PolarHBondContact O-N 2.6Å; L147-G149 VanDerWaalsContact C-N 3.34Å; L147-G149 PolarHBondContact O-N 3.09Å; G149-A152 PolarHBondContact O-N 2.87Å; G149-I153 WeakPolarHBondContact O-CG2 3.28Å; G149-I153 PolarHBondContact O-N 3.06Å
150L91.1Very high81.8Confident56 Ų5663.2 Ų63.229%0.29334%0.338SS..Hα-helixtrans-65.6-45.7178.7-176.7151.3000111.4L91 N146 L147 Y148 A152 I153 L154L91-L150 HydrophobicContact CD1-CB 4.4Å; L91-L150 HydrophobicContact CD1-CD1 4.26Å; L91-L150 HydrophobicContact CD1-CG 4.15Å; N146-L150 WeakPolarHBondContact O-CB 3.23Å; N146-L150 PolarHBondContact O-N 3.4Å; L147-L150 PolarHBondContact O-N 3.35Å; Y148-L150 VanDerWaalsContact C-N 3.35Å; L150-A152 VanDerWaalsContact C-N 3.34Å; L150-I153 VanDerWaalsContact O-CG2 3.29Å; L150-I153 WeakPolarHBondContact O-CG2 3.39Å; L150-I153 PolarHBondContact O-N 3.42Å; L150-L154 HydrophobicContact CD2-CD1 3.56Å; L150-L154 HydrophobicContact CD2-CG 4.31Å; L150-L154 HydrophobicContact CG-CD1 4.4Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 VanDerWaalsContact O-CG 3.3Å; L150-L154 WeakPolarHBondContact O-CG 3.46Å; L150-L154 PolarHBondContact O-N 3.3Å
151L93.2Very high83.9Confident101 Ų10157.8 Ų57.853%0.52930%0.3SS..Hα-helixtrans-62.9-43175.3-70.7174.8000111.2L147 Y148 I153 L154 L155L147-L151 WeakPolarHBondContact O-CG 3.16Å; L147-L151 PolarHBondContact O-N 3.44Å; Y148-L151 PolarHBondContact O-N 3.41Å; L151-I153 PolarHBondContact O-N 2.93Å; L151-L154 PolarHBondContact O-N 3.27Å; L151-L155 WeakPolarHBondContact O-CB 3.39Å; L151-L155 VanDerWaalsContact O-CG 3.28Å; L151-L155 WeakPolarHBondContact O-CG 3.19Å; L151-L155 PolarHBondContact O-N 3.04Å
152A93.7Very high86Confident6 Ų655.4 Ų55.45%0.0528%0.276CS..Hα-helixtrans-61.9-44178.600000112.3L75 F78 A79 Y148 G149 L150 L155 A156L75-A152 HydrophobicContact CD2-CB 4.31Å; F78-A152 HydrophobicContact CD1-CB 3.64Å; F78-A152 HydrophobicContact CE1-CB 4.24Å; A79-A152 HydrophobicContact CB-CB 4.31Å; Y148-A152 VanDerWaalsContact O-CB 3.31Å; Y148-A152 WeakPolarHBondContact O-CB 3.07Å; Y148-A152 PolarHBondContact O-N 2.75Å; G149-A152 PolarHBondContact O-N 2.87Å; L150-A152 VanDerWaalsContact C-N 3.34Å; A152-L155 PolarHBondContact O-N 3.3Å; A152-A156 VanDerWaalsContact O-CB 3.27Å; A152-A156 WeakPolarHBondContact O-CB 3.04Å; A152-A156 PolarHBondContact O-N 3.4Å
153I94.2Very high87.8Confident0 Ų050.9 Ų50.90%026%0.255CS..Hα-helixtrans-72.4-34.3-179.7-161.6166.6000112.9L76 A79 L83 Y88 L91 G149 L150 L151 A156 S157L76-I153 HydrophobicContact CD2-CG1 4.13Å; A79-I153 HydrophobicContact CB-CB 3.8Å; A79-I153 HydrophobicContact CB-CG1 4.4Å; L83-I153 HydrophobicContact CD1-CB 4.28Å; L83-I153 HydrophobicContact CD1-CD1 4.24Å; L83-I153 HydrophobicContact CD1-CG2 3.93Å; Y88-I153 HydrophobicContact CD2-CD1 3.35Å; Y88-I153 HydrophobicContact CD2-CG1 4.45Å; Y88-I153 HydrophobicContact CE2-CD1 3.6Å; Y88-I153 HydrophobicContact CE2-CG1 4.37Å; Y88-I153 HydrophobicContact CG-CD1 3.97Å; Y88-I153 WeakPolarHBondContact O-CD1 3.23Å; L91-I153 HydrophobicContact CB-CD1 3.87Å; L91-I153 HydrophobicContact CB-CG1 4.39Å; L91-I153 HydrophobicContact CB-CG2 3.62Å; L91-I153 HydrophobicContact CD1-CG2 3.86Å; L91-I153 HydrophobicContact CG-CG2 4.32Å; G149-I153 WeakPolarHBondContact O-CG2 3.28Å; G149-I153 PolarHBondContact O-N 3.06Å; L150-I153 VanDerWaalsContact O-CG2 3.29Å; L150-I153 WeakPolarHBondContact O-CG2 3.39Å; L150-I153 PolarHBondContact O-N 3.42Å; L151-I153 PolarHBondContact O-N 2.93Å; I153-A156 PolarHBondContact O-N 2.96Å; I153-S157 WeakPolarHBondContact O-CB 3.37Å; I153-S157 PolarHBondContact O-N 3.19Å; I153-S157 PolarHBondContact O-OG 3.07Å
154L94.1Very high89.5Confident66 Ų6645.8 Ų45.835%0.34624%0.238SC..Hα-helixtrans-66.8-42.8173-71.4-179.9000111.3L150 L151 A156 S157 V158L150-L154 HydrophobicContact CD2-CD1 3.56Å; L150-L154 HydrophobicContact CD2-CG 4.31Å; L150-L154 HydrophobicContact CG-CD1 4.4Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 VanDerWaalsContact O-CG 3.3Å; L150-L154 WeakPolarHBondContact O-CG 3.46Å; L150-L154 PolarHBondContact O-N 3.3Å; L151-L154 PolarHBondContact O-N 3.27Å; L154-A156 VanDerWaalsContact C-N 3.34Å; L154-S157 PolarHBondContact O-N 3.47Å; L154-S157 PolarHBondContact O-OG 3.48Å; L154-V158 VanDerWaalsContact O-CG2 3.29Å; L154-V158 WeakPolarHBondContact O-CG2 3.35Å; L154-V158 PolarHBondContact O-N 3.48Å
155L96Very high91.2Very high103 Ų10339.3 Ų39.354%0.53921%0.208SC..Hα-helixtrans-63.9-41.4174-72.9172.3000111.3L75 L151 A152 S157 T159L75-L155 HydrophobicContact CD1-CB 4.04Å; L151-L155 WeakPolarHBondContact O-CB 3.39Å; L151-L155 VanDerWaalsContact O-CG 3.28Å; L151-L155 WeakPolarHBondContact O-CG 3.19Å; L151-L155 PolarHBondContact O-N 3.04Å; A152-L155 PolarHBondContact O-N 3.3Å; L155-S157 VanDerWaalsContact C-N 3.33Å; L155-S157 PolarHBondContact O-N 2.88Å; L155-T159 WeakPolarHBondContact O-CB 3.37Å; L155-T159 VanDerWaalsContact O-CG2 3.3Å; L155-T159 WeakPolarHBondContact O-CG2 3.48Å; L155-T159 PolarHBondContact O-N 3.36Å; L155-T159 PolarHBondContact O-OG1 3.22Å
156A95.8Very high92.4Very high1 Ų139.3 Ų39.31%0.00820%0.201CC..Hα-helixtrans-62.5-40.2174.700000111.9Q72 L75 L76 A152 I153 L154 T159 S160Q72-A156 HydrophobicContact CB-CB 4.38Å; L75-A156 HydrophobicContact CB-CB 3.8Å; L75-A156 HydrophobicContact CD1-CB 4.4Å; L76-A156 HydrophobicContact CD2-CB 3.6Å; L76-A156 HydrophobicContact CG-CB 3.86Å; A152-A156 VanDerWaalsContact O-CB 3.27Å; A152-A156 WeakPolarHBondContact O-CB 3.04Å; A152-A156 PolarHBondContact O-N 3.4Å; I153-A156 PolarHBondContact O-N 2.96Å; L154-A156 VanDerWaalsContact C-N 3.34Å; A156-T159 WeakPolarHBondContact CA-OG1 3.29Å; A156-T159 PolarHBondContact O-OG1 3.01Å; A156-T159 VanDerWaalsContact O-OG1 3.09Å; A156-S160 WeakPolarHBondContact O-CB 3.41Å; A156-S160 PolarHBondContact O-N 3.05Å
157S94.6Very high93Very high1 Ų138.1 Ų38.11%0.00720%0.195CC..Hα-helixtrans-71.6-38.9-17973.70000112.1S94 T98 I153 L154 L155 G161S94-S157 VanDerWaalsContact OG-CB 3.25Å; S94-S157 WeakPolarHBondContact OG-CB 3.23Å; S94-S157 PolarHBondContact OG-OG 3.37Å; T98-S157 PolarHBondContact OG1-O 3.32Å; I153-S157 WeakPolarHBondContact O-CB 3.37Å; I153-S157 PolarHBondContact O-N 3.19Å; I153-S157 PolarHBondContact O-OG 3.07Å; L154-S157 PolarHBondContact O-N 3.47Å; L154-S157 PolarHBondContact O-OG 3.48Å; L155-S157 VanDerWaalsContact C-N 3.33Å; L155-S157 PolarHBondContact O-N 2.88Å; S157-G161 PolarHBondContact O-N 2.82Å
158V95.3Very high93.1Very high64 Ų6438.1 Ų38.139%0.38819%0.193SC..Hα-helixtrans-65.3-51.8174172.20000110.8T98 F102 L154 S160 G161 F162T98-V158 HydrophobicContact CG2-CB 4.48Å; T98-V158 HydrophobicContact CG2-CG2 3.77Å; F102-V158 HydrophobicContact CE2-CG1 4.01Å; F102-V158 WeakPolarHBondContact CE2-O 3.26Å; F102-V158 HydrophobicContact CZ-CG1 4.07Å; L154-V158 VanDerWaalsContact O-CG2 3.29Å; L154-V158 WeakPolarHBondContact O-CG2 3.35Å; L154-V158 PolarHBondContact O-N 3.48Å; V158-S160 VanDerWaalsContact C-N 3.28Å; V158-S160 PolarHBondContact O-N 2.95Å; V158-G161 PolarHBondContact O-N 3.43Å; V158-F162 PolarHBondContact O-N 2.78Å
159T95.4Very high93.1Very high29 Ų2935.8 Ų35.818%0.17819%0.186CC..Hα-helixtrans-61.9-37.5178.751.50000111.8L68 L155 A156 A163L68-T159 HydrophobicContact CD2-CG2 4.14Å; L155-T159 WeakPolarHBondContact O-CB 3.37Å; L155-T159 VanDerWaalsContact O-CG2 3.3Å; L155-T159 WeakPolarHBondContact O-CG2 3.48Å; L155-T159 PolarHBondContact O-N 3.36Å; L155-T159 PolarHBondContact O-OG1 3.22Å; A156-T159 WeakPolarHBondContact CA-OG1 3.29Å; A156-T159 PolarHBondContact O-OG1 3.01Å; A156-T159 VanDerWaalsContact O-OG1 3.09Å; T159-A163 VanDerWaalsContact O-CB 3.23Å; T159-A163 WeakPolarHBondContact O-CB 3.5Å; T159-A163 PolarHBondContact O-N 3.46Å
160S94.4Very high92.9Very high2 Ų236.4 Ų36.41%0.01419%0.189CC..Hα-helixtrans-67.9-42.9175.5-160.50000113.7Q72 K95 A156 V158 F162 A163 G164Q72-S160 PolarHBondContact NE2-OG 3.12Å; Q72-S160 PolarHBondContact OE1-OG 3.42Å; K95-S160 WeakPolarHBondContact CE-OG 3.42Å; K95-S160 PolarHBondContact NZ-OG 3.23Å; A156-S160 WeakPolarHBondContact O-CB 3.41Å; A156-S160 PolarHBondContact O-N 3.05Å; V158-S160 VanDerWaalsContact C-N 3.28Å; V158-S160 PolarHBondContact O-N 2.95Å; S160-F162 VanDerWaalsContact C-N 3.34Å; S160-A163 PolarHBondContact O-N 3.08Å; S160-G164 PolarHBondContact O-N 2.72Å
161G93.9Very high92.5Very high0 Ų036 Ų360%019%0.185CC..Hα-helixtrans-61.7-44.7175.600000111.4T99 S157 V158 V165T99-G161 WeakPolarHBondContact OG1-CA 3Å; S157-G161 PolarHBondContact O-N 2.82Å; V158-G161 PolarHBondContact O-N 3.43Å; G161-V165 WeakPolarHBondContact O-CG2 3.46Å; G161-V165 PolarHBondContact O-N 2.77Å; G161-V165 VanDerWaalsContact O-N 3.15Å
162F95.4Very high91.9Very high57 Ų5737.5 Ų37.525%0.2519%0.187CC..Hα-helixtrans-62.8-51.6175.7178.4-89.4000111.8I64 L68 F102 L106 V158 S160 G164 V165 Y166I64-F162 HydrophobicContact CG2-CE1 4.29Å; L68-F162 HydrophobicContact CD1-CD1 3.43Å; L68-F162 VanDerWaalsContact CD1-CD1 3.43Å; L68-F162 HydrophobicContact CD1-CE1 3.78Å; F102-F162 HydrophobicContact CD1-CB 4.43Å; F102-F162 AromaticContact CD1-CD2 3.94Å; F102-F162 HydrophobicContact CD1-CD2 3.94Å; F102-F162 HydrophobicContact CD2-CB 3.93Å; F102-F162 VanDerWaalsContact CD2-N 3.3Å; F102-F162 HydrophobicContact CE1-CB 4.29Å; F102-F162 AromaticContact CE1-CD2 3.8Å; F102-F162 HydrophobicContact CE1-CD2 3.8Å; F102-F162 HydrophobicContact CE2-CB 3.76Å; F102-F162 HydrophobicContact CG-CB 4.28Å; F102-F162 HydrophobicContact CG-CD2 4.49Å; F102-F162 HydrophobicContact CZ-CB 3.95Å; F102-F162 HydrophobicContact CZ-CD2 4.24Å; L106-F162 HydrophobicContact CD1-CD2 3.79Å; L106-F162 HydrophobicContact CD1-CE2 3.75Å; L106-F162 HydrophobicContact CD2-CE2 4.31Å; V158-F162 PolarHBondContact O-N 2.78Å; S160-F162 VanDerWaalsContact C-N 3.34Å; F162-G164 VanDerWaalsContact C-N 3.3Å; F162-G164 PolarHBondContact O-N 3.08Å; F162-V165 PolarHBondContact O-N 3.42Å; F162-Y166 HydrophobicContact CE1-CD2 4.3Å; F162-Y166 HydrophobicContact CE1-CG 4.3Å; F162-Y166 HydrophobicContact CZ-CD2 4.02Å; F162-Y166 HydrophobicContact CZ-CG 4.46Å; F162-Y166 WeakPolarHBondContact O-CB 3.25Å; F162-Y166 PolarHBondContact O-N 3.05Å
163A94.5Very high90.8Very high0 Ų040.4 Ų40.40%022%0.218CC..Hα-helixtrans-60.6-39.4-178.100000112.1P65 L68 Y69 T159 S160 L167P65-A163 HydrophobicContact CB-CB 4.18Å; L68-A163 HydrophobicContact CB-CB 3.82Å; L68-A163 HydrophobicContact CD1-CB 4.17Å; Y69-A163 HydrophobicContact CD1-CB 4.5Å; Y69-A163 HydrophobicContact CD2-CB 4.42Å; Y69-A163 HydrophobicContact CE1-CB 4.2Å; Y69-A163 HydrophobicContact CE2-CB 4.13Å; T159-A163 VanDerWaalsContact O-CB 3.23Å; T159-A163 WeakPolarHBondContact O-CB 3.5Å; T159-A163 PolarHBondContact O-N 3.46Å; S160-A163 PolarHBondContact O-N 3.08Å; A163-L167 WeakPolarHBondContact O-CB 3.31Å; A163-L167 PolarHBondContact O-N 2.91Å
164G91.5Very high90.1Very high21 Ų2142.7 Ų42.722%0.21623%0.232CC..Hα-helixtrans-60-54.117500000112.6Y69 S160 F162 Y166 L167 E168Y69-G164 VanDerWaalsContact OH-CA 3.23Å; Y69-G164 WeakPolarHBondContact OH-CA 3.39Å; Y69-G164 PolarHBondContact OH-N 2.64Å; S160-G164 PolarHBondContact O-N 2.72Å; F162-G164 VanDerWaalsContact C-N 3.3Å; F162-G164 PolarHBondContact O-N 3.08Å; G164-Y166 PolarHBondContact O-N 3.35Å; G164-L167 PolarHBondContact O-N 3.31Å; G164-E168 PolarHBondContact O-N 3Å
165V92.4Very high89.2Confident0 Ų045.8 Ų45.80%026%0.259CS..Hα-helixtrans-68-37.6-178.71770000111.9T99 F102 M103 L106 L107 G161 F162 E168 K169T99-V165 HydrophobicContact CG2-CG2 3.88Å; T99-V165 WeakPolarHBondContact O-CG2 3.25Å; F102-V165 HydrophobicContact CB-CB 4.06Å; F102-V165 HydrophobicContact CB-CG1 4.36Å; F102-V165 HydrophobicContact CB-CG2 3.85Å; M103-V165 HydrophobicContact CB-CG2 4.2Å; L106-V165 HydrophobicContact CB-CG1 3.88Å; L106-V165 HydrophobicContact CD1-CB 4.33Å; L106-V165 HydrophobicContact CD1-CG1 4.01Å; L107-V165 HydrophobicContact CD1-CG1 3.72Å; L107-V165 HydrophobicContact CG-CG1 3.9Å; G161-V165 WeakPolarHBondContact O-CG2 3.46Å; G161-V165 PolarHBondContact O-N 2.77Å; G161-V165 VanDerWaalsContact O-N 3.15Å; F162-V165 PolarHBondContact O-N 3.42Å; V165-E168 PolarHBondContact O-N 3.12Å; V165-K169 WeakPolarHBondContact O-CB 3.41Å; V165-K169 PolarHBondContact O-N 2.73Å
166Y92.7Very high88.6Confident50 Ų5042.3 Ų42.320%0.19624%0.242CC..Hα-helixtrans-64.3-42.2176.4-171-92.2000111.4Q61 I64 P65 F162 G164 K169 I170Q61-Y166 WeakPolarHBondContact O-CE1 3.3Å; I64-Y166 HydrophobicContact CB-CE1 4.18Å; I64-Y166 HydrophobicContact CD1-CE1 4.27Å; I64-Y166 HydrophobicContact CG2-CE1 4.42Å; P65-Y166 HydrophobicContact CG-CD1 4.12Å; F162-Y166 HydrophobicContact CE1-CD2 4.3Å; F162-Y166 HydrophobicContact CE1-CG 4.3Å; F162-Y166 HydrophobicContact CZ-CD2 4.02Å; F162-Y166 HydrophobicContact CZ-CG 4.46Å; F162-Y166 WeakPolarHBondContact O-CB 3.25Å; F162-Y166 PolarHBondContact O-N 3.05Å; G164-Y166 PolarHBondContact O-N 3.35Å; Y166-K169 WeakPolarHBondContact O-CB 3.41Å; Y166-K169 PolarHBondContact O-N 3.47Å; Y166-I170 HydrophobicContact CD1-CD1 3.72Å; Y166-I170 HydrophobicContact CD1-CG1 4.4Å; Y166-I170 HydrophobicContact CE1-CD1 3.5Å; Y166-I170 HydrophobicContact CE1-CG1 4.19Å; Y166-I170 WeakPolarHBondContact O-CG1 3.33Å; Y166-I170 PolarHBondContact O-N 2.9Å; Y166-I170 VanDerWaalsContact O-N 3.09Å
167L90.7Very high88.2Confident17 Ų1743.6 Ų43.69%0.08925%0.251CS..Hα-helixtrans-61.3-44.4173.6-172.673.3000111.4P65 Y69 A163 G164 K169 I170 F171 L185P65-L167 HydrophobicContact CB-CB 4.37Å; P65-L167 HydrophobicContact CB-CD1 4.46Å; P65-L167 HydrophobicContact CG-CD1 4.07Å; Y69-L167 HydrophobicContact CE2-CD2 4.24Å; A163-L167 WeakPolarHBondContact O-CB 3.31Å; A163-L167 PolarHBondContact O-N 2.91Å; G164-L167 PolarHBondContact O-N 3.31Å; L167-K169 VanDerWaalsContact C-N 3.3Å; L167-K169 PolarHBondContact O-N 3.13Å; L167-I170 PolarHBondContact O-N 3.41Å; L167-F171 HydrophobicContact CD1-CD1 4.28Å; L167-F171 HydrophobicContact CD1-CE1 3.37Å; L167-F171 HydrophobicContact CD1-CZ 3.54Å; L167-F171 HydrophobicContact CD2-CE1 4.36Å; L167-F171 HydrophobicContact CD2-CE2 4.11Å; L167-F171 HydrophobicContact CD2-CZ 3.71Å; L167-F171 HydrophobicContact CG-CD1 4.26Å; L167-F171 HydrophobicContact CG-CE1 3.6Å; L167-F171 HydrophobicContact CG-CE2 4.03Å; L167-F171 HydrophobicContact CG-CZ 3.44Å; L167-F171 VanDerWaalsContact CG-CZ 3.44Å; L167-F171 WeakPolarHBondContact O-CD1 3.35Å; L167-F171 WeakPolarHBondContact O-CG 3.44Å; L167-F171 PolarHBondContact O-N 3.45Å; L167-L185 HydrophobicContact CD1-CD1 4.14Å; L167-L185 HydrophobicContact CD1-CD2 4.18Å; L167-L185 HydrophobicContact CD1-CG 4.41Å; L167-L185 HydrophobicContact CD2-CD1 3.89Å
168E87.8Confident87.8Confident73 Ų7345 Ų4534%0.34126%0.258SS..Hα-helixtrans-60-40175.5-171.6-174.9152.100111.9L107 G164 V165 I170 F171 K172L107-E168 HydrophobicContact CD1-CB 4.43Å; L107-E168 HydrophobicContact CD1-CG 4.24Å; G164-E168 PolarHBondContact O-N 3Å; V165-E168 PolarHBondContact O-N 3.12Å; E168-I170 PolarHBondContact O-N 3.32Å; E168-F171 PolarHBondContact O-N 2.93Å; E168-F171 VanDerWaalsContact O-N 3.13Å; E168-K172 PolarHBondContact O-N 3.49Å; E168-K172 WeakPolarHBondContact OE1-CE 3.4Å; E168-K172 IonicContact OE1-NZ 2.64Å; E168-K172 PolarHBondContact OE1-NZ 3.31Å
169K88.8Confident87.5Confident105 Ų10543.3 Ų43.346%0.45725%0.245SC..Hα-helixtrans-60.4-43.2175.6-174.6171.4-178163.60112.5L106 L107 V165 Y166 L167 F171L106-K169 PolarHBondContact O-NZ 3.39Å; L107-K169 HydrophobicContact CD2-CB 3.6Å; L107-K169 HydrophobicContact CD2-CD 4.29Å; L107-K169 HydrophobicContact CD2-CG 3.79Å; L107-K169 HydrophobicContact CG-CB 4.42Å; V165-K169 WeakPolarHBondContact O-CB 3.41Å; V165-K169 PolarHBondContact O-N 2.73Å; Y166-K169 WeakPolarHBondContact O-CB 3.41Å; Y166-K169 PolarHBondContact O-N 3.47Å; L167-K169 VanDerWaalsContact C-N 3.3Å; L167-K169 PolarHBondContact O-N 3.13Å; K169-F171 VanDerWaalsContact C-N 3.3Å
170I86.3Confident87.3Confident12 Ų1242 Ų426%0.06224%0.237CC..Hα-helixtrans-63.1-41.7174.3-63.5163.8000109.9Q61 I62 P65 Y166 L167 E168 G173 T174Q61-I170 HydrophobicContact CB-CD1 3.74Å; Q61-I170 HydrophobicContact CB-CG1 4.16Å; I62-I170 HydrophobicContact CG1-CD1 4.27Å; I62-I170 HydrophobicContact CG1-CG2 4.46Å; P65-I170 HydrophobicContact CG-CD1 4.46Å; Y166-I170 HydrophobicContact CD1-CD1 3.72Å; Y166-I170 HydrophobicContact CD1-CG1 4.4Å; Y166-I170 HydrophobicContact CE1-CD1 3.5Å; Y166-I170 HydrophobicContact CE1-CG1 4.19Å; Y166-I170 WeakPolarHBondContact O-CG1 3.33Å; Y166-I170 PolarHBondContact O-N 2.9Å; Y166-I170 VanDerWaalsContact O-N 3.09Å; L167-I170 PolarHBondContact O-N 3.41Å; E168-I170 PolarHBondContact O-N 3.32Å; I170-G173 PolarHBondContact O-N 2.97Å; I170-T174 PolarHBondContact O-OG1 2.86Å
171F81.5Confident87.1Confident47 Ų4742 Ų4221%0.20624%0.236CC..Hα-helixtrans-69.3-39.6-175.2-72.812.8000112.5L167 E168 K169 G173 T174 R181L167-F171 HydrophobicContact CD1-CD1 4.28Å; L167-F171 HydrophobicContact CD1-CE1 3.37Å; L167-F171 HydrophobicContact CD1-CZ 3.54Å; L167-F171 HydrophobicContact CD2-CE1 4.36Å; L167-F171 HydrophobicContact CD2-CE2 4.11Å; L167-F171 HydrophobicContact CD2-CZ 3.71Å; L167-F171 HydrophobicContact CG-CD1 4.26Å; L167-F171 HydrophobicContact CG-CE1 3.6Å; L167-F171 HydrophobicContact CG-CE2 4.03Å; L167-F171 HydrophobicContact CG-CZ 3.44Å; L167-F171 VanDerWaalsContact CG-CZ 3.44Å; L167-F171 WeakPolarHBondContact O-CD1 3.35Å; L167-F171 WeakPolarHBondContact O-CG 3.44Å; L167-F171 PolarHBondContact O-N 3.45Å; E168-F171 PolarHBondContact O-N 2.93Å; E168-F171 VanDerWaalsContact O-N 3.13Å; K169-F171 VanDerWaalsContact C-N 3.3Å; F171-G173 PolarHBondContact O-N 3.43Å; F171-G173 VanDerWaalsContact O-N 3.09Å; F171-T174 PolarHBondContact O-N 3.46Å; F171-T174 PolarHBondContact O-OG1 3.21Å; F171-R181 HydrophobicContact CD1-CG 3.91Å; F171-R181 HydrophobicContact CE1-CB 3.55Å; F171-R181 HydrophobicContact CE1-CG 3.35Å; F171-R181 HydrophobicContact CE2-CB 3.99Å; F171-R181 HydrophobicContact CE2-CG 4.07Å; F171-R181 HydrophobicContact CZ-CB 3.22Å; F171-R181 HydrophobicContact CZ-CG 3.46Å; F171-R181 VanDerWaalsContact CZ-CG 3.46Å
172K80.3Confident86.9Confident133 Ų13343 Ų4358%0.57824%0.242SC*.Hα-helixtrans-58.6-24.2179.1-78.3-179.2179.4168.90113.8L107 E168L107-K172 HydrophobicContact CD2-CD 4.37Å; E168-K172 PolarHBondContact O-N 3.49Å; E168-K172 WeakPolarHBondContact OE1-CE 3.4Å; E168-K172 IonicContact OE1-NZ 2.64Å; E168-K172 PolarHBondContact OE1-NZ 3.31Å
173G71.8Confident86.9Confident68 Ų6840.5 Ų40.570%0.70123%0.231SC*.THydrogen-bonded Turntrans-86.1-3.1177.400000115.3I170 F171I170-G173 PolarHBondContact O-N 2.97Å; F171-G173 PolarHBondContact O-N 3.43Å; F171-G173 VanDerWaalsContact O-N 3.09Å
174T78.2Confident86.9Confident47 Ų4740.5 Ų40.529%0.28823%0.231SC..  trans-141.2146.1-165.862.50000113I170 F171 T176 R181I170-T174 PolarHBondContact O-OG1 2.86Å; F171-T174 PolarHBondContact O-N 3.46Å; F171-T174 PolarHBondContact O-OG1 3.21Å; T174-T176 VanDerWaalsContact C-N 3.27Å; T174-T176 PolarHBondContact O-N 2.94Å; T174-R181 VanDerWaalsContact CG2-NH2 3.28Å; T174-R181 PolarHBondContact OG1-NH2 3.29Å
175S76.2Confident87Confident132 Ų13240.3 Ų40.392%0.92323%0.225SC*.  trans-91.926.317758.60000113.2
176T83.3Confident87.1Confident30 Ų3040.3 Ų40.318%0.18423%0.225CC..  trans-77.4140.6-176.1-53.90000110.7Q51 T174 M180 R181Q51-T176 HydrophobicContact CG-CG2 4.09Å; Q51-T176 PolarHBondContact OE1-OG1 3.28Å; T174-T176 VanDerWaalsContact C-N 3.27Å; T174-T176 PolarHBondContact O-N 2.94Å; T176-M180 HydrophobicContact CG2-CB 3.71Å; T176-M180 HydrophobicContact CG2-CG 3.63Å; T176-R181 VanDerWaalsContact CB-NE 3.35Å; T176-R181 HydrophobicContact CG2-CG 3.99Å; T176-R181 PolarHBondContact OG1-NH2 3.04Å; T176-R181 VanDerWaalsContact OG1-NH2 3.14Å
177S87Confident87.2Confident28 Ų2841 Ų4120%0.19623%0.232CC..  trans-65.7145.9179.477.10000111.7W179 M180 R181S177-W179 PolarHBondContact O-N 3.45Å; S177-M180 WeakPolarHBondContact O-CB 3.45Å; S177-M180 PolarHBondContact O-N 3.45Å; S177-M180 WeakPolarHBondContact OG-CB 3.42Å; S177-M180 PolarHBondContact OG-N 2.91Å; S177-M180 VanDerWaalsContact OG-N 3.17Å; S177-R181 PolarHBondContact O-N 2.9Å
178I86.1Confident87.4Confident30 Ų3042.1 Ų42.115%0.15424%0.238CC..Hα-helixtrans-60-33.4179.3-69.4163.4000111.5R181 N182 A233 R237I178-R181 PolarHBondContact O-N 3.09Å; I178-N182 PolarHBondContact O-N 3.46Å; I178-N182 PolarHBondContact O-ND2 3.44Å; I178-A233 HydrophobicContact CG2-CB 3.54Å; I178-R237 HydrophobicContact CD1-CB 3.38Å; I178-R237 HydrophobicContact CD1-CG 3.62Å
179W89.8Confident87.8Confident28 Ų2838.7 Ų38.711%0.10622%0.221CC..Hα-helixtrans-66.3-42.6174.7-47125.5000111.7L33 I34 Q37 S177 R181 N182 L183 L230 F234L33-W179 HydrophobicContact CB-CD2 4.07Å; L33-W179 HydrophobicContact CB-CE3 4.37Å; L33-W179 HydrophobicContact CB-CG 4.15Å; L33-W179 HydrophobicContact CD1-CD2 3.96Å; L33-W179 HydrophobicContact CD1-CE3 3.51Å; L33-W179 HydrophobicContact CD1-CH2 3.78Å; L33-W179 HydrophobicContact CD1-CZ2 4.19Å; L33-W179 HydrophobicContact CD1-CZ3 3.43Å; L33-W179 VanDerWaalsContact CD1-CZ3 3.43Å; I34-W179 HydrophobicContact CD1-CB 4.36Å; I34-W179 HydrophobicContact CG1-CB 3.7Å; Q37-W179 VanDerWaalsContact OE1-NE1 3.17Å; S177-W179 PolarHBondContact O-N 3.45Å; W179-R181 VanDerWaalsContact C-N 3.3Å; W179-R181 PolarHBondContact O-N 3.02Å; W179-N182 PolarHBondContact O-N 3.39Å; W179-L183 WeakPolarHBondContact O-CB 3.27Å; W179-L183 PolarHBondContact O-N 3.11Å; W179-L230 HydrophobicContact CZ3-CD2 4.33Å; W179-F234 HydrophobicContact CH2-CB 4.38Å; W179-F234 AromaticContact CH2-CD2 3.97Å; W179-F234 HydrophobicContact CH2-CD2 3.97Å; W179-F234 HydrophobicContact CZ2-CD2 4.08Å
180M91Very high88.2Confident3 Ų334.6 Ų34.62%0.01521%0.205CC..Hα-helixtrans-62.2-39.9176-17566.473.300111.5I34 S47 I48 Q51 T176 S177 L183 Q184I34-M180 HydrophobicContact CD1-CB 4.33Å; I34-M180 HydrophobicContact CD1-CE 4.19Å; I34-M180 HydrophobicContact CD1-SD 4.1Å; I34-M180 HydrophobicContact CG2-CE 4.32Å; S47-M180 WeakPolarHBondContact OG-CE 3.46Å; I48-M180 HydrophobicContact CB-CE 4.41Å; I48-M180 HydrophobicContact CG1-CE 3.77Å; I48-M180 HydrophobicContact CG1-SD 4.11Å; Q51-M180 HydrophobicContact CB-CE 4.38Å; Q51-M180 HydrophobicContact CB-CG 3.92Å; Q51-M180 HydrophobicContact CB-SD 3.89Å; Q51-M180 HydrophobicContact CG-CG 3.48Å; Q51-M180 VanDerWaalsContact CG-CG 3.48Å; Q51-M180 HydrophobicContact CG-SD 4.02Å; T176-M180 HydrophobicContact CG2-CB 3.71Å; T176-M180 HydrophobicContact CG2-CG 3.63Å; S177-M180 WeakPolarHBondContact O-CB 3.45Å; S177-M180 PolarHBondContact O-N 3.45Å; S177-M180 WeakPolarHBondContact OG-CB 3.42Å; S177-M180 PolarHBondContact OG-N 2.91Å; S177-M180 VanDerWaalsContact OG-N 3.17Å; M180-L183 WeakPolarHBondContact O-CB 3.45Å; M180-L183 PolarHBondContact O-N 3.43Å; M180-L183 HydrophobicContact SD-CD2 4.4Å; M180-Q184 WeakPolarHBondContact O-CG 3.29Å; M180-Q184 PolarHBondContact O-N 2.72Å
181R89.1Confident88.7Confident1 Ų137.5 Ų37.50%0.00423%0.225CC..Hα-helixtrans-66.9-40.8174.8-61.9-57.5-165.4-168.4-1.6113D58 F171 T174 T176 S177 I178 W179 L183 Q184 L185D58-R181 IonicContact OD2-CZ 2.72Å; D58-R181 IonicContact OD2-NH1 2.86Å; D58-R181 PolarHBondContact OD2-NH1 2.9Å; D58-R181 IonicContact OD2-NH2 2.68Å; D58-R181 PolarHBondContact OD2-NH2 3.46Å; F171-R181 HydrophobicContact CD1-CG 3.91Å; F171-R181 HydrophobicContact CE1-CB 3.55Å; F171-R181 HydrophobicContact CE1-CG 3.35Å; F171-R181 HydrophobicContact CE2-CB 3.99Å; F171-R181 HydrophobicContact CE2-CG 4.07Å; F171-R181 HydrophobicContact CZ-CB 3.22Å; F171-R181 HydrophobicContact CZ-CG 3.46Å; F171-R181 VanDerWaalsContact CZ-CG 3.46Å; T174-R181 VanDerWaalsContact CG2-NH2 3.28Å; T174-R181 PolarHBondContact OG1-NH2 3.29Å; T176-R181 VanDerWaalsContact CB-NE 3.35Å; T176-R181 HydrophobicContact CG2-CG 3.99Å; T176-R181 PolarHBondContact OG1-NH2 3.04Å; T176-R181 VanDerWaalsContact OG1-NH2 3.14Å; S177-R181 PolarHBondContact O-N 2.9Å; I178-R181 PolarHBondContact O-N 3.09Å; W179-R181 VanDerWaalsContact C-N 3.3Å; W179-R181 PolarHBondContact O-N 3.02Å; R181-L183 VanDerWaalsContact C-N 3.28Å; R181-L183 PolarHBondContact O-N 3.38Å; R181-Q184 PolarHBondContact O-N 3.24Å; R181-L185 WeakPolarHBondContact O-CG 3.18Å; R181-L185 PolarHBondContact O-N 2.92Å
182N91.6Very high89.4Confident21 Ų2137 Ų3711%0.11222%0.224CC..Hα-helixtrans-64.1-35.2173-82.1-77.8000112S30 I178 W179 L185 G186 L230 A233S30-N182 VanDerWaalsContact OG-CB 3.27Å; S30-N182 WeakPolarHBondContact OG-CB 3.35Å; I178-N182 PolarHBondContact O-N 3.46Å; I178-N182 PolarHBondContact O-ND2 3.44Å; W179-N182 PolarHBondContact O-N 3.39Å; N182-L185 PolarHBondContact O-N 3.3Å; N182-G186 PolarHBondContact O-N 2.95Å; N182-L230 HydrophobicContact CB-CD2 4.22Å; N182-A233 WeakPolarHBondContact ND2-CB 3.44Å
183L94.2Very high90.1Very high4 Ų430.8 Ų30.82%0.02120%0.197CC..Hα-helixtrans-62.5-46.9171.7178.2153.7000110.9L27 T31 I34 I48 I52 W179 M180 R181 L185 G186 L187L27-L183 HydrophobicContact CD1-CG 4.04Å; L27-L183 WeakPolarHBondContact CD1-O 3.38Å; T31-L183 WeakPolarHBondContact OG1-CD1 3.26Å; I34-L183 HydrophobicContact CD1-CB 3.91Å; I34-L183 HydrophobicContact CD1-CD1 3.48Å; I34-L183 VanDerWaalsContact CD1-CD1 3.48Å; I34-L183 HydrophobicContact CD1-CG 4.3Å; I48-L183 HydrophobicContact CD1-CD1 4Å; I48-L183 HydrophobicContact CG1-CD1 4.22Å; I52-L183 HydrophobicContact CD1-CD2 4Å; I52-L183 HydrophobicContact CG1-CD2 4.43Å; W179-L183 WeakPolarHBondContact O-CB 3.27Å; W179-L183 PolarHBondContact O-N 3.11Å; M180-L183 WeakPolarHBondContact O-CB 3.45Å; M180-L183 PolarHBondContact O-N 3.43Å; M180-L183 HydrophobicContact SD-CD2 4.4Å; R181-L183 VanDerWaalsContact C-N 3.28Å; R181-L183 PolarHBondContact O-N 3.38Å; L183-L185 PolarHBondContact O-N 2.76Å; L183-G186 PolarHBondContact O-N 3.49Å; L183-L187 HydrophobicContact CD2-CD1 3.43Å; L183-L187 VanDerWaalsContact CD2-CD1 3.43Å; L183-L187 HydrophobicContact CD2-CG 3.97Å; L183-L187 HydrophobicContact CG-CD1 4.36Å; L183-L187 HydrophobicContact CG-CG 4.43Å; L183-L187 WeakPolarHBondContact O-CB 3.3Å; L183-L187 WeakPolarHBondContact O-CG 3.46Å; L183-L187 PolarHBondContact O-N 2.85Å
184Q94.1Very high91.2Very high0 Ų031.4 Ų31.40%018%0.184CC..Hα-helixtrans-60.5-44.8176.3-67.9178.5-59.200111.9Q51 M59 I62 M180 R181 G186 L187 L188Q51-Q184 PolarHBondContact O-NE2 3.44Å; M59-Q184 HydrophobicContact CE-CB 4.06Å; M59-Q184 HydrophobicContact CE-CG 3.64Å; M59-Q184 HydrophobicContact SD-CB 3.79Å; M59-Q184 HydrophobicContact SD-CG 3.72Å; I62-Q184 HydrophobicContact CD1-CB 3.97Å; I62-Q184 HydrophobicContact CD1-CG 4.38Å; I62-Q184 HydrophobicContact CG2-CB 4.19Å; M180-Q184 WeakPolarHBondContact O-CG 3.29Å; M180-Q184 PolarHBondContact O-N 2.72Å; R181-Q184 PolarHBondContact O-N 3.24Å; Q184-G186 VanDerWaalsContact C-N 3.34Å; Q184-G186 PolarHBondContact O-N 2.94Å; Q184-L187 PolarHBondContact O-N 3.1Å; Q184-L188 WeakPolarHBondContact O-CG 3.3Å; Q184-L188 PolarHBondContact O-N 2.82Å; Q184-L188 VanDerWaalsContact O-N 3.12Å
185L93.4Very high92Very high17 Ų1735.2 Ų35.29%0.08920%0.197CC..Hα-helixtrans-59.4-43.7175.7-77.8170000112I62 S66 Y69 L167 R181 N182 L183 G189I62-L185 HydrophobicContact CG2-CD2 3.66Å; I62-L185 HydrophobicContact CG2-CG 3.98Å; S66-L185 PolarHBondContact OG-O 2.75Å; S66-L185 VanDerWaalsContact OG-O 3.05Å; Y69-L185 HydrophobicContact CD2-CD2 4.31Å; L167-L185 HydrophobicContact CD1-CD1 4.14Å; L167-L185 HydrophobicContact CD1-CD2 4.18Å; L167-L185 HydrophobicContact CD1-CG 4.41Å; L167-L185 HydrophobicContact CD2-CD1 3.89Å; R181-L185 WeakPolarHBondContact O-CG 3.18Å; R181-L185 PolarHBondContact O-N 2.92Å; N182-L185 PolarHBondContact O-N 3.3Å; L183-L185 PolarHBondContact O-N 2.76Å; L185-G189 VanDerWaalsContact O-CA 3.3Å; L185-G189 WeakPolarHBondContact O-CA 3.48Å; L185-G189 PolarHBondContact O-N 3.3Å
186G94.4Very high92.8Very high0 Ų029.4 Ų29.40%016%0.158CC..Hα-helixtrans-70-38.7177.800000113N182 L183 Q184 L188 G189 V190N182-G186 PolarHBondContact O-N 2.95Å; L183-G186 PolarHBondContact O-N 3.49Å; Q184-G186 VanDerWaalsContact C-N 3.34Å; Q184-G186 PolarHBondContact O-N 2.94Å; G186-L188 VanDerWaalsContact C-N 3.31Å; G186-L188 PolarHBondContact O-N 3.15Å; G186-G189 PolarHBondContact O-N 3.44Å; G186-V190 WeakPolarHBondContact O-CB 3.27Å; G186-V190 WeakPolarHBondContact O-CG2 3.39Å; G186-V190 PolarHBondContact O-N 2.95Å
187L95.5Very high93.2Very high66 Ų6628.3 Ų28.335%0.34615%0.152SC..Hα-helixtrans-63.7-36.9178.4-81.5-177000112.2L27 I52 M59 L183 Q184 P191L27-L187 HydrophobicContact CD1-CB 4.41Å; L27-L187 HydrophobicContact CD1-CD2 3.73Å; L27-L187 HydrophobicContact CD1-CG 3.64Å; L27-L187 HydrophobicContact CD2-CD2 4.01Å; L27-L187 HydrophobicContact CG-CD2 4.49Å; I52-L187 HydrophobicContact CD1-CD1 3.32Å; I52-L187 HydrophobicContact CG1-CD1 4.11Å; M59-L187 HydrophobicContact CE-CD1 4.37Å; L183-L187 HydrophobicContact CD2-CD1 3.43Å; L183-L187 VanDerWaalsContact CD2-CD1 3.43Å; L183-L187 HydrophobicContact CD2-CG 3.97Å; L183-L187 HydrophobicContact CG-CD1 4.36Å; L183-L187 HydrophobicContact CG-CG 4.43Å; L183-L187 WeakPolarHBondContact O-CB 3.3Å; L183-L187 WeakPolarHBondContact O-CG 3.46Å; L183-L187 PolarHBondContact O-N 2.85Å; Q184-L187 PolarHBondContact O-N 3.1Å; L187-P191 WeakPolarHBondContact O-CD 3.09Å; L187-P191 WeakPolarHBondContact O-CG 3.23Å
188L95.5Very high93.5Very high40 Ų4034 Ų3421%0.20917%0.173CC..Hα-helixtrans-83-37.2174.2-62.9175.8000111.2M59 I62 L63 Q184 G186 P191 I192M59-L188 WeakPolarHBondContact O-CD1 3.23Å; M59-L188 HydrophobicContact SD-CD1 4.07Å; M59-L188 HydrophobicContact SD-CG 4.43Å; I62-L188 HydrophobicContact CB-CD1 4.33Å; I62-L188 HydrophobicContact CG2-CD1 4.1Å; L63-L188 HydrophobicContact CB-CD1 4.13Å; L63-L188 HydrophobicContact CD1-CB 4.38Å; L63-L188 HydrophobicContact CD1-CD1 4.29Å; L63-L188 HydrophobicContact CD1-CD2 4.2Å; Q184-L188 WeakPolarHBondContact O-CG 3.3Å; Q184-L188 PolarHBondContact O-N 2.82Å; Q184-L188 VanDerWaalsContact O-N 3.12Å; G186-L188 VanDerWaalsContact C-N 3.31Å; G186-L188 PolarHBondContact O-N 3.15Å; L188-P191 WeakPolarHBondContact O-CD 3.06Å; L188-I192 HydrophobicContact CB-CD1 4.39Å; L188-I192 WeakPolarHBondContact O-CB 3.29Å; L188-I192 VanDerWaalsContact O-CD1 3.25Å; L188-I192 WeakPolarHBondContact O-CD1 3.37Å; L188-I192 WeakPolarHBondContact O-CG1 3.23Å; L188-I192 PolarHBondContact O-N 3.19Å
189G95.6Very high93.7Very high0 Ų037.7 Ų37.70%019%0.192CC..Hα-helixtrans-69.6-36.7-174.400000113.5S66 I70 L185 G186 G193S66-G189 VanDerWaalsContact OG-CA 3.25Å; S66-G189 WeakPolarHBondContact OG-CA 3.35Å; S66-G189 PolarHBondContact OG-N 2.83Å; S66-G189 VanDerWaalsContact OG-N 3.08Å; I70-G189 WeakPolarHBondContact CD1-O 3.38Å; L185-G189 VanDerWaalsContact O-CA 3.3Å; L185-G189 WeakPolarHBondContact O-CA 3.48Å; L185-G189 PolarHBondContact O-N 3.3Å; G186-G189 PolarHBondContact O-N 3.44Å; G189-G193 WeakPolarHBondContact O-CA 3.38Å; G189-G193 PolarHBondContact O-N 3.31Å
190V96.9Very high93.5Very high19 Ų1941.5 Ų41.512%0.11521%0.214CC..Hα-helixtrans-64.3-52.7178.8168.80000111.7E23 F24 L27 G186 I192 G193 L194E23-V190 HydrophobicContact CB-CG2 3.93Å; F24-V190 HydrophobicContact CB-CG2 3.94Å; F24-V190 HydrophobicContact CD2-CG2 4.4Å; L27-V190 HydrophobicContact CD2-CG2 4.4Å; G186-V190 WeakPolarHBondContact O-CB 3.27Å; G186-V190 WeakPolarHBondContact O-CG2 3.39Å; G186-V190 PolarHBondContact O-N 2.95Å; V190-I192 PolarHBondContact O-N 2.81Å; V190-G193 PolarHBondContact O-N 2.81Å; V190-L194 HydrophobicContact CG1-CD1 4.07Å; V190-L194 WeakPolarHBondContact O-CB 3.27Å; V190-L194 WeakPolarHBondContact O-CG 3.39Å; V190-L194 PolarHBondContact O-N 3.37Å
191P96.5Very high93.4Very high74 Ų7442 Ų4248%0.48122%0.217SC..Hα-helixtrans-59.2-43.8174.2-25.534.2000113.5L187 L188 G193 L194 F195L187-P191 WeakPolarHBondContact O-CD 3.09Å; L187-P191 WeakPolarHBondContact O-CG 3.23Å; L188-P191 WeakPolarHBondContact O-CD 3.06Å; P191-G193 VanDerWaalsContact C-N 3.33Å; P191-G193 PolarHBondContact O-N 2.93Å; P191-L194 PolarHBondContact O-N 3.45Å; P191-F195 WeakPolarHBondContact O-CB 3.44Å; P191-F195 PolarHBondContact O-N 3.31Å
192I95.9Very high93.3Very high37 Ų3743.7 Ų43.719%0.1923%0.231CC..Hα-helixtrans-64.1-41.3178.5-67165.1000110.8L63 T67 I70 L188 V190 F195 G196L63-I192 HydrophobicContact CD1-CD1 3.57Å; T67-I192 HydrophobicContact CG2-CG2 4.24Å; T67-I192 VanDerWaalsContact OG1-CD1 3.27Å; T67-I192 WeakPolarHBondContact OG1-CD1 3.42Å; I70-I192 HydrophobicContact CB-CG2 4.23Å; I70-I192 HydrophobicContact CG1-CB 4.42Å; I70-I192 HydrophobicContact CG1-CG2 4.12Å; I70-I192 HydrophobicContact CG2-CG2 4.29Å; L188-I192 HydrophobicContact CB-CD1 4.39Å; L188-I192 WeakPolarHBondContact O-CB 3.29Å; L188-I192 VanDerWaalsContact O-CD1 3.25Å; L188-I192 WeakPolarHBondContact O-CD1 3.37Å; L188-I192 WeakPolarHBondContact O-CG1 3.23Å; L188-I192 PolarHBondContact O-N 3.19Å; V190-I192 PolarHBondContact O-N 2.81Å; I192-F195 WeakPolarHBondContact O-CB 3.25Å; I192-F195 PolarHBondContact O-N 3.14Å; I192-G196 PolarHBondContact O-N 3.3Å
193G95.3Very high93.1Very high1 Ų146.7 Ų46.71%0.0125%0.254CS..Hα-helixtrans-64.2-43.9175.500000112V20 G189 V190 P191 F195 G196 V197V20-G193 WeakPolarHBondContact CG2-O 3.33Å; G189-G193 WeakPolarHBondContact O-CA 3.38Å; G189-G193 PolarHBondContact O-N 3.31Å; V190-G193 PolarHBondContact O-N 2.81Å; P191-G193 VanDerWaalsContact C-N 3.33Å; P191-G193 PolarHBondContact O-N 2.93Å; G193-F195 VanDerWaalsContact C-N 3.29Å; G193-F195 PolarHBondContact O-N 3.31Å; G193-G196 CarbonylContact O-C 3.6Å; G193-G196 WeakPolarHBondContact O-CA 3.17Å; G193-G196 PolarHBondContact O-N 2.79Å; G193-V197 WeakPolarHBondContact O-CG2 3.46Å; G193-V197 PolarHBondContact O-N 2.95Å
194L95.7Very high92.6Very high81 Ų8151.8 Ų51.842%0.42428%0.276SS..Hα-helixtrans-61.1-39.2174.6-75.7171.2000111.7V20 V190 P191 G196 V197 F198 F210V20-L194 HydrophobicContact CG1-CD2 3.78Å; V20-L194 HydrophobicContact CG1-CG 3.92Å; V20-L194 HydrophobicContact CG2-CD2 4.48Å; V20-L194 HydrophobicContact CG2-CG 4.45Å; V190-L194 HydrophobicContact CG1-CD1 4.07Å; V190-L194 WeakPolarHBondContact O-CB 3.27Å; V190-L194 WeakPolarHBondContact O-CG 3.39Å; V190-L194 PolarHBondContact O-N 3.37Å; P191-L194 PolarHBondContact O-N 3.45Å; L194-G196 VanDerWaalsContact C-N 3.32Å; L194-V197 WeakPolarHBondContact O-CB 3.4Å; L194-V197 PolarHBondContact O-N 2.86Å; L194-F198 PolarHBondContact O-N 3.36Å; L194-F210 HydrophobicContact CD2-CE2 4.04Å; L194-F210 HydrophobicContact CD2-CZ 4.41Å
195F95.1Very high92.4Very high127 Ų12753.4 Ų53.456%0.55729%0.286SS*.Hα-helixtrans-63.3-39.7171.7-175.4-108.7000111.7P191 I192 G193 V197 F198 I199P191-F195 WeakPolarHBondContact O-CB 3.44Å; P191-F195 PolarHBondContact O-N 3.31Å; I192-F195 WeakPolarHBondContact O-CB 3.25Å; I192-F195 PolarHBondContact O-N 3.14Å; G193-F195 VanDerWaalsContact C-N 3.29Å; G193-F195 PolarHBondContact O-N 3.31Å; F195-V197 PolarHBondContact O-N 3.17Å; F195-F198 WeakPolarHBondContact O-CB 3.15Å; F195-F198 PolarHBondContact O-N 2.92Å; F195-I199 HydrophobicContact CD1-CD1 3.8Å; F195-I199 HydrophobicContact CE1-CD1 3.27Å; F195-I199 HydrophobicContact CE1-CG1 4.29Å; F195-I199 HydrophobicContact CE2-CD1 4.34Å; F195-I199 HydrophobicContact CZ-CD1 3.59Å; F195-I199 HydrophobicContact CZ-CG1 4.29Å; F195-I199 PolarHBondContact O-N 3.03Å
196G92.3Very high92.1Very high11 Ų1161.7 Ų61.711%0.11332%0.321CS..Hα-helixtrans-60.7-40.6171.500000113.4I192 G193 L194 F198 I199 N200I192-G196 PolarHBondContact O-N 3.3Å; G193-G196 CarbonylContact O-C 3.6Å; G193-G196 WeakPolarHBondContact O-CA 3.17Å; G193-G196 PolarHBondContact O-N 2.79Å; L194-G196 VanDerWaalsContact C-N 3.32Å; G196-F198 VanDerWaalsContact C-N 3.34Å; G196-I199 PolarHBondContact O-N 3.37Å; G196-N200 PolarHBondContact O-N 2.86Å; G196-N200 PolarHBondContact O-ND2 3.48Å
197V93Very high91.9Very high7 Ų766.9 Ų66.94%0.04235%0.353CS..Hα-helixtrans-62.2-43.9172.7175.40000110.2S16 T17 V20 G193 L194 F195 I199 N200 D201 A202 V205 F210S16-V197 WeakPolarHBondContact OG-CG2 3.31Å; T17-V197 HydrophobicContact CG2-CG1 3.92Å; T17-V197 HydrophobicContact CG2-CG2 4.08Å; V20-V197 HydrophobicContact CG2-CG2 3.78Å; G193-V197 WeakPolarHBondContact O-CG2 3.46Å; G193-V197 PolarHBondContact O-N 2.95Å; L194-V197 WeakPolarHBondContact O-CB 3.4Å; L194-V197 PolarHBondContact O-N 2.86Å; F195-V197 PolarHBondContact O-N 3.17Å; V197-I199 VanDerWaalsContact C-N 3.32Å; V197-I199 PolarHBondContact O-N 3.46Å; V197-N200 PolarHBondContact O-N 3.32Å; V197-D201 CarbonylContact O-C 3.51Å; V197-D201 WeakPolarHBondContact O-CA 3.34Å; V197-D201 PolarHBondContact O-N 2.76Å; V197-A202 PolarHBondContact O-N 3.06Å; V197-A202 VanDerWaalsContact O-N 3.09Å; V197-V205 HydrophobicContact CG1-CG2 3.74Å; V197-F210 HydrophobicContact CG1-CE2 4.21Å; V197-F210 HydrophobicContact CG2-CE2 4.39Å
198F92.4Very high91.4Very high147 Ų14767.8 Ų67.865%0.64536%0.357SS*.Hα-helixtrans-62.6-36.7178.4-177.3-96.9000112.7L194 F195 G196 A202L194-F198 PolarHBondContact O-N 3.36Å; F195-F198 WeakPolarHBondContact O-CB 3.15Å; F195-F198 PolarHBondContact O-N 2.92Å; G196-F198 VanDerWaalsContact C-N 3.34Å; F198-A202 HydrophobicContact CD2-CB 4.32Å; F198-A202 WeakPolarHBondContact O-CB 3.4Å
199I90.7Very high91.1Very high107 Ų10767.4 Ų67.455%0.54936%0.364SS..Hα-helixtrans-74.9-46.3177.9-69.4174.3000111.8F195 G196 V197F195-I199 HydrophobicContact CD1-CD1 3.8Å; F195-I199 HydrophobicContact CE1-CD1 3.27Å; F195-I199 HydrophobicContact CE1-CG1 4.29Å; F195-I199 HydrophobicContact CE2-CD1 4.34Å; F195-I199 HydrophobicContact CZ-CD1 3.59Å; F195-I199 HydrophobicContact CZ-CG1 4.29Å; F195-I199 PolarHBondContact O-N 3.03Å; G196-I199 PolarHBondContact O-N 3.37Å; V197-I199 VanDerWaalsContact C-N 3.32Å; V197-I199 PolarHBondContact O-N 3.46Å
200N86Confident90.8Very high108 Ų10869.7 Ų69.758%0.57837%0.374SS*.Hα-helixtrans-94.2-32.6-166.8-64.8-73.2000113.9G196 V197G196-N200 PolarHBondContact O-N 2.86Å; G196-N200 PolarHBondContact O-ND2 3.48Å; V197-N200 PolarHBondContact O-N 3.32Å
201D87.4Confident90.4Very high15 Ų1574.2 Ų74.28%0.0839%0.392CS..SBendtrans-132.115.5-170-68.6-61.5000113S14 S16 V197 S203 K204 V205S14-D201 VanDerWaalsContact OG-CG 3.23Å; S14-D201 PolarHBondContact OG-OD2 2.96Å; S16-D201 PolarHBondContact OG-OD2 2.93Å; V197-D201 CarbonylContact O-C 3.51Å; V197-D201 WeakPolarHBondContact O-CA 3.34Å; V197-D201 PolarHBondContact O-N 2.76Å; D201-S203 VanDerWaalsContact C-N 3.28Å; D201-S203 PolarHBondContact O-N 3.04Å; D201-K204 PolarHBondContact O-N 3.28Å; D201-K204 VanDerWaalsContact O-N 3.15Å; D201-K204 IonicContact OD1-NZ 2.93Å; D201-K204 PolarHBondContact OD1-NZ 3.34Å; D201-V205 HydrophobicContact CB-CG2 4.35Å; D201-V205 WeakPolarHBondContact O-CB 3.46Å; D201-V205 WeakPolarHBondContact O-CG2 3.41Å; D201-V205 PolarHBondContact O-N 3.2Å
202A88Confident89.9Confident36 Ų3675 Ų7530%0.29839%0.386SS..Hα-helixtrans-55.1-41.1-179.800000113.3V197 F198 K206V197-A202 PolarHBondContact O-N 3.06Å; V197-A202 VanDerWaalsContact O-N 3.09Å; F198-A202 HydrophobicContact CD2-CB 4.32Å; F198-A202 WeakPolarHBondContact O-CB 3.4Å; A202-K206 WeakPolarHBondContact O-CB 3.47Å; A202-K206 PolarHBondContact O-N 3.45Å
203S87.4Confident89.4Confident84 Ų8473.4 Ų73.459%0.58738%0.379SS*.Hα-helixtrans-61.3-51.4177.753.90000110.8D201 K206 T207D201-S203 VanDerWaalsContact C-N 3.28Å; D201-S203 PolarHBondContact O-N 3.04Å; S203-K206 PolarHBondContact O-N 3.5Å; S203-T207 WeakPolarHBondContact O-CG2 3.41Å; S203-T207 PolarHBondContact O-N 3.09Å; S203-T207 PolarHBondContact O-OG1 3.41Å
204K84.3Confident89.1Confident110 Ų11074.9 Ų74.948%0.47838%0.384SS..Hα-helixtrans-61.2-46.3178.6-62.6-177.7-164.1149.40112D201 K206 T207 L208D201-K204 PolarHBondContact O-N 3.28Å; D201-K204 VanDerWaalsContact O-N 3.15Å; D201-K204 IonicContact OD1-NZ 2.93Å; D201-K204 PolarHBondContact OD1-NZ 3.34Å; K204-K206 VanDerWaalsContact C-N 3.32Å; K204-K206 PolarHBondContact O-N 3.27Å; K204-T207 PolarHBondContact O-N 3.49Å; K204-T207 PolarHBondContact O-OG1 3.1Å; K204-L208 VanDerWaalsContact O-CB 3.29Å; K204-L208 WeakPolarHBondContact O-CB 3.01Å; K204-L208 PolarHBondContact O-N 3.41Å
205V88.4Confident88.9Confident34 Ų3474 Ų7421%0.20638%0.382CS..Hα-helixtrans-65.1-37.3179.9169.70000111.3T17 V197 D201 G209 F210T17-V205 HydrophobicContact CG2-CG2 4.05Å; V197-V205 HydrophobicContact CG1-CG2 3.74Å; D201-V205 HydrophobicContact CB-CG2 4.35Å; D201-V205 WeakPolarHBondContact O-CB 3.46Å; D201-V205 WeakPolarHBondContact O-CG2 3.41Å; D201-V205 PolarHBondContact O-N 3.2Å; V205-G209 CarbonylContact O-C 3.36Å; V205-G209 WeakPolarHBondContact O-CA 3.34Å; V205-G209 PolarHBondContact O-N 2.88Å; V205-F210 HydrophobicContact CG1-CB 4.11Å; V205-F210 HydrophobicContact CG1-CD2 4.11Å
206K88Confident88.7Confident192 Ų19272.9 Ų72.984%0.83539%0.388SS*.Hα-helixtrans-71-38.1177.4-173.3178.7179.4-177.30112.4A202 S203 K204A202-K206 WeakPolarHBondContact O-CB 3.47Å; A202-K206 PolarHBondContact O-N 3.45Å; S203-K206 PolarHBondContact O-N 3.5Å; K204-K206 VanDerWaalsContact C-N 3.32Å; K204-K206 PolarHBondContact O-N 3.27Å
207T89.1Confident88.5Confident108 Ų10878 Ų7866%0.66341%0.411SS*.Hα-helixtrans-85.5-35.4-176.9550000113.5S203 K204S203-T207 WeakPolarHBondContact O-CG2 3.41Å; S203-T207 PolarHBondContact O-N 3.09Å; S203-T207 PolarHBondContact O-OG1 3.41Å; K204-T207 PolarHBondContact O-N 3.49Å; K204-T207 PolarHBondContact O-OG1 3.1Å
208L87.1Confident88.4Confident85 Ų8578 Ų7845%0.44541%0.411SS..Hα-helixtrans-112.5-15.9-171.5-57.9168.6000113.1K204 Y212K204-L208 VanDerWaalsContact O-CB 3.29Å; K204-L208 WeakPolarHBondContact O-CB 3.01Å; K204-L208 PolarHBondContact O-N 3.41Å; L208-Y212 HydrophobicContact CB-CD1 3.89Å; L208-Y212 HydrophobicContact CB-CD2 3.77Å; L208-Y212 HydrophobicContact CB-CE1 4.44Å; L208-Y212 HydrophobicContact CB-CE2 4.35Å; L208-Y212 HydrophobicContact CB-CG 3.51Å; L208-Y212 HydrophobicContact CD1-CD1 3.69Å; L208-Y212 HydrophobicContact CD1-CE1 3.7Å; L208-Y212 HydrophobicContact CD1-CG 4.22Å; L208-Y212 HydrophobicContact CD2-CD2 4.42Å; L208-Y212 HydrophobicContact CD2-CE1 4.46Å; L208-Y212 HydrophobicContact CD2-CE2 4.18Å; L208-Y212 HydrophobicContact CG-CD1 4.29Å; L208-Y212 HydrophobicContact CG-CE1 4.41Å; L208-Y212 HydrophobicContact CG-CG 4.33Å
209G88.3Confident88.5Confident33 Ų3376.1 Ų76.134%0.3440%0.4SS..  trans96.1159.6-174.900000113.2V205 F211 Y212V205-G209 CarbonylContact O-C 3.36Å; V205-G209 WeakPolarHBondContact O-CA 3.34Å; V205-G209 PolarHBondContact O-N 2.88Å; G209-F211 VanDerWaalsContact C-N 3.34Å; G209-F211 PolarHBondContact O-N 3.35Å; G209-Y212 PolarHBondContact O-N 3.22Å
210F88.9Confident88.7Confident48 Ų4875.6 Ų75.621%0.21140%0.397CS..THydrogen-bonded Turntrans-65.8-34.5-177-173.3-88.7000113.4T17 V20 L194 V197 V205T17-F210 HydrophobicContact CG2-CD1 4.43Å; T17-F210 HydrophobicContact CG2-CD2 3.88Å; T17-F210 HydrophobicContact CG2-CE1 4.26Å; T17-F210 HydrophobicContact CG2-CE2 3.69Å; T17-F210 HydrophobicContact CG2-CG 4.26Å; T17-F210 HydrophobicContact CG2-CZ 3.89Å; V20-F210 HydrophobicContact CB-CZ 4.3Å; V20-F210 HydrophobicContact CG1-CZ 4.13Å; L194-F210 HydrophobicContact CD2-CE2 4.04Å; L194-F210 HydrophobicContact CD2-CZ 4.41Å; V197-F210 HydrophobicContact CG1-CE2 4.21Å; V197-F210 HydrophobicContact CG2-CE2 4.39Å; V205-F210 HydrophobicContact CG1-CB 4.11Å; V205-F210 HydrophobicContact CG1-CD2 4.11Å
211F89.9Confident89Confident113 Ų11373 Ų7350%0.49639%0.385SS..THydrogen-bonded Turntrans-101.220.7-177.6-59.2-74.7000113.1G209 G213 Y214 W219G209-F211 VanDerWaalsContact C-N 3.34Å; G209-F211 PolarHBondContact O-N 3.35Å; F211-G213 PolarHBondContact O-N 3.5Å; F211-Y214 HydrophobicContact CB-CD2 4.25Å; F211-Y214 HydrophobicContact CB-CG 4.27Å; F211-Y214 HydrophobicContact CD1-CD1 4.09Å; F211-Y214 AromaticContact CD1-CE1 3.99Å; F211-Y214 HydrophobicContact CD1-CE1 3.99Å; F211-Y214 HydrophobicContact CD1-CE2 4.43Å; F211-Y214 HydrophobicContact CD1-CG 4.32Å; F211-Y214 WeakPolarHBondContact O-CB 3.42Å; F211-Y214 WeakPolarHBondContact O-CD2 3.32Å; F211-Y214 PolarHBondContact O-N 3.41Å; F211-W219 HydrophobicContact CD1-CH2 4.36Å; F211-W219 HydrophobicContact CD1-CZ2 4.1Å; F211-W219 AromaticContact CE1-CH2 3.98Å; F211-W219 HydrophobicContact CE1-CH2 3.98Å; F211-W219 HydrophobicContact CE1-CZ2 4.15Å
212Y85.4Confident89.3Confident90 Ų9072.2 Ų72.235%0.35338%0.381SS..THydrogen-bonded Turntrans-63134.4177.1-175.3-102.9000111.5E11 L208 G209 Y214E11-Y212 HydrophobicContact CB-CE1 3.96Å; E11-Y212 HydrophobicContact CG-CE1 4.29Å; L208-Y212 HydrophobicContact CB-CD1 3.89Å; L208-Y212 HydrophobicContact CB-CD2 3.77Å; L208-Y212 HydrophobicContact CB-CE1 4.44Å; L208-Y212 HydrophobicContact CB-CE2 4.35Å; L208-Y212 HydrophobicContact CB-CG 3.51Å; L208-Y212 HydrophobicContact CD1-CD1 3.69Å; L208-Y212 HydrophobicContact CD1-CE1 3.7Å; L208-Y212 HydrophobicContact CD1-CG 4.22Å; L208-Y212 HydrophobicContact CD2-CD2 4.42Å; L208-Y212 HydrophobicContact CD2-CE1 4.46Å; L208-Y212 HydrophobicContact CD2-CE2 4.18Å; L208-Y212 HydrophobicContact CG-CD1 4.29Å; L208-Y212 HydrophobicContact CG-CE1 4.41Å; L208-Y212 HydrophobicContact CG-CG 4.33Å; G209-Y212 PolarHBondContact O-N 3.22Å; Y212-Y214 VanDerWaalsContact C-N 3.27Å; Y212-Y214 PolarHBondContact O-N 3.27Å
213G86Confident89.6Confident4 Ų474 Ų744%0.04139%0.385CS..THydrogen-bonded Turntrans75.75.5-17600000115.5E11 F211 T215E11-G213 VanDerWaalsContact CB-CA 3.49Å; E11-G213 WeakPolarHBondContact OE2-CA 3.17Å; F211-G213 PolarHBondContact O-N 3.5Å; G213-T215 PolarHBondContact O-N 3.01Å
214Y88.2Confident89.9Confident32 Ų3275.4 Ų75.413%0.12539%0.385CS..  trans-74.297.7176.9-85.3-121.1000110.9T17 V18 C21 F211 Y212 V218 W219 V222T17-Y214 WeakPolarHBondContact CB-OH 3.43Å; T17-Y214 PolarHBondContact O-OH 3.01Å; T17-Y214 PolarHBondContact OG1-OH 3.11Å; T17-Y214 VanDerWaalsContact OG1-OH 3.11Å; V18-Y214 WeakPolarHBondContact CA-OH 3.45Å; V18-Y214 HydrophobicContact CG2-CE2 4.39Å; V18-Y214 PolarHBondContact N-OH 3.35Å; V18-Y214 VanDerWaalsContact N-OH 3.1Å; C21-Y214 PolarHBondContact SG-OH 2.93Å; C21-Y214 VanDerWaalsContact SG-OH 3.41Å; F211-Y214 HydrophobicContact CB-CD2 4.25Å; F211-Y214 HydrophobicContact CB-CG 4.27Å; F211-Y214 HydrophobicContact CD1-CD1 4.09Å; F211-Y214 AromaticContact CD1-CE1 3.99Å; F211-Y214 HydrophobicContact CD1-CE1 3.99Å; F211-Y214 HydrophobicContact CD1-CE2 4.43Å; F211-Y214 HydrophobicContact CD1-CG 4.32Å; F211-Y214 WeakPolarHBondContact O-CB 3.42Å; F211-Y214 WeakPolarHBondContact O-CD2 3.32Å; F211-Y214 PolarHBondContact O-N 3.41Å; Y212-Y214 VanDerWaalsContact C-N 3.27Å; Y212-Y214 PolarHBondContact O-N 3.27Å; Y214-V218 HydrophobicContact CD1-CB 4.45Å; Y214-V218 HydrophobicContact CD1-CG1 3.77Å; Y214-V218 HydrophobicContact CD2-CG1 4.31Å; Y214-V218 HydrophobicContact CE1-CG1 3.9Å; Y214-V218 HydrophobicContact CE2-CG1 4.41Å; Y214-V218 HydrophobicContact CG-CG1 4.01Å; Y214-W219 HydrophobicContact CD1-CD2 4.21Å; Y214-W219 AromaticContact CD1-CE2 3.74Å; Y214-W219 HydrophobicContact CD1-CH2 4.5Å; Y214-W219 AromaticContact CD1-CZ2 3.9Å; Y214-W219 HydrophobicContact CD1-CZ2 3.9Å; Y214-W219 AromaticContact CD1-NE1 3.87Å; Y214-W219 HydrophobicContact CE1-CH2 4.47Å; Y214-W219 HydrophobicContact CE1-CZ2 4.3Å; Y214-V222 HydrophobicContact CE1-CG2 4.39Å
215T90.4Very high90.2Very high63 Ų6372.3 Ų72.339%0.38737%0.372SS..  trans-85.3165.5167.463.80000110.7G213 I217 V218 W219G213-T215 PolarHBondContact O-N 3.01Å; T215-I217 PolarHBondContact O-N 3.42Å; T215-I217 VanDerWaalsContact O-N 3.09Å; T215-V218 WeakPolarHBondContact O-CB 3.4Å; T215-V218 PolarHBondContact O-N 2.9Å; T215-W219 PolarHBondContact O-N 3.5Å
216P90.9Very high90.4Very high103 Ų10370.7 Ų70.767%0.66936%0.363SS*.Hα-helixtrans-53.4-30171.8-28.136.2000113.5W219 I220P216-W219 PolarHBondContact O-N 3.25Å; P216-I220 WeakPolarHBondContact O-CG1 2.88Å; P216-I220 PolarHBondContact O-N 2.94Å
217I90.2Very high90.6Very high119 Ų11966.8 Ų66.861%0.6135%0.346SS*.Hα-helixtrans-66.6-40175.8-61.9169.9000111T215 W219 I220 V221T215-I217 PolarHBondContact O-N 3.42Å; T215-I217 VanDerWaalsContact O-N 3.09Å; I217-W219 VanDerWaalsContact C-N 3.33Å; I217-W219 PolarHBondContact O-N 2.81Å; I217-I220 WeakPolarHBondContact O-CB 3.4Å; I217-I220 PolarHBondContact O-N 3.41Å; I217-V221 WeakPolarHBondContact O-CG2 3.1Å; I217-V221 PolarHBondContact O-N 3.49Å
218V90.8Very high90.5Very high7 Ų763.1 Ų63.14%0.04233%0.33CS..Hα-helixtrans-63.7-41.2176.5178.40000110.3Y13 V18 Y214 T215 I220 V221 V222Y13-V218 HydrophobicContact CD1-CG2 3.63Å; Y13-V218 HydrophobicContact CD2-CG1 4.41Å; Y13-V218 HydrophobicContact CE1-CG2 4.05Å; Y13-V218 HydrophobicContact CG-CG1 4.32Å; Y13-V218 HydrophobicContact CG-CG2 4Å; V18-V218 HydrophobicContact CG2-CG1 3.67Å; Y214-V218 HydrophobicContact CD1-CB 4.45Å; Y214-V218 HydrophobicContact CD1-CG1 3.77Å; Y214-V218 HydrophobicContact CD2-CG1 4.31Å; Y214-V218 HydrophobicContact CE1-CG1 3.9Å; Y214-V218 HydrophobicContact CE2-CG1 4.41Å; Y214-V218 HydrophobicContact CG-CG1 4.01Å; T215-V218 WeakPolarHBondContact O-CB 3.4Å; T215-V218 PolarHBondContact O-N 2.9Å; V218-I220 VanDerWaalsContact C-N 3.34Å; V218-I220 PolarHBondContact O-N 3.26Å; V218-V221 WeakPolarHBondContact O-CB 3.45Å; V218-V221 PolarHBondContact O-N 2.96Å; V218-V221 VanDerWaalsContact O-N 3.11Å; V218-V222 WeakPolarHBondContact O-CG2 3.31Å; V218-V222 PolarHBondContact O-N 3.37Å
219W94.1Very high90.4Very high108 Ų10860.3 Ų60.341%0.40932%0.321SS..Hα-helixtrans-62.4-39.2173.6-77.4112.3000113F211 Y214 T215 P216 I217 V221 V222 I223F211-W219 HydrophobicContact CD1-CH2 4.36Å; F211-W219 HydrophobicContact CD1-CZ2 4.1Å; F211-W219 AromaticContact CE1-CH2 3.98Å; F211-W219 HydrophobicContact CE1-CH2 3.98Å; F211-W219 HydrophobicContact CE1-CZ2 4.15Å; Y214-W219 HydrophobicContact CD1-CD2 4.21Å; Y214-W219 AromaticContact CD1-CE2 3.74Å; Y214-W219 HydrophobicContact CD1-CH2 4.5Å; Y214-W219 AromaticContact CD1-CZ2 3.9Å; Y214-W219 HydrophobicContact CD1-CZ2 3.9Å; Y214-W219 AromaticContact CD1-NE1 3.87Å; Y214-W219 HydrophobicContact CE1-CH2 4.47Å; Y214-W219 HydrophobicContact CE1-CZ2 4.3Å; T215-W219 PolarHBondContact O-N 3.5Å; P216-W219 PolarHBondContact O-N 3.25Å; I217-W219 VanDerWaalsContact C-N 3.33Å; I217-W219 PolarHBondContact O-N 2.81Å; W219-V221 VanDerWaalsContact C-N 3.3Å; W219-V221 PolarHBondContact O-N 3.36Å; W219-V222 HydrophobicContact CE3-CB 4.37Å; W219-V222 HydrophobicContact CE3-CG1 4.37Å; W219-V222 HydrophobicContact CZ3-CG1 4.42Å; W219-V222 PolarHBondContact O-N 3.18Å; W219-I223 WeakPolarHBondContact O-CB 3.36Å; W219-I223 VanDerWaalsContact O-CG1 3.27Å; W219-I223 WeakPolarHBondContact O-CG1 3.28Å; W219-I223 PolarHBondContact O-N 3.04Å
220I94.3Very high90.3Very high95 Ų9559.2 Ų59.249%0.48731%0.307SS..Hα-helixtrans-60.3-42.2172.2-69.7166.2000110.6P216 I217 V218 I223 L224P216-I220 WeakPolarHBondContact O-CG1 2.88Å; P216-I220 PolarHBondContact O-N 2.94Å; I217-I220 WeakPolarHBondContact O-CB 3.4Å; I217-I220 PolarHBondContact O-N 3.41Å; V218-I220 VanDerWaalsContact C-N 3.34Å; V218-I220 PolarHBondContact O-N 3.26Å; I220-I223 PolarHBondContact O-N 3.13Å; I220-L224 HydrophobicContact CG2-CD1 3.69Å; I220-L224 HydrophobicContact CG2-CG 4.15Å; I220-L224 VanDerWaalsContact O-CB 3.32Å; I220-L224 WeakPolarHBondContact O-CB 3.37Å; I220-L224 VanDerWaalsContact O-CG 3.25Å; I220-L224 WeakPolarHBondContact O-CG 3.5Å; I220-L224 PolarHBondContact O-N 2.85Å
221V91.3Very high90.2Very high53 Ų5359.4 Ų59.432%0.32132%0.318SS..Hα-helixtrans-62.1-45.6175.8174.90000111.3V18 I217 V218 W219 I223 L224 Q225V18-V221 HydrophobicContact CG1-CG1 4.47Å; I217-V221 WeakPolarHBondContact O-CG2 3.1Å; I217-V221 PolarHBondContact O-N 3.49Å; V218-V221 WeakPolarHBondContact O-CB 3.45Å; V218-V221 PolarHBondContact O-N 2.96Å; V218-V221 VanDerWaalsContact O-N 3.11Å; W219-V221 VanDerWaalsContact C-N 3.3Å; W219-V221 PolarHBondContact O-N 3.36Å; V221-I223 VanDerWaalsContact C-N 3.34Å; V221-I223 PolarHBondContact O-N 2.85Å; V221-L224 PolarHBondContact O-N 3.2Å; V221-Q225 VanDerWaalsContact O-CB 3.31Å; V221-Q225 WeakPolarHBondContact O-CB 3.46Å; V221-Q225 PolarHBondContact O-N 3.47Å
222V94.2Very high89.8Confident0 Ų059.2 Ų59.20%032%0.32CS..Hα-helixtrans-56.6-48.7176.2170.10000110.9V18 C21 L25 Y214 V218 W219 Q225 A226V18-V222 HydrophobicContact CB-CG2 4.46Å; V18-V222 HydrophobicContact CG1-CG2 3.81Å; C21-V222 HydrophobicContact CB-CG1 3.78Å; C21-V222 HydrophobicContact CB-CG2 4.01Å; L25-V222 HydrophobicContact CD1-CG1 4.31Å; Y214-V222 HydrophobicContact CE1-CG2 4.39Å; V218-V222 WeakPolarHBondContact O-CG2 3.31Å; V218-V222 PolarHBondContact O-N 3.37Å; W219-V222 HydrophobicContact CE3-CB 4.37Å; W219-V222 HydrophobicContact CE3-CG1 4.37Å; W219-V222 HydrophobicContact CZ3-CG1 4.42Å; W219-V222 PolarHBondContact O-N 3.18Å; V222-Q225 PolarHBondContact O-N 2.84Å; V222-A226 WeakPolarHBondContact O-CB 3.28Å; V222-A226 PolarHBondContact O-N 3.21Å
223I95Very high89.7Confident73 Ų7355.1 Ų55.137%0.37431%0.306SS..Hα-helixtrans-62.6-50.2179.2-69.9168.8000109.9L25 W219 I220 V221 Q225 A226 F227L25-I223 HydrophobicContact CD1-CG1 4.02Å; W219-I223 WeakPolarHBondContact O-CB 3.36Å; W219-I223 VanDerWaalsContact O-CG1 3.27Å; W219-I223 WeakPolarHBondContact O-CG1 3.28Å; W219-I223 PolarHBondContact O-N 3.04Å; I220-I223 PolarHBondContact O-N 3.13Å; V221-I223 VanDerWaalsContact C-N 3.34Å; V221-I223 PolarHBondContact O-N 2.85Å; I223-Q225 VanDerWaalsContact C-N 3.32Å; I223-Q225 PolarHBondContact O-N 3.41Å; I223-A226 PolarHBondContact O-N 2.85Å; I223-F227 HydrophobicContact CG2-CD2 3.56Å; I223-F227 HydrophobicContact CG2-CE2 3.78Å; I223-F227 WeakPolarHBondContact O-CB 3.36Å; I223-F227 WeakPolarHBondContact O-CD2 3.44Å; I223-F227 PolarHBondContact O-N 3.49Å
224L92.7Very high89.4Confident114 Ų11460.2 Ų60.260%0.59733%0.327SS*.Hα-helixtrans-60.7-39.8179.3-75.2173.3000112.4I220 V221 G228I220-L224 HydrophobicContact CG2-CD1 3.69Å; I220-L224 HydrophobicContact CG2-CG 4.15Å; I220-L224 VanDerWaalsContact O-CB 3.32Å; I220-L224 WeakPolarHBondContact O-CB 3.37Å; I220-L224 VanDerWaalsContact O-CG 3.25Å; I220-L224 WeakPolarHBondContact O-CG 3.5Å; I220-L224 PolarHBondContact O-N 2.85Å; V221-L224 PolarHBondContact O-N 3.2Å; L224-G228 WeakPolarHBondContact O-CA 3.46Å; L224-G228 PolarHBondContact O-N 3.26Å
225Q90.8Very high89.2Confident45 Ų4563.1 Ų63.121%0.2135%0.348CS..Hα-helixtrans-65.2-42.4176.8-174.1177.111.500111S22 Y77 V221 V222 I223 G229S22-Q225 PolarHBondContact OG-OE1 2.92Å; Y77-Q225 PolarHBondContact OH-OE1 3.31Å; V221-Q225 VanDerWaalsContact O-CB 3.31Å; V221-Q225 WeakPolarHBondContact O-CB 3.46Å; V221-Q225 PolarHBondContact O-N 3.47Å; V222-Q225 PolarHBondContact O-N 2.84Å; I223-Q225 VanDerWaalsContact C-N 3.32Å; I223-Q225 PolarHBondContact O-N 3.41Å; Q225-G229 PolarHBondContact O-N 3.33Å; Q225-G229 VanDerWaalsContact O-N 3.09Å
226A92.7Very high88.5Confident0 Ų064.9 Ų64.90%035%0.353CS..Hα-helixtrans-67.2-50.6178.900000112.4L25 K26 V222 I223 G228 G229 L230L25-A226 HydrophobicContact CB-CB 4Å; L25-A226 HydrophobicContact CD2-CB 3.5Å; L25-A226 VanDerWaalsContact CD2-CB 3.5Å; L25-A226 HydrophobicContact CG-CB 4.23Å; K26-A226 VanDerWaalsContact CG-CA 3.5Å; K26-A226 HydrophobicContact CG-CB 3.7Å; K26-A226 WeakPolarHBondContact CG-O 3.4Å; V222-A226 WeakPolarHBondContact O-CB 3.28Å; V222-A226 PolarHBondContact O-N 3.21Å; I223-A226 PolarHBondContact O-N 2.85Å; A226-G228 VanDerWaalsContact C-N 3.35Å; A226-G228 PolarHBondContact O-N 3.04Å; A226-G229 PolarHBondContact O-N 2.9Å; A226-L230 PolarHBondContact O-N 3.48Å; A226-L230 VanDerWaalsContact O-N 3.16Å
227F91.6Very high87.8Confident110 Ų11064.1 Ų64.148%0.48234%0.337SS..Hα-helixtrans-64.4-38.6176.2-85.4-84000112.1L29 I223 G229 L230 A231L29-F227 HydrophobicContact CD1-CD2 4.38Å; L29-F227 HydrophobicContact CD1-CE1 4.21Å; L29-F227 HydrophobicContact CD1-CE2 3.99Å; L29-F227 HydrophobicContact CD1-CZ 3.91Å; I223-F227 HydrophobicContact CG2-CD2 3.56Å; I223-F227 HydrophobicContact CG2-CE2 3.78Å; I223-F227 WeakPolarHBondContact O-CB 3.36Å; I223-F227 WeakPolarHBondContact O-CD2 3.44Å; I223-F227 PolarHBondContact O-N 3.49Å; F227-G229 VanDerWaalsContact C-N 3.33Å; F227-G229 PolarHBondContact O-N 3.32Å; F227-L230 PolarHBondContact O-N 3.23Å; F227-A231 WeakPolarHBondContact O-CB 3.42Å; F227-A231 PolarHBondContact O-N 3.4Å
228G87.3Confident87.2Confident31 Ų3165.2 Ų65.232%0.3233%0.334SS..Hα-helixtrans-59-43.9175.900000111.9L224 A226 A231 I232L224-G228 WeakPolarHBondContact O-CA 3.46Å; L224-G228 PolarHBondContact O-N 3.26Å; A226-G228 VanDerWaalsContact C-N 3.35Å; A226-G228 PolarHBondContact O-N 3.04Å; G228-A231 PolarHBondContact O-N 2.88Å; G228-I232 WeakPolarHBondContact O-CD1 3.42Å; G228-I232 VanDerWaalsContact O-CG1 3.28Å; G228-I232 WeakPolarHBondContact O-CG1 3.44Å; G228-I232 PolarHBondContact O-N 3.42Å; G228-I232 VanDerWaalsContact O-N 3.09Å
229G85.3Confident86.7Confident25 Ų2566.9 Ų66.926%0.25835%0.349SS..Hα-helixtrans-60.7-44.7174.200000113.1Q225 A226 F227 A233Q225-G229 PolarHBondContact O-N 3.33Å; Q225-G229 VanDerWaalsContact O-N 3.09Å; A226-G229 PolarHBondContact O-N 2.9Å; F227-G229 VanDerWaalsContact C-N 3.33Å; F227-G229 PolarHBondContact O-N 3.32Å; G229-A233 PolarHBondContact O-N 3.45Å
230L86.9Confident85.7Confident11 Ų1165.9 Ų65.96%0.05835%0.351CS..Hα-helixtrans-70.5-35.8178-66.7174.8000112.9K26 L29 W179 N182 A226 F227 A233 F234K26-L230 HydrophobicContact CG-CG 4.33Å; L29-L230 HydrophobicContact CB-CD1 3.59Å; L29-L230 HydrophobicContact CD1-CD1 3.5Å; L29-L230 HydrophobicContact CG-CD1 4.22Å; W179-L230 HydrophobicContact CZ3-CD2 4.33Å; N182-L230 HydrophobicContact CB-CD2 4.22Å; A226-L230 PolarHBondContact O-N 3.48Å; A226-L230 VanDerWaalsContact O-N 3.16Å; F227-L230 PolarHBondContact O-N 3.23Å; L230-A233 WeakPolarHBondContact O-CB 3.45Å; L230-A233 PolarHBondContact O-N 2.74Å; L230-F234 WeakPolarHBondContact O-CB 3.37Å; L230-F234 PolarHBondContact O-N 3.35Å
231A85.7Confident84.9Confident52 Ų5265.4 Ų65.443%0.4335%0.35SS..Hα-helixtrans-63.8-43.1177.900000110.9F227 G228 A233 F234 V235F227-A231 WeakPolarHBondContact O-CB 3.42Å; F227-A231 PolarHBondContact O-N 3.4Å; G228-A231 PolarHBondContact O-N 2.88Å; A231-A233 VanDerWaalsContact C-N 3.29Å; A231-A233 PolarHBondContact O-N 2.59Å; A231-F234 PolarHBondContact O-N 2.95Å; A231-V235 VanDerWaalsContact O-CG2 3.29Å; A231-V235 WeakPolarHBondContact O-CG2 3.41Å; A231-V235 PolarHBondContact O-N 3.42Å
232I82.5Confident84.2Confident108 Ų10866.5 Ų66.555%0.55435%0.353SS*.Hα-helixtrans-58.9-44.7173.9-66.1163.3000110.1G228 F234 V235 M236G228-I232 WeakPolarHBondContact O-CD1 3.42Å; G228-I232 VanDerWaalsContact O-CG1 3.28Å; G228-I232 WeakPolarHBondContact O-CG1 3.44Å; G228-I232 PolarHBondContact O-N 3.42Å; G228-I232 VanDerWaalsContact O-N 3.09Å; I232-F234 VanDerWaalsContact C-N 3.34Å; I232-F234 PolarHBondContact O-N 2.84Å; I232-V235 PolarHBondContact O-N 2.89Å; I232-M236 HydrophobicContact CG2-CE 4.18Å; I232-M236 WeakPolarHBondContact O-CG 3.41Å; I232-M236 PolarHBondContact O-N 3.46Å
233A82Confident83.2Confident5 Ų570.6 Ų70.64%0.04137%0.374CS..Hα-helixtrans-62.7-39.7177.700000112.7I178 N182 G229 L230 A231 M236 R237I178-A233 HydrophobicContact CG2-CB 3.54Å; N182-A233 WeakPolarHBondContact ND2-CB 3.44Å; G229-A233 PolarHBondContact O-N 3.45Å; L230-A233 WeakPolarHBondContact O-CB 3.45Å; L230-A233 PolarHBondContact O-N 2.74Å; A231-A233 VanDerWaalsContact C-N 3.29Å; A231-A233 PolarHBondContact O-N 2.59Å; A233-M236 HydrophobicContact CB-CE 4.49Å; A233-R237 PolarHBondContact O-N 3.29Å
234F81.2Confident82.2Confident110 Ų11073.1 Ų73.148%0.48238%0.383SS..Hα-helixtrans-66.9-44.2175.8-175.9-97000112.5W179 L230 A231 I232 M236 R237 Y238W179-F234 HydrophobicContact CH2-CB 4.38Å; W179-F234 AromaticContact CH2-CD2 3.97Å; W179-F234 HydrophobicContact CH2-CD2 3.97Å; W179-F234 HydrophobicContact CZ2-CD2 4.08Å; L230-F234 WeakPolarHBondContact O-CB 3.37Å; L230-F234 PolarHBondContact O-N 3.35Å; A231-F234 PolarHBondContact O-N 2.95Å; I232-F234 VanDerWaalsContact C-N 3.34Å; I232-F234 PolarHBondContact O-N 2.84Å; F234-M236 VanDerWaalsContact C-N 3.32Å; F234-M236 PolarHBondContact O-N 3.36Å; F234-R237 WeakPolarHBondContact O-CB 3.34Å; F234-R237 PolarHBondContact O-N 3.41Å; F234-Y238 PolarHBondContact O-N 3.31Å
235V83Confident81.4Confident94 Ų9469.6 Ų69.657%0.5737%0.373SS*.Hα-helixtrans-60.7-42.5177170.20000110.8A231 I232 R237 Y238 A239A231-V235 VanDerWaalsContact O-CG2 3.29Å; A231-V235 WeakPolarHBondContact O-CG2 3.41Å; A231-V235 PolarHBondContact O-N 3.42Å; I232-V235 PolarHBondContact O-N 2.89Å; V235-R237 VanDerWaalsContact C-N 3.33Å; V235-R237 PolarHBondContact O-N 3.21Å; V235-Y238 PolarHBondContact O-N 3.41Å; V235-A239 WeakPolarHBondContact O-CB 3.22Å; V235-A239 PolarHBondContact O-N 3.03Å
236M75.7Confident80.9Confident100 Ų10071.4 Ų71.449%0.49338%0.384SS..Hα-helixtrans-58.3-44.9175.1-72.2-172-6400111.6I232 A233 F234 Y238 A239 D240I232-M236 HydrophobicContact CG2-CE 4.18Å; I232-M236 WeakPolarHBondContact O-CG 3.41Å; I232-M236 PolarHBondContact O-N 3.46Å; A233-M236 HydrophobicContact CB-CE 4.49Å; F234-M236 VanDerWaalsContact C-N 3.32Å; F234-M236 PolarHBondContact O-N 3.36Å; M236-Y238 VanDerWaalsContact C-N 3.3Å; M236-Y238 PolarHBondContact O-N 3.35Å; M236-A239 PolarHBondContact O-N 3.49Å; M236-D240 PolarHBondContact O-N 2.97Å
237R76.1Confident80.1Confident87 Ų8779.7 Ų79.733%0.32842%0.416SS..Hα-helixtrans-57.2-44.4175.4-163.1176.4177.2163.5-5112.5Q37 I178 A233 F234 V235 N241Q37-R237 VanDerWaalsContact OE1-NH1 3.16Å; I178-R237 HydrophobicContact CD1-CB 3.38Å; I178-R237 HydrophobicContact CD1-CG 3.62Å; A233-R237 PolarHBondContact O-N 3.29Å; F234-R237 WeakPolarHBondContact O-CB 3.34Å; F234-R237 PolarHBondContact O-N 3.41Å; V235-R237 VanDerWaalsContact C-N 3.33Å; V235-R237 PolarHBondContact O-N 3.21Å; R237-N241 PolarHBondContact O-N 3.41Å; R237-N241 VanDerWaalsContact O-N 3.14Å; R237-N241 PolarHBondContact O-ND2 3.35Å
238Y78.8Confident79.3Confident141 Ų14181.6 Ų81.655%0.55343%0.431SS*.Hα-helixtrans-73.4-39.7-175-166.3-108.1000111.6F234 V235 M236 D240 N241 I242F234-Y238 PolarHBondContact O-N 3.31Å; V235-Y238 PolarHBondContact O-N 3.41Å; M236-Y238 VanDerWaalsContact C-N 3.3Å; M236-Y238 PolarHBondContact O-N 3.35Å; Y238-D240 PolarHBondContact O-N 2.89Å; Y238-N241 PolarHBondContact O-N 2.87Å; Y238-I242 HydrophobicContact CD1-CD1 3.48Å; Y238-I242 VanDerWaalsContact CD1-CD1 3.48Å; Y238-I242 HydrophobicContact CD1-CG1 4.22Å; Y238-I242 HydrophobicContact CE1-CD1 3.24Å; Y238-I242 HydrophobicContact CE1-CG1 3.96Å; Y238-I242 HydrophobicContact CG-CD1 4.42Å; Y238-I242 WeakPolarHBondContact O-CG1 3.35Å; Y238-I242 PolarHBondContact O-N 3.2Å
239A80Confident78.6Confident43 Ų4384 Ų8436%0.35544%0.442SS..Hα-helixtrans-59.1-46173.700000111.5V235 M236 N241 I242 L243V235-A239 WeakPolarHBondContact O-CB 3.22Å; V235-A239 PolarHBondContact O-N 3.03Å; M236-A239 PolarHBondContact O-N 3.49Å; A239-N241 VanDerWaalsContact C-N 3.31Å; A239-N241 PolarHBondContact O-N 3.38Å; A239-I242 PolarHBondContact O-N 2.92Å; A239-L243 WeakPolarHBondContact O-CB 3.44Å; A239-L243 WeakPolarHBondContact O-CG 3.45Å; A239-L243 PolarHBondContact O-N 2.87Å
240D73.2Confident77.4Confident87 Ų8787.5 Ų87.547%0.46546%0.455SS..Hα-helixtrans-62-38.2176.4-72.4-16.8000112.3M236 Y238 K244M236-D240 PolarHBondContact O-N 2.97Å; Y238-D240 PolarHBondContact O-N 2.89Å; D240-K244 WeakPolarHBondContact O-CB 3.45Å; D240-K244 VanDerWaalsContact O-CG 3.25Å; D240-K244 WeakPolarHBondContact O-CG 2.97Å; D240-K244 PolarHBondContact O-N 3.45Å
241N76.9Confident76Confident84 Ų8491.9 Ų91.945%0.44948%0.484SS..Hα-helixtrans-69.5-41.3178-73.3-18.1000112.6R237 Y238 A239 K244 G245R237-N241 PolarHBondContact O-N 3.41Å; R237-N241 VanDerWaalsContact O-N 3.14Å; R237-N241 PolarHBondContact O-ND2 3.35Å; Y238-N241 PolarHBondContact O-N 2.87Å; A239-N241 VanDerWaalsContact C-N 3.31Å; A239-N241 PolarHBondContact O-N 3.38Å; N241-K244 PolarHBondContact O-N 2.92Å; N241-G245 PolarHBondContact O-N 3.01Å
242I76.3Confident74.2Confident77 Ų77103 Ų10340%0.39552%0.517SS..Hα-helixtrans-62.6-48174.9-70165.5000109.9Y238 A239 K244 G245 I246Y238-I242 HydrophobicContact CD1-CD1 3.48Å; Y238-I242 VanDerWaalsContact CD1-CD1 3.48Å; Y238-I242 HydrophobicContact CD1-CG1 4.22Å; Y238-I242 HydrophobicContact CE1-CD1 3.24Å; Y238-I242 HydrophobicContact CE1-CG1 3.96Å; Y238-I242 HydrophobicContact CG-CD1 4.42Å; Y238-I242 WeakPolarHBondContact O-CG1 3.35Å; Y238-I242 PolarHBondContact O-N 3.2Å; A239-I242 PolarHBondContact O-N 2.92Å; I242-K244 VanDerWaalsContact C-N 3.32Å; I242-K244 PolarHBondContact O-N 2.86Å; I242-G245 WeakPolarHBondContact O-CA 3.27Å; I242-G245 PolarHBondContact O-N 3.09Å; I242-I246 HydrophobicContact CG2-CD1 3.88Å; I242-I246 HydrophobicContact CG2-CG1 4.42Å; I242-I246 WeakPolarHBondContact O-CG1 3.14Å; I242-I246 PolarHBondContact O-N 3.09Å
243L74.4Confident73.8Confident85 Ų85102.8 Ų102.845%0.44552%0.515SS..Hα-helixtrans-56.7-48178.7-75.8169.7000110.9A239 G245 I246 Y247A239-L243 WeakPolarHBondContact O-CB 3.44Å; A239-L243 WeakPolarHBondContact O-CG 3.45Å; A239-L243 PolarHBondContact O-N 2.87Å; L243-G245 VanDerWaalsContact C-N 3.3Å; L243-G245 PolarHBondContact O-N 3.44Å; L243-I246 PolarHBondContact O-N 3.15Å; L243-Y247 HydrophobicContact CB-CE2 4.27Å; L243-Y247 WeakPolarHBondContact O-CD2 3.38Å; L243-Y247 PolarHBondContact O-N 2.84Å
244K72.9Confident73.4Confident127 Ų127107.9 Ų107.955%0.55254%0.54SS*.Hα-helixtrans-59.6-39.1174.6-74.3171.2-175.3175.30112.9D240 N241 I242 Y247 L248D240-K244 WeakPolarHBondContact O-CB 3.45Å; D240-K244 VanDerWaalsContact O-CG 3.25Å; D240-K244 WeakPolarHBondContact O-CG 2.97Å; D240-K244 PolarHBondContact O-N 3.45Å; N241-K244 PolarHBondContact O-N 2.92Å; I242-K244 VanDerWaalsContact C-N 3.32Å; I242-K244 PolarHBondContact O-N 2.86Å; K244-Y247 PolarHBondContact O-N 3.31Å; K244-L248 WeakPolarHBondContact O-CB 3.46Å; K244-L248 VanDerWaalsContact O-CG 3.32Å; K244-L248 WeakPolarHBondContact O-CG 3.1Å; K244-L248 PolarHBondContact O-N 2.95Å
245G76.7Confident72.9Confident39 Ų39107.8 Ų107.840%0.40254%0.544SS..Hα-helixtrans-59.6-45175.500000112.3N241 I242 L243 L248 S249N241-G245 PolarHBondContact O-N 3.01Å; I242-G245 WeakPolarHBondContact O-CA 3.27Å; I242-G245 PolarHBondContact O-N 3.09Å; L243-G245 VanDerWaalsContact C-N 3.3Å; L243-G245 PolarHBondContact O-N 3.44Å; G245-L248 PolarHBondContact O-N 3.36Å; G245-S249 PolarHBondContact O-N 2.98Å; G245-S249 PolarHBondContact O-OG 3.46Å; G245-S249 VanDerWaalsContact O-OG 3.1Å
246I79.9Confident72.4Confident83 Ų83108.6 Ų108.643%0.42654%0.542SS..Hα-helixtrans-64.5-46.4177.9-63.7167.4000110.8I242 L243 L248 S249 D250I242-I246 HydrophobicContact CG2-CD1 3.88Å; I242-I246 HydrophobicContact CG2-CG1 4.42Å; I242-I246 WeakPolarHBondContact O-CG1 3.14Å; I242-I246 PolarHBondContact O-N 3.09Å; L243-I246 PolarHBondContact O-N 3.15Å; I246-L248 VanDerWaalsContact C-N 3.29Å; I246-L248 PolarHBondContact O-N 3.23Å; I246-S249 WeakPolarHBondContact CA-OG 3.29Å; I246-S249 PolarHBondContact O-N 2.9Å; I246-S249 PolarHBondContact O-OG 3.32Å; I246-D250 PolarHBondContact O-N 2.96Å
247Y75.1Confident72.1Confident175 Ų175109.1 Ų109.169%0.68655%0.545SS*.Hα-helixtrans-64.7-30.5178.6-70.9-63.8000113.7L243 K244L243-Y247 HydrophobicContact CB-CE2 4.27Å; L243-Y247 WeakPolarHBondContact O-CD2 3.38Å; L243-Y247 PolarHBondContact O-N 2.84Å; K244-Y247 PolarHBondContact O-N 3.31Å
248L75.6Confident71.9Confident149 Ų149110.6 Ų110.678%0.7856%0.56SS**Hα-helixtrans-79.5-27.1175.3-70.9170.1000112.5K244 G245 I246K244-L248 WeakPolarHBondContact O-CB 3.46Å; K244-L248 VanDerWaalsContact O-CG 3.32Å; K244-L248 WeakPolarHBondContact O-CG 3.1Å; K244-L248 PolarHBondContact O-N 2.95Å; G245-L248 PolarHBondContact O-N 3.36Å; I246-L248 VanDerWaalsContact C-N 3.29Å; I246-L248 PolarHBondContact O-N 3.23Å
249S71.8Confident71.4Confident81 Ų81108.4 Ų108.457%0.56656%0.56SS**Hα-helixtrans-81.3-18.317657.20000114.1G245 I246 P251G245-S249 PolarHBondContact O-N 2.98Å; G245-S249 PolarHBondContact O-OG 3.46Å; G245-S249 VanDerWaalsContact O-OG 3.1Å; I246-S249 WeakPolarHBondContact CA-OG 3.29Å; I246-S249 PolarHBondContact O-N 2.9Å; I246-S249 PolarHBondContact O-OG 3.32Å; S249-P251 VanDerWaalsContact C-CD 3.41Å; S249-P251 WeakPolarHBondContact O-CD 3.4Å
250D61.5Low70.7Confident99 Ų99113.5 Ų113.553%0.52958%0.576SS.*  trans-103.883.3173.8-73-28.2000110.6I246 Y252I246-D250 PolarHBondContact O-N 2.96Å; D250-Y252 PolarHBondContact O-N 2.83Å
251P56.6Low70.5Confident103 Ų103115.7 Ų115.767%0.66959%0.585SS**  trans-80.871.217235.2-34.9000109.9S249S249-P251 VanDerWaalsContact C-CD 3.41Å; S249-P251 WeakPolarHBondContact O-CD 3.4Å
252Y48.6Very low69.9Low286 Ų286118.5 Ų118.5100%1.12260%0.597SS**  trans-135.40171.3-65.1-72.7000111.8D250D250-Y252 PolarHBondContact O-N 2.83Å

Retrieved 252 of 252 residues in 582.7 ms (Link to these results)