G4VKL7_SCHMA Loading...

Protein MIX23

AlphaFold DB , UniProt , Accession G4VKL7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 151 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
1M36.8Very low79Confident228 Ų22874.9 Ų74.9100%1.12344%0.439SS*.  0129.70-66.5178.998.400106.9S3M1-S3 PolarHBondContact O-N 3.11Å
2S41Very low80.5Confident86 Ų8677.3 Ų77.360%0.60145%0.447SS*.  trans-57.5135.9177.2177.50000109.3D4 A5S2-D4 PolarHBondContact O-N 2.93Å; S2-A5 PolarHBondContact O-N 3.33Å
3S56.4Low81.7Confident110 Ų11078.8 Ų78.877%0.76945%0.448SS*.THydrogen-bonded Turntrans-63.9-0.8-177.457.90000114.3M1M1-S3 PolarHBondContact O-N 3.11Å
4D73.4Confident82.8Confident80 Ų8073.2 Ų73.243%0.42842%0.416SS..THydrogen-bonded Turntrans-109.6-2.6-174.4-80.1-35.6000114.9S2 W21 K64S2-D4 PolarHBondContact O-N 2.93Å; D4-W21 WeakPolarHBondContact O-CH2 3.29Å; D4-K64 IonicContact OD1-NZ 3.09Å; D4-K64 PolarHBondContact OD1-NZ 3.36Å; D4-K64 IonicContact OD2-NZ 3.27Å
5A87.1Confident83.8Confident64 Ų6470.1 Ų70.153%0.52940%0.403SS..SBendtrans-100.3140.2179.800000111.7S2S2-A5 PolarHBondContact O-N 3.33Å
6L94.8Very high84.6Confident12 Ų1275.9 Ų75.96%0.06342%0.416CS..  trans-71.1135.7173.1-70.3175000110.5C8 L17 L18 W21 A68 I69L6-C8 VanDerWaalsContact C-N 3.3Å; L6-C8 PolarHBondContact O-N 3.06Å; L6-C8 PolarHBondContact O-SG 3.12Å; L6-C8 VanDerWaalsContact O-SG 3.41Å; L6-L17 HydrophobicContact CD2-CB 3.93Å; L6-L17 HydrophobicContact CD2-CD1 4.41Å; L6-L18 HydrophobicContact CD1-CD1 4.25Å; L6-L18 HydrophobicContact CD1-CD2 3.94Å; L6-L18 HydrophobicContact CD1-CG 4.09Å; L6-L18 HydrophobicContact CD2-CD2 4.29Å; L6-L18 HydrophobicContact CD2-CG 4Å; L6-W21 HydrophobicContact CD1-CZ3 4.37Å; L6-W21 HydrophobicContact CD2-CE3 4.37Å; L6-W21 HydrophobicContact CD2-CH2 3.79Å; L6-W21 HydrophobicContact CD2-CZ3 3.66Å; L6-W21 HydrophobicContact CG-CH2 3.97Å; L6-W21 HydrophobicContact CG-CZ3 3.83Å; L6-A68 HydrophobicContact CD1-CB 3.74Å; L6-A68 HydrophobicContact CG-CB 3.99Å; L6-I69 HydrophobicContact CD1-CG1 4.23Å
7P95.5Very high85.3Confident22 Ų2274.2 Ų74.214%0.14341%0.406CS..  trans-74.683.5173.130.7-33.3000109.8D9 D10 Q13 S14 L17P7-D9 PolarHBondContact O-N 2.76Å; P7-D10 CarbonylContact O-C 3.42Å; P7-D10 PolarHBondContact O-N 3.01Å; P7-D10 VanDerWaalsContact O-O 3.04Å; P7-Q13 HydrophobicContact CG-CB 3.77Å; P7-Q13 HydrophobicContact CG-CG 3.73Å; P7-S14 VanDerWaalsContact C-OG 3.29Å; P7-S14 WeakPolarHBondContact CD-OG 3.5Å; P7-S14 PolarHBondContact O-OG 3.02Å; P7-L17 HydrophobicContact CG-CD1 4.22Å
8C96.7Very high86Confident16 Ų1670.1 Ų70.111%0.10838%0.383CS..THydrogen-bonded Turntrans-61.8-12.7-171.8-52.90000115.2L6 C72 L108 F112L6-C8 VanDerWaalsContact C-N 3.3Å; L6-C8 PolarHBondContact O-N 3.06Å; L6-C8 PolarHBondContact O-SG 3.12Å; L6-C8 VanDerWaalsContact O-SG 3.41Å; C8-C72 VanDerWaalsContact CA-SG 3.54Å; C8-C72 HydrophobicContact CB-CB 3.63Å; C8-C72 WeakPolarHBondContact CB-SG 3.5Å; C8-C72 WeakPolarHBondContact SG-CA 3.3Å; C8-C72 WeakPolarHBondContact SG-CB 3.45Å; C8-C72 CovalentContact SG-SG 2.04Å; C8-C72 PolarHBondContact SG-SG 2.8Å; C8-L108 WeakPolarHBondContact O-CD2 3.43Å; C8-F112 HydrophobicContact CB-CE2 4.48Å; C8-F112 HydrophobicContact CB-CZ 4.47Å; C8-F112 WeakPolarHBondContact O-CE2 3.3Å
9D94.7Very high86.6Confident90 Ų9070.2 Ų70.248%0.48139%0.39SS..THydrogen-bonded Turntrans-88.4-14.2173.4-73.4-56.6000113.9P7 R79 K105P7-D9 PolarHBondContact O-N 2.76Å; D9-R79 IonicContact OD1-CZ 3.77Å; D9-R79 IonicContact OD1-NH1 3.22Å; D9-R79 PolarHBondContact OD1-NH1 2.9Å; D9-R79 IonicContact OD2-CZ 3.31Å; D9-R79 IonicContact OD2-NH1 3.82Å; D9-R79 PolarHBondContact OD2-NH1 2.93Å; D9-R79 IonicContact OD2-NH2 2.77Å; D9-R79 PolarHBondContact OD2-NH2 3.01Å; D9-K105 IonicContact OD1-NZ 3.13Å; D9-K105 PolarHBondContact OD1-NZ 3.09Å
10D95.6Very high87Confident72 Ų7271.5 Ų71.539%0.38540%0.396SS..  trans-122.294.9176.9-173.8-20.1000109.3P7 L12 Q13 S14P7-D10 CarbonylContact O-C 3.42Å; P7-D10 PolarHBondContact O-N 3.01Å; P7-D10 VanDerWaalsContact O-O 3.04Å; D10-L12 VanDerWaalsContact C-N 3.26Å; D10-L12 PolarHBondContact O-N 3.2Å; D10-L12 WeakPolarHBondContact OD1-CB 3.28Å; D10-L12 PolarHBondContact OD1-N 3.38Å; D10-Q13 HydrophobicContact CB-CB 4.01Å; D10-Q13 PolarHBondContact O-N 3.44Å; D10-Q13 PolarHBondContact OD1-N 3.03Å; D10-S14 WeakPolarHBondContact O-CB 3.47Å; D10-S14 PolarHBondContact O-N 3.38Å; D10-S14 PolarHBondContact O-OG 2.59Å
11F97.4Very high87.5Confident44 Ų4470.8 Ų70.819%0.19339%0.387CS..Hα-helixtrans-60.6-36.6178.1-177.5-107.5000112.2S14 A15 L108 Q111 F112 E115F11-S14 PolarHBondContact O-N 2.88Å; F11-A15 HydrophobicContact CE1-CB 4.32Å; F11-A15 HydrophobicContact CZ-CB 4.32Å; F11-A15 VanDerWaalsContact O-CB 3.29Å; F11-A15 WeakPolarHBondContact O-CB 3.29Å; F11-A15 PolarHBondContact O-N 3.41Å; F11-L108 HydrophobicContact CB-CD1 3.65Å; F11-L108 HydrophobicContact CG-CD1 4.49Å; F11-Q111 HydrophobicContact CD1-CB 4.17Å; F11-Q111 HydrophobicContact CD1-CG 4.22Å; F11-Q111 HydrophobicContact CD2-CB 3.66Å; F11-Q111 HydrophobicContact CE1-CB 4.08Å; F11-Q111 HydrophobicContact CE1-CG 4.19Å; F11-Q111 HydrophobicContact CE2-CB 3.57Å; F11-Q111 HydrophobicContact CG-CB 3.97Å; F11-Q111 HydrophobicContact CG-CG 4.39Å; F11-Q111 HydrophobicContact CZ-CB 3.79Å; F11-Q111 HydrophobicContact CZ-CG 4.35Å; F11-F112 HydrophobicContact CD2-CD1 4.3Å; F11-F112 HydrophobicContact CD2-CE1 4.04Å; F11-F112 HydrophobicContact CD2-CE2 4.42Å; F11-F112 HydrophobicContact CD2-CZ 4.09Å; F11-F112 HydrophobicContact CE2-CD1 4.41Å; F11-F112 HydrophobicContact CE2-CE1 4.45Å; F11-E115 HydrophobicContact CE2-CG 3.72Å; F11-E115 HydrophobicContact CZ-CG 3.94Å
12L97Very high90.3Very high103 Ų10361.2 Ų61.254%0.53934%0.339SS..Hα-helixtrans-68.1-41.9-176.6-174.865.7000110.7D10 R16D10-L12 VanDerWaalsContact C-N 3.26Å; D10-L12 PolarHBondContact O-N 3.2Å; D10-L12 WeakPolarHBondContact OD1-CB 3.28Å; D10-L12 PolarHBondContact OD1-N 3.38Å; L12-R16 WeakPolarHBondContact O-CG 3.3Å; L12-R16 PolarHBondContact O-N 3.28Å
13Q96.2Very high93Very high98 Ų9862.1 Ų62.146%0.45833%0.331SS..Hα-helixtrans-67.1-41.6174.1-167.3179.423.300111.5P7 D10 R16 L17P7-Q13 HydrophobicContact CG-CB 3.77Å; P7-Q13 HydrophobicContact CG-CG 3.73Å; D10-Q13 HydrophobicContact CB-CB 4.01Å; D10-Q13 PolarHBondContact O-N 3.44Å; D10-Q13 PolarHBondContact OD1-N 3.03Å; Q13-R16 PolarHBondContact O-N 2.97Å; Q13-L17 PolarHBondContact O-N 3.42Å
14S97.1Very high94.8Very high0 Ų057.4 Ų57.40%030%0.298CS..Hα-helixtrans-59.9-47175.7-66.60000112.3P7 D10 F11 R16 L17 L18P7-S14 VanDerWaalsContact C-OG 3.29Å; P7-S14 WeakPolarHBondContact CD-OG 3.5Å; P7-S14 PolarHBondContact O-OG 3.02Å; D10-S14 WeakPolarHBondContact O-CB 3.47Å; D10-S14 PolarHBondContact O-N 3.38Å; D10-S14 PolarHBondContact O-OG 2.59Å; F11-S14 PolarHBondContact O-N 2.88Å; S14-R16 VanDerWaalsContact C-N 3.31Å; S14-R16 PolarHBondContact O-N 3.06Å; S14-L17 PolarHBondContact O-N 2.9Å; S14-L18 WeakPolarHBondContact O-CG 3.39Å; S14-L18 PolarHBondContact O-N 3.18Å
15A97.2Very high95.9Very high27 Ų2754.4 Ų54.422%0.22328%0.282CS..Hα-helixtrans-62.1-38.417900000112F11 L18 S19F11-A15 HydrophobicContact CE1-CB 4.32Å; F11-A15 HydrophobicContact CZ-CB 4.32Å; F11-A15 VanDerWaalsContact O-CB 3.29Å; F11-A15 WeakPolarHBondContact O-CB 3.29Å; F11-A15 PolarHBondContact O-N 3.41Å; A15-L18 PolarHBondContact O-N 2.96Å; A15-S19 WeakPolarHBondContact O-CB 3.24Å; A15-S19 PolarHBondContact O-N 3.03Å
16R96.9Very high96.3Very high162 Ų16257.7 Ų57.761%0.61129%0.291SS*.Hα-helixtrans-63.8-44.5173.8-73.5173.5-176172.42.4112.1L12 Q13 S14 S19 L20L12-R16 WeakPolarHBondContact O-CG 3.3Å; L12-R16 PolarHBondContact O-N 3.28Å; Q13-R16 PolarHBondContact O-N 2.97Å; S14-R16 VanDerWaalsContact C-N 3.31Å; S14-R16 PolarHBondContact O-N 3.06Å; R16-S19 PolarHBondContact O-N 3.42Å; R16-L20 WeakPolarHBondContact O-CG 3.01Å; R16-L20 PolarHBondContact O-N 3.1Å
17L96.8Very high96.3Very high47 Ų4762.6 Ų62.625%0.24631%0.309CS..Hα-helixtrans-64.1-43.6177.2-72.9172.5000111.6L6 P7 Q13 S14 S19 L20 W21L6-L17 HydrophobicContact CD2-CB 3.93Å; L6-L17 HydrophobicContact CD2-CD1 4.41Å; P7-L17 HydrophobicContact CG-CD1 4.22Å; Q13-L17 PolarHBondContact O-N 3.42Å; S14-L17 PolarHBondContact O-N 2.9Å; L17-S19 VanDerWaalsContact C-N 3.32Å; L17-S19 PolarHBondContact O-N 2.87Å; L17-L20 HydrophobicContact CD2-CD1 4.5Å; L17-L20 WeakPolarHBondContact O-CB 3.46Å; L17-L20 PolarHBondContact O-N 3.04Å; L17-L20 VanDerWaalsContact O-N 3.14Å; L17-W21 VanDerWaalsContact O-CG 3.26Å; L17-W21 PolarHBondContact O-N 3.5Å
18L97.5Very high96.3Very high0 Ų061.7 Ų61.70%030%0.303CS..Hα-helixtrans-58-44.6174.3-75.3172.2000111.6L6 S14 A15 L20 W21 R22 R65 I69 E115L6-L18 HydrophobicContact CD1-CD1 4.25Å; L6-L18 HydrophobicContact CD1-CD2 3.94Å; L6-L18 HydrophobicContact CD1-CG 4.09Å; L6-L18 HydrophobicContact CD2-CD2 4.29Å; L6-L18 HydrophobicContact CD2-CG 4Å; S14-L18 WeakPolarHBondContact O-CG 3.39Å; S14-L18 PolarHBondContact O-N 3.18Å; A15-L18 PolarHBondContact O-N 2.96Å; L18-L20 VanDerWaalsContact C-N 3.33Å; L18-L20 PolarHBondContact O-N 3.09Å; L18-W21 HydrophobicContact CD2-CE3 4.05Å; L18-W21 HydrophobicContact CD2-CZ3 4.37Å; L18-W21 PolarHBondContact O-N 3.04Å; L18-R22 WeakPolarHBondContact O-CB 3.44Å; L18-R22 WeakPolarHBondContact O-CD 3.08Å; L18-R22 VanDerWaalsContact O-CG 3.23Å; L18-R22 WeakPolarHBondContact O-CG 2.98Å; L18-R22 PolarHBondContact O-N 2.98Å; L18-R65 HydrophobicContact CD2-CB 4.48Å; L18-I69 HydrophobicContact CD1-CD1 4.23Å; L18-I69 HydrophobicContact CD1-CG1 4.11Å; L18-I69 HydrophobicContact CD2-CD1 4.03Å; L18-I69 HydrophobicContact CD2-CG1 4.06Å; L18-E115 HydrophobicContact CD1-CB 4.36Å; L18-E115 HydrophobicContact CD1-CG 4.1Å
19S96.7Very high96.2Very high73 Ų7368.7 Ų68.751%0.5133%0.327SS..Hα-helixtrans-59.8-41.6175.2176.20000112.4A15 R16 L17 R22 K23A15-S19 WeakPolarHBondContact O-CB 3.24Å; A15-S19 PolarHBondContact O-N 3.03Å; R16-S19 PolarHBondContact O-N 3.42Å; L17-S19 VanDerWaalsContact C-N 3.32Å; L17-S19 PolarHBondContact O-N 2.87Å; S19-R22 PolarHBondContact O-N 3.4Å; S19-K23 PolarHBondContact O-N 3.36Å
20L96.3Very high96.2Very high96 Ų9672.5 Ų72.550%0.50334%0.336SS..Hα-helixtrans-63.9-42.3175.3-70.5170.8000112.1R16 L17 L18 R22 K23R16-L20 WeakPolarHBondContact O-CG 3.01Å; R16-L20 PolarHBondContact O-N 3.1Å; L17-L20 HydrophobicContact CD2-CD1 4.5Å; L17-L20 WeakPolarHBondContact O-CB 3.46Å; L17-L20 PolarHBondContact O-N 3.04Å; L17-L20 VanDerWaalsContact O-N 3.14Å; L18-L20 VanDerWaalsContact C-N 3.33Å; L18-L20 PolarHBondContact O-N 3.09Å; L20-R22 VanDerWaalsContact C-N 3.29Å; L20-R22 PolarHBondContact O-N 2.89Å; L20-K23 WeakPolarHBondContact O-CB 3.43Å; L20-K23 WeakPolarHBondContact O-CG 3.47Å; L20-K23 PolarHBondContact O-N 3.35Å
21W95.9Very high96Very high57 Ų5770.2 Ų70.222%0.21632%0.323CS..Hα-helixtrans-69.3-26.3178.2-63.1-13.2000113.1D4 L6 L17 L18 K23 S24 R65 A68D4-W21 WeakPolarHBondContact O-CH2 3.29Å; L6-W21 HydrophobicContact CD1-CZ3 4.37Å; L6-W21 HydrophobicContact CD2-CE3 4.37Å; L6-W21 HydrophobicContact CD2-CH2 3.79Å; L6-W21 HydrophobicContact CD2-CZ3 3.66Å; L6-W21 HydrophobicContact CG-CH2 3.97Å; L6-W21 HydrophobicContact CG-CZ3 3.83Å; L17-W21 VanDerWaalsContact O-CG 3.26Å; L17-W21 PolarHBondContact O-N 3.5Å; L18-W21 HydrophobicContact CD2-CE3 4.05Å; L18-W21 HydrophobicContact CD2-CZ3 4.37Å; L18-W21 PolarHBondContact O-N 3.04Å; W21-K23 VanDerWaalsContact C-N 3.31Å; W21-S24 PolarHBondContact O-OG 3.45Å; W21-R65 HydrophobicContact CB-CG 4.33Å; W21-R65 HydrophobicContact CE3-CG 3.96Å; W21-R65 PolarHBondContact O-NH1 2.85Å; W21-A68 HydrophobicContact CZ3-CB 4.22Å
22R97.2Very high95.8Very high27 Ų2768.2 Ų68.210%0.10231%0.314CS..THydrogen-bonded Turntrans-81.1-5.2178.1-74.1161.1174.3160.82.1114L18 S19 L20 S24 D25 D26 E115 E119 I122L18-R22 WeakPolarHBondContact O-CB 3.44Å; L18-R22 WeakPolarHBondContact O-CD 3.08Å; L18-R22 VanDerWaalsContact O-CG 3.23Å; L18-R22 WeakPolarHBondContact O-CG 2.98Å; L18-R22 PolarHBondContact O-N 2.98Å; S19-R22 PolarHBondContact O-N 3.4Å; L20-R22 VanDerWaalsContact C-N 3.29Å; L20-R22 PolarHBondContact O-N 2.89Å; R22-S24 PolarHBondContact O-N 3.39Å; R22-S24 VanDerWaalsContact O-N 3.09Å; R22-D25 WeakPolarHBondContact CA-OD2 3.43Å; R22-D25 WeakPolarHBondContact O-CA 3.46Å; R22-D25 VanDerWaalsContact O-CB 3.26Å; R22-D25 WeakPolarHBondContact O-CB 3.49Å; R22-D25 PolarHBondContact O-N 2.04Å; R22-D26 PolarHBondContact O-N 3.44Å; R22-E115 IonicContact CZ-OE2 3.5Å; R22-E115 VanDerWaalsContact CZ-OE2 3.31Å; R22-E115 IonicContact NH1-OE2 2.73Å; R22-E115 PolarHBondContact NH1-OE2 3Å; R22-E115 IonicContact NH2-OE2 2.72Å; R22-E115 PolarHBondContact NH2-OE2 3.49Å; R22-E119 IonicContact CZ-OE2 2.72Å; R22-E119 IonicContact NE-OE2 2.75Å; R22-E119 PolarHBondContact NE-OE2 3.04Å; R22-E119 IonicContact NH2-OE2 3Å; R22-E119 PolarHBondContact NH2-OE2 3.41Å; R22-I122 HydrophobicContact CG-CD1 4.29Å; R22-I122 VanDerWaalsContact NE-CD1 3.29Å
23K96.4Very high95.3Very high104 Ų10467.6 Ų67.645%0.45231%0.312SS..Hα-helixtrans-58-24.6175.4-75.1-171.7173.2-177.90113.7S19 L20 W21 D25 R27S19-K23 PolarHBondContact O-N 3.36Å; L20-K23 WeakPolarHBondContact O-CB 3.43Å; L20-K23 WeakPolarHBondContact O-CG 3.47Å; L20-K23 PolarHBondContact O-N 3.35Å; W21-K23 VanDerWaalsContact C-N 3.31Å; K23-D25 VanDerWaalsContact C-N 3.3Å; K23-R27 WeakPolarHBondContact O-CG 3.29Å; K23-R27 PolarHBondContact O-N 2.91Å
24S94Very high94.9Very high11 Ų1166.9 Ų66.98%0.07732%0.317CS..Hα-helixtrans-63-39.8171.943.70000111.9W21 R22 R27 V28W21-S24 PolarHBondContact O-OG 3.45Å; R22-S24 PolarHBondContact O-N 3.39Å; R22-S24 VanDerWaalsContact O-N 3.09Å; S24-R27 PolarHBondContact O-N 3.06Å; S24-V28 PolarHBondContact O-N 3.32Å
25D97.3Very high94.3Very high17 Ų1769.6 Ų69.69%0.09133%0.33CS..Hα-helixtrans-69.3-41.6-175.8-53.3-108.4000110.7R22 K23 R27 V28 M58 H62 R65 I122R22-D25 WeakPolarHBondContact CA-OD2 3.43Å; R22-D25 WeakPolarHBondContact O-CA 3.46Å; R22-D25 VanDerWaalsContact O-CB 3.26Å; R22-D25 WeakPolarHBondContact O-CB 3.49Å; R22-D25 PolarHBondContact O-N 2.04Å; K23-D25 VanDerWaalsContact C-N 3.3Å; D25-R27 PolarHBondContact O-N 2.95Å; D25-V28 WeakPolarHBondContact O-CB 3.34Å; D25-V28 VanDerWaalsContact O-CG2 3.3Å; D25-V28 WeakPolarHBondContact O-CG2 3.21Å; D25-V28 PolarHBondContact O-N 3.1Å; D25-M58 HydrophobicContact CB-CE 4.44Å; D25-M58 WeakPolarHBondContact OD1-CE 3.37Å; D25-H62 IonicContact OD1-CE1 3.61Å; D25-H62 PolarHBondContact OD1-CE1 2.98Å; D25-H62 IonicContact OD1-ND1 2.73Å; D25-H62 PolarHBondContact OD1-ND1 3.5Å; D25-H62 IonicContact OD1-NE2 3.1Å; D25-R65 VanDerWaalsContact CG-NH2 3.31Å; D25-R65 IonicContact OD1-CZ 3.22Å; D25-R65 IonicContact OD1-NH1 3.65Å; D25-R65 IonicContact OD1-NH2 2.84Å; D25-R65 PolarHBondContact OD1-NH2 3.22Å; D25-R65 IonicContact OD2-CZ 3.43Å; D25-R65 VanDerWaalsContact OD2-CZ 3.31Å; D25-R65 IonicContact OD2-NH1 3.97Å; D25-R65 PolarHBondContact OD2-NH1 3.17Å; D25-R65 IonicContact OD2-NH2 3.82Å; D25-R65 PolarHBondContact OD2-NH2 3.35Å; D25-R65 VanDerWaalsContact OD2-NH2 3.13Å; D25-I122 HydrophobicContact CB-CG2 3.92Å
26D94.8Very high93.8Very high134 Ų13468.4 Ų68.472%0.71732%0.32SS*.Hα-helixtrans-61.4-28.7174.9-62.8-28.4000112.7R22R22-D26 PolarHBondContact O-N 3.44Å
27R95.4Very high92.8Very high115 Ų11562.4 Ų62.443%0.43430%0.302SS..THydrogen-bonded Turntrans-97.52.5-177-66.4-165.3-52.6-103.6-3.7114.1K23 S24 D25 R29 Y30 E31K23-R27 WeakPolarHBondContact O-CG 3.29Å; K23-R27 PolarHBondContact O-N 2.91Å; S24-R27 PolarHBondContact O-N 3.06Å; D25-R27 PolarHBondContact O-N 2.95Å; R27-R29 VanDerWaalsContact C-N 3.29Å; R27-R29 PolarHBondContact O-N 2.71Å; R27-Y30 WeakPolarHBondContact O-CA 3.34Å; R27-Y30 WeakPolarHBondContact O-CB 3.15Å; R27-Y30 PolarHBondContact O-N 2.98Å; R27-E31 HydrophobicContact CB-CG 4.2Å; R27-E31 IonicContact CZ-OE1 2.91Å; R27-E31 IonicContact NE-OE1 3.4Å; R27-E31 PolarHBondContact NE-OE1 3.01Å; R27-E31 IonicContact NH2-OE1 2.77Å; R27-E31 PolarHBondContact NH2-OE1 3.3Å; R27-E31 PolarHBondContact O-N 2.8Å
28V96.2Very high91.6Very high3 Ų364.6 Ų64.62%0.01832%0.317CS..Hα-helixtrans-49.9-48.6-176.4164.30000112.3S24 D25 Y30 E31 L32 F54 M58 A126 V129 I130S24-V28 PolarHBondContact O-N 3.32Å; D25-V28 WeakPolarHBondContact O-CB 3.34Å; D25-V28 VanDerWaalsContact O-CG2 3.3Å; D25-V28 WeakPolarHBondContact O-CG2 3.21Å; D25-V28 PolarHBondContact O-N 3.1Å; V28-Y30 VanDerWaalsContact C-N 3.35Å; V28-Y30 PolarHBondContact O-N 3.31Å; V28-E31 PolarHBondContact O-N 3.07Å; V28-L32 HydrophobicContact CG1-CD1 3.8Å; V28-L32 HydrophobicContact CG1-CG 4.47Å; V28-L32 WeakPolarHBondContact O-CB 3.31Å; V28-L32 WeakPolarHBondContact O-CG 3.46Å; V28-L32 PolarHBondContact O-N 2.87Å; V28-F54 HydrophobicContact CB-CE1 4.49Å; V28-F54 HydrophobicContact CB-CZ 4.42Å; V28-F54 HydrophobicContact CG1-CE1 3.97Å; V28-F54 HydrophobicContact CG1-CZ 4.29Å; V28-F54 HydrophobicContact CG2-CE1 4.2Å; V28-F54 HydrophobicContact CG2-CZ 4.23Å; V28-M58 HydrophobicContact CG2-CE 3.72Å; V28-M58 HydrophobicContact CG2-SD 4.09Å; V28-A126 HydrophobicContact CG2-CB 4.24Å; V28-V129 HydrophobicContact CG1-CB 4.03Å; V28-V129 HydrophobicContact CG1-CG1 3.9Å; V28-I130 HydrophobicContact CG1-CD1 4.32Å; V28-I130 HydrophobicContact CG1-CG1 3.66Å
29R93.6Very high90Very high163 Ų16368 Ų6862%0.61535%0.345SS*.Hα-helixtrans-61.9-43179.1-173.9-178.7-64.3140.51.1112.2R27 N33 V129R27-R29 VanDerWaalsContact C-N 3.29Å; R27-R29 PolarHBondContact O-N 2.71Å; R29-N33 WeakPolarHBondContact O-CB 3.4Å; R29-N33 PolarHBondContact O-N 3.15Å; R29-N33 PolarHBondContact O-ND2 3.43Å; R29-V129 HydrophobicContact CB-CG1 4.1Å
30Y93.6Very high88.5Confident169 Ų16969.2 Ų69.266%0.66335%0.354SS*.Hα-helixtrans-66.6-47-179.5173.4-96000111.3R27 V28 N33 S34R27-Y30 WeakPolarHBondContact O-CA 3.34Å; R27-Y30 WeakPolarHBondContact O-CB 3.15Å; R27-Y30 PolarHBondContact O-N 2.98Å; V28-Y30 VanDerWaalsContact C-N 3.35Å; V28-Y30 PolarHBondContact O-N 3.31Å; Y30-N33 PolarHBondContact O-N 3.13Å; Y30-S34 PolarHBondContact O-N 3.1Å
31E93.1Very high87.1Confident24 Ų2469.5 Ų69.511%0.11235%0.351CS..Hα-helixtrans-64.6-41.5178.9-65.9-175.6-159.600111.2R27 V28 N33 S34 E35 F54 K57R27-E31 HydrophobicContact CB-CG 4.2Å; R27-E31 IonicContact CZ-OE1 2.91Å; R27-E31 IonicContact NE-OE1 3.4Å; R27-E31 PolarHBondContact NE-OE1 3.01Å; R27-E31 IonicContact NH2-OE1 2.77Å; R27-E31 PolarHBondContact NH2-OE1 3.3Å; R27-E31 PolarHBondContact O-N 2.8Å; V28-E31 PolarHBondContact O-N 3.07Å; E31-N33 PolarHBondContact O-N 2.67Å; E31-S34 PolarHBondContact O-N 2.96Å; E31-S34 PolarHBondContact O-OG 3.46Å; E31-E35 WeakPolarHBondContact O-CG 3.4Å; E31-E35 PolarHBondContact O-N 3.12Å; E31-E35 VanDerWaalsContact O-N 3.1Å; E31-F54 HydrophobicContact CB-CE2 3.66Å; E31-F54 HydrophobicContact CB-CZ 4.12Å; E31-K57 IonicContact OE2-NZ 2.98Å; E31-K57 PolarHBondContact OE2-NZ 2.65Å
32L91.5Very high85.6Confident2 Ų269.6 Ų69.61%0.0136%0.356CS..Hα-helixtrans-64.2-40174.7-76.1171.4000112.7V28 S34 E35 L36 F54 V129 I130 R133V28-L32 HydrophobicContact CG1-CD1 3.8Å; V28-L32 HydrophobicContact CG1-CG 4.47Å; V28-L32 WeakPolarHBondContact O-CB 3.31Å; V28-L32 WeakPolarHBondContact O-CG 3.46Å; V28-L32 PolarHBondContact O-N 2.87Å; L32-S34 VanDerWaalsContact C-N 3.28Å; L32-S34 PolarHBondContact O-N 3.46Å; L32-E35 PolarHBondContact O-N 3.17Å; L32-L36 HydrophobicContact CD2-CD1 4.01Å; L32-L36 WeakPolarHBondContact O-CA 3.45Å; L32-L36 VanDerWaalsContact O-CB 3.29Å; L32-L36 WeakPolarHBondContact O-CB 3.21Å; L32-L36 PolarHBondContact O-N 2.98Å; L32-F54 HydrophobicContact CD1-CE1 4.38Å; L32-F54 HydrophobicContact CD2-CB 4.25Å; L32-F54 HydrophobicContact CD2-CD1 3.75Å; L32-F54 HydrophobicContact CD2-CD2 4.04Å; L32-F54 HydrophobicContact CD2-CE1 4.11Å; L32-F54 HydrophobicContact CD2-CE2 4.38Å; L32-F54 HydrophobicContact CD2-CG 3.72Å; L32-F54 HydrophobicContact CD2-CZ 4.42Å; L32-F54 HydrophobicContact CG-CD1 4.17Å; L32-F54 HydrophobicContact CG-CD2 4.49Å; L32-F54 HydrophobicContact CG-CE1 4Å; L32-F54 HydrophobicContact CG-CE2 4.34Å; L32-F54 HydrophobicContact CG-CG 4.42Å; L32-F54 HydrophobicContact CG-CZ 4.1Å; L32-V129 HydrophobicContact CD1-CG1 4.42Å; L32-I130 HydrophobicContact CD1-CB 4.3Å; L32-I130 HydrophobicContact CD1-CG1 3.97Å; L32-I130 HydrophobicContact CD1-CG2 4.49Å; L32-R133 HydrophobicContact CB-CG 4.32Å; L32-R133 HydrophobicContact CD1-CB 4.1Å; L32-R133 HydrophobicContact CD1-CG 4.41Å
33N88.3Confident84.2Confident91 Ų9176.5 Ų76.549%0.48740%0.395SS..Hα-helixtrans-69.2-26.6179.2-75.1-15.3000112.9R29 Y30 E31R29-N33 WeakPolarHBondContact O-CB 3.4Å; R29-N33 PolarHBondContact O-N 3.15Å; R29-N33 PolarHBondContact O-ND2 3.43Å; Y30-N33 PolarHBondContact O-N 3.13Å; E31-N33 PolarHBondContact O-N 2.67Å
34S87.6Confident83.2Confident82 Ų8279.6 Ų79.657%0.57341%0.408SS*.Hα-helixtrans-79.1-30.4174.167.80000112.4Y30 E31 L32Y30-S34 PolarHBondContact O-N 3.1Å; E31-S34 PolarHBondContact O-N 2.96Å; E31-S34 PolarHBondContact O-OG 3.46Å; L32-S34 VanDerWaalsContact C-N 3.28Å; L32-S34 PolarHBondContact O-N 3.46Å
35E84.7Confident82.6Confident58 Ų5881 Ų8127%0.27142%0.416SS..Hα-helixtrans-87.5-31.7179.1-69.6-172.1-167.100114.1E31 L32E31-E35 WeakPolarHBondContact O-CG 3.4Å; E31-E35 PolarHBondContact O-N 3.12Å; E31-E35 VanDerWaalsContact O-N 3.1Å; L32-E35 PolarHBondContact O-N 3.17Å
36L85.2Confident82.1Confident2 Ų285 Ų851%0.0144%0.437CS..SBendtrans-115.897.8-176.9-57.5175.2000108.5L32 Y47 K50 R133L32-L36 HydrophobicContact CD2-CD1 4.01Å; L32-L36 WeakPolarHBondContact O-CA 3.45Å; L32-L36 VanDerWaalsContact O-CB 3.29Å; L32-L36 WeakPolarHBondContact O-CB 3.21Å; L32-L36 PolarHBondContact O-N 2.98Å; L36-Y47 HydrophobicContact CB-CE1 4.13Å; L36-Y47 HydrophobicContact CD1-CD1 4.49Å; L36-Y47 HydrophobicContact CD2-CD1 3.89Å; L36-Y47 HydrophobicContact CD2-CD2 4.37Å; L36-Y47 HydrophobicContact CD2-CE1 4.17Å; L36-Y47 HydrophobicContact CD2-CG 4.04Å; L36-K50 HydrophobicContact CD2-CB 3.61Å; L36-K50 HydrophobicContact CD2-CG 4.29Å; L36-R133 HydrophobicContact CD1-CG 3.85Å; L36-R133 PolarHBondContact O-NH2 3.32Å
37P76.7Confident81.8Confident35 Ų3579.2 Ų79.223%0.22741%0.406CS..  trans-66.7168.6-179.728.7-34.8000111.1F41 V45 Y47 R133P37-F41 HydrophobicContact CB-CB 3.82Å; P37-F41 HydrophobicContact CB-CD2 4.27Å; P37-F41 HydrophobicContact CB-CG 4.38Å; P37-F41 HydrophobicContact CG-CB 3.71Å; P37-V45 HydrophobicContact CG-CG2 3.83Å; P37-Y47 PolarHBondContact O-OH 2.87Å; P37-R133 PolarHBondContact O-NH2 2.94Å
38T71.6Confident81.6Confident93 Ų9377.1 Ų77.157%0.57141%0.406SS*.  trans-64.2162.8176.640.20000111.9S40 F41T38-S40 PolarHBondContact O-N 3.32Å; T38-F41 PolarHBondContact O-N 2.84Å
39A64.9Low81.4Confident72 Ų7279.8 Ų79.860%0.59543%0.425SS*.G310 helixtrans-47-29.9-17200000114.7F41 L42A39-F41 PolarHBondContact O-N 3.37Å; A39-F41 VanDerWaalsContact O-N 3.1Å; A39-L42 HydrophobicContact CB-CD1 3.99Å; A39-L42 VanDerWaalsContact O-CD1 3.24Å; A39-L42 WeakPolarHBondContact O-CD1 3.37Å; A39-L42 VanDerWaalsContact O-CG 3.3Å; A39-L42 WeakPolarHBondContact O-CG 3.45Å; A39-L42 PolarHBondContact O-N 3.33Å
40S63.3Low81.3Confident99 Ų9976.3 Ų76.369%0.69241%0.414SS*.G310 helixtrans-60.7-15175.919.90000115.4T38T38-S40 PolarHBondContact O-N 3.32Å
41F67.2Low81.4Confident102 Ų10268.2 Ų68.245%0.44738%0.382SS..G310 helixtrans-120.315.6179.8-61.2-81.1000114P37 T38 A39 N43 K44P37-F41 HydrophobicContact CB-CB 3.82Å; P37-F41 HydrophobicContact CB-CD2 4.27Å; P37-F41 HydrophobicContact CB-CG 4.38Å; P37-F41 HydrophobicContact CG-CB 3.71Å; T38-F41 PolarHBondContact O-N 2.84Å; A39-F41 PolarHBondContact O-N 3.37Å; A39-F41 VanDerWaalsContact O-N 3.1Å; F41-N43 PolarHBondContact O-N 2.86Å; F41-N43 VanDerWaalsContact O-N 3.12Å; F41-K44 HydrophobicContact CD1-CD 4.35Å; F41-K44 PolarHBondContact O-N 2.95Å
42L64.1Low81.5Confident58 Ų5870.1 Ų70.130%0.30439%0.393SS..G310 helixtrans-48.1-41.6-179.5-82.2159.7000112.9A39 K44 V45 Y47A39-L42 HydrophobicContact CB-CD1 3.99Å; A39-L42 VanDerWaalsContact O-CD1 3.24Å; A39-L42 WeakPolarHBondContact O-CD1 3.37Å; A39-L42 VanDerWaalsContact O-CG 3.3Å; A39-L42 WeakPolarHBondContact O-CG 3.45Å; A39-L42 PolarHBondContact O-N 3.33Å; L42-K44 PolarHBondContact O-N 2.92Å; L42-V45 PolarHBondContact O-N 3.25Å; L42-V45 VanDerWaalsContact O-O 3.14Å; L42-Y47 HydrophobicContact CD2-CD1 4.34Å; L42-Y47 HydrophobicContact CD2-CD2 3.78Å; L42-Y47 HydrophobicContact CD2-CE1 3.91Å; L42-Y47 HydrophobicContact CD2-CE2 3.34Å; L42-Y47 HydrophobicContact CD2-CG 4.24Å; L42-Y47 HydrophobicContact CG-CE2 4.19Å
43N69.1Low81.6Confident172 Ų17273.8 Ų73.892%0.9242%0.416SS*.G310 helixtrans-70.2-5-175.8-61.2-13.8000114.8F41F41-N43 PolarHBondContact O-N 2.86Å; F41-N43 VanDerWaalsContact O-N 3.12Å
44K74.9Confident82Confident169 Ų16969.6 Ų69.674%0.73539%0.393SS*.G310 helixtrans-103.4-7.3-179.1-63.2-169.9-179.5-1770113.6F41 L42F41-K44 HydrophobicContact CD1-CD 4.35Å; F41-K44 PolarHBondContact O-N 2.95Å; L42-K44 PolarHBondContact O-N 2.92Å
45V80.8Confident82.4Confident40 Ų4065.7 Ų65.724%0.24237%0.366CS..SBendtrans-136.8131.1-173-1780000109.9P37 L42 Y47 K50P37-V45 HydrophobicContact CG-CG2 3.83Å; L42-V45 PolarHBondContact O-N 3.25Å; L42-V45 VanDerWaalsContact O-O 3.14Å; V45-Y47 HydrophobicContact CB-CD2 4.34Å; V45-Y47 HydrophobicContact CB-CE2 4.39Å; V45-Y47 HydrophobicContact CG1-CD2 4.44Å; V45-Y47 WeakPolarHBondContact O-CD2 3.33Å; V45-Y47 PolarHBondContact O-N 2.81Å; V45-K50 HydrophobicContact CG1-CG 3.78Å
46D87.8Confident83Confident101 Ų10166.4 Ų66.454%0.5437%0.372SS..  trans-75.294168.2-176.9-13.5000109.6T48 S49 K50D46-T48 VanDerWaalsContact C-N 3.3Å; D46-T48 PolarHBondContact O-N 3.12Å; D46-T48 WeakPolarHBondContact OD1-CB 3.32Å; D46-T48 PolarHBondContact OD1-N 2.98Å; D46-T48 VanDerWaalsContact OD1-N 3.11Å; D46-S49 VanDerWaalsContact CG-CB 3.42Å; D46-S49 PolarHBondContact O-N 3.2Å; D46-S49 PolarHBondContact OD1-N 3.29Å; D46-S49 VanDerWaalsContact OD2-CB 3.29Å; D46-S49 WeakPolarHBondContact OD2-CB 3.36Å; D46-K50 WeakPolarHBondContact O-CB 3.36Å; D46-K50 VanDerWaalsContact O-CG 3.29Å; D46-K50 WeakPolarHBondContact O-CG 3.48Å; D46-K50 PolarHBondContact O-N 2.73Å
47Y89.1Confident83.5Confident14 Ų1469.6 Ų69.66%0.05539%0.385CS..Hα-helixtrans-58.5-41.5179.3-93.4-113.6000112.5L36 P37 L42 V45 K50 C51 H137L36-Y47 HydrophobicContact CB-CE1 4.13Å; L36-Y47 HydrophobicContact CD1-CD1 4.49Å; L36-Y47 HydrophobicContact CD2-CD1 3.89Å; L36-Y47 HydrophobicContact CD2-CD2 4.37Å; L36-Y47 HydrophobicContact CD2-CE1 4.17Å; L36-Y47 HydrophobicContact CD2-CG 4.04Å; P37-Y47 PolarHBondContact O-OH 2.87Å; L42-Y47 HydrophobicContact CD2-CD1 4.34Å; L42-Y47 HydrophobicContact CD2-CD2 3.78Å; L42-Y47 HydrophobicContact CD2-CE1 3.91Å; L42-Y47 HydrophobicContact CD2-CE2 3.34Å; L42-Y47 HydrophobicContact CD2-CG 4.24Å; L42-Y47 HydrophobicContact CG-CE2 4.19Å; V45-Y47 HydrophobicContact CB-CD2 4.34Å; V45-Y47 HydrophobicContact CB-CE2 4.39Å; V45-Y47 HydrophobicContact CG1-CD2 4.44Å; V45-Y47 WeakPolarHBondContact O-CD2 3.33Å; V45-Y47 PolarHBondContact O-N 2.81Å; Y47-K50 PolarHBondContact O-N 3.46Å; Y47-C51 VanDerWaalsContact O-CB 3.28Å; Y47-C51 WeakPolarHBondContact O-CB 3.5Å; Y47-C51 PolarHBondContact O-N 2.91Å; Y47-C51 PolarHBondContact O-SG 3.24Å; Y47-C51 VanDerWaalsContact O-SG 3.38Å; Y47-H137 AromaticContact CD1-CD2 3.67Å
48T90.2Very high84.5Confident71 Ų7168 Ų6844%0.43638%0.375SS..Hα-helixtrans-63-49.4-179-57.60000110.1D46 K50 N52 H137 F138D46-T48 VanDerWaalsContact C-N 3.3Å; D46-T48 PolarHBondContact O-N 3.12Å; D46-T48 WeakPolarHBondContact OD1-CB 3.32Å; D46-T48 PolarHBondContact OD1-N 2.98Å; D46-T48 VanDerWaalsContact OD1-N 3.11Å; T48-K50 PolarHBondContact O-N 3.43Å; T48-N52 VanDerWaalsContact O-CB 3.3Å; T48-N52 WeakPolarHBondContact O-CB 3.29Å; T48-N52 PolarHBondContact O-N 3.15Å; T48-H137 PolarHBondContact OG1-O 3.43Å; T48-F138 HydrophobicContact CG2-CD2 4.11Å
49S92Very high85.7Confident59 Ų5966.2 Ų66.241%0.41336%0.362SS..Hα-helixtrans-63.1-40.1178.1-177.50000112.4D46 T53D46-S49 VanDerWaalsContact CG-CB 3.42Å; D46-S49 PolarHBondContact O-N 3.2Å; D46-S49 PolarHBondContact OD1-N 3.29Å; D46-S49 VanDerWaalsContact OD2-CB 3.29Å; D46-S49 WeakPolarHBondContact OD2-CB 3.36Å; S49-T53 WeakPolarHBondContact O-CB 3.21Å; S49-T53 PolarHBondContact O-N 3.19Å; S49-T53 PolarHBondContact O-OG1 2.96Å
50K92.7Very high87.3Confident89 Ų8966 Ų6639%0.38736%0.355SS..Hα-helixtrans-67.9-49.2179.6-72-69.4180-1800112L36 V45 D46 Y47 T48 N52 T53 F54L36-K50 HydrophobicContact CD2-CB 3.61Å; L36-K50 HydrophobicContact CD2-CG 4.29Å; V45-K50 HydrophobicContact CG1-CG 3.78Å; D46-K50 WeakPolarHBondContact O-CB 3.36Å; D46-K50 VanDerWaalsContact O-CG 3.29Å; D46-K50 WeakPolarHBondContact O-CG 3.48Å; D46-K50 PolarHBondContact O-N 2.73Å; Y47-K50 PolarHBondContact O-N 3.46Å; T48-K50 PolarHBondContact O-N 3.43Å; K50-N52 VanDerWaalsContact C-N 3.32Å; K50-N52 PolarHBondContact O-N 3.22Å; K50-T53 PolarHBondContact O-N 2.86Å; K50-F54 WeakPolarHBondContact O-CB 3.37Å; K50-F54 PolarHBondContact O-N 2.91Å
51C94.1Very high88.9Confident0 Ų065.5 Ų65.50%034%0.339CS..Hα-helixtrans-59-42.9175.6-75.10000112Y47 F54 V55 C134 F138Y47-C51 VanDerWaalsContact O-CB 3.28Å; Y47-C51 WeakPolarHBondContact O-CB 3.5Å; Y47-C51 PolarHBondContact O-N 2.91Å; Y47-C51 PolarHBondContact O-SG 3.24Å; Y47-C51 VanDerWaalsContact O-SG 3.38Å; C51-F54 PolarHBondContact O-N 3.45Å; C51-V55 WeakPolarHBondContact O-CB 3.43Å; C51-V55 WeakPolarHBondContact O-CG2 3.26Å; C51-V55 PolarHBondContact O-N 3.32Å; C51-C134 HydrophobicContact CB-CB 3.75Å; C51-C134 WeakPolarHBondContact CB-SG 3.44Å; C51-C134 WeakPolarHBondContact SG-CB 3.3Å; C51-C134 CovalentContact SG-SG 2.04Å; C51-C134 PolarHBondContact SG-SG 3.43Å; C51-F138 HydrophobicContact CB-CB 3.73Å; C51-F138 HydrophobicContact CB-CD1 3.58Å; C51-F138 HydrophobicContact CB-CD2 4.42Å; C51-F138 HydrophobicContact CB-CE1 4.32Å; C51-F138 HydrophobicContact CB-CG 3.65Å
52N95.2Very high90.3Very high64 Ų6460.8 Ų60.834%0.34232%0.319SS..Hα-helixtrans-60.9-46.4175.8-174.646.1000111.9T48 K50 F54 V55 N56 F138T48-N52 VanDerWaalsContact O-CB 3.3Å; T48-N52 WeakPolarHBondContact O-CB 3.29Å; T48-N52 PolarHBondContact O-N 3.15Å; K50-N52 VanDerWaalsContact C-N 3.32Å; K50-N52 PolarHBondContact O-N 3.22Å; N52-F54 VanDerWaalsContact C-N 3.33Å; N52-F54 PolarHBondContact O-N 3.43Å; N52-V55 PolarHBondContact O-N 3.04Å; N52-N56 WeakPolarHBondContact O-CB 3.34Å; N52-N56 VanDerWaalsContact O-CG 3.26Å; N52-N56 PolarHBondContact O-N 3.02Å; N52-N56 PolarHBondContact O-ND2 3.31Å; N52-N56 PolarHBondContact OD1-ND2 3.42Å; N52-F138 HydrophobicContact CB-CD2 4.37Å; N52-F138 HydrophobicContact CB-CE2 3.61Å; N52-F138 HydrophobicContact CB-CZ 3.85Å
53T95Very high91.9Very high79 Ų7963.8 Ų63.849%0.48533%0.331SS..Hα-helixtrans-59.8-45.8178-57.40000111.1S49 K50 N56 K57S49-T53 WeakPolarHBondContact O-CB 3.21Å; S49-T53 PolarHBondContact O-N 3.19Å; S49-T53 PolarHBondContact O-OG1 2.96Å; K50-T53 PolarHBondContact O-N 2.86Å; T53-N56 PolarHBondContact O-N 3.19Å; T53-K57 WeakPolarHBondContact O-CB 3.44Å; T53-K57 PolarHBondContact O-N 3.44Å
54F95.2Very high93.3Very high2 Ų259.9 Ų59.91%0.00931%0.306CS..Hα-helixtrans-65-44.8-179.8-162.5-86.7000112.1V28 E31 L32 K50 C51 N52 K57 M58 I130V28-F54 HydrophobicContact CB-CE1 4.49Å; V28-F54 HydrophobicContact CB-CZ 4.42Å; V28-F54 HydrophobicContact CG1-CE1 3.97Å; V28-F54 HydrophobicContact CG1-CZ 4.29Å; V28-F54 HydrophobicContact CG2-CE1 4.2Å; V28-F54 HydrophobicContact CG2-CZ 4.23Å; E31-F54 HydrophobicContact CB-CE2 3.66Å; E31-F54 HydrophobicContact CB-CZ 4.12Å; L32-F54 HydrophobicContact CD1-CE1 4.38Å; L32-F54 HydrophobicContact CD2-CB 4.25Å; L32-F54 HydrophobicContact CD2-CD1 3.75Å; L32-F54 HydrophobicContact CD2-CD2 4.04Å; L32-F54 HydrophobicContact CD2-CE1 4.11Å; L32-F54 HydrophobicContact CD2-CE2 4.38Å; L32-F54 HydrophobicContact CD2-CG 3.72Å; L32-F54 HydrophobicContact CD2-CZ 4.42Å; L32-F54 HydrophobicContact CG-CD1 4.17Å; L32-F54 HydrophobicContact CG-CD2 4.49Å; L32-F54 HydrophobicContact CG-CE1 4Å; L32-F54 HydrophobicContact CG-CE2 4.34Å; L32-F54 HydrophobicContact CG-CG 4.42Å; L32-F54 HydrophobicContact CG-CZ 4.1Å; K50-F54 WeakPolarHBondContact O-CB 3.37Å; K50-F54 PolarHBondContact O-N 2.91Å; C51-F54 PolarHBondContact O-N 3.45Å; N52-F54 VanDerWaalsContact C-N 3.33Å; N52-F54 PolarHBondContact O-N 3.43Å; F54-K57 PolarHBondContact O-N 2.88Å; F54-M58 HydrophobicContact CD1-CG 3.9Å; F54-M58 HydrophobicContact CE1-CG 3.55Å; F54-M58 HydrophobicContact CE1-SD 4.22Å; F54-M58 HydrophobicContact CZ-CG 4.21Å; F54-M58 HydrophobicContact CZ-SD 4.37Å; F54-M58 WeakPolarHBondContact O-CG 3.29Å; F54-M58 PolarHBondContact O-N 2.88Å; F54-I130 HydrophobicContact CD1-CD1 3.84Å; F54-I130 HydrophobicContact CD1-CG1 3.95Å; F54-I130 HydrophobicContact CD1-CG2 4.37Å; F54-I130 HydrophobicContact CE1-CD1 3.75Å; F54-I130 HydrophobicContact CE1-CG1 3.82Å
55V96.3Very high94.3Very high0 Ų052 Ų520%027%0.272CS..Hα-helixtrans-60.2-47.1176.4164.70000111.3C51 N52 K57 M58 L59 F127 I130 F138 V142 F143C51-V55 WeakPolarHBondContact O-CB 3.43Å; C51-V55 WeakPolarHBondContact O-CG2 3.26Å; C51-V55 PolarHBondContact O-N 3.32Å; N52-V55 PolarHBondContact O-N 3.04Å; V55-K57 VanDerWaalsContact C-N 3.33Å; V55-K57 PolarHBondContact O-N 2.53Å; V55-M58 PolarHBondContact O-N 3.43Å; V55-L59 HydrophobicContact CG1-CD1 3.76Å; V55-L59 HydrophobicContact CG1-CG 4.24Å; V55-L59 WeakPolarHBondContact O-CB 3.44Å; V55-L59 WeakPolarHBondContact O-CG 3.26Å; V55-L59 PolarHBondContact O-N 3.42Å; V55-F127 HydrophobicContact CG1-CE1 4.21Å; V55-F127 HydrophobicContact CG2-CE1 4.46Å; V55-I130 HydrophobicContact CG2-CG2 3.71Å; V55-F138 HydrophobicContact CB-CE1 4.28Å; V55-F138 HydrophobicContact CG2-CE1 3.88Å; V55-V142 HydrophobicContact CG1-CG1 4.24Å; V55-F143 HydrophobicContact CG2-CE1 4.35Å; V55-F143 HydrophobicContact CG2-CZ 3.69Å
56N97Very high95.2Very high74 Ų7451.1 Ų51.140%0.39627%0.266SS..Hα-helixtrans-62.9-40.5179.6-69.7-32.8000112.2N52 T53 L59 S60N52-N56 WeakPolarHBondContact O-CB 3.34Å; N52-N56 VanDerWaalsContact O-CG 3.26Å; N52-N56 PolarHBondContact O-N 3.02Å; N52-N56 PolarHBondContact O-ND2 3.31Å; N52-N56 PolarHBondContact OD1-ND2 3.42Å; T53-N56 PolarHBondContact O-N 3.19Å; N56-L59 PolarHBondContact O-N 3.18Å; N56-S60 PolarHBondContact O-N 3.39Å
57K96.5Very high95.6Very high69 Ų6949.6 Ų49.630%0.326%0.258SS..Hα-helixtrans-59.6-49.5174.3179.8-173.4175.6-162.40111.2E31 T53 F54 V55 S60 Y61E31-K57 IonicContact OE2-NZ 2.98Å; E31-K57 PolarHBondContact OE2-NZ 2.65Å; T53-K57 WeakPolarHBondContact O-CB 3.44Å; T53-K57 PolarHBondContact O-N 3.44Å; F54-K57 PolarHBondContact O-N 2.88Å; V55-K57 VanDerWaalsContact C-N 3.33Å; V55-K57 PolarHBondContact O-N 2.53Å; K57-S60 PolarHBondContact O-N 3.28Å; K57-Y61 HydrophobicContact CD-CE2 4.25Å; K57-Y61 WeakPolarHBondContact CE-OH 3.3Å; K57-Y61 HydrophobicContact CG-CD2 4.42Å; K57-Y61 HydrophobicContact CG-CE1 4.32Å; K57-Y61 HydrophobicContact CG-CE2 3.76Å; K57-Y61 PolarHBondContact O-N 3.4Å; K57-Y61 VanDerWaalsContact O-N 3.12Å
58M97.4Very high96Very high0 Ų049.7 Ų49.70%026%0.261CS..Hα-helixtrans-65-43.3-179.8-70.4-57.9-60.500112D25 V28 F54 V55 S60 Y61 H62 A126 F127 I130D25-M58 HydrophobicContact CB-CE 4.44Å; D25-M58 WeakPolarHBondContact OD1-CE 3.37Å; V28-M58 HydrophobicContact CG2-CE 3.72Å; V28-M58 HydrophobicContact CG2-SD 4.09Å; F54-M58 HydrophobicContact CD1-CG 3.9Å; F54-M58 HydrophobicContact CE1-CG 3.55Å; F54-M58 HydrophobicContact CE1-SD 4.22Å; F54-M58 HydrophobicContact CZ-CG 4.21Å; F54-M58 HydrophobicContact CZ-SD 4.37Å; F54-M58 WeakPolarHBondContact O-CG 3.29Å; F54-M58 PolarHBondContact O-N 2.88Å; V55-M58 PolarHBondContact O-N 3.43Å; M58-S60 VanDerWaalsContact C-N 3.31Å; M58-S60 PolarHBondContact O-N 2.72Å; M58-Y61 PolarHBondContact O-N 2.84Å; M58-Y61 VanDerWaalsContact O-N 3.17Å; M58-Y61 HydrophobicContact SD-CD2 4.22Å; M58-H62 VanDerWaalsContact C-CD2 3.5Å; M58-H62 WeakPolarHBondContact O-CB 3.39Å; M58-H62 PolarHBondContact O-CD2 3.06Å; M58-H62 PolarHBondContact O-N 3.35Å; M58-A126 HydrophobicContact CE-CB 4.19Å; M58-F127 HydrophobicContact CB-CE1 4.25Å; M58-F127 HydrophobicContact CB-CZ 4.15Å; M58-I130 HydrophobicContact CB-CD1 4.26Å; M58-I130 HydrophobicContact CG-CD1 3.94Å
59L97.5Very high96.4Very high57 Ų5746.3 Ų46.330%0.29824%0.241SC..Hα-helixtrans-56-45.1174.7-75.7171.7000111.8V55 N56 Y61 H62 E63 F127 V142V55-L59 HydrophobicContact CG1-CD1 3.76Å; V55-L59 HydrophobicContact CG1-CG 4.24Å; V55-L59 WeakPolarHBondContact O-CB 3.44Å; V55-L59 WeakPolarHBondContact O-CG 3.26Å; V55-L59 PolarHBondContact O-N 3.42Å; N56-L59 PolarHBondContact O-N 3.18Å; L59-Y61 PolarHBondContact O-N 2.87Å; L59-H62 PolarHBondContact O-N 3.07Å; L59-E63 VanDerWaalsContact O-CB 3.31Å; L59-E63 WeakPolarHBondContact O-CB 3.39Å; L59-E63 PolarHBondContact O-N 3.37Å; L59-F127 HydrophobicContact CD2-CE1 4.34Å; L59-F127 HydrophobicContact CD2-CE2 3.93Å; L59-F127 HydrophobicContact CD2-CZ 3.46Å; L59-F127 VanDerWaalsContact CD2-CZ 3.46Å; L59-F127 HydrophobicContact CG-CE1 4.28Å; L59-F127 HydrophobicContact CG-CZ 3.67Å; L59-V142 HydrophobicContact CD2-CG2 4.24Å
60S97.5Very high96.7Very high66 Ų6648.5 Ų48.546%0.46224%0.243SC..Hα-helixtrans-62.5-40.8177.51780000112.5N56 K57 M58 K64N56-S60 PolarHBondContact O-N 3.39Å; K57-S60 PolarHBondContact O-N 3.28Å; M58-S60 VanDerWaalsContact C-N 3.31Å; M58-S60 PolarHBondContact O-N 2.72Å; S60-K64 WeakPolarHBondContact O-CB 3.4Å; S60-K64 PolarHBondContact O-N 2.86Å
61Y97.2Very high97Very high90 Ų9048.7 Ų48.735%0.35325%0.248SC..Hα-helixtrans-64.4-46.5175.7-65-13.1000111.9K57 M58 L59 K64 R65K57-Y61 HydrophobicContact CD-CE2 4.25Å; K57-Y61 WeakPolarHBondContact CE-OH 3.3Å; K57-Y61 HydrophobicContact CG-CD2 4.42Å; K57-Y61 HydrophobicContact CG-CE1 4.32Å; K57-Y61 HydrophobicContact CG-CE2 3.76Å; K57-Y61 PolarHBondContact O-N 3.4Å; K57-Y61 VanDerWaalsContact O-N 3.12Å; M58-Y61 PolarHBondContact O-N 2.84Å; M58-Y61 VanDerWaalsContact O-N 3.17Å; M58-Y61 HydrophobicContact SD-CD2 4.22Å; L59-Y61 PolarHBondContact O-N 2.87Å; Y61-K64 PolarHBondContact O-N 3.03Å; Y61-R65 WeakPolarHBondContact O-CG 3.44Å; Y61-R65 PolarHBondContact O-N 3.22Å
62H97.9Very high97.2Very high3 Ų348.7 Ų48.71%0.01425%0.248CC..Hα-helixtrans-61.4-43.5177.4-66.6-48.5000112.6D25 M58 L59 R65 T66 E119 Q123 F127D25-H62 IonicContact OD1-CE1 3.61Å; D25-H62 PolarHBondContact OD1-CE1 2.98Å; D25-H62 IonicContact OD1-ND1 2.73Å; D25-H62 PolarHBondContact OD1-ND1 3.5Å; D25-H62 IonicContact OD1-NE2 3.1Å; M58-H62 VanDerWaalsContact C-CD2 3.5Å; M58-H62 WeakPolarHBondContact O-CB 3.39Å; M58-H62 PolarHBondContact O-CD2 3.06Å; M58-H62 PolarHBondContact O-N 3.35Å; L59-H62 PolarHBondContact O-N 3.07Å; H62-R65 PolarHBondContact CE1-NH2 3.29Å; H62-R65 PolarHBondContact ND1-NH2 3.46Å; H62-R65 PolarHBondContact O-N 2.77Å; H62-T66 VanDerWaalsContact O-CB 3.26Å; H62-T66 WeakPolarHBondContact O-CB 3.49Å; H62-T66 PolarHBondContact O-N 3.49Å; H62-T66 PolarHBondContact O-OG1 2.98Å; H62-E119 IonicContact ND1-OE1 3.8Å; H62-Q123 HydrophobicContact CB-CG 3.8Å; H62-Q123 VanDerWaalsContact CG-CG 3.47Å; H62-Q123 VanDerWaalsContact ND1-CG 3.3Å; H62-Q123 WeakPolarHBondContact ND1-CG 3.44Å; H62-F127 AromaticContact CD2-CE2 3.29Å; H62-F127 WeakPolarHBondContact CD2-CE2 3.5Å; H62-F127 AromaticContact CD2-CZ 3.61Å; H62-F127 AromaticContact NE2-CE2 3.51Å; H62-F127 AromaticContact NE2-CZ 3.94Å
63E97.4Very high97.3Very high121 Ų12147 Ų4757%0.56524%0.239SC*.Hα-helixtrans-61.7-48.6176.7-179.4177.6-156.500110.9L59 R65 T66 N67L59-E63 VanDerWaalsContact O-CB 3.31Å; L59-E63 WeakPolarHBondContact O-CB 3.39Å; L59-E63 PolarHBondContact O-N 3.37Å; E63-R65 VanDerWaalsContact C-N 3.32Å; E63-R65 PolarHBondContact O-N 3.22Å; E63-T66 PolarHBondContact O-N 3.36Å; E63-N67 WeakPolarHBondContact O-CB 2.97Å; E63-N67 VanDerWaalsContact O-CG 3.27Å; E63-N67 PolarHBondContact O-N 3.46Å; E63-N67 PolarHBondContact O-ND2 3.23Å
64K96.7Very high97.5Very high90 Ų9049.4 Ų49.439%0.39124%0.243SC..Hα-helixtrans-55.5-47.5177.7-177.7175.9177176.80111.4D4 S60 Y61 A68D4-K64 IonicContact OD1-NZ 3.09Å; D4-K64 PolarHBondContact OD1-NZ 3.36Å; D4-K64 IonicContact OD2-NZ 3.27Å; S60-K64 WeakPolarHBondContact O-CB 3.4Å; S60-K64 PolarHBondContact O-N 2.86Å; Y61-K64 PolarHBondContact O-N 3.03Å; K64-A68 WeakPolarHBondContact O-CB 3.49Å; K64-A68 PolarHBondContact O-N 3.36Å
65R97.5Very high97.6Very high4 Ų452.7 Ų52.72%0.01526%0.26CS..Hα-helixtrans-67.9-44.4179.6-65-167.2-56.8-111.46.9112.3L18 W21 D25 Y61 H62 E63 N67 A68 I69 E119L18-R65 HydrophobicContact CD2-CB 4.48Å; W21-R65 HydrophobicContact CB-CG 4.33Å; W21-R65 HydrophobicContact CE3-CG 3.96Å; W21-R65 PolarHBondContact O-NH1 2.85Å; D25-R65 VanDerWaalsContact CG-NH2 3.31Å; D25-R65 IonicContact OD1-CZ 3.22Å; D25-R65 IonicContact OD1-NH1 3.65Å; D25-R65 IonicContact OD1-NH2 2.84Å; D25-R65 PolarHBondContact OD1-NH2 3.22Å; D25-R65 IonicContact OD2-CZ 3.43Å; D25-R65 VanDerWaalsContact OD2-CZ 3.31Å; D25-R65 IonicContact OD2-NH1 3.97Å; D25-R65 PolarHBondContact OD2-NH1 3.17Å; D25-R65 IonicContact OD2-NH2 3.82Å; D25-R65 PolarHBondContact OD2-NH2 3.35Å; D25-R65 VanDerWaalsContact OD2-NH2 3.13Å; Y61-R65 WeakPolarHBondContact O-CG 3.44Å; Y61-R65 PolarHBondContact O-N 3.22Å; H62-R65 PolarHBondContact CE1-NH2 3.29Å; H62-R65 PolarHBondContact ND1-NH2 3.46Å; H62-R65 PolarHBondContact O-N 2.77Å; E63-R65 VanDerWaalsContact C-N 3.32Å; E63-R65 PolarHBondContact O-N 3.22Å; R65-N67 VanDerWaalsContact C-N 3.32Å; R65-N67 PolarHBondContact O-N 3.33Å; R65-A68 PolarHBondContact O-N 2.92Å; R65-I69 VanDerWaalsContact O-CG1 3.3Å; R65-I69 WeakPolarHBondContact O-CG1 3.44Å; R65-I69 PolarHBondContact O-N 2.88Å; R65-E119 IonicContact CZ-OE1 3.39Å; R65-E119 VanDerWaalsContact CZ-OE1 3.27Å; R65-E119 IonicContact NE-OE1 3.72Å; R65-E119 PolarHBondContact NE-OE1 2.93Å; R65-E119 IonicContact NE-OE2 2.65Å; R65-E119 PolarHBondContact NE-OE2 3.13Å; R65-E119 IonicContact NH2-OE1 3.27Å; R65-E119 PolarHBondContact NH2-OE1 3.23Å; R65-E119 IonicContact NH2-OE2 3.49Å
66T98.1Very high97.6Very high20 Ų2052.7 Ų52.712%0.12326%0.26CS..Hα-helixtrans-59.2-45.4178.7-60.10000111H62 E63 I69 K70 L116 Q123H62-T66 VanDerWaalsContact O-CB 3.26Å; H62-T66 WeakPolarHBondContact O-CB 3.49Å; H62-T66 PolarHBondContact O-N 3.49Å; H62-T66 PolarHBondContact O-OG1 2.98Å; E63-T66 PolarHBondContact O-N 3.36Å; T66-I69 PolarHBondContact O-N 3.09Å; T66-K70 HydrophobicContact CG2-CD 4.06Å; T66-K70 WeakPolarHBondContact O-CB 3.35Å; T66-K70 WeakPolarHBondContact O-CG 3.5Å; T66-K70 PolarHBondContact O-N 3.49Å; T66-L116 HydrophobicContact CG2-CD1 4.06Å; T66-Q123 PolarHBondContact OG1-NE2 2.93Å
67N97.7Very high97.7Very high70 Ų7050.6 Ų50.637%0.37425%0.253SS..Hα-helixtrans-64.6-45.8178.2-70-16.1000111E63 R65 I69 K70 D71E63-N67 WeakPolarHBondContact O-CB 2.97Å; E63-N67 VanDerWaalsContact O-CG 3.27Å; E63-N67 PolarHBondContact O-N 3.46Å; E63-N67 PolarHBondContact O-ND2 3.23Å; R65-N67 VanDerWaalsContact C-N 3.32Å; R65-N67 PolarHBondContact O-N 3.33Å; N67-I69 VanDerWaalsContact C-N 3.32Å; N67-I69 PolarHBondContact O-N 2.91Å; N67-K70 PolarHBondContact O-N 3.23Å; N67-D71 WeakPolarHBondContact O-CB 3.48Å; N67-D71 VanDerWaalsContact O-CG 3.26Å; N67-D71 PolarHBondContact O-N 3.37Å
68A97.6Very high97.7Very high15 Ų1552 Ų5212%0.12426%0.26CS..Hα-helixtrans-59.6-40.4177.200000113L6 W21 K64 R65 C72L6-A68 HydrophobicContact CD1-CB 3.74Å; L6-A68 HydrophobicContact CG-CB 3.99Å; W21-A68 HydrophobicContact CZ3-CB 4.22Å; K64-A68 WeakPolarHBondContact O-CB 3.49Å; K64-A68 PolarHBondContact O-N 3.36Å; R65-A68 PolarHBondContact O-N 2.92Å; A68-C72 PolarHBondContact O-N 3.38Å; A68-C72 VanDerWaalsContact O-N 3.17Å
69I98.4Very high97.6Very high0 Ų056.8 Ų56.80%028%0.278CS..Hα-helixtrans-66.7-45.7176-65163.4000110.4L6 L18 R65 T66 N67 D71 C72 I73 F112 E115 L116 E119L6-I69 HydrophobicContact CD1-CG1 4.23Å; L18-I69 HydrophobicContact CD1-CD1 4.23Å; L18-I69 HydrophobicContact CD1-CG1 4.11Å; L18-I69 HydrophobicContact CD2-CD1 4.03Å; L18-I69 HydrophobicContact CD2-CG1 4.06Å; R65-I69 VanDerWaalsContact O-CG1 3.3Å; R65-I69 WeakPolarHBondContact O-CG1 3.44Å; R65-I69 PolarHBondContact O-N 2.88Å; T66-I69 PolarHBondContact O-N 3.09Å; N67-I69 VanDerWaalsContact C-N 3.32Å; N67-I69 PolarHBondContact O-N 2.91Å; I69-D71 VanDerWaalsContact C-N 3.31Å; I69-D71 PolarHBondContact O-N 3.26Å; I69-C72 PolarHBondContact O-N 3.25Å; I69-I73 HydrophobicContact CG2-CD1 4.15Å; I69-I73 WeakPolarHBondContact O-CG1 3.32Å; I69-I73 PolarHBondContact O-N 3.24Å; I69-F112 WeakPolarHBondContact CG2-O 3.4Å; I69-E115 HydrophobicContact CD1-CB 4.37Å; I69-E115 HydrophobicContact CG2-CB 4.3Å; I69-L116 HydrophobicContact CG2-CB 3.87Å; I69-L116 HydrophobicContact CG2-CD1 4.31Å; I69-E119 HydrophobicContact CD1-CB 3.95Å; I69-E119 HydrophobicContact CD1-CG 4.26Å
70K98.4Very high97.6Very high105 Ų10554.8 Ų54.846%0.45727%0.268SS..Hα-helixtrans-61.2-38.8177.8-76.2177.5179175.90112.3T66 N67 I73 K74 L116T66-K70 HydrophobicContact CG2-CD 4.06Å; T66-K70 WeakPolarHBondContact O-CB 3.35Å; T66-K70 WeakPolarHBondContact O-CG 3.5Å; T66-K70 PolarHBondContact O-N 3.49Å; N67-K70 PolarHBondContact O-N 3.23Å; K70-I73 WeakPolarHBondContact O-CB 3.42Å; K70-I73 PolarHBondContact O-N 3.48Å; K70-K74 WeakPolarHBondContact O-CB 3.42Å; K70-K74 PolarHBondContact O-N 3.14Å; K70-L116 HydrophobicContact CG-CD1 4.2Å; K70-L116 HydrophobicContact CG-CD2 4.42Å
71D97.7Very high97.5Very high93 Ų9355.5 Ų55.550%0.49727%0.266SS..Hα-helixtrans-62.5-43175-71.6-21.2000111.1N67 I69 K74 L75N67-D71 WeakPolarHBondContact O-CB 3.48Å; N67-D71 VanDerWaalsContact O-CG 3.26Å; N67-D71 PolarHBondContact O-N 3.37Å; I69-D71 VanDerWaalsContact C-N 3.31Å; I69-D71 PolarHBondContact O-N 3.26Å; D71-K74 PolarHBondContact O-N 2.84Å; D71-L75 WeakPolarHBondContact O-CB 3.19Å; D71-L75 VanDerWaalsContact O-CG 3.3Å; D71-L75 WeakPolarHBondContact O-CG 3.38Å; D71-L75 PolarHBondContact O-N 3.34Å
72C98Very high97.4Very high0 Ų054 Ų540%027%0.272CS..Hα-helixtrans-64.5-38.8174.1-70.20000113.3C8 A68 I69 T76 F112C8-C72 VanDerWaalsContact CA-SG 3.54Å; C8-C72 HydrophobicContact CB-CB 3.63Å; C8-C72 WeakPolarHBondContact CB-SG 3.5Å; C8-C72 WeakPolarHBondContact SG-CA 3.3Å; C8-C72 WeakPolarHBondContact SG-CB 3.45Å; C8-C72 CovalentContact SG-SG 2.04Å; C8-C72 PolarHBondContact SG-SG 2.8Å; A68-C72 PolarHBondContact O-N 3.38Å; A68-C72 VanDerWaalsContact O-N 3.17Å; I69-C72 PolarHBondContact O-N 3.25Å; C72-T76 VanDerWaalsContact O-CB 3.24Å; C72-T76 WeakPolarHBondContact O-CB 3.26Å; C72-T76 PolarHBondContact O-N 2.95Å; C72-T76 PolarHBondContact O-OG1 3.23Å; C72-F112 HydrophobicContact CB-CD1 3.81Å; C72-F112 HydrophobicContact CB-CD2 3.95Å; C72-F112 HydrophobicContact CB-CE1 3.77Å; C72-F112 HydrophobicContact CB-CE2 3.9Å; C72-F112 HydrophobicContact CB-CG 3.91Å; C72-F112 HydrophobicContact CB-CZ 3.83Å
73I98.5Very high97.1Very high30 Ų3055.8 Ų55.815%0.15428%0.281CS..Hα-helixtrans-59.8-49.7173.5-68.4171.4000109.7I69 K70 T76 A77 L109 F112 Q113 L116I69-I73 HydrophobicContact CG2-CD1 4.15Å; I69-I73 WeakPolarHBondContact O-CG1 3.32Å; I69-I73 PolarHBondContact O-N 3.24Å; K70-I73 WeakPolarHBondContact O-CB 3.42Å; K70-I73 PolarHBondContact O-N 3.48Å; I73-T76 PolarHBondContact O-N 3.26Å; I73-A77 VanDerWaalsContact O-CB 3.28Å; I73-A77 WeakPolarHBondContact O-CB 3.43Å; I73-A77 PolarHBondContact O-N 2.93Å; I73-L109 HydrophobicContact CB-CD1 4.48Å; I73-L109 HydrophobicContact CG2-CD1 3.88Å; I73-F112 HydrophobicContact CG1-CB 3.65Å; I73-Q113 HydrophobicContact CD1-CG 4.23Å; I73-Q113 HydrophobicContact CG1-CG 4.47Å; I73-L116 HydrophobicContact CD1-CB 4.13Å; I73-L116 HydrophobicContact CD1-CD2 3.93Å
74K98.2Very high96.8Very high129 Ų12953.5 Ų53.556%0.56127%0.271SS*.Hα-helixtrans-59.3-53.4-180-178.5-179.2173.4-175.40111.5K70 D71 T76 A77 E78K70-K74 WeakPolarHBondContact O-CB 3.42Å; K70-K74 PolarHBondContact O-N 3.14Å; D71-K74 PolarHBondContact O-N 2.84Å; K74-T76 VanDerWaalsContact C-N 3.3Å; K74-T76 PolarHBondContact O-N 3.42Å; K74-A77 PolarHBondContact O-N 3.17Å; K74-E78 WeakPolarHBondContact CE-OE1 3.47Å; K74-E78 WeakPolarHBondContact CG-OE1 3.23Å; K74-E78 WeakPolarHBondContact O-CG 3.34Å; K74-E78 PolarHBondContact O-N 3.18Å
75L97.3Very high96.6Very high70 Ų7057.2 Ų57.237%0.36628%0.282SS..Hα-helixtrans-59.4-41.5179.7-71.9170.2000112D71 R79D71-L75 WeakPolarHBondContact O-CB 3.19Å; D71-L75 VanDerWaalsContact O-CG 3.3Å; D71-L75 WeakPolarHBondContact O-CG 3.38Å; D71-L75 PolarHBondContact O-N 3.34Å; L75-R79 WeakPolarHBondContact O-CB 3.45Å; L75-R79 WeakPolarHBondContact O-CD 3.24Å; L75-R79 VanDerWaalsContact O-CG 3.25Å; L75-R79 WeakPolarHBondContact O-CG 3.44Å; L75-R79 PolarHBondContact O-N 2.91Å; L75-R79 VanDerWaalsContact O-N 3.1Å
76T97.3Very high96.1Very high0 Ų059.4 Ų59.40%030%0.298CS..Hα-helixtrans-69.7-39.6179.7-53.80000111.4C72 I73 K74 R79 L80 K105 L108 L109C72-T76 VanDerWaalsContact O-CB 3.24Å; C72-T76 WeakPolarHBondContact O-CB 3.26Å; C72-T76 PolarHBondContact O-N 2.95Å; C72-T76 PolarHBondContact O-OG1 3.23Å; I73-T76 PolarHBondContact O-N 3.26Å; K74-T76 VanDerWaalsContact C-N 3.3Å; K74-T76 PolarHBondContact O-N 3.42Å; T76-R79 PolarHBondContact O-N 2.77Å; T76-L80 WeakPolarHBondContact O-CB 3.44Å; T76-L80 PolarHBondContact O-N 3.36Å; T76-K105 WeakPolarHBondContact CG2-O 3.47Å; T76-L108 HydrophobicContact CG2-CB 4.1Å; T76-L108 HydrophobicContact CG2-CD2 4.06Å; T76-L108 HydrophobicContact CG2-CG 3.99Å; T76-L109 HydrophobicContact CG2-CB 3.89Å
77A98.1Very high95.5Very high30 Ų3060.1 Ų60.125%0.24830%0.304CS..Hα-helixtrans-64.5-44.9176.200000112I73 K74 R79 L80 I81 L109I73-A77 VanDerWaalsContact O-CB 3.28Å; I73-A77 WeakPolarHBondContact O-CB 3.43Å; I73-A77 PolarHBondContact O-N 2.93Å; K74-A77 PolarHBondContact O-N 3.17Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 2.98Å; A77-L80 PolarHBondContact O-N 3.41Å; A77-I81 WeakPolarHBondContact O-CG1 3.38Å; A77-I81 PolarHBondContact O-N 2.96Å; A77-L109 HydrophobicContact CB-CD1 4.2Å; A77-L109 HydrophobicContact CB-CD2 4.44Å
78E97.6Very high94.8Very high100 Ų10064.2 Ų64.247%0.46732%0.321SS..Hα-helixtrans-59.7-44.6176.3-73.5172.3179.700111.6K74 I81 A82K74-E78 WeakPolarHBondContact CE-OE1 3.47Å; K74-E78 WeakPolarHBondContact CG-OE1 3.23Å; K74-E78 WeakPolarHBondContact O-CG 3.34Å; K74-E78 PolarHBondContact O-N 3.18Å; E78-I81 PolarHBondContact O-N 3.28Å; E78-A82 PolarHBondContact O-N 3.49Å
79R95.8Very high93.9Very high99 Ų9971 Ų7137%0.37435%0.354SS..Hα-helixtrans-65.4-38.3176.6-73168.1172.7177.8-11112.5D9 L75 T76 A77 A82 L83D9-R79 IonicContact OD1-CZ 3.77Å; D9-R79 IonicContact OD1-NH1 3.22Å; D9-R79 PolarHBondContact OD1-NH1 2.9Å; D9-R79 IonicContact OD2-CZ 3.31Å; D9-R79 IonicContact OD2-NH1 3.82Å; D9-R79 PolarHBondContact OD2-NH1 2.93Å; D9-R79 IonicContact OD2-NH2 2.77Å; D9-R79 PolarHBondContact OD2-NH2 3.01Å; L75-R79 WeakPolarHBondContact O-CB 3.45Å; L75-R79 WeakPolarHBondContact O-CD 3.24Å; L75-R79 VanDerWaalsContact O-CG 3.25Å; L75-R79 WeakPolarHBondContact O-CG 3.44Å; L75-R79 PolarHBondContact O-N 2.91Å; L75-R79 VanDerWaalsContact O-N 3.1Å; T76-R79 PolarHBondContact O-N 2.77Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 2.98Å; R79-A82 PolarHBondContact O-N 2.89Å; R79-L83 WeakPolarHBondContact O-CG 3.39Å; R79-L83 PolarHBondContact O-N 3.41Å
80L96Very high92.7Very high15 Ų1572.4 Ų72.48%0.07936%0.364CS..Hα-helixtrans-63.2-44.7175.9176.859.8000111.2T76 A77 A82 L83 Q84 I102 K105 Q106 L109T76-L80 WeakPolarHBondContact O-CB 3.44Å; T76-L80 PolarHBondContact O-N 3.36Å; A77-L80 PolarHBondContact O-N 3.41Å; L80-A82 VanDerWaalsContact C-N 3.32Å; L80-A82 PolarHBondContact O-N 3.29Å; L80-L83 PolarHBondContact O-N 3.44Å; L80-Q84 HydrophobicContact CD1-CG 4.37Å; L80-Q84 WeakPolarHBondContact O-CG 3.48Å; L80-Q84 PolarHBondContact O-N 2.92Å; L80-I102 HydrophobicContact CD1-CB 4.45Å; L80-I102 HydrophobicContact CD1-CG2 3.92Å; L80-K105 HydrophobicContact CB-CB 4.37Å; L80-K105 HydrophobicContact CD1-CB 4.17Å; L80-Q106 HydrophobicContact CD1-CG 3.76Å; L80-Q106 HydrophobicContact CD2-CG 3.73Å; L80-Q106 HydrophobicContact CG-CG 4.42Å; L80-L109 HydrophobicContact CD2-CD2 4.01Å
81I96.4Very high91.3Very high81 Ų8171.7 Ų71.742%0.41537%0.372SS..Hα-helixtrans-61.2-42.3176.4-67.8164.6000110.7A77 E78 Q84 R85A77-I81 WeakPolarHBondContact O-CG1 3.38Å; A77-I81 PolarHBondContact O-N 2.96Å; E78-I81 PolarHBondContact O-N 3.28Å; I81-Q84 PolarHBondContact O-N 2.95Å; I81-R85 WeakPolarHBondContact O-CG 3.48Å; I81-R85 PolarHBondContact O-N 2.97Å
82A94Very high89.7Confident59 Ų5973.9 Ų73.949%0.48838%0.384SS..Hα-helixtrans-61.7-43.817700000112.2E78 R79 L80 R85 S86E78-A82 PolarHBondContact O-N 3.49Å; R79-A82 PolarHBondContact O-N 2.89Å; L80-A82 VanDerWaalsContact C-N 3.32Å; L80-A82 PolarHBondContact O-N 3.29Å; A82-R85 PolarHBondContact O-N 2.9Å; A82-S86 PolarHBondContact O-N 3.04Å; A82-S86 PolarHBondContact O-OG 3.24Å
83L92.6Very high88Confident40 Ų4082.1 Ų82.121%0.20942%0.422CS..Hα-helixtrans-63-43.2176.3-74.1169.9000112R79 L80 R85 S86 S87 D101 I102 K105R79-L83 WeakPolarHBondContact O-CG 3.39Å; R79-L83 PolarHBondContact O-N 3.41Å; L80-L83 PolarHBondContact O-N 3.44Å; L83-R85 PolarHBondContact O-N 3.34Å; L83-S86 WeakPolarHBondContact CA-OG 3.28Å; L83-S86 PolarHBondContact O-N 2.9Å; L83-S86 PolarHBondContact O-OG 3.41Å; L83-S87 PolarHBondContact O-N 2.04Å; L83-D101 HydrophobicContact CD1-CB 4.23Å; L83-D101 HydrophobicContact CD2-CB 4.43Å; L83-I102 HydrophobicContact CB-CG1 3.8Å; L83-K105 HydrophobicContact CD1-CB 4.29Å; L83-K105 HydrophobicContact CD1-CG 3.6Å
84Q91.8Very high86.5Confident73 Ų7383.6 Ų83.634%0.34144%0.435SS..Hα-helixtrans-59.4-46.2176.9-73.5174.7-39.200111.5L80 I81 S86 S87 E88 I102L80-Q84 HydrophobicContact CD1-CG 4.37Å; L80-Q84 WeakPolarHBondContact O-CG 3.48Å; L80-Q84 PolarHBondContact O-N 2.92Å; I81-Q84 PolarHBondContact O-N 2.95Å; Q84-S86 VanDerWaalsContact C-N 3.34Å; Q84-S86 PolarHBondContact O-N 3.49Å; Q84-S87 WeakPolarHBondContact O-CB 3.3Å; Q84-S87 PolarHBondContact O-N 3.41Å; Q84-S87 VanDerWaalsContact O-N 3.12Å; Q84-S87 PolarHBondContact O-OG 3Å; Q84-E88 PolarHBondContact O-N 2.97Å; Q84-I102 HydrophobicContact CG-CD1 4.18Å; Q84-I102 HydrophobicContact CG-CG1 4.46Å
85R90.9Very high85.3Confident168 Ų16879.4 Ų79.463%0.63442%0.419SS*.Hα-helixtrans-61.5-40.5175.8-71.9177.8-178.5172.61.2112.7I81 A82 L83 S87 E88I81-R85 WeakPolarHBondContact O-CG 3.48Å; I81-R85 PolarHBondContact O-N 2.97Å; A82-R85 PolarHBondContact O-N 2.9Å; L83-R85 PolarHBondContact O-N 3.34Å; R85-S87 VanDerWaalsContact C-N 3.28Å; R85-S87 PolarHBondContact O-N 3.18Å; R85-E88 PolarHBondContact O-N 3.33Å
86S86.7Confident84.6Confident50 Ų5083.2 Ų83.235%0.3543%0.432SS..Hα-helixtrans-65.6-31.9176.1630000113A82 L83 Q84 E88 L89 S90A82-S86 PolarHBondContact O-N 3.04Å; A82-S86 PolarHBondContact O-OG 3.24Å; L83-S86 WeakPolarHBondContact CA-OG 3.28Å; L83-S86 PolarHBondContact O-N 2.9Å; L83-S86 PolarHBondContact O-OG 3.41Å; Q84-S86 VanDerWaalsContact C-N 3.34Å; Q84-S86 PolarHBondContact O-N 3.49Å; S86-E88 VanDerWaalsContact C-N 3.31Å; S86-E88 PolarHBondContact O-N 3.43Å; S86-L89 PolarHBondContact O-N 3.03Å; S86-S90 PolarHBondContact O-N 2.93Å; S86-S90 PolarHBondContact O-OG 3.14Å
87S85.7Confident84Confident35 Ų3589.5 Ų89.525%0.24546%0.461CS..Hα-helixtrans-68-29.7179.879.50000113.4L83 Q84 R85 L89 S90 V98L83-S87 PolarHBondContact O-N 2.04Å; Q84-S87 WeakPolarHBondContact O-CB 3.3Å; Q84-S87 PolarHBondContact O-N 3.41Å; Q84-S87 VanDerWaalsContact O-N 3.12Å; Q84-S87 PolarHBondContact O-OG 3Å; R85-S87 VanDerWaalsContact C-N 3.28Å; R85-S87 PolarHBondContact O-N 3.18Å; S87-L89 PolarHBondContact O-N 2.89Å; S87-S90 WeakPolarHBondContact CA-OG 3.5Å; S87-S90 PolarHBondContact O-OG 3.39Å; S87-V98 VanDerWaalsContact CB-CG1 3.47Å
88E83.2Confident83.4Confident157 Ų15788.9 Ų88.973%0.73446%0.455SS*.Hα-helixtrans-70.9-20.2176.8-66.9170.7-174.900112.1Q84 R85 S86Q84-E88 PolarHBondContact O-N 2.97Å; R85-E88 PolarHBondContact O-N 3.33Å; S86-E88 VanDerWaalsContact C-N 3.31Å; S86-E88 PolarHBondContact O-N 3.43Å
89L80.1Confident83Confident157 Ų15787.3 Ų87.382%0.82245%0.452SS*.THydrogen-bonded Turntrans-101.2-7.8-176.1-62.7171.4000113.4S86 S87S86-L89 PolarHBondContact O-N 3.03Å; S87-L89 PolarHBondContact O-N 2.89Å
90S72.7Confident82.8Confident30 Ų3090.1 Ų90.121%0.2146%0.462CS..SBendtrans-98.1148.7-170.552.70000114.6S86 S87 N95S86-S90 PolarHBondContact O-N 2.93Å; S86-S90 PolarHBondContact O-OG 3.14Å; S87-S90 WeakPolarHBondContact CA-OG 3.5Å; S87-S90 PolarHBondContact O-OG 3.39Å; S90-N95 PolarHBondContact O-OD1 3.23Å; S90-N95 PolarHBondContact OG-OD1 3.35Å
91S68Low82.6Confident89 Ų8992.7 Ų92.762%0.62248%0.476SS*.  trans-74.3161.9175.667.70000112.6E93 C94 N95S91-E93 VanDerWaalsContact C-N 3.3Å; S91-E93 PolarHBondContact O-N 2.9Å; S91-C94 PolarHBondContact O-N 3.31Å; S91-C94 VanDerWaalsContact O-N 3.07Å; S91-N95 PolarHBondContact O-N 2.88Å; S91-N95 VanDerWaalsContact O-N 3.14Å; S91-N95 PolarHBondContact O-OD1 3.38Å
92N65.6Low82.6Confident140 Ų14089.8 Ų89.875%0.74946%0.461SS*.THydrogen-bonded Turntrans-51.8-32.5-167.9-72.4-25.1000117
93E62.6Low82.6Confident172 Ų17292.4 Ų92.480%0.80446%0.464SS*.THydrogen-bonded Turntrans-78.3-40.5178.9-113.1171.9171.700112.5S91 N95 K96S91-E93 VanDerWaalsContact C-N 3.3Å; S91-E93 PolarHBondContact O-N 2.9Å; E93-N95 PolarHBondContact O-N 2.95Å; E93-K96 PolarHBondContact O-N 3.26Å
94C66.6Low82.8Confident61 Ų6197 Ų9741%0.41248%0.482SS..Hα-helixtrans-64.7-26.6174.8-162.40000111.3S91 K96 E97 V98S91-C94 PolarHBondContact O-N 3.31Å; S91-C94 VanDerWaalsContact O-N 3.07Å; C94-K96 VanDerWaalsContact C-N 3.26Å; C94-K96 PolarHBondContact O-N 2.71Å; C94-E97 PolarHBondContact O-N 3.17Å; C94-V98 WeakPolarHBondContact O-CG2 3.25Å; C94-V98 PolarHBondContact O-N 3.23Å
95N73Confident83Confident42 Ų4295.6 Ų95.623%0.22548%0.475CS..Hα-helixtrans-59.7-30.3178-70.2-14.1000113.8S90 S91 E93 T99S90-N95 PolarHBondContact O-OD1 3.23Å; S90-N95 PolarHBondContact OG-OD1 3.35Å; S91-N95 PolarHBondContact O-N 2.88Å; S91-N95 VanDerWaalsContact O-N 3.14Å; S91-N95 PolarHBondContact O-OD1 3.38Å; E93-N95 PolarHBondContact O-N 2.95Å; N95-T99 VanDerWaalsContact O-CB 3.23Å; N95-T99 WeakPolarHBondContact O-CB 3.41Å; N95-T99 PolarHBondContact O-N 2.94Å; N95-T99 PolarHBondContact O-OG1 2.95Å
96K81.5Confident83.3Confident150 Ų15090.5 Ų90.565%0.65246%0.458SS*.Hα-helixtrans-69.7-42.6-179.3-71.6-176.6-176.5171.90112.5E93 C94 R100E93-K96 PolarHBondContact O-N 3.26Å; C94-K96 VanDerWaalsContact C-N 3.26Å; C94-K96 PolarHBondContact O-N 2.71Å; K96-R100 WeakPolarHBondContact O-CG 3.24Å; K96-R100 PolarHBondContact O-N 3.21Å
97E85.6Confident83.8Confident131 Ų13192.6 Ų92.661%0.61247%0.465SS*.Hα-helixtrans-69.1-46.8178.7-67.7-173.5163.100110.8C94 T99 R100 D101C94-E97 PolarHBondContact O-N 3.17Å; E97-T99 VanDerWaalsContact C-N 3.29Å; E97-T99 PolarHBondContact O-N 3.4Å; E97-R100 WeakPolarHBondContact O-CB 3.42Å; E97-R100 PolarHBondContact O-N 3.23Å; E97-R100 VanDerWaalsContact O-N 3.07Å; E97-D101 PolarHBondContact O-N 3.17Å
98V86Confident84.4Confident18 Ų1891.5 Ų91.511%0.10946%0.456CS..Hα-helixtrans-59.9-40.7177.3-179.60000111.2S87 C94 R100 D101 I102S87-V98 VanDerWaalsContact CB-CG1 3.47Å; C94-V98 WeakPolarHBondContact O-CG2 3.25Å; C94-V98 PolarHBondContact O-N 3.23Å; V98-R100 VanDerWaalsContact C-N 3.35Å; V98-R100 PolarHBondContact O-N 3Å; V98-D101 PolarHBondContact O-N 3.24Å; V98-I102 HydrophobicContact CG1-CD1 3.95Å; V98-I102 HydrophobicContact CG1-CG1 4.4Å; V98-I102 VanDerWaalsContact O-CG1 3.3Å; V98-I102 WeakPolarHBondContact O-CG1 3.06Å; V98-I102 PolarHBondContact O-N 3.2Å
99T88.8Confident85.1Confident66 Ų6685.2 Ų85.241%0.40543%0.428SS..Hα-helixtrans-61.2-42175.8-610000112.1N95 E97 D101 I102 Q103N95-T99 VanDerWaalsContact O-CB 3.23Å; N95-T99 WeakPolarHBondContact O-CB 3.41Å; N95-T99 PolarHBondContact O-N 2.94Å; N95-T99 PolarHBondContact O-OG1 2.95Å; E97-T99 VanDerWaalsContact C-N 3.29Å; E97-T99 PolarHBondContact O-N 3.4Å; T99-D101 VanDerWaalsContact C-N 3.33Å; T99-D101 PolarHBondContact O-N 3.37Å; T99-I102 PolarHBondContact O-N 3.29Å; T99-Q103 WeakPolarHBondContact O-CG 3.44Å; T99-Q103 PolarHBondContact O-N 2.9Å
100R91.7Very high86Confident158 Ų15884.9 Ų84.960%0.59642%0.415SS*.Hα-helixtrans-63.3-41176.8-73.8174.1179.5171.10111.4K96 E97 V98 Q103 K104K96-R100 WeakPolarHBondContact O-CG 3.24Å; K96-R100 PolarHBondContact O-N 3.21Å; E97-R100 WeakPolarHBondContact O-CB 3.42Å; E97-R100 PolarHBondContact O-N 3.23Å; E97-R100 VanDerWaalsContact O-N 3.07Å; V98-R100 VanDerWaalsContact C-N 3.35Å; V98-R100 PolarHBondContact O-N 3Å; R100-Q103 PolarHBondContact O-N 3.27Å; R100-K104 WeakPolarHBondContact O-CG 3.26Å; R100-K104 PolarHBondContact O-N 2.75Å
101D92.4Very high87.2Confident69 Ų6986.3 Ų86.337%0.36942%0.419SS..Hα-helixtrans-70.2-38179.5-72.2-17.9000112.2L83 E97 V98 T99 Q103 K104 K105L83-D101 HydrophobicContact CD1-CB 4.23Å; L83-D101 HydrophobicContact CD2-CB 4.43Å; E97-D101 PolarHBondContact O-N 3.17Å; V98-D101 PolarHBondContact O-N 3.24Å; T99-D101 VanDerWaalsContact C-N 3.33Å; T99-D101 PolarHBondContact O-N 3.37Å; D101-Q103 PolarHBondContact O-N 2.72Å; D101-K104 PolarHBondContact O-N 3.24Å; D101-K104 IonicContact OD1-NZ 3.87Å; D101-K105 WeakPolarHBondContact O-CG 3.41Å; D101-K105 PolarHBondContact O-N 3.42Å
102I94.6Very high88.7Confident20 Ų2082.1 Ų82.110%0.10339%0.389CS..Hα-helixtrans-57.1-49.4170-72.4170.2000110.2L80 L83 Q84 V98 T99 K104 K105 Q106L80-I102 HydrophobicContact CD1-CB 4.45Å; L80-I102 HydrophobicContact CD1-CG2 3.92Å; L83-I102 HydrophobicContact CB-CG1 3.8Å; Q84-I102 HydrophobicContact CG-CD1 4.18Å; Q84-I102 HydrophobicContact CG-CG1 4.46Å; V98-I102 HydrophobicContact CG1-CD1 3.95Å; V98-I102 HydrophobicContact CG1-CG1 4.4Å; V98-I102 VanDerWaalsContact O-CG1 3.3Å; V98-I102 WeakPolarHBondContact O-CG1 3.06Å; V98-I102 PolarHBondContact O-N 3.2Å; T99-I102 PolarHBondContact O-N 3.29Å; I102-K104 PolarHBondContact O-N 3.26Å; I102-K105 PolarHBondContact O-N 3.46Å; I102-Q106 HydrophobicContact CG2-CG 4.34Å; I102-Q106 WeakPolarHBondContact O-CB 3.41Å; I102-Q106 VanDerWaalsContact O-CG 3.3Å; I102-Q106 WeakPolarHBondContact O-CG 3.5Å; I102-Q106 PolarHBondContact O-N 2.89Å
103Q95.4Very high90.3Very high115 Ų11579.9 Ų79.954%0.53737%0.374SS..Hα-helixtrans-60.6-43.4179.1-72.8173.6-3.600112.1T99 R100 D101 Q106 L107T99-Q103 WeakPolarHBondContact O-CG 3.44Å; T99-Q103 PolarHBondContact O-N 2.9Å; R100-Q103 PolarHBondContact O-N 3.27Å; D101-Q103 PolarHBondContact O-N 2.72Å; Q103-Q106 PolarHBondContact O-N 2.83Å; Q103-L107 PolarHBondContact O-N 3.01Å
104K95.5Very high92Very high136 Ų13675.2 Ų75.259%0.59136%0.358SS*.Hα-helixtrans-61-45.8175.5-73.8174.4-176.8170.80111.7R100 D101 I102 L107 L108R100-K104 WeakPolarHBondContact O-CG 3.26Å; R100-K104 PolarHBondContact O-N 2.75Å; D101-K104 PolarHBondContact O-N 3.24Å; D101-K104 IonicContact OD1-NZ 3.87Å; I102-K104 PolarHBondContact O-N 3.26Å; K104-L107 PolarHBondContact O-N 2.96Å; K104-L108 WeakPolarHBondContact O-CB 3.35Å; K104-L108 PolarHBondContact O-N 3Å
105K95.9Very high93.5Very high43 Ų4373.3 Ų73.319%0.18734%0.343CS..Hα-helixtrans-68.8-34.6178.8-69.1-55.4-174.5-170.20112.5D9 T76 L80 L83 D101 I102 L108 L109D9-K105 IonicContact OD1-NZ 3.13Å; D9-K105 PolarHBondContact OD1-NZ 3.09Å; T76-K105 WeakPolarHBondContact CG2-O 3.47Å; L80-K105 HydrophobicContact CB-CB 4.37Å; L80-K105 HydrophobicContact CD1-CB 4.17Å; L83-K105 HydrophobicContact CD1-CB 4.29Å; L83-K105 HydrophobicContact CD1-CG 3.6Å; D101-K105 WeakPolarHBondContact O-CG 3.41Å; D101-K105 PolarHBondContact O-N 3.42Å; I102-K105 PolarHBondContact O-N 3.46Å; K105-L108 HydrophobicContact CD-CD2 4.09Å; K105-L108 PolarHBondContact O-N 2.72Å; K105-L109 WeakPolarHBondContact O-CB 3.32Å; K105-L109 PolarHBondContact O-N 2.8Å
106Q97.3Very high94.7Very high61 Ų6172.9 Ų72.929%0.28534%0.34SS..Hα-helixtrans-62.7-44.4171.6-76.1176.5-13.500112L80 I102 Q103 L109 R110L80-Q106 HydrophobicContact CD1-CG 3.76Å; L80-Q106 HydrophobicContact CD2-CG 3.73Å; L80-Q106 HydrophobicContact CG-CG 4.42Å; I102-Q106 HydrophobicContact CG2-CG 4.34Å; I102-Q106 WeakPolarHBondContact O-CB 3.41Å; I102-Q106 VanDerWaalsContact O-CG 3.3Å; I102-Q106 WeakPolarHBondContact O-CG 3.5Å; I102-Q106 PolarHBondContact O-N 2.89Å; Q103-Q106 PolarHBondContact O-N 2.83Å; Q106-L109 PolarHBondContact O-N 2.97Å; Q106-R110 WeakPolarHBondContact O-CG 3.45Å; Q106-R110 PolarHBondContact O-N 3.17Å; Q106-R110 VanDerWaalsContact O-N 3.08Å
107L97.8Very high95.5Very high94 Ų9470.7 Ų70.749%0.49234%0.335SS..Hα-helixtrans-60.7-48175.4176.361.1000111Q103 K104 L109 R110 Q111Q103-L107 PolarHBondContact O-N 3.01Å; K104-L107 PolarHBondContact O-N 2.96Å; L107-L109 VanDerWaalsContact C-N 3.32Å; L107-L109 PolarHBondContact O-N 2.94Å; L107-R110 PolarHBondContact O-N 3.03Å; L107-Q111 HydrophobicContact CD1-CG 4.34Å; L107-Q111 WeakPolarHBondContact O-CG 3.43Å; L107-Q111 PolarHBondContact O-N 3.1Å
108L97.9Very high96.1Very high13 Ų1367.6 Ų67.67%0.06832%0.323CS..Hα-helixtrans-58.8-42.8178.7-174.759.4000112.2C8 F11 T76 K104 K105 Q111 F112C8-L108 WeakPolarHBondContact O-CD2 3.43Å; F11-L108 HydrophobicContact CB-CD1 3.65Å; F11-L108 HydrophobicContact CG-CD1 4.49Å; T76-L108 HydrophobicContact CG2-CB 4.1Å; T76-L108 HydrophobicContact CG2-CD2 4.06Å; T76-L108 HydrophobicContact CG2-CG 3.99Å; K104-L108 WeakPolarHBondContact O-CB 3.35Å; K104-L108 PolarHBondContact O-N 3Å; K105-L108 HydrophobicContact CD-CD2 4.09Å; K105-L108 PolarHBondContact O-N 2.72Å; L108-Q111 WeakPolarHBondContact O-CB 3.08Å; L108-Q111 PolarHBondContact O-N 3.31Å; L108-F112 HydrophobicContact CD1-CD2 4.06Å; L108-F112 HydrophobicContact CD1-CE2 3.51Å; L108-F112 HydrophobicContact CD1-CZ 4.36Å; L108-F112 HydrophobicContact CG-CD2 4.15Å; L108-F112 HydrophobicContact CG-CE2 3.88Å; L108-F112 WeakPolarHBondContact O-CD2 3.29Å; L108-F112 PolarHBondContact O-N 2.94Å; L108-F112 VanDerWaalsContact O-N 3.1Å
109L98.5Very high96.7Very high25 Ų2566.7 Ų66.713%0.13132%0.317CS..Hα-helixtrans-60.9-46.6176.4-17960.5000111.4I73 T76 A77 L80 K105 Q106 L107 Q111 F112 Q113I73-L109 HydrophobicContact CB-CD1 4.48Å; I73-L109 HydrophobicContact CG2-CD1 3.88Å; T76-L109 HydrophobicContact CG2-CB 3.89Å; A77-L109 HydrophobicContact CB-CD1 4.2Å; A77-L109 HydrophobicContact CB-CD2 4.44Å; L80-L109 HydrophobicContact CD2-CD2 4.01Å; K105-L109 WeakPolarHBondContact O-CB 3.32Å; K105-L109 PolarHBondContact O-N 2.8Å; Q106-L109 PolarHBondContact O-N 2.97Å; L107-L109 VanDerWaalsContact C-N 3.32Å; L107-L109 PolarHBondContact O-N 2.94Å; L109-Q111 VanDerWaalsContact C-N 3.31Å; L109-Q111 PolarHBondContact O-N 3.36Å; L109-F112 PolarHBondContact O-N 3.41Å; L109-Q113 WeakPolarHBondContact O-CG 3.45Å; L109-Q113 PolarHBondContact O-N 3.24Å
110R98.6Very high97.1Very high150 Ų15068.6 Ų68.657%0.56632%0.322SS*.Hα-helixtrans-61.1-40.7176.8-70.2173.2-172.8159.63.8111.6Q106 L107 F112 Q113 T114Q106-R110 WeakPolarHBondContact O-CG 3.45Å; Q106-R110 PolarHBondContact O-N 3.17Å; Q106-R110 VanDerWaalsContact O-N 3.08Å; L107-R110 PolarHBondContact O-N 3.03Å; R110-F112 PolarHBondContact O-N 3.45Å; R110-Q113 PolarHBondContact O-N 2.92Å; R110-T114 PolarHBondContact O-N 3.37Å; R110-T114 PolarHBondContact O-OG1 3.46Å
111Q98.6Very high97.4Very high60 Ų6065.8 Ų65.828%0.2832%0.322SS..Hα-helixtrans-61-44.5178.2-73.9174.6-43.800112F11 L107 L108 L109 T114 E115F11-Q111 HydrophobicContact CD1-CB 4.17Å; F11-Q111 HydrophobicContact CD1-CG 4.22Å; F11-Q111 HydrophobicContact CD2-CB 3.66Å; F11-Q111 HydrophobicContact CE1-CB 4.08Å; F11-Q111 HydrophobicContact CE1-CG 4.19Å; F11-Q111 HydrophobicContact CE2-CB 3.57Å; F11-Q111 HydrophobicContact CG-CB 3.97Å; F11-Q111 HydrophobicContact CG-CG 4.39Å; F11-Q111 HydrophobicContact CZ-CB 3.79Å; F11-Q111 HydrophobicContact CZ-CG 4.35Å; L107-Q111 HydrophobicContact CD1-CG 4.34Å; L107-Q111 WeakPolarHBondContact O-CG 3.43Å; L107-Q111 PolarHBondContact O-N 3.1Å; L108-Q111 WeakPolarHBondContact O-CB 3.08Å; L108-Q111 PolarHBondContact O-N 3.31Å; L109-Q111 VanDerWaalsContact C-N 3.31Å; L109-Q111 PolarHBondContact O-N 3.36Å; Q111-T114 PolarHBondContact O-N 3.4Å; Q111-E115 PolarHBondContact O-N 3.45Å
112F98.6Very high97.6Very high0 Ų064.7 Ų64.70%032%0.315CS..Hα-helixtrans-70.3-32.9176.1-75.4-63.5000113.6C8 F11 I69 C72 I73 L108 L109 R110 T114 E115 L116C8-F112 HydrophobicContact CB-CE2 4.48Å; C8-F112 HydrophobicContact CB-CZ 4.47Å; C8-F112 WeakPolarHBondContact O-CE2 3.3Å; F11-F112 HydrophobicContact CD2-CD1 4.3Å; F11-F112 HydrophobicContact CD2-CE1 4.04Å; F11-F112 HydrophobicContact CD2-CE2 4.42Å; F11-F112 HydrophobicContact CD2-CZ 4.09Å; F11-F112 HydrophobicContact CE2-CD1 4.41Å; F11-F112 HydrophobicContact CE2-CE1 4.45Å; I69-F112 WeakPolarHBondContact CG2-O 3.4Å; C72-F112 HydrophobicContact CB-CD1 3.81Å; C72-F112 HydrophobicContact CB-CD2 3.95Å; C72-F112 HydrophobicContact CB-CE1 3.77Å; C72-F112 HydrophobicContact CB-CE2 3.9Å; C72-F112 HydrophobicContact CB-CG 3.91Å; C72-F112 HydrophobicContact CB-CZ 3.83Å; I73-F112 HydrophobicContact CG1-CB 3.65Å; L108-F112 HydrophobicContact CD1-CD2 4.06Å; L108-F112 HydrophobicContact CD1-CE2 3.51Å; L108-F112 HydrophobicContact CD1-CZ 4.36Å; L108-F112 HydrophobicContact CG-CD2 4.15Å; L108-F112 HydrophobicContact CG-CE2 3.88Å; L108-F112 WeakPolarHBondContact O-CD2 3.29Å; L108-F112 PolarHBondContact O-N 2.94Å; L108-F112 VanDerWaalsContact O-N 3.1Å; L109-F112 PolarHBondContact O-N 3.41Å; R110-F112 PolarHBondContact O-N 3.45Å; F112-T114 VanDerWaalsContact C-N 3.33Å; F112-E115 PolarHBondContact O-N 3.37Å; F112-L116 PolarHBondContact O-N 2.98Å
113Q98.6Very high97.7Very high94 Ų9465.9 Ų65.944%0.43932%0.321SS..Hα-helixtrans-62-42.3171.4-72.4172.3-28.500111.4I73 L109 R110 E115 L116 L117I73-Q113 HydrophobicContact CD1-CG 4.23Å; I73-Q113 HydrophobicContact CG1-CG 4.47Å; L109-Q113 WeakPolarHBondContact O-CG 3.45Å; L109-Q113 PolarHBondContact O-N 3.24Å; R110-Q113 PolarHBondContact O-N 2.92Å; Q113-E115 VanDerWaalsContact C-N 3.34Å; Q113-E115 PolarHBondContact O-N 3.42Å; Q113-L116 WeakPolarHBondContact O-CB 3.49Å; Q113-L116 PolarHBondContact O-N 3.14Å; Q113-L117 PolarHBondContact O-N 3.43Å
114T98.6Very high97.8Very high73 Ų7363.1 Ų63.145%0.44831%0.312SS..Hα-helixtrans-62.2-40.5172.4-59.10000111.8R110 Q111 F112 L116 L117 N118R110-T114 PolarHBondContact O-N 3.37Å; R110-T114 PolarHBondContact O-OG1 3.46Å; Q111-T114 PolarHBondContact O-N 3.4Å; F112-T114 VanDerWaalsContact C-N 3.33Å; T114-L116 VanDerWaalsContact C-N 3.27Å; T114-L116 PolarHBondContact O-N 2.94Å; T114-L117 PolarHBondContact O-N 3.33Å; T114-N118 VanDerWaalsContact O-CG 3.28Å; T114-N118 PolarHBondContact O-N 3.5Å
115E98.2Very high97.8Very high21 Ų2160.3 Ų60.310%0.09831%0.309CS..Hα-helixtrans-63.5-31.9175.8-80.6-57.1128.200113.5F11 L18 R22 I69 Q111 F112 Q113 N118 E119F11-E115 HydrophobicContact CE2-CG 3.72Å; F11-E115 HydrophobicContact CZ-CG 3.94Å; L18-E115 HydrophobicContact CD1-CB 4.36Å; L18-E115 HydrophobicContact CD1-CG 4.1Å; R22-E115 IonicContact CZ-OE2 3.5Å; R22-E115 VanDerWaalsContact CZ-OE2 3.31Å; R22-E115 IonicContact NH1-OE2 2.73Å; R22-E115 PolarHBondContact NH1-OE2 3Å; R22-E115 IonicContact NH2-OE2 2.72Å; R22-E115 PolarHBondContact NH2-OE2 3.49Å; I69-E115 HydrophobicContact CD1-CB 4.37Å; I69-E115 HydrophobicContact CG2-CB 4.3Å; Q111-E115 PolarHBondContact O-N 3.45Å; F112-E115 PolarHBondContact O-N 3.37Å; Q113-E115 VanDerWaalsContact C-N 3.34Å; Q113-E115 PolarHBondContact O-N 3.42Å; E115-N118 PolarHBondContact O-N 2.91Å; E115-N118 PolarHBondContact OE1-ND2 3.29Å; E115-N118 VanDerWaalsContact OE1-ND2 3.09Å; E115-E119 WeakPolarHBondContact O-CB 3.35Å; E115-E119 PolarHBondContact O-N 2.73Å
116L98.6Very high97.8Very high34 Ų3458.5 Ų58.518%0.17830%0.302CS..Hα-helixtrans-65.8-43.9174.1-174.362.3000111.1T66 I69 K70 I73 F112 Q113 T114 N118 E119 E120T66-L116 HydrophobicContact CG2-CD1 4.06Å; I69-L116 HydrophobicContact CG2-CB 3.87Å; I69-L116 HydrophobicContact CG2-CD1 4.31Å; K70-L116 HydrophobicContact CG-CD1 4.2Å; K70-L116 HydrophobicContact CG-CD2 4.42Å; I73-L116 HydrophobicContact CD1-CB 4.13Å; I73-L116 HydrophobicContact CD1-CD2 3.93Å; F112-L116 PolarHBondContact O-N 2.98Å; Q113-L116 WeakPolarHBondContact O-CB 3.49Å; Q113-L116 PolarHBondContact O-N 3.14Å; T114-L116 VanDerWaalsContact C-N 3.27Å; T114-L116 PolarHBondContact O-N 2.94Å; L116-N118 VanDerWaalsContact C-N 3.35Å; L116-E119 PolarHBondContact O-N 3.1Å; L116-E120 PolarHBondContact O-N 3.32Å
117L98.4Very high97.8Very high104 Ų10455.7 Ų55.755%0.54529%0.289SS..Hα-helixtrans-62.7-42174.3-63.2174.5000111.5Q113 T114 E119 E120 V121Q113-L117 PolarHBondContact O-N 3.43Å; T114-L117 PolarHBondContact O-N 3.33Å; L117-E119 VanDerWaalsContact C-N 3.29Å; L117-E119 PolarHBondContact O-N 3.27Å; L117-E120 PolarHBondContact O-N 3.47Å; L117-V121 WeakPolarHBondContact O-CG2 3.33Å; L117-V121 PolarHBondContact O-N 2.72Å
118N98.1Very high97.7Very high65 Ų6555.1 Ų55.135%0.34828%0.283SS..Hα-helixtrans-59.6-41.6175.3-69.8-19.6000111.3T114 E115 L116 E120 V121 I122T114-N118 VanDerWaalsContact O-CG 3.28Å; T114-N118 PolarHBondContact O-N 3.5Å; E115-N118 PolarHBondContact O-N 2.91Å; E115-N118 PolarHBondContact OE1-ND2 3.29Å; E115-N118 VanDerWaalsContact OE1-ND2 3.09Å; L116-N118 VanDerWaalsContact C-N 3.35Å; N118-E120 VanDerWaalsContact C-N 3.34Å; N118-E120 PolarHBondContact O-N 3.39Å; N118-V121 PolarHBondContact O-N 3.49Å; N118-I122 WeakPolarHBondContact O-CD1 3.38Å; N118-I122 VanDerWaalsContact O-CG1 3.24Å; N118-I122 WeakPolarHBondContact O-CG1 3.49Å; N118-I122 PolarHBondContact O-N 3.37Å
119E98.2Very high97.5Very high0 Ų055.8 Ų55.80%029%0.287CS..Hα-helixtrans-63.3-38.2178.7-172.359-149.400112.2R22 H62 R65 I69 E115 L116 L117 I122 Q123R22-E119 IonicContact CZ-OE2 2.72Å; R22-E119 IonicContact NE-OE2 2.75Å; R22-E119 PolarHBondContact NE-OE2 3.04Å; R22-E119 IonicContact NH2-OE2 3Å; R22-E119 PolarHBondContact NH2-OE2 3.41Å; H62-E119 IonicContact ND1-OE1 3.8Å; R65-E119 IonicContact CZ-OE1 3.39Å; R65-E119 VanDerWaalsContact CZ-OE1 3.27Å; R65-E119 IonicContact NE-OE1 3.72Å; R65-E119 PolarHBondContact NE-OE1 2.93Å; R65-E119 IonicContact NE-OE2 2.65Å; R65-E119 PolarHBondContact NE-OE2 3.13Å; R65-E119 IonicContact NH2-OE1 3.27Å; R65-E119 PolarHBondContact NH2-OE1 3.23Å; R65-E119 IonicContact NH2-OE2 3.49Å; I69-E119 HydrophobicContact CD1-CB 3.95Å; I69-E119 HydrophobicContact CD1-CG 4.26Å; E115-E119 WeakPolarHBondContact O-CB 3.35Å; E115-E119 PolarHBondContact O-N 2.73Å; L116-E119 PolarHBondContact O-N 3.1Å; L117-E119 VanDerWaalsContact C-N 3.29Å; L117-E119 PolarHBondContact O-N 3.27Å; E119-I122 PolarHBondContact O-N 2.99Å; E119-Q123 WeakPolarHBondContact O-CB 3.48Å; E119-Q123 VanDerWaalsContact O-CG 3.26Å; E119-Q123 WeakPolarHBondContact O-CG 3.4Å; E119-Q123 PolarHBondContact O-N 2.97Å
120E97.4Very high97.4Very high105 Ų10554.6 Ų54.649%0.49128%0.281SS..Hα-helixtrans-64.3-39.6175.3-68.8176.4177.100112.7L116 L117 N118 T124L116-E120 PolarHBondContact O-N 3.32Å; L117-E120 PolarHBondContact O-N 3.47Å; N118-E120 VanDerWaalsContact C-N 3.34Å; N118-E120 PolarHBondContact O-N 3.39Å; E120-T124 WeakPolarHBondContact O-CB 3.33Å; E120-T124 PolarHBondContact O-N 3.05Å; E120-T124 PolarHBondContact O-OG1 2.99Å
121V97.5Very high97.2Very high100 Ų10048.5 Ų48.561%0.60626%0.258SS*.Hα-helixtrans-66-44.5175.5177.60000110.5L117 N118 T124 S125L117-V121 WeakPolarHBondContact O-CG2 3.33Å; L117-V121 PolarHBondContact O-N 2.72Å; N118-V121 PolarHBondContact O-N 3.49Å; V121-T124 PolarHBondContact O-N 3.01Å; V121-S125 WeakPolarHBondContact O-CB 3.41Å; V121-S125 PolarHBondContact O-N 3.39Å
122I97.8Very high96.9Very high45 Ų4550.3 Ų50.323%0.23127%0.267CS..Hα-helixtrans-61.7-46.6178.4-69.7164.3000110.6R22 D25 N118 E119 T124 S125 A126R22-I122 HydrophobicContact CG-CD1 4.29Å; R22-I122 VanDerWaalsContact NE-CD1 3.29Å; D25-I122 HydrophobicContact CB-CG2 3.92Å; N118-I122 WeakPolarHBondContact O-CD1 3.38Å; N118-I122 VanDerWaalsContact O-CG1 3.24Å; N118-I122 WeakPolarHBondContact O-CG1 3.49Å; N118-I122 PolarHBondContact O-N 3.37Å; E119-I122 PolarHBondContact O-N 2.99Å; I122-T124 VanDerWaalsContact C-N 3.32Å; I122-T124 PolarHBondContact O-N 2.83Å; I122-S125 PolarHBondContact O-N 3.42Å; I122-A126 WeakPolarHBondContact O-CB 3.34Å; I122-A126 PolarHBondContact O-N 3.2Å
123Q97.3Very high96.5Very high45 Ų4553.6 Ų53.621%0.2128%0.279CS..Hα-helixtrans-54.7-48.7173.8-78.6177.936.600111.8H62 T66 E119 S125 A126 F127H62-Q123 HydrophobicContact CB-CG 3.8Å; H62-Q123 VanDerWaalsContact CG-CG 3.47Å; H62-Q123 VanDerWaalsContact ND1-CG 3.3Å; H62-Q123 WeakPolarHBondContact ND1-CG 3.44Å; T66-Q123 PolarHBondContact OG1-NE2 2.93Å; E119-Q123 WeakPolarHBondContact O-CB 3.48Å; E119-Q123 VanDerWaalsContact O-CG 3.26Å; E119-Q123 WeakPolarHBondContact O-CG 3.4Å; E119-Q123 PolarHBondContact O-N 2.97Å; Q123-S125 PolarHBondContact O-N 3.08Å; Q123-A126 PolarHBondContact O-N 3.27Å; Q123-F127 WeakPolarHBondContact O-CD2 3.35Å; Q123-F127 PolarHBondContact O-N 3.33Å
124T96.3Very high96.2Very high58 Ų5849.1 Ų49.136%0.35626%0.258SS..Hα-helixtrans-64.3-42.5-178.7-61.40000111.6E120 V121 I122 K128 K145 F146E120-T124 WeakPolarHBondContact O-CB 3.33Å; E120-T124 PolarHBondContact O-N 3.05Å; E120-T124 PolarHBondContact O-OG1 2.99Å; V121-T124 PolarHBondContact O-N 3.01Å; I122-T124 VanDerWaalsContact C-N 3.32Å; I122-T124 PolarHBondContact O-N 2.83Å; T124-K128 WeakPolarHBondContact O-CB 3.45Å; T124-K128 PolarHBondContact O-N 3.35Å; T124-K145 PolarHBondContact OG1-NZ 3.37Å; T124-F146 HydrophobicContact CG2-CE1 3.91Å; T124-F146 HydrophobicContact CG2-CZ 4.18Å; T124-F146 WeakPolarHBondContact O-CZ 3.23Å
125S95.7Very high95.8Very high77 Ų7750.7 Ų50.754%0.53826%0.256SS..Hα-helixtrans-62.2-49176.1-174.70000112.1V121 I122 Q123 F127 K128 V129V121-S125 WeakPolarHBondContact O-CB 3.41Å; V121-S125 PolarHBondContact O-N 3.39Å; I122-S125 PolarHBondContact O-N 3.42Å; Q123-S125 PolarHBondContact O-N 3.08Å; S125-F127 PolarHBondContact O-N 2.9Å; S125-K128 PolarHBondContact O-N 2.97Å; S125-V129 PolarHBondContact O-N 3.43Å
126A96.9Very high95.4Very high5 Ų557 Ų574%0.04129%0.286CS..Hα-helixtrans-59.9-49.9179.500000111.6V28 M58 I122 Q123 K128 V129 I130V28-A126 HydrophobicContact CG2-CB 4.24Å; M58-A126 HydrophobicContact CE-CB 4.19Å; I122-A126 WeakPolarHBondContact O-CB 3.34Å; I122-A126 PolarHBondContact O-N 3.2Å; Q123-A126 PolarHBondContact O-N 3.27Å; A126-K128 VanDerWaalsContact C-N 3.3Å; A126-K128 PolarHBondContact O-N 3.4Å; A126-V129 PolarHBondContact O-N 3.42Å; A126-I130 WeakPolarHBondContact O-CG1 3.44Å; A126-I130 PolarHBondContact O-N 3.37Å; A126-I130 VanDerWaalsContact O-N 3.17Å
127F96.7Very high94.8Very high2 Ų259.1 Ų59.11%0.00929%0.294CS..Hα-helixtrans-69.4-24.9-179.6-76.1-64.7000114V55 M58 L59 H62 Q123 S125 I130 Y131 V142 F143 F146V55-F127 HydrophobicContact CG1-CE1 4.21Å; V55-F127 HydrophobicContact CG2-CE1 4.46Å; M58-F127 HydrophobicContact CB-CE1 4.25Å; M58-F127 HydrophobicContact CB-CZ 4.15Å; L59-F127 HydrophobicContact CD2-CE1 4.34Å; L59-F127 HydrophobicContact CD2-CE2 3.93Å; L59-F127 HydrophobicContact CD2-CZ 3.46Å; L59-F127 VanDerWaalsContact CD2-CZ 3.46Å; L59-F127 HydrophobicContact CG-CE1 4.28Å; L59-F127 HydrophobicContact CG-CZ 3.67Å; H62-F127 AromaticContact CD2-CE2 3.29Å; H62-F127 WeakPolarHBondContact CD2-CE2 3.5Å; H62-F127 AromaticContact CD2-CZ 3.61Å; H62-F127 AromaticContact NE2-CE2 3.51Å; H62-F127 AromaticContact NE2-CZ 3.94Å; Q123-F127 WeakPolarHBondContact O-CD2 3.35Å; Q123-F127 PolarHBondContact O-N 3.33Å; S125-F127 PolarHBondContact O-N 2.9Å; F127-I130 HydrophobicContact CD1-CD1 3.66Å; F127-I130 HydrophobicContact CE1-CD1 3.93Å; F127-I130 HydrophobicContact CG-CD1 4.45Å; F127-I130 PolarHBondContact O-N 2.97Å; F127-Y131 VanDerWaalsContact O-CB 3.29Å; F127-Y131 WeakPolarHBondContact O-CB 3.37Å; F127-Y131 PolarHBondContact O-N 3.41Å; F127-V142 HydrophobicContact CD1-CG1 3.92Å; F127-V142 HydrophobicContact CD1-CG2 4.03Å; F127-V142 HydrophobicContact CD2-CG2 3.87Å; F127-V142 HydrophobicContact CE1-CG1 4.13Å; F127-V142 HydrophobicContact CE1-CG2 4.13Å; F127-V142 HydrophobicContact CE2-CG2 3.93Å; F127-V142 HydrophobicContact CG-CG1 4.5Å; F127-V142 HydrophobicContact CG-CG2 3.94Å; F127-V142 HydrophobicContact CZ-CG2 4.09Å; F127-F143 HydrophobicContact CD1-CE1 4.19Å; F127-F146 HydrophobicContact CB-CE2 3.6Å; F127-F146 HydrophobicContact CB-CZ 3.89Å
128K95.3Very high94.5Very high81 Ų8155 Ų5535%0.35227%0.272SS..Hα-helixtrans-62.2-45171.7-176.1173.8178.3175.10111.1T124 S125 A126 I130 Y131 E132 F146T124-K128 WeakPolarHBondContact O-CB 3.45Å; T124-K128 PolarHBondContact O-N 3.35Å; S125-K128 PolarHBondContact O-N 2.97Å; A126-K128 VanDerWaalsContact C-N 3.3Å; A126-K128 PolarHBondContact O-N 3.4Å; K128-I130 VanDerWaalsContact C-N 3.33Å; K128-I130 PolarHBondContact O-N 3.38Å; K128-Y131 WeakPolarHBondContact O-CB 3.44Å; K128-Y131 PolarHBondContact O-N 2.66Å; K128-E132 WeakPolarHBondContact CE-OE1 3.38Å; K128-E132 WeakPolarHBondContact O-CG 3.43Å; K128-E132 PolarHBondContact O-N 3.19Å; K128-F146 HydrophobicContact CB-CD1 4.33Å; K128-F146 HydrophobicContact CB-CE1 3.83Å; K128-F146 HydrophobicContact CB-CZ 4.08Å; K128-F146 HydrophobicContact CG-CD1 4.49Å; K128-F146 HydrophobicContact CG-CE1 4.42Å
129V94.8Very high94.2Very high28 Ų2861.3 Ų61.317%0.1729%0.291CS..Hα-helixtrans-63.4-41176.7179.80000111.3V28 R29 L32 S125 A126 R133V28-V129 HydrophobicContact CG1-CB 4.03Å; V28-V129 HydrophobicContact CG1-CG1 3.9Å; R29-V129 HydrophobicContact CB-CG1 4.1Å; L32-V129 HydrophobicContact CD1-CG1 4.42Å; S125-V129 PolarHBondContact O-N 3.43Å; A126-V129 PolarHBondContact O-N 3.42Å; V129-R133 PolarHBondContact O-N 2.9Å
130I94.8Very high94Very high0 Ų063.3 Ų63.30%030%0.3CS..Hα-helixtrans-65.7-43.2177.5-55.1162.9000110.3V28 L32 F54 V55 M58 A126 F127 K128 R133 C134 F143V28-I130 HydrophobicContact CG1-CD1 4.32Å; V28-I130 HydrophobicContact CG1-CG1 3.66Å; L32-I130 HydrophobicContact CD1-CB 4.3Å; L32-I130 HydrophobicContact CD1-CG1 3.97Å; L32-I130 HydrophobicContact CD1-CG2 4.49Å; F54-I130 HydrophobicContact CD1-CD1 3.84Å; F54-I130 HydrophobicContact CD1-CG1 3.95Å; F54-I130 HydrophobicContact CD1-CG2 4.37Å; F54-I130 HydrophobicContact CE1-CD1 3.75Å; F54-I130 HydrophobicContact CE1-CG1 3.82Å; V55-I130 HydrophobicContact CG2-CG2 3.71Å; M58-I130 HydrophobicContact CB-CD1 4.26Å; M58-I130 HydrophobicContact CG-CD1 3.94Å; A126-I130 WeakPolarHBondContact O-CG1 3.44Å; A126-I130 PolarHBondContact O-N 3.37Å; A126-I130 VanDerWaalsContact O-N 3.17Å; F127-I130 HydrophobicContact CD1-CD1 3.66Å; F127-I130 HydrophobicContact CE1-CD1 3.93Å; F127-I130 HydrophobicContact CG-CD1 4.45Å; F127-I130 PolarHBondContact O-N 2.97Å; K128-I130 VanDerWaalsContact C-N 3.33Å; K128-I130 PolarHBondContact O-N 3.38Å; I130-R133 PolarHBondContact O-N 3.43Å; I130-C134 WeakPolarHBondContact O-CB 3.33Å; I130-C134 PolarHBondContact O-N 3.12Å; I130-F143 HydrophobicContact CB-CE1 4.3Å; I130-F143 HydrophobicContact CB-CZ 4.4Å; I130-F143 HydrophobicContact CG2-CE1 4.21Å; I130-F143 HydrophobicContact CG2-CZ 3.83Å
131Y94.8Very high93.9Very high22 Ų2262.8 Ų62.89%0.08631%0.306CS..Hα-helixtrans-56.3-54.3176.3174.1-111.9000111.3F127 K128 R133 C134 R135 F143 F146 D150F127-Y131 VanDerWaalsContact O-CB 3.29Å; F127-Y131 WeakPolarHBondContact O-CB 3.37Å; F127-Y131 PolarHBondContact O-N 3.41Å; K128-Y131 WeakPolarHBondContact O-CB 3.44Å; K128-Y131 PolarHBondContact O-N 2.66Å; Y131-R133 PolarHBondContact O-N 3.43Å; Y131-R133 VanDerWaalsContact O-N 3.15Å; Y131-C134 PolarHBondContact O-N 3.25Å; Y131-C134 VanDerWaalsContact O-N 3.12Å; Y131-R135 HydrophobicContact CD2-CB 3.89Å; Y131-R135 HydrophobicContact CE2-CB 3.59Å; Y131-R135 WeakPolarHBondContact O-CB 3.48Å; Y131-R135 WeakPolarHBondContact O-CG 3.37Å; Y131-R135 PolarHBondContact O-N 3.34Å; Y131-F143 HydrophobicContact CD2-CB 3.57Å; Y131-F143 HydrophobicContact CD2-CD1 4.06Å; Y131-F143 AromaticContact CD2-CD2 3.99Å; Y131-F143 HydrophobicContact CD2-CD2 3.99Å; Y131-F143 AromaticContact CD2-CG 3.63Å; Y131-F143 HydrophobicContact CD2-CG 3.63Å; Y131-F143 HydrophobicContact CE2-CB 4.02Å; Y131-F143 HydrophobicContact CE2-CG 4.48Å; Y131-F143 HydrophobicContact CG-CB 4.47Å; Y131-F143 HydrophobicContact CG-CD1 4.39Å; Y131-F143 HydrophobicContact CG-CG 4.39Å; Y131-F146 HydrophobicContact CD1-CB 3.62Å; Y131-F146 HydrophobicContact CD1-CG 4.38Å; Y131-F146 HydrophobicContact CD2-CB 4.36Å; Y131-F146 HydrophobicContact CE1-CB 3.88Å; Y131-F146 HydrophobicContact CG-CB 3.87Å; Y131-F146 HydrophobicContact CG-CD2 4.24Å; Y131-F146 HydrophobicContact CG-CG 4.38Å; Y131-D150 PolarHBondContact OH-OD2 2.67Å
132E92.2Very high93.7Very high97 Ų9759.4 Ų59.445%0.45329%0.285SS..Hα-helixtrans-54.5-37.1179.8-73169-176.800111.9K128K128-E132 WeakPolarHBondContact CE-OE1 3.38Å; K128-E132 WeakPolarHBondContact O-CG 3.43Å; K128-E132 PolarHBondContact O-N 3.19Å
133R90.8Very high93.5Very high69 Ų6957.4 Ų57.426%0.2628%0.275SS..Hα-helixtrans-81.5-30.9-179.5-165.767-176.798.4-1.5114.1L32 L36 P37 V129 I130 Y131L32-R133 HydrophobicContact CB-CG 4.32Å; L32-R133 HydrophobicContact CD1-CB 4.1Å; L32-R133 HydrophobicContact CD1-CG 4.41Å; L36-R133 HydrophobicContact CD1-CG 3.85Å; L36-R133 PolarHBondContact O-NH2 3.32Å; P37-R133 PolarHBondContact O-NH2 2.94Å; V129-R133 PolarHBondContact O-N 2.9Å; I130-R133 PolarHBondContact O-N 3.43Å; Y131-R133 PolarHBondContact O-N 3.43Å; Y131-R133 VanDerWaalsContact O-N 3.15Å
134C92Very high93.2Very high1 Ų158.9 Ų58.91%0.00728%0.284CS..Hα-helixtrans-106.8-16.2-168.6-73.50000115C51 I130 Y131 E136 H137 F138C51-C134 HydrophobicContact CB-CB 3.75Å; C51-C134 WeakPolarHBondContact CB-SG 3.44Å; C51-C134 WeakPolarHBondContact SG-CB 3.3Å; C51-C134 CovalentContact SG-SG 2.04Å; C51-C134 PolarHBondContact SG-SG 3.43Å; I130-C134 WeakPolarHBondContact O-CB 3.33Å; I130-C134 PolarHBondContact O-N 3.12Å; Y131-C134 PolarHBondContact O-N 3.25Å; Y131-C134 VanDerWaalsContact O-N 3.12Å; C134-E136 PolarHBondContact O-N 3Å; C134-H137 PolarHBondContact O-N 3.49Å; C134-H137 VanDerWaalsContact O-N 3.09Å; C134-F138 HydrophobicContact CB-CB 4.27Å; C134-F138 HydrophobicContact CB-CD1 4.34Å; C134-F138 PolarHBondContact O-N 3.25Å
135R91.2Very high92.9Very high105 Ų10561 Ų6140%0.39629%0.289SS..THydrogen-bonded Turntrans-57.1-26.8-168.563.4-178.6-176.3-164-1.8115.9Y131 H137 D150Y131-R135 HydrophobicContact CD2-CB 3.89Å; Y131-R135 HydrophobicContact CE2-CB 3.59Å; Y131-R135 WeakPolarHBondContact O-CB 3.48Å; Y131-R135 WeakPolarHBondContact O-CG 3.37Å; Y131-R135 PolarHBondContact O-N 3.34Å; R135-H137 VanDerWaalsContact C-N 3.34Å; R135-D150 IonicContact CZ-OD1 3Å; R135-D150 IonicContact NH1-OD1 3.31Å; R135-D150 PolarHBondContact NH1-OD1 3.2Å; R135-D150 IonicContact NH1-OD2 2.95Å
136E88.3Confident92.7Very high155 Ų15557.5 Ų57.572%0.72426%0.264SS*.THydrogen-bonded Turntrans-73.1-25.3-179.3-65.6-176.3173.100113.1C134C134-E136 PolarHBondContact O-N 3Å
137H87.1Confident91.8Very high77 Ų7762.7 Ų62.736%0.35628%0.282SS..THydrogen-bonded Turntrans-131.6-3.3-169.8-55.7-52.7000114Y47 T48 C134 R135Y47-H137 AromaticContact CD1-CD2 3.67Å; T48-H137 PolarHBondContact OG1-O 3.43Å; C134-H137 PolarHBondContact O-N 3.49Å; C134-H137 VanDerWaalsContact O-N 3.09Å; R135-H137 VanDerWaalsContact C-N 3.34Å
138F91.4Very high90.7Very high18 Ų1868.8 Ų68.88%0.07932%0.315CS..  trans-145.1129.8-176.5-180-115.1000111.3T48 C51 N52 V55 C134 H140 F143T48-F138 HydrophobicContact CG2-CD2 4.11Å; C51-F138 HydrophobicContact CB-CB 3.73Å; C51-F138 HydrophobicContact CB-CD1 3.58Å; C51-F138 HydrophobicContact CB-CD2 4.42Å; C51-F138 HydrophobicContact CB-CE1 4.32Å; C51-F138 HydrophobicContact CB-CG 3.65Å; N52-F138 HydrophobicContact CB-CD2 4.37Å; N52-F138 HydrophobicContact CB-CE2 3.61Å; N52-F138 HydrophobicContact CB-CZ 3.85Å; V55-F138 HydrophobicContact CB-CE1 4.28Å; V55-F138 HydrophobicContact CG2-CE1 3.88Å; C134-F138 HydrophobicContact CB-CB 4.27Å; C134-F138 HydrophobicContact CB-CD1 4.34Å; C134-F138 PolarHBondContact O-N 3.25Å; F138-H140 HydrophobicContact CD1-CB 4.45Å; F138-H140 HydrophobicContact CE1-CB 3.61Å; F138-H140 HydrophobicContact CZ-CB 3.77Å; F138-H140 AromaticContact CZ-CD2 3.98Å; F138-F143 AromaticContact CD1-CE2 3.69Å; F138-F143 HydrophobicContact CD1-CE2 3.69Å; F138-F143 HydrophobicContact CD1-CZ 4.36Å; F138-F143 AromaticContact CE1-CE2 3.89Å; F138-F143 HydrophobicContact CE1-CE2 3.89Å; F138-F143 HydrophobicContact CE1-CZ 4.36Å
139R92Very high89.2Confident197 Ų19772.1 Ų72.174%0.74333%0.326SS*.  trans-114.8135.8174.5-65.3-169.3-177.8-103.71109.4
140H94.4Very high87.4Confident42 Ų4274.7 Ų74.719%0.19434%0.339CS..  trans-149.8143.4177.9-170.1-91.5000110F138 V142 F143F138-H140 HydrophobicContact CD1-CB 4.45Å; F138-H140 HydrophobicContact CE1-CB 3.61Å; F138-H140 HydrophobicContact CZ-CB 3.77Å; F138-H140 AromaticContact CZ-CD2 3.98Å; H140-V142 HydrophobicContact CB-CG1 4.29Å; H140-V142 VanDerWaalsContact ND1-CB 3.34Å; H140-V142 WeakPolarHBondContact ND1-CB 3.44Å; H140-V142 WeakPolarHBondContact ND1-CG1 3.33Å; H140-V142 PolarHBondContact ND1-N 3.2Å; H140-V142 VanDerWaalsContact ND1-N 3.15Å; H140-V142 PolarHBondContact O-N 3.07Å; H140-V142 VanDerWaalsContact O-N 3.13Å; H140-F143 HydrophobicContact CB-CD2 3.98Å; H140-F143 HydrophobicContact CB-CE2 4.04Å; H140-F143 WeakPolarHBondContact O-CB 3.3Å; H140-F143 PolarHBondContact O-N 3.21Å
141P94.1Very high85Confident94 Ų9485.1 Ų85.161%0.6139%0.394SS*.G310 helixtrans-56.3-30.4-179.1-27.535.2000114.4F143 D144P141-F143 PolarHBondContact O-N 3.49Å; P141-D144 WeakPolarHBondContact O-CB 3.3Å; P141-D144 VanDerWaalsContact O-CG 3.27Å; P141-D144 PolarHBondContact O-N 3.02Å
142V93.5Very high84.5Confident29 Ų2988.3 Ų88.318%0.17641%0.409CS..G310 helixtrans-58.5-21.5176.480.70000113.2V55 L59 F127 H140V55-V142 HydrophobicContact CG1-CG1 4.24Å; L59-V142 HydrophobicContact CD2-CG2 4.24Å; F127-V142 HydrophobicContact CD1-CG1 3.92Å; F127-V142 HydrophobicContact CD1-CG2 4.03Å; F127-V142 HydrophobicContact CD2-CG2 3.87Å; F127-V142 HydrophobicContact CE1-CG1 4.13Å; F127-V142 HydrophobicContact CE1-CG2 4.13Å; F127-V142 HydrophobicContact CE2-CG2 3.93Å; F127-V142 HydrophobicContact CG-CG1 4.5Å; F127-V142 HydrophobicContact CG-CG2 3.94Å; F127-V142 HydrophobicContact CZ-CG2 4.09Å; H140-V142 HydrophobicContact CB-CG1 4.29Å; H140-V142 VanDerWaalsContact ND1-CB 3.34Å; H140-V142 WeakPolarHBondContact ND1-CB 3.44Å; H140-V142 WeakPolarHBondContact ND1-CG1 3.33Å; H140-V142 PolarHBondContact ND1-N 3.2Å; H140-V142 VanDerWaalsContact ND1-N 3.15Å; H140-V142 PolarHBondContact O-N 3.07Å; H140-V142 VanDerWaalsContact O-N 3.13Å
143F93.9Very high84.1Confident4 Ų487.8 Ų87.82%0.01841%0.407CS..G310 helixtrans-90.8-5.8179.7-58.3-33.5000114.4V55 F127 I130 Y131 F138 H140 P141 K145 F146V55-F143 HydrophobicContact CG2-CE1 4.35Å; V55-F143 HydrophobicContact CG2-CZ 3.69Å; F127-F143 HydrophobicContact CD1-CE1 4.19Å; I130-F143 HydrophobicContact CB-CE1 4.3Å; I130-F143 HydrophobicContact CB-CZ 4.4Å; I130-F143 HydrophobicContact CG2-CE1 4.21Å; I130-F143 HydrophobicContact CG2-CZ 3.83Å; Y131-F143 HydrophobicContact CD2-CB 3.57Å; Y131-F143 HydrophobicContact CD2-CD1 4.06Å; Y131-F143 AromaticContact CD2-CD2 3.99Å; Y131-F143 HydrophobicContact CD2-CD2 3.99Å; Y131-F143 AromaticContact CD2-CG 3.63Å; Y131-F143 HydrophobicContact CD2-CG 3.63Å; Y131-F143 HydrophobicContact CE2-CB 4.02Å; Y131-F143 HydrophobicContact CE2-CG 4.48Å; Y131-F143 HydrophobicContact CG-CB 4.47Å; Y131-F143 HydrophobicContact CG-CD1 4.39Å; Y131-F143 HydrophobicContact CG-CG 4.39Å; F138-F143 AromaticContact CD1-CE2 3.69Å; F138-F143 HydrophobicContact CD1-CE2 3.69Å; F138-F143 HydrophobicContact CD1-CZ 4.36Å; F138-F143 AromaticContact CE1-CE2 3.89Å; F138-F143 HydrophobicContact CE1-CE2 3.89Å; F138-F143 HydrophobicContact CE1-CZ 4.36Å; H140-F143 HydrophobicContact CB-CD2 3.98Å; H140-F143 HydrophobicContact CB-CE2 4.04Å; H140-F143 WeakPolarHBondContact O-CB 3.3Å; H140-F143 PolarHBondContact O-N 3.21Å; P141-F143 PolarHBondContact O-N 3.49Å; F143-K145 PolarHBondContact O-N 3.07Å; F143-F146 HydrophobicContact CD1-CD2 4.2Å; F143-F146 HydrophobicContact CD1-CE2 4.44Å; F143-F146 PolarHBondContact O-N 2.97Å
144D91.5Very high83.8Confident75 Ų7588.9 Ų88.940%0.40142%0.415SS..G310 helixtrans-60.2-34.7-176-66.4-15.8000111.4P141 F146 R147P141-D144 WeakPolarHBondContact O-CB 3.3Å; P141-D144 VanDerWaalsContact O-CG 3.27Å; P141-D144 PolarHBondContact O-N 3.02Å; D144-F146 PolarHBondContact O-N 3.15Å; D144-R147 PolarHBondContact O-N 3.16Å; D144-R147 IonicContact OD1-CZ 2.85Å; D144-R147 IonicContact OD1-NE 3.88Å; D144-R147 PolarHBondContact OD1-NE 3.05Å; D144-R147 VanDerWaalsContact OD1-NE 3.1Å; D144-R147 IonicContact OD1-NH2 2.67Å; D144-R147 PolarHBondContact OD1-NH2 3.3Å
145K89.9Confident83.3Confident102 Ų10294.1 Ų94.144%0.44344%0.439SS..G310 helixtrans-66.9-10.9174.370.1177.1-179.3178.70115.2T124 F143T124-K145 PolarHBondContact OG1-NZ 3.37Å; F143-K145 PolarHBondContact O-N 3.07Å
146F91.4Very high82.8Confident4 Ų493.4 Ų93.42%0.01844%0.442CS..G310 helixtrans-105.7-8.7-179.2-57-61.5000114T124 F127 K128 Y131 F143 D144 D148 Y149T124-F146 HydrophobicContact CG2-CE1 3.91Å; T124-F146 HydrophobicContact CG2-CZ 4.18Å; T124-F146 WeakPolarHBondContact O-CZ 3.23Å; F127-F146 HydrophobicContact CB-CE2 3.6Å; F127-F146 HydrophobicContact CB-CZ 3.89Å; K128-F146 HydrophobicContact CB-CD1 4.33Å; K128-F146 HydrophobicContact CB-CE1 3.83Å; K128-F146 HydrophobicContact CB-CZ 4.08Å; K128-F146 HydrophobicContact CG-CD1 4.49Å; K128-F146 HydrophobicContact CG-CE1 4.42Å; Y131-F146 HydrophobicContact CD1-CB 3.62Å; Y131-F146 HydrophobicContact CD1-CG 4.38Å; Y131-F146 HydrophobicContact CD2-CB 4.36Å; Y131-F146 HydrophobicContact CE1-CB 3.88Å; Y131-F146 HydrophobicContact CG-CB 3.87Å; Y131-F146 HydrophobicContact CG-CD2 4.24Å; Y131-F146 HydrophobicContact CG-CG 4.38Å; F143-F146 HydrophobicContact CD1-CD2 4.2Å; F143-F146 HydrophobicContact CD1-CE2 4.44Å; F143-F146 PolarHBondContact O-N 2.97Å; D144-F146 PolarHBondContact O-N 3.15Å; F146-D148 PolarHBondContact O-N 3.33Å; F146-Y149 HydrophobicContact CB-CD2 4.44Å; F146-Y149 HydrophobicContact CD1-CD2 4.38Å; F146-Y149 HydrophobicContact CD1-CE2 4.27Å; F146-Y149 WeakPolarHBondContact O-CB 3.41Å; F146-Y149 PolarHBondContact O-N 3.33Å; F146-Y149 VanDerWaalsContact O-N 3.14Å
147R78.1Confident82.4Confident115 Ų11589.3 Ų89.343%0.43442%0.423SS..G310 helixtrans-63.4-30.3-174.8-66-176.1-174.3-170.27113.1D144 Y149 D150D144-R147 PolarHBondContact O-N 3.16Å; D144-R147 IonicContact OD1-CZ 2.85Å; D144-R147 IonicContact OD1-NE 3.88Å; D144-R147 PolarHBondContact OD1-NE 3.05Å; D144-R147 VanDerWaalsContact OD1-NE 3.1Å; D144-R147 IonicContact OD1-NH2 2.67Å; D144-R147 PolarHBondContact OD1-NH2 3.3Å; R147-Y149 PolarHBondContact O-N 3.14Å; R147-D150 PolarHBondContact O-N 2.65Å
148D73.9Confident82.1Confident129 Ų12990.1 Ų90.169%0.6943%0.428SS*.G310 helixtrans-75.5-7.9-179.2-57.7-29.7000113.3F146 D150F146-D148 PolarHBondContact O-N 3.33Å; D148-D150 VanDerWaalsContact C-N 3.29Å
149Y63.6Low81.4Confident151 Ų15195.7 Ų95.759%0.59246%0.455SS*.G310 helixtrans-83.9-1.4175.7-69.5-87.2000113.5F146 R147 L151F146-Y149 HydrophobicContact CB-CD2 4.44Å; F146-Y149 HydrophobicContact CD1-CD2 4.38Å; F146-Y149 HydrophobicContact CD1-CE2 4.27Å; F146-Y149 WeakPolarHBondContact O-CB 3.41Å; F146-Y149 PolarHBondContact O-N 3.33Å; F146-Y149 VanDerWaalsContact O-N 3.14Å; R147-Y149 PolarHBondContact O-N 3.14Å; Y149-L151 VanDerWaalsContact C-N 3.32Å
150D57.7Low80.5Confident83 Ų8387.3 Ų87.344%0.44443%0.431SS..G310 helixtrans-91.813.7178.9-69.4-30.9000113.5Y131 R135 R147 D148Y131-D150 PolarHBondContact OH-OD2 2.67Å; R135-D150 IonicContact CZ-OD1 3Å; R135-D150 IonicContact NH1-OD1 3.31Å; R135-D150 PolarHBondContact NH1-OD1 3.2Å; R135-D150 IonicContact NH1-OD2 2.95Å; R147-D150 PolarHBondContact O-N 2.65Å; D148-D150 VanDerWaalsContact C-N 3.29Å
151L44.3Very low79.2Confident219 Ų21991.4 Ų91.4100%1.14745%0.452SS*.  trans-101.60171.2-70.4169.4000111.1Y149Y149-L151 VanDerWaalsContact C-N 3.32Å

Retrieved 151 of 151 residues in 36.7 ms (Link to these results)

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