A0A060W767_ONCMY Loading...

ascorbate ferrireductase (transmembrane)

AlphaFold DB , UniProt , Accession A0A060W767, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 231 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
1M36.9Very low42.1Very low250 Ų250143.9 Ų143.9100%1.23278%0.783SS**  0112.60-92.9168.6171.500108.1
2R37.1Very low42.9Very low237 Ų237142.1 Ų142.189%0.89477%0.765SS**  trans-82126.3164.8-78178174.1154.6-1.9106.2
3A38.8Very low43.7Very low94 Ų94135.5 Ų135.578%0.77775%0.751SS**  trans-89.2107.6168.200000106.6V5A3-V5 PolarHBondContact O-N 3.32Å
4D44.8Very low44.5Very low148 Ų148134.6 Ų134.679%0.79174%0.744SS**  trans-71112.4170.9-59.7-41.6000107.2E6D4-E6 PolarHBondContact O-N 3.31Å
5V46.7Very low45.6Very low136 Ų136128.6 Ų128.682%0.82472%0.724SS**  trans-81.7104.9173178.50000107.1A3 Y7A3-V5 PolarHBondContact O-N 3.32Å; V5-Y7 PolarHBondContact O-N 3.29Å
6E40.7Very low46.6Very low184 Ų184127.5 Ų127.586%0.8671%0.713SS**  trans-67.5112.9173-164.2168.6-165.700109.4D4 S8D4-E6 PolarHBondContact O-N 3.31Å; E6-S8 PolarHBondContact O-N 3.32Å
7Y40.3Very low48.1Very low179 Ų179123.1 Ų123.170%0.70269%0.693SS**  trans-78.9107.5175.8-167.2-92000109.1V5V5-Y7 PolarHBondContact O-N 3.29Å
8S41.1Very low49.5Very low86 Ų86123.6 Ų123.660%0.60169%0.689SS**  trans-78.1123.6175.5-1730000110.6E6 V10E6-S8 PolarHBondContact O-N 3.32Å; S8-V10 PolarHBondContact O-N 3.2Å
9P45.6Very low51Low97 Ų97123.5 Ų123.563%0.6368%0.68SS**G310 helixtrans-82.510.6-172.433.5-34.7000113.9G11P9-G11 VanDerWaalsContact C-N 3.25Å; P9-G11 PolarHBondContact O-N 3.2Å
10V44.8Very low52.6Low111 Ų111123.9 Ų123.967%0.67367%0.671SS**G310 helixtrans-78.8-4.9-165-173.10000113.4S8S8-V10 PolarHBondContact O-N 3.2Å
11G46.7Very low54.1Low61 Ų61123.1 Ų123.163%0.62967%0.666SS**G310 helixtrans-96.6-18.3-177.100000117P9P9-G11 VanDerWaalsContact C-N 3.25Å; P9-G11 PolarHBondContact O-N 3.2Å
12E51.4Low56.3Low122 Ų122116.7 Ų116.757%0.5763%0.629SS**Hα-helixtrans-80.9-29.1-168.6-71.3-169.1149.800113.8M16E12-M16 WeakPolarHBondContact O-CB 3.22Å; E12-M16 WeakPolarHBondContact O-CG 3.44Å
13G53Low58.6Low56 Ų56106.3 Ų106.358%0.57759%0.592SS**Hα-helixtrans-80.5-42.5-174.400000115.1S17G13-S17 PolarHBondContact O-N 3.1Å
14L54.9Low61Low124 Ų124108.9 Ų108.965%0.64958%0.582SS**Hα-helixtrans-71.5-47.1-175.9-73168.8000111.6M16 S17 E18L14-M16 VanDerWaalsContact C-N 3.33Å; L14-M16 PolarHBondContact O-N 2.74Å; L14-S17 PolarHBondContact O-N 3.17Å; L14-S17 PolarHBondContact O-OG 2.93Å; L14-E18 WeakPolarHBondContact O-CG 3.47Å; L14-E18 PolarHBondContact O-N 3.17Å; L14-E18 VanDerWaalsContact O-N 3.09Å
15G61.2Low63.1Low44 Ų44108.3 Ų108.345%0.45458%0.576SS.*Hα-helixtrans-65.2-33.3179.100000113.8F19G15-F19 WeakPolarHBondContact O-CB 3.49Å; G15-F19 PolarHBondContact O-N 3.18Å; G15-F19 VanDerWaalsContact O-N 3.1Å
16M62.4Low65.2Low111 Ų111104 Ų10455%0.54755%0.545SS..Hα-helixtrans-67.9-43.1172.6-76.3-176.361.800111.8E12 L14 E18 F19 W20E12-M16 WeakPolarHBondContact O-CB 3.22Å; E12-M16 WeakPolarHBondContact O-CG 3.44Å; L14-M16 VanDerWaalsContact C-N 3.33Å; L14-M16 PolarHBondContact O-N 2.74Å; M16-E18 PolarHBondContact O-N 3.09Å; M16-F19 WeakPolarHBondContact O-CB 3.39Å; M16-F19 PolarHBondContact O-N 3.38Å; M16-W20 PolarHBondContact O-N 3.33Å
17S71.3Confident67.5Low52 Ų5299.9 Ų99.936%0.36452%0.521SS..Hα-helixtrans-61.6-42.4178.876.40000112.3G13 L14 W20 L21G13-S17 PolarHBondContact O-N 3.1Å; L14-S17 PolarHBondContact O-N 3.17Å; L14-S17 PolarHBondContact O-OG 2.93Å; S17-W20 PolarHBondContact O-N 3.1Å; S17-L21 WeakPolarHBondContact O-CB 3.25Å; S17-L21 VanDerWaalsContact O-CG 3.25Å; S17-L21 WeakPolarHBondContact O-CG 3.39Å; S17-L21 PolarHBondContact O-N 3.47Å
18E73.5Confident70Confident133 Ų13395.6 Ų95.662%0.62151%0.513SS*.Hα-helixtrans-66.2-38.5176.5-68.8-174.4161.900112.2L14 M16 L21 Y22L14-E18 WeakPolarHBondContact O-CG 3.47Å; L14-E18 PolarHBondContact O-N 3.17Å; L14-E18 VanDerWaalsContact O-N 3.09Å; M16-E18 PolarHBondContact O-N 3.09Å; E18-L21 PolarHBondContact O-N 2.96Å; E18-Y22 WeakPolarHBondContact O-CB 3.46Å; E18-Y22 PolarHBondContact O-N 3.48Å
19F78.4Confident72.6Confident121 Ų12192.8 Ų92.853%0.53150%0.495SS..Hα-helixtrans-61.4-46.5173.5174.3-97.4000112G15 M16 Y22 V23G15-F19 WeakPolarHBondContact O-CB 3.49Å; G15-F19 PolarHBondContact O-N 3.18Å; G15-F19 VanDerWaalsContact O-N 3.1Å; M16-F19 WeakPolarHBondContact O-CB 3.39Å; M16-F19 PolarHBondContact O-N 3.38Å; F19-Y22 PolarHBondContact O-N 3.09Å; F19-V23 HydrophobicContact CE1-CG2 4.14Å; F19-V23 HydrophobicContact CE2-CG2 4.34Å; F19-V23 HydrophobicContact CZ-CG2 4.02Å; F19-V23 WeakPolarHBondContact O-CG2 3.43Å; F19-V23 PolarHBondContact O-N 3.25Å
20W82.7Confident75Confident132 Ų13288.7 Ų88.750%0.547%0.468SS..Hα-helixtrans-65.6-43.6178.1-73.7113.4000111.9M16 S17 Y22 V23 W24M16-W20 PolarHBondContact O-N 3.33Å; S17-W20 PolarHBondContact O-N 3.1Å; W20-Y22 VanDerWaalsContact C-N 3.31Å; W20-Y22 PolarHBondContact O-N 2.98Å; W20-V23 PolarHBondContact O-N 3.29Å; W20-W24 WeakPolarHBondContact O-CB 3.39Å; W20-W24 PolarHBondContact O-N 3.1Å
21L84.9Confident77.3Confident108 Ų10888.4 Ų88.457%0.56546%0.462SS*.Hα-helixtrans-55.3-47.4174.2-74.5167.6000111.1S17 E18 V23 W24 M25S17-L21 WeakPolarHBondContact O-CB 3.25Å; S17-L21 VanDerWaalsContact O-CG 3.25Å; S17-L21 WeakPolarHBondContact O-CG 3.39Å; S17-L21 PolarHBondContact O-N 3.47Å; E18-L21 PolarHBondContact O-N 2.96Å; L21-V23 PolarHBondContact O-N 3.41Å; L21-W24 PolarHBondContact O-N 3.44Å; L21-M25 WeakPolarHBondContact O-CB 3.46Å; L21-M25 VanDerWaalsContact O-CG 3.26Å; L21-M25 WeakPolarHBondContact O-CG 3.42Å; L21-M25 PolarHBondContact O-N 3.14Å
22Y83.1Confident79.7Confident115 Ų11586.9 Ų86.945%0.45144%0.444SS..Hα-helixtrans-59.7-45.6177.6175.5-103.7000113E18 F19 W20 M25 R26E18-Y22 WeakPolarHBondContact O-CB 3.46Å; E18-Y22 PolarHBondContact O-N 3.48Å; F19-Y22 PolarHBondContact O-N 3.09Å; W20-Y22 VanDerWaalsContact C-N 3.31Å; W20-Y22 PolarHBondContact O-N 2.98Å; Y22-M25 PolarHBondContact O-N 2.93Å; Y22-R26 HydrophobicContact CE2-CG 4.34Å; Y22-R26 WeakPolarHBondContact O-CG 3.5Å; Y22-R26 PolarHBondContact O-N 3.29Å; Y22-R26 VanDerWaalsContact O-N 3.1Å; Y22-R26 WeakPolarHBondContact OH-CD 3.26Å
23V84.7Confident81.9Confident18 Ų1881.1 Ų81.111%0.10942%0.417CS..Hα-helixtrans-62.2-45.3177.3171.80000110.9F19 W20 L21 R26 R27F19-V23 HydrophobicContact CE1-CG2 4.14Å; F19-V23 HydrophobicContact CE2-CG2 4.34Å; F19-V23 HydrophobicContact CZ-CG2 4.02Å; F19-V23 WeakPolarHBondContact O-CG2 3.43Å; F19-V23 PolarHBondContact O-N 3.25Å; W20-V23 PolarHBondContact O-N 3.29Å; L21-V23 PolarHBondContact O-N 3.41Å; V23-R26 PolarHBondContact O-N 3.46Å; V23-R27 WeakPolarHBondContact O-CG 3.47Å; V23-R27 PolarHBondContact O-N 3.06Å; V23-R27 VanDerWaalsContact O-N 3.07Å
24W88.4Confident84Confident149 Ų14979.4 Ų79.456%0.56439%0.393SS*.Hα-helixtrans-62.3-45.5177.8-80115.2000112.3W20 L21 R26 R27 V28W20-W24 WeakPolarHBondContact O-CB 3.39Å; W20-W24 PolarHBondContact O-N 3.1Å; L21-W24 PolarHBondContact O-N 3.44Å; W24-R26 VanDerWaalsContact C-N 3.29Å; W24-R26 PolarHBondContact O-N 3.37Å; W24-R27 PolarHBondContact O-N 2.87Å; W24-V28 WeakPolarHBondContact O-CG2 3.28Å; W24-V28 PolarHBondContact O-N 3.45Å
25M89.9Confident86Confident135 Ų13578 Ų7867%0.66539%0.39SS*.Hα-helixtrans-58.3-41.6177-73.2178.372.900112L21 Y22 V28 A29L21-M25 WeakPolarHBondContact O-CB 3.46Å; L21-M25 VanDerWaalsContact O-CG 3.26Å; L21-M25 WeakPolarHBondContact O-CG 3.42Å; L21-M25 PolarHBondContact O-N 3.14Å; Y22-M25 PolarHBondContact O-N 2.93Å; M25-V28 PolarHBondContact O-N 3.2Å; M25-A29 WeakPolarHBondContact O-CB 3.32Å; M25-A29 PolarHBondContact O-N 3.27Å
26R89.5Confident87.8Confident47 Ų4777.3 Ų77.318%0.17738%0.376CS..Hα-helixtrans-66.9-40177.7-70.9-177.166.8-137.3-3.8112.6Y22 V23 W24 A29 V30 E80Y22-R26 HydrophobicContact CE2-CG 4.34Å; Y22-R26 WeakPolarHBondContact O-CG 3.5Å; Y22-R26 PolarHBondContact O-N 3.29Å; Y22-R26 VanDerWaalsContact O-N 3.1Å; Y22-R26 WeakPolarHBondContact OH-CD 3.26Å; V23-R26 PolarHBondContact O-N 3.46Å; W24-R26 VanDerWaalsContact C-N 3.29Å; W24-R26 PolarHBondContact O-N 3.37Å; R26-A29 PolarHBondContact O-N 2.89Å; R26-V30 WeakPolarHBondContact O-CG2 3.3Å; R26-V30 PolarHBondContact O-N 3.37Å; R26-E80 HydrophobicContact CB-CG 4.02Å; R26-E80 IonicContact CZ-OE1 3.66Å; R26-E80 IonicContact NH1-OE1 3.37Å; R26-E80 PolarHBondContact NH1-OE1 2.97Å; R26-E80 IonicContact NH2-OE1 2.84Å; R26-E80 PolarHBondContact NH2-OE1 3.36Å
27R90.8Very high89.5Confident97 Ų9772.1 Ų72.137%0.36635%0.35SS..Hα-helixtrans-62.4-48.2174.3-71.7176.2178.7-172.9-0.2111.5V23 W24 A29 V30 I31 E80V23-R27 WeakPolarHBondContact O-CG 3.47Å; V23-R27 PolarHBondContact O-N 3.06Å; V23-R27 VanDerWaalsContact O-N 3.07Å; W24-R27 PolarHBondContact O-N 2.87Å; R27-A29 VanDerWaalsContact C-N 3.3Å; R27-A29 PolarHBondContact O-N 3.37Å; R27-V30 PolarHBondContact O-N 2.89Å; R27-I31 VanDerWaalsContact O-CG1 3.32Å; R27-I31 WeakPolarHBondContact O-CG1 3.42Å; R27-I31 PolarHBondContact O-N 3.45Å; R27-E80 HydrophobicContact CG-CB 3.95Å; R27-E80 IonicContact NE-OE2 3.89Å
28V92.8Very high90.8Very high89 Ų8973 Ų7354%0.53935%0.354SS..Hα-helixtrans-59.2-43.2177171.30000110.7W24 M25 V30 I31 A32W24-V28 WeakPolarHBondContact O-CG2 3.28Å; W24-V28 PolarHBondContact O-N 3.45Å; M25-V28 PolarHBondContact O-N 3.2Å; V28-V30 PolarHBondContact O-N 3.34Å; V28-I31 PolarHBondContact O-N 3.07Å; V28-A32 VanDerWaalsContact O-CB 3.3Å; V28-A32 WeakPolarHBondContact O-CB 3.34Å; V28-A32 PolarHBondContact O-N 3.33Å
29A95Very high92Very high27 Ų2768.1 Ų68.122%0.22334%0.338CS..Hα-helixtrans-63-41.6177.500000112.8M25 R26 R27 A32 A33 F210 V214M25-A29 WeakPolarHBondContact O-CB 3.32Å; M25-A29 PolarHBondContact O-N 3.27Å; R26-A29 PolarHBondContact O-N 2.89Å; R27-A29 VanDerWaalsContact C-N 3.3Å; R27-A29 PolarHBondContact O-N 3.37Å; A29-A32 PolarHBondContact O-N 2.82Å; A29-A33 PolarHBondContact O-N 2.67Å; A29-F210 HydrophobicContact CB-CZ 4.16Å; A29-F210 WeakPolarHBondContact O-CE1 3.45Å; A29-V214 HydrophobicContact CB-CG2 4.11Å
30V94.7Very high92.9Very high10 Ų1062.6 Ų62.66%0.06131%0.314CS..Hα-helixtrans-65.8-43.9176171.30000111.1R26 R27 V28 A32 A33 H34 E80 V214R26-V30 WeakPolarHBondContact O-CG2 3.3Å; R26-V30 PolarHBondContact O-N 3.37Å; R27-V30 PolarHBondContact O-N 2.89Å; V28-V30 PolarHBondContact O-N 3.34Å; V30-A32 VanDerWaalsContact C-N 3.34Å; V30-A32 PolarHBondContact O-N 3.48Å; V30-A33 WeakPolarHBondContact O-CB 3.38Å; V30-A33 PolarHBondContact O-N 2.93Å; V30-H34 PolarHBondContact O-CD2 3.02Å; V30-H34 PolarHBondContact O-N 3.23Å; V30-H34 VanDerWaalsContact O-N 3.11Å; V30-E80 HydrophobicContact CG2-CB 4.22Å; V30-V214 HydrophobicContact CG2-CG1 3.87Å
31I95.1Very high93.7Very high106 Ų10656.7 Ų56.754%0.54429%0.293SS..Hα-helixtrans-60.2-45.7175.3-67.5165.2000110.6R27 V28 A33 H34 V35R27-I31 VanDerWaalsContact O-CG1 3.32Å; R27-I31 WeakPolarHBondContact O-CG1 3.42Å; R27-I31 PolarHBondContact O-N 3.45Å; V28-I31 PolarHBondContact O-N 3.07Å; I31-A33 VanDerWaalsContact C-N 3.3Å; I31-A33 PolarHBondContact O-N 2.8Å; I31-H34 WeakPolarHBondContact O-CB 3.32Å; I31-H34 PolarHBondContact O-N 2.81Å; I31-V35 HydrophobicContact CG2-CG2 4.39Å; I31-V35 WeakPolarHBondContact O-CG2 3.48Å; I31-V35 PolarHBondContact O-N 3.38Å
32A96.4Very high94.4Very high29 Ų2955.4 Ų55.424%0.2429%0.289CS..Hα-helixtrans-60.8-39176.700000111.7V28 A29 V30 H34 V35 I36 F210V28-A32 VanDerWaalsContact O-CB 3.3Å; V28-A32 WeakPolarHBondContact O-CB 3.34Å; V28-A32 PolarHBondContact O-N 3.33Å; A29-A32 PolarHBondContact O-N 2.82Å; V30-A32 VanDerWaalsContact C-N 3.34Å; V30-A32 PolarHBondContact O-N 3.48Å; A32-H34 PolarHBondContact O-N 3.41Å; A32-V35 PolarHBondContact O-N 2.85Å; A32-I36 VanDerWaalsContact O-CB 3.31Å; A32-I36 WeakPolarHBondContact O-CB 3.44Å; A32-I36 WeakPolarHBondContact O-CD1 3.25Å; A32-I36 WeakPolarHBondContact O-CG1 3.4Å; A32-I36 PolarHBondContact O-N 3.34Å; A32-F210 HydrophobicContact CB-CE1 3.65Å; A32-F210 HydrophobicContact CB-CZ 4.01Å
33A97.4Very high95.1Very high0 Ų054 Ų540%029%0.289CS..Hα-helixtrans-61.8-42.1175.800000112.4A29 V30 I31 A37 L75 P211 V214A29-A33 PolarHBondContact O-N 2.67Å; V30-A33 WeakPolarHBondContact O-CB 3.38Å; V30-A33 PolarHBondContact O-N 2.93Å; I31-A33 VanDerWaalsContact C-N 3.3Å; I31-A33 PolarHBondContact O-N 2.8Å; A33-A37 WeakPolarHBondContact O-CB 3.41Å; A33-A37 PolarHBondContact O-N 3.07Å; A33-L75 HydrophobicContact CB-CD1 3.8Å; A33-P211 HydrophobicContact CB-CB 4.14Å; A33-P211 HydrophobicContact CB-CG 4.28Å; A33-V214 HydrophobicContact CB-CB 4.19Å; A33-V214 HydrophobicContact CB-CG1 4.16Å; A33-V214 HydrophobicContact CB-CG2 4.21Å
34H97Very high95.7Very high20 Ų2053.8 Ų53.89%0.09329%0.287CS..Hα-helixtrans-62.1-48.2173.4-69.8-64.1000112V30 I31 A32 I36 A37 V38 E72 L75V30-H34 PolarHBondContact O-CD2 3.02Å; V30-H34 PolarHBondContact O-N 3.23Å; V30-H34 VanDerWaalsContact O-N 3.11Å; I31-H34 WeakPolarHBondContact O-CB 3.32Å; I31-H34 PolarHBondContact O-N 2.81Å; A32-H34 PolarHBondContact O-N 3.41Å; H34-I36 VanDerWaalsContact C-N 3.34Å; H34-I36 PolarHBondContact O-N 3.43Å; H34-A37 PolarHBondContact O-N 2.92Å; H34-V38 WeakPolarHBondContact O-CG2 3.36Å; H34-V38 PolarHBondContact O-N 3.41Å; H34-E72 IonicContact CE1-OE1 3.75Å; H34-E72 IonicContact CE1-OE2 2.75Å; H34-E72 PolarHBondContact CE1-OE2 3.02Å; H34-E72 IonicContact CG-OE1 2.67Å; H34-E72 IonicContact ND1-OE1 3.16Å; H34-E72 PolarHBondContact ND1-OE1 3.27Å; H34-E72 IonicContact ND1-OE2 3.13Å; H34-E72 PolarHBondContact ND1-OE2 3.29Å; H34-L75 VanDerWaalsContact CE1-CB 3.49Å; H34-L75 WeakPolarHBondContact CE1-CB 3.45Å
35V97.7Very high96.2Very high96 Ų9647.9 Ų47.958%0.58227%0.269SS*.Hα-helixtrans-62.3-42.4179.6172.10000111.2I31 A32 G39I31-V35 HydrophobicContact CG2-CG2 4.39Å; I31-V35 WeakPolarHBondContact O-CG2 3.48Å; I31-V35 PolarHBondContact O-N 3.38Å; A32-V35 PolarHBondContact O-N 2.85Å; V35-G39 PolarHBondContact O-N 2.89Å
36I98.4Very high96.6Very high29 Ų2946.4 Ų46.415%0.14927%0.267CS..Hα-helixtrans-64.4-44.2177.2-71.4167.3000110.6A32 H34 G39 L40 L207 F210 P211A32-I36 VanDerWaalsContact O-CB 3.31Å; A32-I36 WeakPolarHBondContact O-CB 3.44Å; A32-I36 WeakPolarHBondContact O-CD1 3.25Å; A32-I36 WeakPolarHBondContact O-CG1 3.4Å; A32-I36 PolarHBondContact O-N 3.34Å; H34-I36 VanDerWaalsContact C-N 3.34Å; H34-I36 PolarHBondContact O-N 3.43Å; I36-G39 PolarHBondContact O-N 3.44Å; I36-L40 HydrophobicContact CG2-CD1 3.78Å; I36-L40 HydrophobicContact CG2-CG 4.17Å; I36-L40 VanDerWaalsContact O-CB 3.29Å; I36-L40 WeakPolarHBondContact O-CB 3.47Å; I36-L40 WeakPolarHBondContact O-CG 3.26Å; I36-L40 PolarHBondContact O-N 3.27Å; I36-L207 HydrophobicContact CD1-CD2 4.12Å; I36-L207 HydrophobicContact CG1-CD2 4.13Å; I36-L207 HydrophobicContact CG2-CB 4.11Å; I36-L207 HydrophobicContact CG2-CD2 4.38Å; I36-F210 HydrophobicContact CD1-CB 4.05Å; I36-F210 HydrophobicContact CD1-CD1 3.55Å; I36-F210 HydrophobicContact CD1-CE1 4.24Å; I36-F210 HydrophobicContact CD1-CG 3.93Å; I36-P211 HydrophobicContact CB-CG 4.22Å; I36-P211 HydrophobicContact CG2-CG 3.84Å
37A98.3Very high97Very high1 Ų146.8 Ų46.81%0.00827%0.272CS..Hα-helixtrans-59.2-49.2178.500000111.5A33 H34 T41 L68 T71A33-A37 WeakPolarHBondContact O-CB 3.41Å; A33-A37 PolarHBondContact O-N 3.07Å; H34-A37 PolarHBondContact O-N 2.92Å; A37-T41 WeakPolarHBondContact O-CB 3.42Å; A37-T41 PolarHBondContact O-N 3.46Å; A37-T41 PolarHBondContact O-OG1 3.11Å; A37-T41 VanDerWaalsContact O-OG1 3.07Å; A37-L68 HydrophobicContact CB-CD1 4.49Å; A37-T71 HydrophobicContact CB-CG2 4.02Å
38V98.5Very high97.3Very high72 Ų7242.4 Ų42.444%0.43626%0.256SS..Hα-helixtrans-63.7-49.9176.5175.20000111.2H34 L40 T41 V42 L68H34-V38 WeakPolarHBondContact O-CG2 3.36Å; H34-V38 PolarHBondContact O-N 3.41Å; V38-L40 PolarHBondContact O-N 3.19Å; V38-T41 PolarHBondContact O-N 3.48Å; V38-V42 HydrophobicContact CG1-CG2 4.39Å; V38-V42 WeakPolarHBondContact O-CG2 3.4Å; V38-V42 PolarHBondContact O-N 3.23Å; V38-L68 HydrophobicContact CG2-CD1 3.71Å
39G98.4Very high97.5Very high29 Ų2946.8 Ų46.830%0.29926%0.263SS..Hα-helixtrans-60.4-46.9-176.200000112.6V35 I36 V42 L43V35-G39 PolarHBondContact O-N 2.89Å; I36-G39 PolarHBondContact O-N 3.44Å; G39-V42 PolarHBondContact O-N 2.68Å; G39-L43 WeakPolarHBondContact O-CB 3.33Å; G39-L43 VanDerWaalsContact O-CG 3.23Å; G39-L43 WeakPolarHBondContact O-CG 3.46Å; G39-L43 PolarHBondContact O-N 3.19Å
40L98.3Very high97.6Very high6 Ų648.4 Ų48.43%0.03127%0.272CS..Hα-helixtrans-63.6-43.2176.9-78179.2000112.3I36 V38 V42 L43 I44 I67 F204 L207 P208I36-L40 HydrophobicContact CG2-CD1 3.78Å; I36-L40 HydrophobicContact CG2-CG 4.17Å; I36-L40 VanDerWaalsContact O-CB 3.29Å; I36-L40 WeakPolarHBondContact O-CB 3.47Å; I36-L40 WeakPolarHBondContact O-CG 3.26Å; I36-L40 PolarHBondContact O-N 3.27Å; V38-L40 PolarHBondContact O-N 3.19Å; L40-V42 VanDerWaalsContact C-N 3.34Å; L40-V42 PolarHBondContact O-N 2.93Å; L40-L43 PolarHBondContact O-N 3.32Å; L40-I44 WeakPolarHBondContact O-CB 3.3Å; L40-I44 VanDerWaalsContact O-CG1 3.3Å; L40-I44 WeakPolarHBondContact O-CG1 3.07Å; L40-I44 PolarHBondContact O-N 3.18Å; L40-I67 HydrophobicContact CB-CG2 3.92Å; L40-I67 HydrophobicContact CD1-CG2 4.3Å; L40-F204 HydrophobicContact CD2-CD1 3.89Å; L40-F204 HydrophobicContact CD2-CE1 4.11Å; L40-L207 HydrophobicContact CD1-CB 3.79Å; L40-L207 HydrophobicContact CD2-CB 4.04Å; L40-L207 HydrophobicContact CD2-CD1 3.81Å; L40-L207 HydrophobicContact CG-CB 4.19Å; L40-L207 HydrophobicContact CG-CD1 4.43Å; L40-P208 HydrophobicContact CD1-CG 3.88Å
41T98.7Very high97.6Very high7 Ų750.6 Ų50.64%0.04330%0.296CS..Hα-helixtrans-61.7-43.1177.4-65.90000111.4A37 V38 S45 S63 I64 L68A37-T41 WeakPolarHBondContact O-CB 3.42Å; A37-T41 PolarHBondContact O-N 3.46Å; A37-T41 PolarHBondContact O-OG1 3.11Å; A37-T41 VanDerWaalsContact O-OG1 3.07Å; V38-T41 PolarHBondContact O-N 3.48Å; T41-S45 VanDerWaalsContact O-CB 3.27Å; T41-S45 WeakPolarHBondContact O-CB 3.13Å; T41-S45 PolarHBondContact O-N 2.83Å; T41-S45 PolarHBondContact O-OG 2.96Å; T41-S63 PolarHBondContact OG1-O 3.48Å; T41-I64 HydrophobicContact CG2-CG1 3.83Å; T41-L68 HydrophobicContact CG2-CB 4.21Å; T41-L68 HydrophobicContact CG2-CD2 4.28Å; T41-L68 WeakPolarHBondContact OG1-CB 3.4Å
42V98.6Very high97.7Very high81 Ų8150.5 Ų50.549%0.49130%0.301SS..Hα-helixtrans-63.4-49.4175.8170.90000111V38 G39 L40 I44 S45 V46V38-V42 HydrophobicContact CG1-CG2 4.39Å; V38-V42 WeakPolarHBondContact O-CG2 3.4Å; V38-V42 PolarHBondContact O-N 3.23Å; G39-V42 PolarHBondContact O-N 2.68Å; L40-V42 VanDerWaalsContact C-N 3.34Å; L40-V42 PolarHBondContact O-N 2.93Å; V42-I44 PolarHBondContact O-N 3.4Å; V42-S45 PolarHBondContact O-N 2.92Å; V42-V46 HydrophobicContact CG1-CG2 4.44Å; V42-V46 WeakPolarHBondContact O-CG2 3.48Å; V42-V46 PolarHBondContact O-N 3.31Å
43L98.3Very high97.7Very high87 Ų8751.7 Ų51.746%0.45531%0.307SS..Hα-helixtrans-60.1-48.5-179.4-73.8171000111.8G39 L40 S45 V46 L47 F204G39-L43 WeakPolarHBondContact O-CB 3.33Å; G39-L43 VanDerWaalsContact O-CG 3.23Å; G39-L43 WeakPolarHBondContact O-CG 3.46Å; G39-L43 PolarHBondContact O-N 3.19Å; L40-L43 PolarHBondContact O-N 3.32Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 3.37Å; L43-V46 PolarHBondContact O-N 3.42Å; L43-L47 WeakPolarHBondContact O-CB 3.17Å; L43-L47 VanDerWaalsContact O-CG 3.26Å; L43-L47 WeakPolarHBondContact O-CG 3.31Å; L43-L47 PolarHBondContact O-N 3.06Å; L43-F204 HydrophobicContact CB-CE1 4.1Å; L43-F204 HydrophobicContact CB-CZ 3.99Å; L43-F204 HydrophobicContact CD1-CZ 4.23Å
44I98.3Very high97.7Very high12 Ų1255 Ų556%0.06232%0.324CS..Hα-helixtrans-60.1-43.1176.4-70168.1000109.9L40 V42 V46 L47 S48 P59 I67 F204L40-I44 WeakPolarHBondContact O-CB 3.3Å; L40-I44 VanDerWaalsContact O-CG1 3.3Å; L40-I44 WeakPolarHBondContact O-CG1 3.07Å; L40-I44 PolarHBondContact O-N 3.18Å; V42-I44 PolarHBondContact O-N 3.4Å; I44-V46 PolarHBondContact O-N 3.47Å; I44-L47 PolarHBondContact O-N 3.09Å; I44-S48 VanDerWaalsContact O-CB 3.27Å; I44-S48 WeakPolarHBondContact O-CB 3.49Å; I44-S48 PolarHBondContact O-N 3.29Å; I44-S48 PolarHBondContact O-OG 3.2Å; I44-P59 HydrophobicContact CG2-CB 3.91Å; I44-I67 HydrophobicContact CD1-CD1 3.47Å; I44-I67 VanDerWaalsContact CD1-CD1 3.47Å; I44-F204 HydrophobicContact CG1-CD1 4.49Å; I44-F204 HydrophobicContact CG1-CE1 4.1Å
45S98.1Very high97.7Very high26 Ų2656.2 Ų56.218%0.18233%0.329CS..Hα-helixtrans-61.9-43.6180-61.40000112.4T41 V42 L43 S48 R49 P50T41-S45 VanDerWaalsContact O-CB 3.27Å; T41-S45 WeakPolarHBondContact O-CB 3.13Å; T41-S45 PolarHBondContact O-N 2.83Å; T41-S45 PolarHBondContact O-OG 2.96Å; V42-S45 PolarHBondContact O-N 2.92Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 3.37Å; S45-S48 PolarHBondContact O-N 3.47Å; S45-R49 PolarHBondContact O-N 3.11Å; S45-P50 VanDerWaalsContact O-CD 3.3Å; S45-P50 WeakPolarHBondContact O-CD 3.49Å
46V98.3Very high97.7Very high104 Ų10451.7 Ų51.763%0.6330%0.302SS*.Hα-helixtrans-64-47.2176.5171.50000111.2V42 L43 I44 S48 R49V42-V46 HydrophobicContact CG1-CG2 4.44Å; V42-V46 WeakPolarHBondContact O-CG2 3.48Å; V42-V46 PolarHBondContact O-N 3.31Å; L43-V46 PolarHBondContact O-N 3.42Å; I44-V46 PolarHBondContact O-N 3.47Å; V46-S48 PolarHBondContact O-N 3.21Å; V46-R49 PolarHBondContact O-N 3.39Å
47L97.9Very high97.7Very high55 Ų5554.8 Ų54.829%0.28831%0.312SS..Hα-helixtrans-63.9-30.6179.2-70.5174.9000112.7L43 I44 R49 T195 V196 F204L43-L47 WeakPolarHBondContact O-CB 3.17Å; L43-L47 VanDerWaalsContact O-CG 3.26Å; L43-L47 WeakPolarHBondContact O-CG 3.31Å; L43-L47 PolarHBondContact O-N 3.06Å; I44-L47 PolarHBondContact O-N 3.09Å; L47-R49 VanDerWaalsContact C-N 3.29Å; L47-R49 PolarHBondContact O-N 2.96Å; L47-T195 HydrophobicContact CB-CG2 4.08Å; L47-T195 HydrophobicContact CD2-CG2 4.14Å; L47-V196 HydrophobicContact CD1-CG2 3.71Å; L47-F204 HydrophobicContact CD1-CE1 4.27Å; L47-F204 HydrophobicContact CD1-CE2 4.3Å; L47-F204 HydrophobicContact CD1-CZ 3.67Å
48S97.4Very high97.7Very high4 Ų455.8 Ų55.83%0.02832%0.316CS..Hα-helixtrans-70-24.9179.8-58.80000113.5I44 S45 V46 S56 P59I44-S48 VanDerWaalsContact O-CB 3.27Å; I44-S48 WeakPolarHBondContact O-CB 3.49Å; I44-S48 PolarHBondContact O-N 3.29Å; I44-S48 PolarHBondContact O-OG 3.2Å; S45-S48 PolarHBondContact O-N 3.47Å; V46-S48 PolarHBondContact O-N 3.21Å; S48-S56 WeakPolarHBondContact CB-O 3.29Å; S48-S56 WeakPolarHBondContact O-CB 3.47Å; S48-P59 WeakPolarHBondContact OG-CB 3.44Å; S48-P59 WeakPolarHBondContact OG-CG 3.12Å
49R97.4Very high97.7Very high181 Ų18153 Ų5368%0.68330%0.3SS*.  trans52.163.9-177.6-57.5178.4-179.9-177.3-0.7111.5S45 V46 L47 G51 T52 S56S45-R49 PolarHBondContact O-N 3.11Å; V46-R49 PolarHBondContact O-N 3.39Å; L47-R49 VanDerWaalsContact C-N 3.29Å; L47-R49 PolarHBondContact O-N 2.96Å; R49-G51 PolarHBondContact O-N 3.19Å; R49-T52 HydrophobicContact CB-CG2 3.86Å; R49-T52 WeakPolarHBondContact O-CG2 3.47Å; R49-T52 PolarHBondContact O-N 2.83Å; R49-T52 PolarHBondContact O-OG1 2.86Å; R49-S56 WeakPolarHBondContact O-CB 3.4Å
50P96.5Very high97.7Very high62 Ų6252.1 Ų52.140%0.40329%0.289SS..THydrogen-bonded Turntrans-52.3132-176.220.6-32.3000111.6S45 W57 V60S45-P50 VanDerWaalsContact O-CD 3.3Å; S45-P50 WeakPolarHBondContact O-CD 3.49Å; P50-W57 HydrophobicContact CB-CD2 4.22Å; P50-W57 HydrophobicContact CB-CE3 4.05Å; P50-W57 HydrophobicContact CB-CH2 3.78Å; P50-W57 HydrophobicContact CB-CZ2 3.93Å; P50-W57 HydrophobicContact CB-CZ3 3.83Å; P50-V60 HydrophobicContact CB-CG2 4.21Å; P50-V60 HydrophobicContact CG-CG2 4.46Å
51G95.1Very high97.8Very high55 Ų5552.5 Ų52.557%0.56729%0.291SS*.THydrogen-bonded Turntrans99.4-12.9-179.600000114.8R49 S53 S56R49-G51 PolarHBondContact O-N 3.19Å; G51-S53 VanDerWaalsContact C-N 3.34Å; G51-S56 PolarHBondContact N-OG 2.92Å; G51-S56 VanDerWaalsContact N-OG 3.08Å
52T96.1Very high97.8Very high105 Ų10553.7 Ų53.764%0.64430%0.297SS*.SBendtrans-77.2-21.2175.3610000113.3R49R49-T52 HydrophobicContact CB-CG2 3.86Å; R49-T52 WeakPolarHBondContact O-CG2 3.47Å; R49-T52 PolarHBondContact O-N 2.83Å; R49-T52 PolarHBondContact O-OG1 2.86Å
53S96.6Very high97.8Very high53 Ų5350 Ų5037%0.37127%0.274SS..  trans-159.5162.2174.767.50000111G51 F55 S56G51-S53 VanDerWaalsContact C-N 3.34Å; S53-F55 PolarHBondContact O-N 3.06Å; S53-S56 WeakPolarHBondContact O-CB 3.44Å; S53-S56 PolarHBondContact O-N 3.23Å; S53-S56 VanDerWaalsContact O-N 3.16Å; S53-S56 PolarHBondContact O-OG 3.21Å; S53-S56 PolarHBondContact OG-N 3.29Å; S53-S56 VanDerWaalsContact OG-N 3.08Å
54L97.5Very high97.8Very high69 Ų6948.8 Ų48.836%0.36127%0.268SS..THydrogen-bonded Turntrans-58.7-40.1171.3-66.6176.1000111S56 W57 F113 A116 V120L54-S56 VanDerWaalsContact C-N 3.29Å; L54-S56 PolarHBondContact O-N 3.34Å; L54-W57 PolarHBondContact O-N 3.45Å; L54-F113 HydrophobicContact CD2-CD1 3.97Å; L54-F113 HydrophobicContact CD2-CE1 4.09Å; L54-A116 HydrophobicContact CD1-CB 4.1Å; L54-V120 HydrophobicContact CD1-CG2 4.11Å
55F97.6Very high97.8Very high46 Ų4648.2 Ų48.220%0.20227%0.265CS..THydrogen-bonded Turntrans-58.1-37.1175.9177.7-95000113S53 W57 H58 P59 M114 S117 W191S53-F55 PolarHBondContact O-N 3.06Å; F55-W57 PolarHBondContact O-N 2.99Å; F55-H58 VanDerWaalsContact O-CB 3.28Å; F55-H58 WeakPolarHBondContact O-CB 3.29Å; F55-H58 PolarHBondContact O-N 3.2Å; F55-P59 HydrophobicContact CE1-CG 4.47Å; F55-P59 WeakPolarHBondContact O-CD 3.42Å; F55-M114 HydrophobicContact CD2-CE 3.71Å; F55-M114 HydrophobicContact CD2-SD 3.57Å; F55-M114 VanDerWaalsContact CD2-SD 3.57Å; F55-M114 HydrophobicContact CE2-CE 4.22Å; F55-M114 HydrophobicContact CE2-SD 3.63Å; F55-S117 PolarHBondContact N-OG 3.3Å; F55-W191 HydrophobicContact CD1-CG 4.35Å; F55-W191 HydrophobicContact CE1-CB 3.91Å; F55-W191 AromaticContact CE1-CD1 3.58Å; F55-W191 AromaticContact CE1-CD2 3.56Å; F55-W191 HydrophobicContact CE1-CD2 3.56Å; F55-W191 AromaticContact CE1-CE2 3.93Å; F55-W191 HydrophobicContact CE1-CE3 4.16Å; F55-W191 AromaticContact CE1-CG 3.36Å; F55-W191 HydrophobicContact CE1-CG 3.36Å; F55-W191 AromaticContact CE1-NE1 3.89Å; F55-W191 HydrophobicContact CZ-CB 4Å; F55-W191 HydrophobicContact CZ-CD2 4.08Å; F55-W191 HydrophobicContact CZ-CE3 4.32Å; F55-W191 AromaticContact CZ-CG 3.9Å; F55-W191 HydrophobicContact CZ-CG 3.9Å
56S97.9Very high97.8Very high1 Ų147.9 Ų47.91%0.00726%0.26CS..THydrogen-bonded Turntrans-54.8-28.5-177.667.50000114.1S48 R49 G51 S53 L54 V60S48-S56 WeakPolarHBondContact CB-O 3.29Å; S48-S56 WeakPolarHBondContact O-CB 3.47Å; R49-S56 WeakPolarHBondContact O-CB 3.4Å; G51-S56 PolarHBondContact N-OG 2.92Å; G51-S56 VanDerWaalsContact N-OG 3.08Å; S53-S56 WeakPolarHBondContact O-CB 3.44Å; S53-S56 PolarHBondContact O-N 3.23Å; S53-S56 VanDerWaalsContact O-N 3.16Å; S53-S56 PolarHBondContact O-OG 3.21Å; S53-S56 PolarHBondContact OG-N 3.29Å; S53-S56 VanDerWaalsContact OG-N 3.08Å; L54-S56 VanDerWaalsContact C-N 3.29Å; L54-S56 PolarHBondContact O-N 3.34Å; S56-V60 VanDerWaalsContact O-CG2 3.27Å; S56-V60 WeakPolarHBondContact O-CG2 3.46Å
57W98.5Very high97.9Very high95 Ų9543.6 Ų43.636%0.3623%0.233SC..Hα-helixtrans-76-24.3177.8-69.5105.4000113.4P50 L54 F55 V60 C61 F113P50-W57 HydrophobicContact CB-CD2 4.22Å; P50-W57 HydrophobicContact CB-CE3 4.05Å; P50-W57 HydrophobicContact CB-CH2 3.78Å; P50-W57 HydrophobicContact CB-CZ2 3.93Å; P50-W57 HydrophobicContact CB-CZ3 3.83Å; L54-W57 PolarHBondContact O-N 3.45Å; F55-W57 PolarHBondContact O-N 2.99Å; W57-V60 PolarHBondContact O-N 3.15Å; W57-C61 VanDerWaalsContact O-CB 3.28Å; W57-C61 WeakPolarHBondContact O-CB 3.08Å; W57-C61 PolarHBondContact O-N 3.03Å; W57-C61 PolarHBondContact O-SG 3.11Å; W57-F113 HydrophobicContact CB-CB 3.95Å; W57-F113 HydrophobicContact CB-CD1 3.96Å; W57-F113 HydrophobicContact CB-CD2 3.49Å; W57-F113 VanDerWaalsContact CB-CD2 3.49Å; W57-F113 HydrophobicContact CB-CE1 4.34Å; W57-F113 HydrophobicContact CB-CE2 3.9Å; W57-F113 HydrophobicContact CB-CG 3.53Å; W57-F113 HydrophobicContact CB-CZ 4.31Å; W57-F113 AromaticContact CD1-CD1 3.94Å; W57-F113 AromaticContact CD1-CE1 3.75Å; W57-F113 HydrophobicContact CG-CD1 4.16Å; W57-F113 HydrophobicContact CG-CD2 4.1Å; W57-F113 HydrophobicContact CG-CE1 4.09Å; W57-F113 HydrophobicContact CG-CE2 4.02Å; W57-F113 HydrophobicContact CG-CG 4.17Å; W57-F113 HydrophobicContact CG-CZ 4.02Å
58H98.4Very high97.9Very high22 Ų2243.1 Ų43.110%0.10223%0.231CC..Hα-helixtrans-59.6-59.8178.8174.972.4000113F55 V60 C61 M62 G110 M114 H130F55-H58 VanDerWaalsContact O-CB 3.28Å; F55-H58 WeakPolarHBondContact O-CB 3.29Å; F55-H58 PolarHBondContact O-N 3.2Å; H58-V60 VanDerWaalsContact C-N 3.28Å; H58-V60 PolarHBondContact O-N 2.86Å; H58-C61 PolarHBondContact O-N 2.87Å; H58-M62 VanDerWaalsContact CE1-CG 3.48Å; H58-M62 WeakPolarHBondContact CE1-CG 3.44Å; H58-M62 VanDerWaalsContact O-CB 3.31Å; H58-M62 WeakPolarHBondContact O-CB 3.22Å; H58-M62 WeakPolarHBondContact O-CG 3.43Å; H58-M62 PolarHBondContact O-N 3.01Å; H58-G110 PolarHBondContact ND1-O 3.24Å; H58-M114 HydrophobicContact CB-CB 4.12Å; H58-M114 HydrophobicContact CB-SD 4.48Å; H58-H130 AromaticContact NE2-NE2 3.92Å
59P98.3Very high97.9Very high13 Ų1343.7 Ų43.78%0.08424%0.235CC..Hα-helixtrans-62.7-32.7178.924-32.9000113I44 S48 F55 S63 W191I44-P59 HydrophobicContact CG2-CB 3.91Å; S48-P59 WeakPolarHBondContact OG-CB 3.44Å; S48-P59 WeakPolarHBondContact OG-CG 3.12Å; F55-P59 HydrophobicContact CE1-CG 4.47Å; F55-P59 WeakPolarHBondContact O-CD 3.42Å; P59-S63 WeakPolarHBondContact O-CB 3.47Å; P59-S63 PolarHBondContact O-N 3.33Å; P59-S63 PolarHBondContact O-OG 3.3Å; P59-W191 HydrophobicContact CB-CH2 4.09Å; P59-W191 HydrophobicContact CB-CZ3 4.05Å; P59-W191 HydrophobicContact CG-CH2 4.01Å; P59-W191 HydrophobicContact CG-CZ2 4.4Å; P59-W191 HydrophobicContact CG-CZ3 4.22Å
60V98.6Very high98Very high11 Ų1135.4 Ų35.47%0.06720%0.204CC..Hα-helixtrans-60.4-59.4173.5176.60000110.1P50 S56 W57 H58 M62 S63 I64P50-V60 HydrophobicContact CB-CG2 4.21Å; P50-V60 HydrophobicContact CG-CG2 4.46Å; S56-V60 VanDerWaalsContact O-CG2 3.27Å; S56-V60 WeakPolarHBondContact O-CG2 3.46Å; W57-V60 PolarHBondContact O-N 3.15Å; H58-V60 VanDerWaalsContact C-N 3.28Å; H58-V60 PolarHBondContact O-N 2.86Å; V60-M62 VanDerWaalsContact C-N 3.33Å; V60-M62 PolarHBondContact O-N 3.46Å; V60-S63 PolarHBondContact O-N 3.03Å; V60-S63 PolarHBondContact O-OG 3.21Å; V60-I64 HydrophobicContact CG1-CD1 4.02Å; V60-I64 WeakPolarHBondContact O-CG1 3.46Å; V60-I64 PolarHBondContact O-N 3.48Å
61C98.8Very high98.1Very high13 Ų1332.5 Ų32.59%0.08819%0.185CC..Hα-helixtrans-62.1-40-178.2-69.80000112.4W57 H58 I64 A65 A106 G110W57-C61 VanDerWaalsContact O-CB 3.28Å; W57-C61 WeakPolarHBondContact O-CB 3.08Å; W57-C61 PolarHBondContact O-N 3.03Å; W57-C61 PolarHBondContact O-SG 3.11Å; H58-C61 PolarHBondContact O-N 2.87Å; C61-I64 PolarHBondContact O-N 3.23Å; C61-A65 WeakPolarHBondContact O-CB 3.43Å; C61-A65 PolarHBondContact O-N 2.99Å; C61-A106 WeakPolarHBondContact CB-O 3.3Å; C61-G110 VanDerWaalsContact CB-CA 3.46Å
62M98.7Very high98.2Very high32 Ų3230.6 Ų30.616%0.15816%0.161CC..Hα-helixtrans-67.8-38.2178.3-69.8-60.9167.200112.6H58 V60 A65 Y66 A107 V111H58-M62 VanDerWaalsContact CE1-CG 3.48Å; H58-M62 WeakPolarHBondContact CE1-CG 3.44Å; H58-M62 VanDerWaalsContact O-CB 3.31Å; H58-M62 WeakPolarHBondContact O-CB 3.22Å; H58-M62 WeakPolarHBondContact O-CG 3.43Å; H58-M62 PolarHBondContact O-N 3.01Å; V60-M62 VanDerWaalsContact C-N 3.33Å; V60-M62 PolarHBondContact O-N 3.46Å; M62-A65 PolarHBondContact O-N 2.93Å; M62-Y66 PolarHBondContact O-N 3.45Å; M62-Y66 HydrophobicContact SD-CD2 3.91Å; M62-Y66 HydrophobicContact SD-CE2 3.79Å; M62-A107 VanDerWaalsContact CE-O 3.28Å; M62-A107 WeakPolarHBondContact CE-O 3.38Å; M62-V111 HydrophobicContact CE-CB 4.3Å; M62-V111 HydrophobicContact CE-CG2 3.35Å
63S98.7Very high98.2Very high3 Ų325.6 Ų25.62%0.02113%0.131CC..Iπ-helixtrans-68.9-36.9175.269.60000112.1T41 P59 V60 I67 L68T41-S63 PolarHBondContact OG1-O 3.48Å; P59-S63 WeakPolarHBondContact O-CB 3.47Å; P59-S63 PolarHBondContact O-N 3.33Å; P59-S63 PolarHBondContact O-OG 3.3Å; V60-S63 PolarHBondContact O-N 3.03Å; V60-S63 PolarHBondContact O-OG 3.21Å; S63-I67 WeakPolarHBondContact O-CA 3.32Å; S63-I67 VanDerWaalsContact O-CB 3.28Å; S63-I67 WeakPolarHBondContact O-CB 3.34Å; S63-I67 PolarHBondContact O-N 2.88Å; S63-I67 VanDerWaalsContact O-N 3.13Å; S63-L68 PolarHBondContact O-N 3.41Å
64I98.8Very high98.2Very high62 Ų6224 Ų2432%0.31812%0.118SC..Iπ-helixtrans-62.6-47.5172.1-67.4167.1000110.1T41 V60 C61 C69 A106T41-I64 HydrophobicContact CG2-CG1 3.83Å; V60-I64 HydrophobicContact CG1-CD1 4.02Å; V60-I64 WeakPolarHBondContact O-CG1 3.46Å; V60-I64 PolarHBondContact O-N 3.48Å; C61-I64 PolarHBondContact O-N 3.23Å; I64-C69 WeakPolarHBondContact O-CB 3.46Å; I64-C69 PolarHBondContact O-N 2.81Å; I64-C69 PolarHBondContact O-SG 3.28Å; I64-C69 VanDerWaalsContact O-SG 3.36Å; I64-A106 HydrophobicContact CG2-CB 4.28Å
65A98.8Very high98.1Very high0 Ų020.8 Ų20.80%010%0.101CC..Iπ-helixtrans-65.1-59.7-178.200000112.6C61 M62 L70 V103 A106 A107C61-A65 WeakPolarHBondContact O-CB 3.43Å; C61-A65 PolarHBondContact O-N 2.99Å; M62-A65 PolarHBondContact O-N 2.93Å; A65-L70 WeakPolarHBondContact O-CB 3.3Å; A65-L70 PolarHBondContact O-N 3.45Å; A65-V103 HydrophobicContact CB-CG1 4.29Å; A65-A106 HydrophobicContact CB-CB 3.89Å; A65-A107 HydrophobicContact CB-CB 4.13Å
66Y98.8Very high97.9Very high19 Ų1918.6 Ų18.68%0.0759%0.091CC..Iπ-helixtrans-97.5-24.3-163.6-71.3-68.4000114.5M62 L70 V103 A107 T137 T141 A179M62-Y66 PolarHBondContact O-N 3.45Å; M62-Y66 HydrophobicContact SD-CD2 3.91Å; M62-Y66 HydrophobicContact SD-CE2 3.79Å; Y66-L70 HydrophobicContact CD1-CD2 3.88Å; Y66-L70 HydrophobicContact CE1-CD2 4.49Å; Y66-V103 HydrophobicContact CE1-CG1 4.31Å; Y66-A107 HydrophobicContact CE2-CB 3.77Å; Y66-T137 HydrophobicContact CD1-CG2 4.28Å; Y66-T137 HydrophobicContact CE1-CG2 3.78Å; Y66-T141 HydrophobicContact CE1-CG2 4.31Å; Y66-T141 WeakPolarHBondContact CE1-OG1 3.39Å; Y66-T141 PolarHBondContact OH-OG1 3.25Å; Y66-A179 HydrophobicContact CD1-CB 3.71Å; Y66-A179 HydrophobicContact CE1-CB 4.37Å; Y66-A179 HydrophobicContact CG-CB 4.36Å
67I98.7Very high97.6Very high15 Ų1520.6 Ų20.68%0.07710%0.1CC..Iπ-helixtrans-92.6-51177.2-58.5174.6000109.9L40 I44 S63 T71 V183L40-I67 HydrophobicContact CB-CG2 3.92Å; L40-I67 HydrophobicContact CD1-CG2 4.3Å; I44-I67 HydrophobicContact CD1-CD1 3.47Å; I44-I67 VanDerWaalsContact CD1-CD1 3.47Å; S63-I67 WeakPolarHBondContact O-CA 3.32Å; S63-I67 VanDerWaalsContact O-CB 3.28Å; S63-I67 WeakPolarHBondContact O-CB 3.34Å; S63-I67 PolarHBondContact O-N 2.88Å; S63-I67 VanDerWaalsContact O-N 3.13Å; I67-T71 WeakPolarHBondContact O-CB 3.44Å; I67-T71 PolarHBondContact O-OG1 3.13Å; I67-V183 HydrophobicContact CD1-CG1 3.88Å; I67-V183 HydrophobicContact CD1-CG2 4.34Å; I67-V183 HydrophobicContact CG1-CG1 4.2Å; I67-V183 HydrophobicContact CG1-CG2 3.98Å
68L98.6Very high97Very high44 Ų4416.3 Ų16.323%0.238%0.084CC..Iπ-helixtrans-83.4-72.7-177.8-178.662.9000112.4A37 V38 T41 S63 L70 T71 E72A37-L68 HydrophobicContact CB-CD1 4.49Å; V38-L68 HydrophobicContact CG2-CD1 3.71Å; T41-L68 HydrophobicContact CG2-CB 4.21Å; T41-L68 HydrophobicContact CG2-CD2 4.28Å; T41-L68 WeakPolarHBondContact OG1-CB 3.4Å; S63-L68 PolarHBondContact O-N 3.41Å; L68-L70 PolarHBondContact O-N 3.11Å; L68-T71 PolarHBondContact O-N 2.82Å; L68-E72 HydrophobicContact CD1-CG 3.86Å; L68-E72 HydrophobicContact CG-CG 4.49Å; L68-E72 WeakPolarHBondContact O-CG 3.29Å; L68-E72 PolarHBondContact O-N 2.75Å
69C98.5Very high96.1Very high16 Ų1619.7 Ų19.711%0.10811%0.108CC..Iπ-helixtrans-61.1-44.1-168.4-70.90000112.5I64 T71 E72 G73 I99 V103I64-C69 WeakPolarHBondContact O-CB 3.46Å; I64-C69 PolarHBondContact O-N 2.81Å; I64-C69 PolarHBondContact O-SG 3.28Å; I64-C69 VanDerWaalsContact O-SG 3.36Å; C69-T71 VanDerWaalsContact C-N 3.35Å; C69-T71 PolarHBondContact O-N 3.41Å; C69-E72 PolarHBondContact O-N 3.48Å; C69-G73 PolarHBondContact O-N 3.03Å; C69-I99 HydrophobicContact CB-CG2 3.94Å; C69-I99 WeakPolarHBondContact O-CG2 3.45Å; C69-V103 HydrophobicContact CB-CG2 3.53Å
70L98.3Very high95.2Very high8 Ų820.8 Ų20.84%0.04211%0.112CC..Hα-helixtrans-62.9-42.1179.7-171.661.2000112A65 Y66 L68 I74 V103 Y176 A179A65-L70 WeakPolarHBondContact O-CB 3.3Å; A65-L70 PolarHBondContact O-N 3.45Å; Y66-L70 HydrophobicContact CD1-CD2 3.88Å; Y66-L70 HydrophobicContact CE1-CD2 4.49Å; L68-L70 PolarHBondContact O-N 3.11Å; L70-I74 HydrophobicContact CD1-CD1 4.39Å; L70-I74 HydrophobicContact CG-CD1 4.42Å; L70-I74 WeakPolarHBondContact O-CG1 3.36Å; L70-I74 PolarHBondContact O-N 2.87Å; L70-V103 HydrophobicContact CB-CG2 4.19Å; L70-Y176 HydrophobicContact CD2-CD2 3.83Å; L70-Y176 HydrophobicContact CD2-CE2 4.38Å; L70-Y176 HydrophobicContact CG-CD2 3.8Å; L70-Y176 HydrophobicContact CG-CE2 4.18Å; L70-A179 HydrophobicContact CD2-CB 4.02Å
71T98.2Very high93.7Very high1 Ų122 Ų221%0.00613%0.127CC..Hα-helixtrans-63.5-52.1176.5-57.40000111.1A37 I67 L68 C69 G73 I74 L75 Y176 P211 I215A37-T71 HydrophobicContact CB-CG2 4.02Å; I67-T71 WeakPolarHBondContact O-CB 3.44Å; I67-T71 PolarHBondContact O-OG1 3.13Å; L68-T71 PolarHBondContact O-N 2.82Å; C69-T71 VanDerWaalsContact C-N 3.35Å; C69-T71 PolarHBondContact O-N 3.41Å; T71-G73 VanDerWaalsContact C-N 3.3Å; T71-G73 PolarHBondContact O-N 3.45Å; T71-I74 PolarHBondContact O-N 2.84Å; T71-I74 VanDerWaalsContact O-N 3.16Å; T71-L75 HydrophobicContact CG2-CD1 3.74Å; T71-L75 HydrophobicContact CG2-CG 4.22Å; T71-L75 WeakPolarHBondContact O-CB 3.03Å; T71-L75 WeakPolarHBondContact O-CG 3.41Å; T71-L75 PolarHBondContact O-N 2.97Å; T71-Y176 WeakPolarHBondContact OG1-CE2 3.44Å; T71-Y176 PolarHBondContact OG1-OH 2.96Å; T71-P211 HydrophobicContact CG2-CB 4.1Å; T71-I215 HydrophobicContact CG2-CD1 4.07Å
72E97.5Very high92.3Very high15 Ų1522.8 Ų22.87%0.0713%0.131CC..Hα-helixtrans-60.9-40.2179.4-67.8-53.9136.500112.2H34 L68 C69 I74 L75 L76H34-E72 IonicContact CE1-OE1 3.75Å; H34-E72 IonicContact CE1-OE2 2.75Å; H34-E72 PolarHBondContact CE1-OE2 3.02Å; H34-E72 IonicContact CG-OE1 2.67Å; H34-E72 IonicContact ND1-OE1 3.16Å; H34-E72 PolarHBondContact ND1-OE1 3.27Å; H34-E72 IonicContact ND1-OE2 3.13Å; H34-E72 PolarHBondContact ND1-OE2 3.29Å; L68-E72 HydrophobicContact CD1-CG 3.86Å; L68-E72 HydrophobicContact CG-CG 4.49Å; L68-E72 WeakPolarHBondContact O-CG 3.29Å; L68-E72 PolarHBondContact O-N 2.75Å; C69-E72 PolarHBondContact O-N 3.48Å; E72-I74 VanDerWaalsContact C-N 3.25Å; E72-I74 PolarHBondContact O-N 3.16Å; E72-L75 PolarHBondContact O-N 3.45Å; E72-L76 WeakPolarHBondContact O-CB 3.42Å; E72-L76 PolarHBondContact O-N 2.99Å
73G96.4Very high90.7Very high0 Ų025.3 Ų25.30%015%0.15CC..Hα-helixtrans-61.3-33.2178.300000113C69 T71 H96C69-G73 PolarHBondContact O-N 3.03Å; T71-G73 VanDerWaalsContact C-N 3.3Å; T71-G73 PolarHBondContact O-N 3.45Å; G73-H96 PolarHBondContact O-ND1 3.23Å
74I96.5Very high89.3Confident20 Ų2028.5 Ų28.510%0.10316%0.164CC..Hα-helixtrans-85.9-44.7178.2-63.8169.7000111.2L70 T71 E72 L76 F77 Y176 I215 Q218 I219L70-I74 HydrophobicContact CD1-CD1 4.39Å; L70-I74 HydrophobicContact CG-CD1 4.42Å; L70-I74 WeakPolarHBondContact O-CG1 3.36Å; L70-I74 PolarHBondContact O-N 2.87Å; T71-I74 PolarHBondContact O-N 2.84Å; T71-I74 VanDerWaalsContact O-N 3.16Å; E72-I74 VanDerWaalsContact C-N 3.25Å; E72-I74 PolarHBondContact O-N 3.16Å; I74-L76 PolarHBondContact O-N 3.23Å; I74-F77 PolarHBondContact O-N 3.46Å; I74-Y176 HydrophobicContact CD1-CD2 3.46Å; I74-Y176 VanDerWaalsContact CD1-CD2 3.46Å; I74-Y176 HydrophobicContact CD1-CE2 4.24Å; I74-Y176 HydrophobicContact CD1-CG 4.03Å; I74-I215 HydrophobicContact CB-CD1 4.14Å; I74-I215 HydrophobicContact CB-CG1 4.44Å; I74-I215 HydrophobicContact CD1-CD1 4.36Å; I74-I215 HydrophobicContact CD1-CG2 4.4Å; I74-I215 HydrophobicContact CG2-CB 4.47Å; I74-I215 HydrophobicContact CG2-CD1 4.17Å; I74-I215 HydrophobicContact CG2-CG1 3.96Å; I74-I215 HydrophobicContact CG2-CG2 3.78Å; I74-Q218 PolarHBondContact O-NE2 3.17Å; I74-I219 HydrophobicContact CG2-CD1 4.29Å
75L95.4Very high87.5Confident0 Ų031.7 Ų31.70%019%0.19CC..Hα-helixtrans-67.7-16-179.7-69.1-175.3000113.3A33 H34 T71 E72 F77 S78 V214 I215A33-L75 HydrophobicContact CB-CD1 3.8Å; H34-L75 VanDerWaalsContact CE1-CB 3.49Å; H34-L75 WeakPolarHBondContact CE1-CB 3.45Å; T71-L75 HydrophobicContact CG2-CD1 3.74Å; T71-L75 HydrophobicContact CG2-CG 4.22Å; T71-L75 WeakPolarHBondContact O-CB 3.03Å; T71-L75 WeakPolarHBondContact O-CG 3.41Å; T71-L75 PolarHBondContact O-N 2.97Å; E72-L75 PolarHBondContact O-N 3.45Å; L75-F77 PolarHBondContact O-N 2.92Å; L75-S78 WeakPolarHBondContact O-CB 3.35Å; L75-S78 PolarHBondContact O-N 2.9Å; L75-V214 HydrophobicContact CD2-CG1 4.11Å; L75-I215 HydrophobicContact CD2-CD1 4.36Å; L75-I215 HydrophobicContact CD2-CG1 3.62Å; L75-I215 HydrophobicContact CG-CD1 4.28Å; L75-I215 HydrophobicContact CG-CG1 4.08Å
76L93.3Very high86Confident0 Ų036.6 Ų36.60%021%0.212CC..THydrogen-bonded Turntrans-51.4-31.4169.9-177.861.2000113.4E72 I74 T82 F84 K92 L95 H96E72-L76 WeakPolarHBondContact O-CB 3.42Å; E72-L76 PolarHBondContact O-N 2.99Å; I74-L76 PolarHBondContact O-N 3.23Å; L76-T82 HydrophobicContact CD1-CG2 4.33Å; L76-F84 HydrophobicContact CD1-CB 4.05Å; L76-F84 HydrophobicContact CD1-CD2 3.69Å; L76-F84 HydrophobicContact CD1-CG 4.19Å; L76-K92 HydrophobicContact CD1-CG 4.18Å; L76-K92 HydrophobicContact CD2-CB 4.19Å; L76-K92 WeakPolarHBondContact CD2-O 3.36Å; L76-K92 HydrophobicContact CG-CB 4.06Å; L76-K92 HydrophobicContact CG-CG 4.2Å; L76-K92 WeakPolarHBondContact O-CD 3.29Å; L76-K92 WeakPolarHBondContact O-CE 3.47Å; L76-K92 PolarHBondContact O-NZ 3.27Å; L76-L95 HydrophobicContact CD1-CD2 3.77Å; L76-L95 HydrophobicContact CD2-CB 3.83Å; L76-L95 HydrophobicContact CD2-CD2 3.87Å; L76-L95 HydrophobicContact CD2-CG 3.83Å; L76-H96 HydrophobicContact CD2-CB 4.14Å
77F91.2Very high84.6Confident44 Ų4445.8 Ų45.819%0.19325%0.252CS..THydrogen-bonded Turntrans-91.74.1178-61.9-65.4000114.4I74 L75 R89 K92 V93 H96I74-F77 PolarHBondContact O-N 3.46Å; L75-F77 PolarHBondContact O-N 2.92Å; F77-R89 VanDerWaalsContact CD1-NH1 3.27Å; F77-R89 VanDerWaalsContact CE1-CZ 3.46Å; F77-K92 HydrophobicContact CD1-CB 4.09Å; F77-K92 HydrophobicContact CD1-CD 4.37Å; F77-K92 HydrophobicContact CE1-CB 3.63Å; F77-K92 HydrophobicContact CZ-CB 4.43Å; F77-V93 HydrophobicContact CE1-CG2 4.02Å; F77-V93 HydrophobicContact CZ-CG2 4Å; F77-H96 HydrophobicContact CE2-CB 3.7Å; F77-H96 AromaticContact CE2-CG 3.66Å; F77-H96 AromaticContact CE2-ND1 3.67Å; F77-H96 HydrophobicContact CZ-CB 3.81Å
78S87.6Confident83.9Confident4 Ų448 Ų483%0.02827%0.273CS..  trans-58.1134.4173.7-177.40000110.8L75 E80 Q218L75-S78 WeakPolarHBondContact O-CB 3.35Å; L75-S78 PolarHBondContact O-N 2.9Å; S78-E80 VanDerWaalsContact C-N 3.26Å; S78-E80 PolarHBondContact OG-N 3.3Å; S78-Q218 VanDerWaalsContact CB-OE1 3.26Å
79P78.9Confident83.3Confident93 Ų9352.9 Ų52.960%0.60429%0.288SS*.THydrogen-bonded Turntrans-73.4-20.5173.430.1-33.2000112.5G81P79-G81 VanDerWaalsContact C-N 3.3Å; P79-G81 PolarHBondContact O-N 3.16Å
80E78.8Confident82.8Confident37 Ų3760.3 Ų60.317%0.17332%0.319CS..THydrogen-bonded Turntrans-86.5-0-171.8-55.4-50.6150.400114.2R26 R27 V30 S78R26-E80 HydrophobicContact CB-CG 4.02Å; R26-E80 IonicContact CZ-OE1 3.66Å; R26-E80 IonicContact NH1-OE1 3.37Å; R26-E80 PolarHBondContact NH1-OE1 2.97Å; R26-E80 IonicContact NH2-OE1 2.84Å; R26-E80 PolarHBondContact NH2-OE1 3.36Å; R27-E80 HydrophobicContact CG-CB 3.95Å; R27-E80 IonicContact NE-OE2 3.89Å; V30-E80 HydrophobicContact CG2-CB 4.22Å; S78-E80 VanDerWaalsContact C-N 3.26Å; S78-E80 PolarHBondContact OG-N 3.3Å
81G66.4Low82.3Confident36 Ų3660.8 Ų60.837%0.37133%0.326SS..  trans128.8152.7-179.900000111.3P79P79-G81 VanDerWaalsContact C-N 3.3Å; P79-G81 PolarHBondContact O-N 3.16Å
82T69.7Low82Confident30 Ų3062.3 Ų62.318%0.18433%0.332CS..  trans-141.8142.9171171.30000105.9L76 F84L76-T82 HydrophobicContact CD1-CG2 4.33Å; T82-F84 WeakPolarHBondContact CG2-O 3.45Å; T82-F84 PolarHBondContact O-N 3.1Å; T82-F84 VanDerWaalsContact O-N 3.09Å; T82-F84 VanDerWaalsContact OG1-CD2 3.3Å; T82-F84 WeakPolarHBondContact OG1-CD2 3.09Å; T82-F84 PolarHBondContact OG1-N 3.37Å
83P65.9Low81.8Confident84 Ų8464.1 Ų64.155%0.54534%0.344SS..SBendtrans-62.5-15.4177.823.7-32.8000112.3
84F68.1Low81.6Confident70 Ų7073.4 Ų73.431%0.30738%0.379SS..SBendtrans-85.1125.6178.6-54-74.3000111.9L76 T82 F86 L95 I99L76-F84 HydrophobicContact CD1-CB 4.05Å; L76-F84 HydrophobicContact CD1-CD2 3.69Å; L76-F84 HydrophobicContact CD1-CG 4.19Å; T82-F84 WeakPolarHBondContact CG2-O 3.45Å; T82-F84 PolarHBondContact O-N 3.1Å; T82-F84 VanDerWaalsContact O-N 3.09Å; T82-F84 VanDerWaalsContact OG1-CD2 3.3Å; T82-F84 WeakPolarHBondContact OG1-CD2 3.09Å; T82-F84 PolarHBondContact OG1-N 3.37Å; F84-F86 HydrophobicContact CB-CD2 4Å; F84-F86 PolarHBondContact O-N 3.09Å; F84-L95 HydrophobicContact CB-CD2 4Å; F84-L95 HydrophobicContact CD1-CD2 3.83Å; F84-L95 HydrophobicContact CD2-CD2 3.97Å; F84-L95 HydrophobicContact CE1-CD2 4.3Å; F84-L95 HydrophobicContact CE2-CD2 4.45Å; F84-L95 HydrophobicContact CG-CD2 3.65Å; F84-I99 HydrophobicContact CZ-CD1 4.5Å
85C62.6Low81.4Confident130 Ų13073.9 Ų73.988%0.87838%0.381SS*.  trans-70.524.2-178-62.80000115.6K87C85-K87 PolarHBondContact O-N 3.36Å
86F67.1Low81.4Confident102 Ų10275 Ų7545%0.44739%0.387SS..  trans-86.6103.3180-68.8-71000111.9F84 K92 L95F84-F86 HydrophobicContact CB-CD2 4Å; F84-F86 PolarHBondContact O-N 3.09Å; F86-K92 HydrophobicContact CB-CG 4.16Å; F86-K92 WeakPolarHBondContact O-CE 3.16Å; F86-L95 HydrophobicContact CD2-CD2 3.85Å; F86-L95 HydrophobicContact CE2-CD2 3.86Å
87K68.3Low81.5Confident212 Ų21279.4 Ų79.492%0.92240%0.403SS*.  trans-73.7-33.9172.2-65.7-172.4178.6-179.50112.8C85C85-K87 PolarHBondContact O-N 3.36Å
88A83.9Confident81.8Confident63 Ų6383.3 Ų83.352%0.52142%0.421SS..SBendtrans-80.1129.5-175.600000112.7K90 G91 K92A88-K90 VanDerWaalsContact C-N 3.26Å; A88-K90 PolarHBondContact O-N 3.05Å; A88-G91 PolarHBondContact O-N 3.22Å; A88-K92 PolarHBondContact O-N 2.64Å; A88-K92 VanDerWaalsContact O-N 3.16Å
89R86.1Confident82.2Confident145 Ų14583.7 Ų83.755%0.54742%0.422SS..Hα-helixtrans-55.4-38.7177.2-175.768.1-174.8-1607.3112.9F77 G91 K92 V93F77-R89 VanDerWaalsContact CD1-NH1 3.27Å; F77-R89 VanDerWaalsContact CE1-CZ 3.46Å; R89-G91 VanDerWaalsContact C-N 3.32Å; R89-G91 PolarHBondContact O-N 3.3Å; R89-K92 PolarHBondContact O-N 3.16Å; R89-V93 WeakPolarHBondContact O-CG2 3.44Å; R89-V93 PolarHBondContact O-N 2.81Å
90K87.9Confident83.1Confident173 Ų17380.7 Ų80.775%0.75240%0.4SS*.Hα-helixtrans-60.2-40.8176.8-69.6-176.3-179.8178.50112A88 V93 R94A88-K90 VanDerWaalsContact C-N 3.26Å; A88-K90 PolarHBondContact O-N 3.05Å; K90-V93 PolarHBondContact O-N 2.9Å; K90-R94 PolarHBondContact O-N 3.28Å; K90-R94 VanDerWaalsContact O-N 3.08Å
91G89.1Confident84Confident18 Ų1881.6 Ų81.619%0.18641%0.414CS..Hα-helixtrans-64.1-46.3175.800000111.7A88 R89 V93 R94 L95A88-G91 PolarHBondContact O-N 3.22Å; R89-G91 VanDerWaalsContact C-N 3.32Å; R89-G91 PolarHBondContact O-N 3.3Å; G91-V93 VanDerWaalsContact C-N 3.29Å; G91-V93 PolarHBondContact O-N 3.35Å; G91-R94 PolarHBondContact O-N 3.25Å; G91-R94 VanDerWaalsContact O-N 3.16Å; G91-L95 PolarHBondContact O-N 2.72Å
92K91.6Very high85.5Confident32 Ų3282.9 Ų82.914%0.13941%0.412CS..Hα-helixtrans-57.2-41.1174.4-66-172170.3-152.30112.5L76 F77 F86 A88 R89 L95 H96L76-K92 HydrophobicContact CD1-CG 4.18Å; L76-K92 HydrophobicContact CD2-CB 4.19Å; L76-K92 WeakPolarHBondContact CD2-O 3.36Å; L76-K92 HydrophobicContact CG-CB 4.06Å; L76-K92 HydrophobicContact CG-CG 4.2Å; L76-K92 WeakPolarHBondContact O-CD 3.29Å; L76-K92 WeakPolarHBondContact O-CE 3.47Å; L76-K92 PolarHBondContact O-NZ 3.27Å; F77-K92 HydrophobicContact CD1-CB 4.09Å; F77-K92 HydrophobicContact CD1-CD 4.37Å; F77-K92 HydrophobicContact CE1-CB 3.63Å; F77-K92 HydrophobicContact CZ-CB 4.43Å; F86-K92 HydrophobicContact CB-CG 4.16Å; F86-K92 WeakPolarHBondContact O-CE 3.16Å; A88-K92 PolarHBondContact O-N 2.64Å; A88-K92 VanDerWaalsContact O-N 3.16Å; R89-K92 PolarHBondContact O-N 3.16Å; K92-L95 PolarHBondContact O-N 3.43Å; K92-H96 WeakPolarHBondContact O-CB 3.38Å; K92-H96 PolarHBondContact O-N 3.45Å
93V92.3Very high86.9Confident53 Ų5381.5 Ų81.532%0.32140%0.403SS..Hα-helixtrans-63.9-47175.8174.10000111.4F77 R89 K90 G91 L95 H96 W97F77-V93 HydrophobicContact CE1-CG2 4.02Å; F77-V93 HydrophobicContact CZ-CG2 4Å; R89-V93 WeakPolarHBondContact O-CG2 3.44Å; R89-V93 PolarHBondContact O-N 2.81Å; K90-V93 PolarHBondContact O-N 2.9Å; G91-V93 VanDerWaalsContact C-N 3.29Å; G91-V93 PolarHBondContact O-N 3.35Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 2.85Å; V93-H96 WeakPolarHBondContact O-CB 3.34Å; V93-H96 PolarHBondContact O-N 3.17Å; V93-W97 PolarHBondContact O-N 3.39Å
94R92.2Very high88.5Confident196 Ų19680.3 Ų80.374%0.7439%0.391SS*.Hα-helixtrans-60.1-43.8177.9-70.4177.3-179.1173.8-1.9112.4K90 G91 W97 F98K90-R94 PolarHBondContact O-N 3.28Å; K90-R94 VanDerWaalsContact O-N 3.08Å; G91-R94 PolarHBondContact O-N 3.25Å; G91-R94 VanDerWaalsContact O-N 3.16Å; R94-W97 PolarHBondContact O-N 2.91Å; R94-F98 PolarHBondContact O-N 2.92Å
95L93.7Very high89.9Confident29 Ų2982.2 Ų82.215%0.15240%0.404CS..Hα-helixtrans-66.2-39.9177.4177.963.4000111.7L76 F84 F86 G91 K92 V93 W97 F98 I99L76-L95 HydrophobicContact CD1-CD2 3.77Å; L76-L95 HydrophobicContact CD2-CB 3.83Å; L76-L95 HydrophobicContact CD2-CD2 3.87Å; L76-L95 HydrophobicContact CD2-CG 3.83Å; F84-L95 HydrophobicContact CB-CD2 4Å; F84-L95 HydrophobicContact CD1-CD2 3.83Å; F84-L95 HydrophobicContact CD2-CD2 3.97Å; F84-L95 HydrophobicContact CE1-CD2 4.3Å; F84-L95 HydrophobicContact CE2-CD2 4.45Å; F84-L95 HydrophobicContact CG-CD2 3.65Å; F86-L95 HydrophobicContact CD2-CD2 3.85Å; F86-L95 HydrophobicContact CE2-CD2 3.86Å; G91-L95 PolarHBondContact O-N 2.72Å; K92-L95 PolarHBondContact O-N 3.43Å; V93-L95 VanDerWaalsContact C-N 3.34Å; V93-L95 PolarHBondContact O-N 2.85Å; L95-W97 VanDerWaalsContact C-N 3.32Å; L95-W97 PolarHBondContact O-N 3.48Å; L95-F98 HydrophobicContact CD1-CD1 4.19Å; L95-F98 PolarHBondContact O-N 2.89Å; L95-I99 HydrophobicContact CD1-CD1 3.94Å; L95-I99 HydrophobicContact CD1-CG1 4.04Å; L95-I99 HydrophobicContact CD2-CD1 4.39Å; L95-I99 HydrophobicContact CG-CD1 3.78Å; L95-I99 HydrophobicContact CG-CG1 4.31Å; L95-I99 WeakPolarHBondContact O-CB 3.48Å; L95-I99 VanDerWaalsContact O-CG1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.36Å; L95-I99 PolarHBondContact O-N 3.32Å
96H95.4Very high91.6Very high23 Ų2376.8 Ų76.811%0.10637%0.369CS..Hα-helixtrans-55.3-49.2172.8173.682.6000111G73 L76 F77 K92 V93 F98 I99 Q100G73-H96 PolarHBondContact O-ND1 3.23Å; L76-H96 HydrophobicContact CD2-CB 4.14Å; F77-H96 HydrophobicContact CE2-CB 3.7Å; F77-H96 AromaticContact CE2-CG 3.66Å; F77-H96 AromaticContact CE2-ND1 3.67Å; F77-H96 HydrophobicContact CZ-CB 3.81Å; K92-H96 WeakPolarHBondContact O-CB 3.38Å; K92-H96 PolarHBondContact O-N 3.45Å; V93-H96 WeakPolarHBondContact O-CB 3.34Å; V93-H96 PolarHBondContact O-N 3.17Å; H96-F98 PolarHBondContact O-N 3.28Å; H96-I99 PolarHBondContact O-N 3.35Å; H96-Q100 PolarHBondContact CE1-NE2 3.21Å; H96-Q100 VanDerWaalsContact CE1-NE2 3.25Å; H96-Q100 VanDerWaalsContact O-CG 3.31Å; H96-Q100 WeakPolarHBondContact O-CG 3.44Å; H96-Q100 PolarHBondContact O-N 2.94Å
97W95.4Very high93.1Very high94 Ų9471.9 Ų71.936%0.35635%0.347SS..Hα-helixtrans-59.8-45.3178-81.261.6000112.8V93 R94 L95 I99 Q100 A101 G148 I149 L152V93-W97 PolarHBondContact O-N 3.39Å; R94-W97 PolarHBondContact O-N 2.91Å; L95-W97 VanDerWaalsContact C-N 3.32Å; L95-W97 PolarHBondContact O-N 3.48Å; W97-I99 PolarHBondContact O-N 2.92Å; W97-Q100 PolarHBondContact O-N 3.05Å; W97-A101 PolarHBondContact O-N 2.93Å; W97-G148 WeakPolarHBondContact CZ2-O 3.48Å; W97-I149 HydrophobicContact CH2-CB 4.06Å; W97-I149 HydrophobicContact CH2-CG1 3.65Å; W97-I149 HydrophobicContact CH2-CG2 4.43Å; W97-I149 HydrophobicContact CZ3-CG1 3.67Å; W97-L152 HydrophobicContact CH2-CD1 3.45Å; W97-L152 VanDerWaalsContact CH2-CD1 3.45Å; W97-L152 HydrophobicContact CH2-CG 3.92Å; W97-L152 HydrophobicContact CZ2-CD1 3.88Å; W97-L152 HydrophobicContact CZ2-CD2 4.13Å; W97-L152 HydrophobicContact CZ2-CG 3.89Å; W97-L152 HydrophobicContact CZ3-CD1 4.37Å
98F96.1Very high94.6Very high126 Ų12664.4 Ų64.455%0.55333%0.325SS*.Hα-helixtrans-59-47.4175.9175-104.3000111.6R94 L95 H96 Q100 A101 L102R94-F98 PolarHBondContact O-N 2.92Å; L95-F98 HydrophobicContact CD1-CD1 4.19Å; L95-F98 PolarHBondContact O-N 2.89Å; H96-F98 PolarHBondContact O-N 3.28Å; F98-Q100 PolarHBondContact O-N 3.38Å; F98-A101 WeakPolarHBondContact O-CB 3.39Å; F98-A101 PolarHBondContact O-N 2.91Å; F98-L102 HydrophobicContact CD1-CD1 4.17Å; F98-L102 HydrophobicContact CE1-CD1 3.59Å; F98-L102 HydrophobicContact CE1-CG 4.26Å; F98-L102 HydrophobicContact CZ-CD1 3.92Å; F98-L102 HydrophobicContact CZ-CD2 4.33Å; F98-L102 HydrophobicContact CZ-CG 4.26Å; F98-L102 PolarHBondContact O-N 3.5Å; F98-L102 VanDerWaalsContact O-N 3.07Å
99I97.1Very high95.3Very high12 Ų1264.1 Ų64.16%0.06232%0.317CS..Hα-helixtrans-62.3-42.3177.6-67.7170.3000111C69 F84 L95 H96 W97 A101 L102 V103C69-I99 HydrophobicContact CB-CG2 3.94Å; C69-I99 WeakPolarHBondContact O-CG2 3.45Å; F84-I99 HydrophobicContact CZ-CD1 4.5Å; L95-I99 HydrophobicContact CD1-CD1 3.94Å; L95-I99 HydrophobicContact CD1-CG1 4.04Å; L95-I99 HydrophobicContact CD2-CD1 4.39Å; L95-I99 HydrophobicContact CG-CD1 3.78Å; L95-I99 HydrophobicContact CG-CG1 4.31Å; L95-I99 WeakPolarHBondContact O-CB 3.48Å; L95-I99 VanDerWaalsContact O-CG1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.36Å; L95-I99 PolarHBondContact O-N 3.32Å; H96-I99 PolarHBondContact O-N 3.35Å; W97-I99 PolarHBondContact O-N 2.92Å; I99-A101 VanDerWaalsContact C-N 3.3Å; I99-A101 PolarHBondContact O-N 3.44Å; I99-L102 WeakPolarHBondContact O-CA 3.31Å; I99-L102 WeakPolarHBondContact O-CB 3.49Å; I99-L102 PolarHBondContact O-N 2.95Å; I99-L102 VanDerWaalsContact O-N 3.09Å; I99-V103 WeakPolarHBondContact O-CG2 3.37Å; I99-V103 PolarHBondContact O-N 3.19Å
100Q97.5Very high95.9Very high30 Ų3057.2 Ų57.214%0.1429%0.291CS..Hα-helixtrans-64.6-33.4176.8-63.8-47.8-32.500112.6H96 W97 F98 L102 V103 I104H96-Q100 PolarHBondContact CE1-NE2 3.21Å; H96-Q100 VanDerWaalsContact CE1-NE2 3.25Å; H96-Q100 VanDerWaalsContact O-CG 3.31Å; H96-Q100 WeakPolarHBondContact O-CG 3.44Å; H96-Q100 PolarHBondContact O-N 2.94Å; W97-Q100 PolarHBondContact O-N 3.05Å; F98-Q100 PolarHBondContact O-N 3.38Å; Q100-L102 VanDerWaalsContact C-N 3.33Å; Q100-V103 WeakPolarHBondContact O-CB 3.3Å; Q100-V103 PolarHBondContact O-N 3.42Å; Q100-I104 PolarHBondContact O-N 3.45Å; Q100-I104 VanDerWaalsContact O-N 3.13Å
101A97.7Very high96.4Very high55 Ų5551.3 Ų51.346%0.45527%0.269SS..Hα-helixtrans-64.2-39.4171.600000111.5W97 F98 I99 I104 L105W97-A101 PolarHBondContact O-N 2.93Å; F98-A101 WeakPolarHBondContact O-CB 3.39Å; F98-A101 PolarHBondContact O-N 2.91Å; I99-A101 VanDerWaalsContact C-N 3.3Å; I99-A101 PolarHBondContact O-N 3.44Å; A101-I104 PolarHBondContact O-N 2.9Å; A101-L105 WeakPolarHBondContact O-CB 3.36Å; A101-L105 PolarHBondContact O-N 3.37Å
102L98.4Very high96.8Very high64 Ų6452.4 Ų52.434%0.33528%0.281SS..Hα-helixtrans-63.9-37.9173.1-64.3179.2000112.4F98 I99 Q100 L105 A106F98-L102 HydrophobicContact CD1-CD1 4.17Å; F98-L102 HydrophobicContact CE1-CD1 3.59Å; F98-L102 HydrophobicContact CE1-CG 4.26Å; F98-L102 HydrophobicContact CZ-CD1 3.92Å; F98-L102 HydrophobicContact CZ-CD2 4.33Å; F98-L102 HydrophobicContact CZ-CG 4.26Å; F98-L102 PolarHBondContact O-N 3.5Å; F98-L102 VanDerWaalsContact O-N 3.07Å; I99-L102 WeakPolarHBondContact O-CA 3.31Å; I99-L102 WeakPolarHBondContact O-CB 3.49Å; I99-L102 PolarHBondContact O-N 2.95Å; I99-L102 VanDerWaalsContact O-N 3.09Å; Q100-L102 VanDerWaalsContact C-N 3.33Å; L102-L105 PolarHBondContact O-N 3.41Å; L102-A106 VanDerWaalsContact O-CB 3.26Å; L102-A106 WeakPolarHBondContact O-CB 3.38Å; L102-A106 PolarHBondContact O-N 3.32Å
103V98.8Very high97.1Very high0 Ų053.9 Ų53.90%029%0.287CS..Hα-helixtrans-56.8-51.3173.5175.90000110.2A65 Y66 C69 L70 I99 Q100 A107 T141A65-V103 HydrophobicContact CB-CG1 4.29Å; Y66-V103 HydrophobicContact CE1-CG1 4.31Å; C69-V103 HydrophobicContact CB-CG2 3.53Å; L70-V103 HydrophobicContact CB-CG2 4.19Å; I99-V103 WeakPolarHBondContact O-CG2 3.37Å; I99-V103 PolarHBondContact O-N 3.19Å; Q100-V103 WeakPolarHBondContact O-CB 3.3Å; Q100-V103 PolarHBondContact O-N 3.42Å; V103-A107 WeakPolarHBondContact O-CB 3.38Å; V103-A107 PolarHBondContact O-N 3.05Å; V103-T141 HydrophobicContact CG1-CG2 4.05Å
104I98.4Very high97.4Very high59 Ų5952.9 Ų52.930%0.30328%0.279SS..Hα-helixtrans-63.5-45.2-178.7-65170.4000110.9Q100 A101 A107 A108 A145Q100-I104 PolarHBondContact O-N 3.45Å; Q100-I104 VanDerWaalsContact O-N 3.13Å; A101-I104 PolarHBondContact O-N 2.9Å; I104-A107 PolarHBondContact O-N 3.01Å; I104-A108 VanDerWaalsContact O-CB 3.27Å; I104-A108 WeakPolarHBondContact O-CB 3.23Å; I104-A108 PolarHBondContact O-N 2.84Å; I104-A145 HydrophobicContact CD1-CB 3.69Å
105L98.6Very high97.7Very high110 Ų11046.3 Ų46.358%0.57626%0.261SS*.Hα-helixtrans-61.6-51.6180-179.362.6000111.3A101 L102 A107 A108 T109A101-L105 WeakPolarHBondContact O-CB 3.36Å; A101-L105 PolarHBondContact O-N 3.37Å; L102-L105 PolarHBondContact O-N 3.41Å; L105-A107 PolarHBondContact O-N 3.37Å; L105-A108 PolarHBondContact O-N 2.94Å; L105-T109 PolarHBondContact O-N 3.38Å; L105-T109 PolarHBondContact O-OG1 3.47Å
106A98.8Very high97.9Very high16 Ų1646.7 Ų46.713%0.13227%0.268CS..Hα-helixtrans-62.9-41.8179.500000111.6C61 I64 A65 L102 T109 G110C61-A106 WeakPolarHBondContact CB-O 3.3Å; I64-A106 HydrophobicContact CG2-CB 4.28Å; A65-A106 HydrophobicContact CB-CB 3.89Å; L102-A106 VanDerWaalsContact O-CB 3.26Å; L102-A106 WeakPolarHBondContact O-CB 3.38Å; L102-A106 PolarHBondContact O-N 3.32Å; A106-T109 PolarHBondContact O-N 3.48Å; A106-G110 PolarHBondContact O-N 3.09Å
107A98.7Very high98Very high0 Ų046.4 Ų46.40%027%0.269CS..Hα-helixtrans-63-44.6176.300000111.8M62 A65 Y66 V103 I104 L105 T109 G110 V111 L138M62-A107 VanDerWaalsContact CE-O 3.28Å; M62-A107 WeakPolarHBondContact CE-O 3.38Å; A65-A107 HydrophobicContact CB-CB 4.13Å; Y66-A107 HydrophobicContact CE2-CB 3.77Å; V103-A107 WeakPolarHBondContact O-CB 3.38Å; V103-A107 PolarHBondContact O-N 3.05Å; I104-A107 PolarHBondContact O-N 3.01Å; L105-A107 PolarHBondContact O-N 3.37Å; A107-T109 PolarHBondContact O-N 2.95Å; A107-G110 PolarHBondContact O-N 3.16Å; A107-V111 WeakPolarHBondContact O-CG2 3.45Å; A107-V111 PolarHBondContact O-N 2.9Å; A107-L138 HydrophobicContact CB-CD1 3.86Å
108A98.6Very high98.1Very high55 Ų5543.7 Ų43.746%0.45526%0.259SS..Hα-helixtrans-60.9-45.5176.500000111.6I104 L105 G110 V111 G112I104-A108 VanDerWaalsContact O-CB 3.27Å; I104-A108 WeakPolarHBondContact O-CB 3.23Å; I104-A108 PolarHBondContact O-N 2.84Å; L105-A108 PolarHBondContact O-N 2.94Å; A108-G110 PolarHBondContact O-N 3.33Å; A108-V111 PolarHBondContact O-N 2.94Å; A108-G112 PolarHBondContact O-N 2.87Å
109T98.6Very high98.2Very high57 Ų5742.3 Ų42.335%0.3526%0.258SS..Hα-helixtrans-59.7-46.8174.7-58.70000111.5L105 A106 A107 V111 G112 F113L105-T109 PolarHBondContact O-N 3.38Å; L105-T109 PolarHBondContact O-OG1 3.47Å; A106-T109 PolarHBondContact O-N 3.48Å; A107-T109 PolarHBondContact O-N 2.95Å; T109-V111 PolarHBondContact O-N 3.48Å; T109-G112 PolarHBondContact O-N 3.3Å; T109-F113 HydrophobicContact CG2-CD2 3.81Å; T109-F113 HydrophobicContact CG2-CE2 3.68Å; T109-F113 WeakPolarHBondContact O-CD2 3.35Å; T109-F113 PolarHBondContact O-N 3.2Å
110G98.5Very high98.3Very high0 Ų047.1 Ų47.10%029%0.287CS..Hα-helixtrans-64.4-37.6179.500000113.7H58 C61 A106 A107 A108 M114H58-G110 PolarHBondContact ND1-O 3.24Å; C61-G110 VanDerWaalsContact CB-CA 3.46Å; A106-G110 PolarHBondContact O-N 3.09Å; A107-G110 PolarHBondContact O-N 3.16Å; A108-G110 PolarHBondContact O-N 3.33Å; G110-M114 WeakPolarHBondContact O-CB 2.99Å; G110-M114 PolarHBondContact O-N 3.07Å
111V98.4Very high98.2Very high49 Ų4948.9 Ų48.930%0.29730%0.303SS..Hα-helixtrans-68.6-42.1171.9175.10000110.5M62 A107 A108 T109 F113 M114 V115 L138M62-V111 HydrophobicContact CE-CB 4.3Å; M62-V111 HydrophobicContact CE-CG2 3.35Å; A107-V111 WeakPolarHBondContact O-CG2 3.45Å; A107-V111 PolarHBondContact O-N 2.9Å; A108-V111 PolarHBondContact O-N 2.94Å; T109-V111 PolarHBondContact O-N 3.48Å; V111-F113 VanDerWaalsContact C-N 3.34Å; V111-F113 PolarHBondContact O-N 3.05Å; V111-M114 WeakPolarHBondContact O-CB 3.29Å; V111-M114 PolarHBondContact O-N 3.02Å; V111-M114 VanDerWaalsContact O-N 3.11Å; V111-V115 HydrophobicContact CG1-CG2 3.97Å; V111-V115 WeakPolarHBondContact O-CG2 3.45Å; V111-V115 PolarHBondContact O-N 3.2Å; V111-L138 HydrophobicContact CG2-CD2 3.94Å
112G98.5Very high98.1Very high41 Ų4154.9 Ų54.942%0.42332%0.322SS..Hα-helixtrans-55.2-48.6177.800000112.2A108 T109 M114 V115 A116A108-G112 PolarHBondContact O-N 2.87Å; T109-G112 PolarHBondContact O-N 3.3Å; G112-M114 PolarHBondContact O-N 3.44Å; G112-V115 PolarHBondContact O-N 3.34Å; G112-A116 WeakPolarHBondContact O-CB 3.47Å; G112-A116 PolarHBondContact O-N 3.33Å
113F98.5Very high98Very high62 Ų6260.1 Ų60.127%0.27234%0.337SS..Hα-helixtrans-62.7-40.1174.8-84.8-67.1000113.2L54 W57 T109 V111 A116 S117L54-F113 HydrophobicContact CD2-CD1 3.97Å; L54-F113 HydrophobicContact CD2-CE1 4.09Å; W57-F113 HydrophobicContact CB-CB 3.95Å; W57-F113 HydrophobicContact CB-CD1 3.96Å; W57-F113 HydrophobicContact CB-CD2 3.49Å; W57-F113 VanDerWaalsContact CB-CD2 3.49Å; W57-F113 HydrophobicContact CB-CE1 4.34Å; W57-F113 HydrophobicContact CB-CE2 3.9Å; W57-F113 HydrophobicContact CB-CG 3.53Å; W57-F113 HydrophobicContact CB-CZ 4.31Å; W57-F113 AromaticContact CD1-CD1 3.94Å; W57-F113 AromaticContact CD1-CE1 3.75Å; W57-F113 HydrophobicContact CG-CD1 4.16Å; W57-F113 HydrophobicContact CG-CD2 4.1Å; W57-F113 HydrophobicContact CG-CE1 4.09Å; W57-F113 HydrophobicContact CG-CE2 4.02Å; W57-F113 HydrophobicContact CG-CG 4.17Å; W57-F113 HydrophobicContact CG-CZ 4.02Å; T109-F113 HydrophobicContact CG2-CD2 3.81Å; T109-F113 HydrophobicContact CG2-CE2 3.68Å; T109-F113 WeakPolarHBondContact O-CD2 3.35Å; T109-F113 PolarHBondContact O-N 3.2Å; V111-F113 VanDerWaalsContact C-N 3.34Å; V111-F113 PolarHBondContact O-N 3.05Å; F113-A116 PolarHBondContact O-N 3.03Å; F113-S117 VanDerWaalsContact O-CB 3.3Å; F113-S117 WeakPolarHBondContact O-CB 3.43Å; F113-S117 PolarHBondContact O-N 3.27Å
114M97.8Very high97.8Very high33 Ų3364.2 Ų64.216%0.16336%0.364CS..Hα-helixtrans-64.2-44.4177-177.367.2-93.700111.9F55 H58 G110 V111 G112 S117 K118F55-M114 HydrophobicContact CD2-CE 3.71Å; F55-M114 HydrophobicContact CD2-SD 3.57Å; F55-M114 VanDerWaalsContact CD2-SD 3.57Å; F55-M114 HydrophobicContact CE2-CE 4.22Å; F55-M114 HydrophobicContact CE2-SD 3.63Å; H58-M114 HydrophobicContact CB-CB 4.12Å; H58-M114 HydrophobicContact CB-SD 4.48Å; G110-M114 WeakPolarHBondContact O-CB 2.99Å; G110-M114 PolarHBondContact O-N 3.07Å; V111-M114 WeakPolarHBondContact O-CB 3.29Å; V111-M114 PolarHBondContact O-N 3.02Å; V111-M114 VanDerWaalsContact O-N 3.11Å; G112-M114 PolarHBondContact O-N 3.44Å; M114-S117 PolarHBondContact O-N 2.83Å; M114-K118 HydrophobicContact CE-CD 3.84Å; M114-K118 HydrophobicContact CE-CG 3.57Å; M114-K118 PolarHBondContact O-N 2.86Å
115V98.4Very high97.7Very high58 Ų5865.5 Ų65.535%0.35237%0.368SS..Hα-helixtrans-63.4-48.1176.9170.40000110.2V111 G112 S117 K118 N119V111-V115 HydrophobicContact CG1-CG2 3.97Å; V111-V115 WeakPolarHBondContact O-CG2 3.45Å; V111-V115 PolarHBondContact O-N 3.2Å; G112-V115 PolarHBondContact O-N 3.34Å; V115-S117 VanDerWaalsContact C-N 3.33Å; V115-S117 PolarHBondContact O-N 2.87Å; V115-K118 PolarHBondContact O-N 3.5Å; V115-N119 VanDerWaalsContact O-CG 3.24Å; V115-N119 PolarHBondContact O-N 3.37Å; V115-N119 PolarHBondContact O-OD1 3.41Å
116A98.3Very high97.6Very high37 Ų3764.5 Ų64.531%0.30636%0.363SS..Hα-helixtrans-58.9-44.4176.900000111.8L54 G112 F113 K118 N119 V120L54-A116 HydrophobicContact CD1-CB 4.1Å; G112-A116 WeakPolarHBondContact O-CB 3.47Å; G112-A116 PolarHBondContact O-N 3.33Å; F113-A116 PolarHBondContact O-N 3.03Å; A116-K118 VanDerWaalsContact C-N 3.34Å; A116-K118 PolarHBondContact O-N 3.4Å; A116-N119 PolarHBondContact O-N 2.87Å; A116-V120 WeakPolarHBondContact O-CG2 3.34Å; A116-V120 PolarHBondContact O-N 3.23Å
117S98Very high97.4Very high17 Ų1767 Ų6712%0.11938%0.383CS..Hα-helixtrans-60.5-42.3176.5-169.90000112.3F55 F113 M114 V115 S121F55-S117 PolarHBondContact N-OG 3.3Å; F113-S117 VanDerWaalsContact O-CB 3.3Å; F113-S117 WeakPolarHBondContact O-CB 3.43Å; F113-S117 PolarHBondContact O-N 3.27Å; M114-S117 PolarHBondContact O-N 2.83Å; V115-S117 VanDerWaalsContact C-N 3.33Å; V115-S117 PolarHBondContact O-N 2.87Å; S117-S121 WeakPolarHBondContact O-CB 3.41Å; S117-S121 PolarHBondContact O-N 3.25Å; S117-S121 PolarHBondContact O-OG 3.21Å
118K97.1Very high97.3Very high36 Ų3670.4 Ų70.416%0.15741%0.405CS..Hα-helixtrans-67.6-37.6178.2-89.4177.3177.9-143.70112.7M114 V115 A116 S121 E122 R123 P124 H125M114-K118 HydrophobicContact CE-CD 3.84Å; M114-K118 HydrophobicContact CE-CG 3.57Å; M114-K118 PolarHBondContact O-N 2.86Å; V115-K118 PolarHBondContact O-N 3.5Å; A116-K118 VanDerWaalsContact C-N 3.34Å; A116-K118 PolarHBondContact O-N 3.4Å; K118-S121 CarbonylContact O-C 3.57Å; K118-S121 PolarHBondContact O-N 2.87Å; K118-E122 WeakPolarHBondContact O-CA 3.29Å; K118-E122 PolarHBondContact O-N 3.08Å; K118-R123 HydrophobicContact CG-CB 4.12Å; K118-R123 PolarHBondContact O-N 3.35Å; K118-P124 PolarHBondContact NZ-O 2.96Å; K118-H125 WeakPolarHBondContact CB-CE1 3.2Å
119N98Very high97.2Very high97 Ų9777.7 Ų77.752%0.51942%0.421SS..Hα-helixtrans-63.6-47176.2-68-9.8000111V115 A116 S121 E122 H125V115-N119 VanDerWaalsContact O-CG 3.24Å; V115-N119 PolarHBondContact O-N 3.37Å; V115-N119 PolarHBondContact O-OD1 3.41Å; A116-N119 PolarHBondContact O-N 2.87Å; N119-S121 VanDerWaalsContact C-N 3.31Å; N119-S121 PolarHBondContact O-N 2.92Å; N119-E122 PolarHBondContact O-N 3.09Å; N119-H125 PolarHBondContact OD1-CE1 3.26Å; N119-H125 PolarHBondContact OD1-NE2 3.12Å
120V97.8Very high97.2Very high113 Ų11377 Ų7769%0.68541%0.413SS*.Hα-helixtrans-64.7-35.9178.6172.50000112.1L54 A116L54-V120 HydrophobicContact CD1-CG2 4.11Å; A116-V120 WeakPolarHBondContact O-CG2 3.34Å; A116-V120 PolarHBondContact O-N 3.23Å
121S96.1Very high97.1Very high68 Ų6878 Ų7848%0.47642%0.42SS..THydrogen-bonded Turntrans-91.46179.7-56.20000114.3S117 K118 N119 R123S117-S121 WeakPolarHBondContact O-CB 3.41Å; S117-S121 PolarHBondContact O-N 3.25Å; S117-S121 PolarHBondContact O-OG 3.21Å; K118-S121 CarbonylContact O-C 3.57Å; K118-S121 PolarHBondContact O-N 2.87Å; N119-S121 VanDerWaalsContact C-N 3.31Å; N119-S121 PolarHBondContact O-N 2.92Å; S121-R123 WeakPolarHBondContact O-CG 3.17Å; S121-R123 PolarHBondContact O-N 3.19Å; S121-R123 VanDerWaalsContact O-N 3.09Å
122E96.6Very high97.1Very high181 Ų18179.9 Ų79.985%0.84643%0.428SS*.THydrogen-bonded Turntrans48.436.3-177.6-57.1-171.8136.700113.9K118 N119K118-E122 WeakPolarHBondContact O-CA 3.29Å; K118-E122 PolarHBondContact O-N 3.08Å; N119-E122 PolarHBondContact O-N 3.09Å
123R94.9Very high97.1Very high173 Ų17380.4 Ų80.465%0.65342%0.421SS*.PPolyproline II helixtrans-93.6144.3-179.3-64.9-59.9-171.8160.61.8110.8K118 S121K118-R123 HydrophobicContact CG-CB 4.12Å; K118-R123 PolarHBondContact O-N 3.35Å; S121-R123 WeakPolarHBondContact O-CG 3.17Å; S121-R123 PolarHBondContact O-N 3.19Å; S121-R123 VanDerWaalsContact O-N 3.09Å
124P96Very high97Very high86 Ų8678.5 Ų78.556%0.55842%0.419SS*.PPolyproline II helixtrans-63.9141.8-179.726.6-35000112.3K118 A127K118-P124 PolarHBondContact NZ-O 2.96Å; P124-A127 HydrophobicContact CB-CB 4.14Å; P124-A127 HydrophobicContact CG-CB 4.02Å
125H96.1Very high97.1Very high86 Ų8680.5 Ų80.540%0.39843%0.433SS..SBendtrans-83.3151.7173.8-65.9-84000110.8K118 N119 A127K118-H125 WeakPolarHBondContact CB-CE1 3.2Å; N119-H125 PolarHBondContact OD1-CE1 3.26Å; N119-H125 PolarHBondContact OD1-NE2 3.12Å; H125-A127 PolarHBondContact O-N 3.05Å
126L95.8Very high97.1Very high89 Ų8979.4 Ų79.447%0.46643%0.433SS..SBendtrans53.623.5174.8-52-177.3000116.3S131 L132 V135L126-S131 VanDerWaalsContact C-OG 3.24Å; L126-S131 VanDerWaalsContact CA-OG 3.23Å; L126-S131 WeakPolarHBondContact CA-OG 3.31Å; L126-L132 HydrophobicContact CB-CD2 4.21Å; L126-V135 HydrophobicContact CD2-CB 4.48Å; L126-V135 HydrophobicContact CD2-CG2 3.47Å; L126-V135 VanDerWaalsContact CD2-CG2 3.47Å
127A95.6Very high97.1Very high68 Ų6877.7 Ų77.756%0.56242%0.419SS*.  trans-84-6.1-175.200000114.6P124 H125 S131P124-A127 HydrophobicContact CB-CB 4.14Å; P124-A127 HydrophobicContact CG-CB 4.02Å; H125-A127 PolarHBondContact O-N 3.05Å; A127-S131 PolarHBondContact N-OG 3.36Å
128T96Very high97.1Very high72 Ų7278.8 Ų78.844%0.44242%0.423SS..SBendtrans-122.3153.4-176.870.90000111.9H130 S131 L132T128-H130 PolarHBondContact O-N 3.25Å; T128-S131 PolarHBondContact N-OG 3.38Å; T128-S131 PolarHBondContact O-N 3.2Å; T128-S131 PolarHBondContact O-OG 3.36Å; T128-S131 PolarHBondContact OG1-N 2.87Å; T128-S131 PolarHBondContact OG1-OG 3.44Å; T128-L132 PolarHBondContact O-N 2.95Å
129W96.5Very high97.1Very high209 Ų20979.9 Ų79.979%0.79244%0.439SS*.Hα-helixtrans-52.7-43.9172.7-71.6115.1000112.4S131 L132 L133W129-S131 VanDerWaalsContact C-N 3.31Å; W129-S131 PolarHBondContact O-N 2.82Å; W129-L132 HydrophobicContact CE3-CD1 4.41Å; W129-L132 PolarHBondContact O-N 3.2Å; W129-L133 WeakPolarHBondContact O-CB 3.3Å; W129-L133 VanDerWaalsContact O-CG 3.27Å; W129-L133 WeakPolarHBondContact O-CG 3.44Å; W129-L133 PolarHBondContact O-N 3.39Å
130H97.9Very high97.2Very high43 Ų4376.6 Ų76.620%0.19943%0.425CS..Hα-helixtrans-56.8-43.8175.4174.864.5000112.1H58 T128 G134 T182 S185 A186H58-H130 AromaticContact NE2-NE2 3.92Å; T128-H130 PolarHBondContact O-N 3.25Å; H130-G134 WeakPolarHBondContact O-CA 3.41Å; H130-G134 PolarHBondContact O-N 3.25Å; H130-T182 PolarHBondContact ND1-O 3.29Å; H130-S185 PolarHBondContact ND1-OG 3.25Å; H130-S185 VanDerWaalsContact ND1-OG 3.14Å; H130-A186 VanDerWaalsContact CE1-CB 3.41Å; H130-A186 WeakPolarHBondContact CE1-CB 3.5Å
131S97.1Very high97.2Very high19 Ų1971.5 Ų71.513%0.13339%0.394CS..Hα-helixtrans-70.3-35.2179.961.70000113.8L126 A127 T128 W129 G134 V135L126-S131 VanDerWaalsContact C-OG 3.24Å; L126-S131 VanDerWaalsContact CA-OG 3.23Å; L126-S131 WeakPolarHBondContact CA-OG 3.31Å; A127-S131 PolarHBondContact N-OG 3.36Å; T128-S131 PolarHBondContact N-OG 3.38Å; T128-S131 PolarHBondContact O-N 3.2Å; T128-S131 PolarHBondContact O-OG 3.36Å; T128-S131 PolarHBondContact OG1-N 2.87Å; T128-S131 PolarHBondContact OG1-OG 3.44Å; W129-S131 VanDerWaalsContact C-N 3.31Å; W129-S131 PolarHBondContact O-N 2.82Å; S131-G134 PolarHBondContact O-N 3.03Å; S131-V135 PolarHBondContact O-N 3.48Å; S131-V135 VanDerWaalsContact O-N 3.08Å
132L97.9Very high97.3Very high90 Ų9071.8 Ų71.847%0.47139%0.393SS..Hα-helixtrans-68.5-47.7174.8-67.6171.9000111.2L126 T128 W129 G134 V135 G136L126-L132 HydrophobicContact CB-CD2 4.21Å; T128-L132 PolarHBondContact O-N 2.95Å; W129-L132 HydrophobicContact CE3-CD1 4.41Å; W129-L132 PolarHBondContact O-N 3.2Å; L132-G134 VanDerWaalsContact C-N 3.28Å; L132-G134 PolarHBondContact O-N 2.96Å; L132-V135 PolarHBondContact O-N 3.33Å; L132-G136 PolarHBondContact O-N 2.82Å
133L98.1Very high97.3Very high51 Ų5168.7 Ų68.727%0.26738%0.382SS..Hα-helixtrans-61.1-39.1174.4-69.8171.4000111.4W129 G136 T137 L178 V181 T182W129-L133 WeakPolarHBondContact O-CB 3.3Å; W129-L133 VanDerWaalsContact O-CG 3.27Å; W129-L133 WeakPolarHBondContact O-CG 3.44Å; W129-L133 PolarHBondContact O-N 3.39Å; L133-G136 PolarHBondContact O-N 3.33Å; L133-T137 WeakPolarHBondContact O-CB 3.37Å; L133-T137 PolarHBondContact O-N 3.08Å; L133-T137 PolarHBondContact O-OG1 3.21Å; L133-L178 HydrophobicContact CD2-CD1 4.43Å; L133-V181 HydrophobicContact CD1-CG1 4.24Å; L133-T182 PolarHBondContact O-OG1 3.03Å
134G98.1Very high97.4Very high23 Ų2361.6 Ų61.624%0.23736%0.356CS..Hα-helixtrans-60.4-49176.800000113.1H130 S131 L132 T137 L138H130-G134 WeakPolarHBondContact O-CA 3.41Å; H130-G134 PolarHBondContact O-N 3.25Å; S131-G134 PolarHBondContact O-N 3.03Å; L132-G134 VanDerWaalsContact C-N 3.28Å; L132-G134 PolarHBondContact O-N 2.96Å; G134-T137 WeakPolarHBondContact O-CB 3.2Å; G134-T137 PolarHBondContact O-N 3.2Å; G134-L138 WeakPolarHBondContact O-CB 3.33Å; G134-L138 PolarHBondContact O-N 3.1Å
135V97.9Very high97.4Very high75 Ų7558.9 Ų58.946%0.45534%0.34SS..Hα-helixtrans-65-41.8176.11710000111.4L126 S131 L132 T137 L138 A139L126-V135 HydrophobicContact CD2-CB 4.48Å; L126-V135 HydrophobicContact CD2-CG2 3.47Å; L126-V135 VanDerWaalsContact CD2-CG2 3.47Å; S131-V135 PolarHBondContact O-N 3.48Å; S131-V135 VanDerWaalsContact O-N 3.08Å; L132-V135 PolarHBondContact O-N 3.33Å; V135-T137 VanDerWaalsContact C-N 3.33Å; V135-T137 PolarHBondContact O-N 2.65Å; V135-L138 PolarHBondContact O-N 2.9Å; V135-A139 WeakPolarHBondContact O-CB 3.3Å; V135-A139 PolarHBondContact O-N 3.4Å
136G98.4Very high97.2Very high34 Ų3456.9 Ų56.935%0.35134%0.339SS..Hα-helixtrans-59.4-43.5174.500000112.4L132 L133 A139 A140L132-G136 PolarHBondContact O-N 2.82Å; L133-G136 PolarHBondContact O-N 3.33Å; G136-A139 PolarHBondContact O-N 2.87Å; G136-A140 VanDerWaalsContact O-CB 3.3Å; G136-A140 WeakPolarHBondContact O-CB 3.41Å; G136-A140 PolarHBondContact O-N 3.27Å
137T98.6Very high96.9Very high1 Ų155 Ų551%0.00633%0.333CS..Hα-helixtrans-61.9-46.2176.1-56.40000111.1Y66 L133 G134 V135 A140 T141 L178 A179 T182Y66-T137 HydrophobicContact CD1-CG2 4.28Å; Y66-T137 HydrophobicContact CE1-CG2 3.78Å; L133-T137 WeakPolarHBondContact O-CB 3.37Å; L133-T137 PolarHBondContact O-N 3.08Å; L133-T137 PolarHBondContact O-OG1 3.21Å; G134-T137 WeakPolarHBondContact O-CB 3.2Å; G134-T137 PolarHBondContact O-N 3.2Å; V135-T137 VanDerWaalsContact C-N 3.33Å; V135-T137 PolarHBondContact O-N 2.65Å; T137-A140 PolarHBondContact O-N 3.27Å; T137-T141 WeakPolarHBondContact O-CB 3.49Å; T137-T141 PolarHBondContact O-N 3.14Å; T137-T141 PolarHBondContact O-OG1 2.92Å; T137-L178 WeakPolarHBondContact OG1-CG 3.37Å; T137-A179 HydrophobicContact CG2-CB 3.75Å; T137-T182 PolarHBondContact OG1-OG1 3.25Å
138L98.3Very high96.6Very high41 Ų4152.1 Ų52.122%0.21531%0.309CS..Hα-helixtrans-62.2-47.6179.1-178.661.5000111.4A107 V111 G134 V135 A140 T141 V142A107-L138 HydrophobicContact CB-CD1 3.86Å; V111-L138 HydrophobicContact CG2-CD2 3.94Å; G134-L138 WeakPolarHBondContact O-CB 3.33Å; G134-L138 PolarHBondContact O-N 3.1Å; V135-L138 PolarHBondContact O-N 2.9Å; L138-A140 PolarHBondContact O-N 3.38Å; L138-T141 WeakPolarHBondContact O-CB 3.37Å; L138-T141 PolarHBondContact O-N 3.1Å; L138-V142 WeakPolarHBondContact O-CG2 3.48Å; L138-V142 PolarHBondContact O-N 2.7Å
139A98.4Very high96.1Very high59 Ų5952.7 Ų52.749%0.48831%0.309SS..Hα-helixtrans-59.6-46.2177.100000111.5V135 G136 T141 V142 L143V135-A139 WeakPolarHBondContact O-CB 3.3Å; V135-A139 PolarHBondContact O-N 3.4Å; G136-A139 PolarHBondContact O-N 2.87Å; A139-T141 VanDerWaalsContact C-N 3.3Å; A139-T141 PolarHBondContact O-N 3.05Å; A139-V142 PolarHBondContact O-N 3.44Å; A139-L143 WeakPolarHBondContact O-CB 3.35Å; A139-L143 PolarHBondContact O-N 3.32Å
140A98.5Very high95.4Very high28 Ų2845.1 Ų45.123%0.23129%0.288CS..Hα-helixtrans-63.8-35.4177.100000112.2G136 T137 L138 Q144 V175 L178G136-A140 VanDerWaalsContact O-CB 3.3Å; G136-A140 WeakPolarHBondContact O-CB 3.41Å; G136-A140 PolarHBondContact O-N 3.27Å; T137-A140 PolarHBondContact O-N 3.27Å; L138-A140 PolarHBondContact O-N 3.38Å; A140-Q144 WeakPolarHBondContact O-CB 3.39Å; A140-Q144 PolarHBondContact O-N 3.18Å; A140-V175 HydrophobicContact CB-CG2 3.94Å; A140-L178 HydrophobicContact CB-CD2 4.18Å
141T98.4Very high94.7Very high6 Ų645.5 Ų45.54%0.03729%0.291CS..Hα-helixtrans-65.2-46.7176-560000111.4Y66 V103 T137 L138 A139 Q144 A145Y66-T141 HydrophobicContact CE1-CG2 4.31Å; Y66-T141 WeakPolarHBondContact CE1-OG1 3.39Å; Y66-T141 PolarHBondContact OH-OG1 3.25Å; V103-T141 HydrophobicContact CG1-CG2 4.05Å; T137-T141 WeakPolarHBondContact O-CB 3.49Å; T137-T141 PolarHBondContact O-N 3.14Å; T137-T141 PolarHBondContact O-OG1 2.92Å; L138-T141 WeakPolarHBondContact O-CB 3.37Å; L138-T141 PolarHBondContact O-N 3.1Å; A139-T141 VanDerWaalsContact C-N 3.3Å; A139-T141 PolarHBondContact O-N 3.05Å; T141-Q144 PolarHBondContact O-N 3.17Å; T141-A145 PolarHBondContact O-N 3.36Å
142V97.8Very high94Very high74 Ų7449.5 Ų49.545%0.44831%0.31SS..Hα-helixtrans-62.9-44.9177.3171.90000110.7L138 A139 Q144 A145 A146L138-V142 WeakPolarHBondContact O-CG2 3.48Å; L138-V142 PolarHBondContact O-N 2.7Å; A139-V142 PolarHBondContact O-N 3.44Å; V142-Q144 VanDerWaalsContact C-N 3.35Å; V142-Q144 PolarHBondContact O-N 3.49Å; V142-A145 PolarHBondContact O-N 2.95Å; V142-A146 PolarHBondContact O-N 2.86Å
143L96.8Very high93.3Very high116 Ų11651 Ų5161%0.60731%0.313SS*.Hα-helixtrans-61.1-44.4176.3-178.959.8000111.5A139 A145 A146 C147A139-L143 WeakPolarHBondContact O-CB 3.35Å; A139-L143 PolarHBondContact O-N 3.32Å; L143-A145 VanDerWaalsContact C-N 3.33Å; L143-A145 PolarHBondContact O-N 2.59Å; L143-A146 WeakPolarHBondContact O-CB 3.19Å; L143-A146 PolarHBondContact O-N 2.71Å; L143-C147 PolarHBondContact O-N 3.02Å; L143-C147 PolarHBondContact O-SG 3.13Å
144Q97.4Very high92.3Very high24 Ų2450.4 Ų50.411%0.11231%0.312CS..Hα-helixtrans-63.5-38178.2175.96213.600112.4A140 T141 V142 C147 G148 H168 V175A140-Q144 WeakPolarHBondContact O-CB 3.39Å; A140-Q144 PolarHBondContact O-N 3.18Å; T141-Q144 PolarHBondContact O-N 3.17Å; V142-Q144 VanDerWaalsContact C-N 3.35Å; V142-Q144 PolarHBondContact O-N 3.49Å; Q144-C147 WeakPolarHBondContact O-CB 3.5Å; Q144-C147 PolarHBondContact O-N 3.34Å; Q144-G148 PolarHBondContact O-N 2.95Å; Q144-H168 PolarHBondContact NE2-CE1 3Å; Q144-H168 VanDerWaalsContact NE2-CE1 3.25Å; Q144-H168 PolarHBondContact NE2-ND1 2.7Å; Q144-H168 PolarHBondContact NE2-O 3.41Å; Q144-V175 HydrophobicContact CB-CG2 3.9Å; Q144-V175 HydrophobicContact CG-CG2 4.24Å
145A95.4Very high91.3Very high28 Ų2858.9 Ų58.923%0.23134%0.342CS..Hα-helixtrans-64.2-42.4173.100000111.5I104 T141 V142 L143 C147 G148 I149I104-A145 HydrophobicContact CD1-CB 3.69Å; T141-A145 PolarHBondContact O-N 3.36Å; V142-A145 PolarHBondContact O-N 2.95Å; L143-A145 VanDerWaalsContact C-N 3.33Å; L143-A145 PolarHBondContact O-N 2.59Å; A145-C147 PolarHBondContact O-N 2.88Å; A145-G148 WeakPolarHBondContact O-CA 3.41Å; A145-G148 PolarHBondContact O-N 3.38Å; A145-G148 VanDerWaalsContact O-N 3.08Å; A145-I149 PolarHBondContact O-N 3.03Å; A145-I149 VanDerWaalsContact O-N 3.11Å
146A91.7Very high90.3Very high45 Ų4562.1 Ų62.137%0.37236%0.357SS..Hα-helixtrans-61.6-42.4173.300000112.1V142 L143 G148 I149 C150V142-A146 PolarHBondContact O-N 2.86Å; L143-A146 WeakPolarHBondContact O-CB 3.19Å; L143-A146 PolarHBondContact O-N 2.71Å; A146-G148 PolarHBondContact O-N 3.27Å; A146-I149 WeakPolarHBondContact O-CA 3.27Å; A146-I149 WeakPolarHBondContact O-CB 3.38Å; A146-I149 PolarHBondContact O-N 3.09Å; A146-C150 PolarHBondContact O-N 3.4Å; A146-C150 VanDerWaalsContact O-N 3.12Å; A146-C150 PolarHBondContact O-SG 3.5Å; A146-C150 VanDerWaalsContact O-SG 3.4Å
147C90.2Very high89.3Confident49 Ų4963.9 Ų63.933%0.33136%0.358SS..Hα-helixtrans-59.3-36.1172.1-66.20000112.1L143 Q144 A145 I149 C150 L151L143-C147 PolarHBondContact O-N 3.02Å; L143-C147 PolarHBondContact O-SG 3.13Å; Q144-C147 WeakPolarHBondContact O-CB 3.5Å; Q144-C147 PolarHBondContact O-N 3.34Å; A145-C147 PolarHBondContact O-N 2.88Å; C147-I149 VanDerWaalsContact C-N 3.29Å; C147-I149 PolarHBondContact O-N 2.94Å; C147-C150 PolarHBondContact O-N 3.41Å; C147-L151 PolarHBondContact O-N 3.26Å
148G89.1Confident88.7Confident7 Ų773.4 Ų73.47%0.07240%0.399CS..Hα-helixtrans-59.9-37.2171.900000113W97 Q144 A145 A146 L151W97-G148 WeakPolarHBondContact CZ2-O 3.48Å; Q144-G148 PolarHBondContact O-N 2.95Å; A145-G148 WeakPolarHBondContact O-CA 3.41Å; A145-G148 PolarHBondContact O-N 3.38Å; A145-G148 VanDerWaalsContact O-N 3.08Å; A146-G148 PolarHBondContact O-N 3.27Å; G148-L151 WeakPolarHBondContact O-CB 3.27Å; G148-L151 PolarHBondContact O-N 3.36Å
149I86Confident87.9Confident84 Ų8474.4 Ų74.443%0.43140%0.404SS..Hα-helixtrans-67.6-40.2175.2-61.1167.3000111.6W97 A145 A146 C147 L151 L152 F153W97-I149 HydrophobicContact CH2-CB 4.06Å; W97-I149 HydrophobicContact CH2-CG1 3.65Å; W97-I149 HydrophobicContact CH2-CG2 4.43Å; W97-I149 HydrophobicContact CZ3-CG1 3.67Å; A145-I149 PolarHBondContact O-N 3.03Å; A145-I149 VanDerWaalsContact O-N 3.11Å; A146-I149 WeakPolarHBondContact O-CA 3.27Å; A146-I149 WeakPolarHBondContact O-CB 3.38Å; A146-I149 PolarHBondContact O-N 3.09Å; C147-I149 VanDerWaalsContact C-N 3.29Å; C147-I149 PolarHBondContact O-N 2.94Å; I149-L151 PolarHBondContact O-N 3.07Å; I149-L151 VanDerWaalsContact O-N 3.1Å; I149-L152 WeakPolarHBondContact O-CB 3.26Å; I149-L152 WeakPolarHBondContact O-CG 3.43Å; I149-L152 PolarHBondContact O-N 3.2Å; I149-F153 HydrophobicContact CG2-CE2 4.38Å
150C80.6Confident87.4Confident51 Ų5174 Ų7435%0.34540%0.398SS..Hα-helixtrans-61.8-21.1179.1-59.90000113.6A146 C147 L152 F153 L157A146-C150 PolarHBondContact O-N 3.4Å; A146-C150 VanDerWaalsContact O-N 3.12Å; A146-C150 PolarHBondContact O-SG 3.5Å; A146-C150 VanDerWaalsContact O-SG 3.4Å; C147-C150 PolarHBondContact O-N 3.41Å; C150-L152 PolarHBondContact O-N 3.46Å; C150-F153 CarbonylContact O-C 3.54Å; C150-F153 PolarHBondContact O-N 3.01Å; C150-L157 HydrophobicContact CB-CD1 3.67Å
151L84Confident86.8Confident50 Ų5076 Ų7626%0.26241%0.408SS..THydrogen-bonded Turntrans-60.9-21.5171.9-75165000113.5C147 G148 I149 F153 L164 K165 H168C147-L151 PolarHBondContact O-N 3.26Å; G148-L151 WeakPolarHBondContact O-CB 3.27Å; G148-L151 PolarHBondContact O-N 3.36Å; I149-L151 PolarHBondContact O-N 3.07Å; I149-L151 VanDerWaalsContact O-N 3.1Å; L151-F153 VanDerWaalsContact C-N 3.3Å; L151-L164 HydrophobicContact CD2-CB 3.9Å; L151-L164 HydrophobicContact CD2-CD2 3.73Å; L151-L164 HydrophobicContact CD2-CG 3.47Å; L151-L164 VanDerWaalsContact CD2-CG 3.47Å; L151-L164 HydrophobicContact CG-CD2 4.3Å; L151-L164 HydrophobicContact CG-CG 4.22Å; L151-K165 HydrophobicContact CD2-CG 4.09Å; L151-H168 HydrophobicContact CD1-CB 3.92Å
152L82.4Confident86.3Confident103 Ų10380 Ų8054%0.53944%0.435SS..THydrogen-bonded Turntrans-75.7-19.9175.5-59.2-178.1000112.6W97 I149 C150 P154W97-L152 HydrophobicContact CH2-CD1 3.45Å; W97-L152 VanDerWaalsContact CH2-CD1 3.45Å; W97-L152 HydrophobicContact CH2-CG 3.92Å; W97-L152 HydrophobicContact CZ2-CD1 3.88Å; W97-L152 HydrophobicContact CZ2-CD2 4.13Å; W97-L152 HydrophobicContact CZ2-CG 3.89Å; W97-L152 HydrophobicContact CZ3-CD1 4.37Å; I149-L152 WeakPolarHBondContact O-CB 3.26Å; I149-L152 WeakPolarHBondContact O-CG 3.43Å; I149-L152 PolarHBondContact O-N 3.2Å; C150-L152 PolarHBondContact O-N 3.46Å; L152-P154 WeakPolarHBondContact O-CD 3.39Å
153F82.6Confident85.9Confident122 Ų12283.9 Ų83.954%0.53544%0.441SS..  trans-124.755.5-173.7-52.9-75.5000112.4I149 C150 L151 K155 L156I149-F153 HydrophobicContact CG2-CE2 4.38Å; C150-F153 CarbonylContact O-C 3.54Å; C150-F153 PolarHBondContact O-N 3.01Å; L151-F153 VanDerWaalsContact C-N 3.3Å; F153-K155 PolarHBondContact O-N 3.03Å; F153-K155 VanDerWaalsContact O-N 3.17Å; F153-L156 HydrophobicContact CB-CB 4.27Å; F153-L156 WeakPolarHBondContact O-CB 3.27Å; F153-L156 PolarHBondContact O-N 3.04Å
154P76.6Confident85.5Confident39 Ų3979.1 Ų79.125%0.25342%0.416SS..THydrogen-bonded Turntrans-62.4-29.9-173.526-34.9000113.2L152 L156 L157 K158 P161L152-P154 WeakPolarHBondContact O-CD 3.39Å; P154-L156 VanDerWaalsContact C-N 3.27Å; P154-L156 PolarHBondContact O-N 2.74Å; P154-L157 PolarHBondContact O-N 3.45Å; P154-K158 PolarHBondContact O-N 2.9Å; P154-P161 HydrophobicContact CB-CG 4.46Å
155K77.1Confident85.2Confident200 Ų20083.5 Ų83.587%0.8744%0.435SS*.THydrogen-bonded Turntrans-63.1-32.7177.2-66-174.1-179.7-178.70112.5F153 L157F153-K155 PolarHBondContact O-N 3.03Å; F153-K155 VanDerWaalsContact O-N 3.17Å; K155-L157 VanDerWaalsContact C-N 3.34Å
156L77.6Confident85Confident144 Ų14484.9 Ų84.975%0.75444%0.438SS*.THydrogen-bonded Turntrans-71-33.2179.4-169.865.1000111.5F153 P154F153-L156 HydrophobicContact CB-CB 4.27Å; F153-L156 WeakPolarHBondContact O-CB 3.27Å; F153-L156 PolarHBondContact O-N 3.04Å; P154-L156 VanDerWaalsContact C-N 3.27Å; P154-L156 PolarHBondContact O-N 2.74Å
157L78.8Confident85Confident71 Ų7188.5 Ų88.537%0.37244%0.443SS..THydrogen-bonded Turntrans-86.4-5.3-178.2-65.8-176.2000114.5C150 P154 K155 L159 L164C150-L157 HydrophobicContact CB-CD1 3.67Å; P154-L157 PolarHBondContact O-N 3.45Å; K155-L157 VanDerWaalsContact C-N 3.34Å; L157-L159 PolarHBondContact O-N 3.37Å; L157-L164 HydrophobicContact CD1-CD1 3.69Å; L157-L164 HydrophobicContact CD1-CD2 3.82Å; L157-L164 HydrophobicContact CD1-CG 4.44Å
158K84.3Confident85.3Confident201 Ų20188.1 Ų88.187%0.87444%0.436SS*.THydrogen-bonded Turntrans51.626.5-176.2-56.3-179.5-179178.10113.7P154P154-K158 PolarHBondContact O-N 2.9Å
159L82.8Confident85.5Confident62 Ų6288.3 Ų88.333%0.32544%0.437SS..  trans-112.8148.7179-73174.7000110.7L157 L164 Y167L157-L159 PolarHBondContact O-N 3.37Å; L159-L164 HydrophobicContact CD1-CD1 4.15Å; L159-Y167 HydrophobicContact CD1-CD2 4.48Å; L159-Y167 HydrophobicContact CD1-CE2 4.37Å
160S86.7Confident85.9Confident51 Ų5187.6 Ų87.636%0.35744%0.437SS..  trans-71.6142.9175.770.70000111.1P162 R163 L164S160-P162 VanDerWaalsContact C-CD 3.44Å; S160-P162 VanDerWaalsContact C-N 3.34Å; S160-R163 PolarHBondContact O-N 2.91Å; S160-R163 VanDerWaalsContact O-N 3.11Å; S160-R163 WeakPolarHBondContact OG-CG 3.28Å; S160-L164 PolarHBondContact O-N 2.94Å
161P86.7Confident86.7Confident69 Ų6988.2 Ų88.245%0.44844%0.441SS..Hα-helixtrans-54.5-37.4179.8-26.133.3000115.4P154 K165P154-P161 HydrophobicContact CB-CG 4.46Å; P161-K165 VanDerWaalsContact O-CG 3.31Å; P161-K165 WeakPolarHBondContact O-CG 3.49Å; P161-K165 PolarHBondContact O-N 3.29Å; P161-K165 VanDerWaalsContact O-N 3.09Å
162P88.8Confident87.3Confident91 Ų9186.4 Ų86.459%0.59144%0.435SS*.Hα-helixtrans-64.3-42175.2-23.535.2000113.3S160 K165 L166S160-P162 VanDerWaalsContact C-CD 3.44Å; S160-P162 VanDerWaalsContact C-N 3.34Å; P162-K165 PolarHBondContact O-N 3.3Å; P162-L166 PolarHBondContact O-N 3.3Å
163R88Confident88.1Confident154 Ų15482.6 Ų82.658%0.58142%0.415SS*.Hα-helixtrans-65.5-41.8177.6-74.5-177.6-179.3174.20.4111.5S160 K165 L166 Y167S160-R163 PolarHBondContact O-N 2.91Å; S160-R163 VanDerWaalsContact O-N 3.11Å; S160-R163 WeakPolarHBondContact OG-CG 3.28Å; R163-K165 VanDerWaalsContact C-N 3.33Å; R163-K165 PolarHBondContact O-N 2.86Å; R163-L166 WeakPolarHBondContact O-CB 3.33Å; R163-L166 PolarHBondContact O-N 2.65Å; R163-Y167 PolarHBondContact O-N 3.4Å
164L89.6Confident88.8Confident17 Ų1781.1 Ų81.19%0.08942%0.416CS..Hα-helixtrans-65.2-38.3179-164.761.2000111.8L151 L157 L159 S160 Y167 H168L151-L164 HydrophobicContact CD2-CB 3.9Å; L151-L164 HydrophobicContact CD2-CD2 3.73Å; L151-L164 HydrophobicContact CD2-CG 3.47Å; L151-L164 VanDerWaalsContact CD2-CG 3.47Å; L151-L164 HydrophobicContact CG-CD2 4.3Å; L151-L164 HydrophobicContact CG-CG 4.22Å; L157-L164 HydrophobicContact CD1-CD1 3.69Å; L157-L164 HydrophobicContact CD1-CD2 3.82Å; L157-L164 HydrophobicContact CD1-CG 4.44Å; L159-L164 HydrophobicContact CD1-CD1 4.15Å; S160-L164 PolarHBondContact O-N 2.94Å; L164-Y167 PolarHBondContact O-N 3.1Å; L164-H168 WeakPolarHBondContact O-CB 3.36Å; L164-H168 PolarHBondContact O-N 3.22Å
165K90.8Very high89.9Confident115 Ų11579.9 Ų79.950%0.541%0.407SS..Hα-helixtrans-64.7-41.7172.9-73.5173.8-175.5175.60112.5L151 P161 P162 R163 H168 A169 Y223L151-K165 HydrophobicContact CD2-CG 4.09Å; P161-K165 VanDerWaalsContact O-CG 3.31Å; P161-K165 WeakPolarHBondContact O-CG 3.49Å; P161-K165 PolarHBondContact O-N 3.29Å; P161-K165 VanDerWaalsContact O-N 3.09Å; P162-K165 PolarHBondContact O-N 3.3Å; R163-K165 VanDerWaalsContact C-N 3.33Å; R163-K165 PolarHBondContact O-N 2.86Å; K165-H168 PolarHBondContact O-N 2.98Å; K165-A169 WeakPolarHBondContact O-CB 3.48Å; K165-A169 PolarHBondContact O-N 3.13Å; K165-Y223 HydrophobicContact CB-CE1 4.36Å
166L91.6Very high90.9Very high58 Ų5870.8 Ų70.830%0.30437%0.368SS..Hα-helixtrans-59-51174.8172.865.9000110.7P162 R163 H168 A169 T170 Y223P162-L166 PolarHBondContact O-N 3.3Å; R163-L166 WeakPolarHBondContact O-CB 3.33Å; R163-L166 PolarHBondContact O-N 2.65Å; L166-H168 PolarHBondContact O-N 2.89Å; L166-A169 PolarHBondContact O-N 2.92Å; L166-T170 PolarHBondContact O-N 2.66Å; L166-T170 PolarHBondContact O-OG1 2.93Å; L166-T170 VanDerWaalsContact O-OG1 3.11Å; L166-Y223 HydrophobicContact CB-CD1 4.22Å; L166-Y223 HydrophobicContact CD1-CD1 3.86Å; L166-Y223 HydrophobicContact CD1-CG 3.97Å
167Y91.9Very high91.9Very high120 Ų12067 Ų6747%0.47135%0.348SS..Hα-helixtrans-61.3-45.9179-64.8-17.8000112L159 R163 L164 A169 T170 C171L159-Y167 HydrophobicContact CD1-CD2 4.48Å; L159-Y167 HydrophobicContact CD1-CE2 4.37Å; R163-Y167 PolarHBondContact O-N 3.4Å; L164-Y167 PolarHBondContact O-N 3.1Å; Y167-A169 VanDerWaalsContact C-N 3.31Å; Y167-A169 PolarHBondContact O-N 3.3Å; Y167-T170 PolarHBondContact O-N 3.32Å; Y167-C171 VanDerWaalsContact O-CB 3.3Å; Y167-C171 WeakPolarHBondContact O-CB 3.43Å; Y167-C171 PolarHBondContact O-N 3.5Å; Y167-C171 PolarHBondContact O-SG 3.28Å; Y167-C171 VanDerWaalsContact O-SG 3.32Å
168H94.9Very high92.8Very high41 Ų4166 Ų6619%0.1934%0.343CS..Hα-helixtrans-58.4-42.8175.4177.479.1000112.1Q144 L151 L164 K165 L166 G172Q144-H168 PolarHBondContact NE2-CE1 3Å; Q144-H168 VanDerWaalsContact NE2-CE1 3.25Å; Q144-H168 PolarHBondContact NE2-ND1 2.7Å; Q144-H168 PolarHBondContact NE2-O 3.41Å; L151-H168 HydrophobicContact CD1-CB 3.92Å; L164-H168 WeakPolarHBondContact O-CB 3.36Å; L164-H168 PolarHBondContact O-N 3.22Å; K165-H168 PolarHBondContact O-N 2.98Å; L166-H168 PolarHBondContact O-N 2.89Å; H168-G172 PolarHBondContact O-N 3.11Å
169A95.1Very high93.5Very high11 Ų1156.6 Ų56.69%0.09130%0.302CS..Hα-helixtrans-66.4-43.8178.300000112.4K165 L166 Y167 G172 L173 I219 Y223K165-A169 WeakPolarHBondContact O-CB 3.48Å; K165-A169 PolarHBondContact O-N 3.13Å; L166-A169 PolarHBondContact O-N 2.92Å; Y167-A169 VanDerWaalsContact C-N 3.31Å; Y167-A169 PolarHBondContact O-N 3.3Å; A169-G172 PolarHBondContact O-N 3.43Å; A169-L173 PolarHBondContact O-N 3.46Å; A169-I219 HydrophobicContact CB-CG2 4.18Å; A169-Y223 HydrophobicContact CB-CD2 3.83Å; A169-Y223 HydrophobicContact CB-CE1 4.49Å; A169-Y223 HydrophobicContact CB-CE2 3.37Å
170T94.5Very high94.3Very high69 Ų6954.3 Ų54.342%0.42329%0.291SS..Hα-helixtrans-67.7-47.4178.9-58.30000111.9L166 Y167 G172 L173 V174L166-T170 PolarHBondContact O-N 2.66Å; L166-T170 PolarHBondContact O-OG1 2.93Å; L166-T170 VanDerWaalsContact O-OG1 3.11Å; Y167-T170 PolarHBondContact O-N 3.32Å; T170-G172 VanDerWaalsContact C-N 3.28Å; T170-G172 PolarHBondContact O-N 3.3Å; T170-L173 WeakPolarHBondContact O-CB 3.39Å; T170-L173 PolarHBondContact O-N 2.8Å; T170-V174 WeakPolarHBondContact O-CG2 3.44Å; T170-V174 PolarHBondContact O-N 2.91Å
171C96.3Very high94.9Very high64 Ų6455.6 Ų55.643%0.43230%0.297SS..Hα-helixtrans-60.5-40.7174.4-68.60000111.1Y167 L173 V174 V175Y167-C171 VanDerWaalsContact O-CB 3.3Å; Y167-C171 WeakPolarHBondContact O-CB 3.43Å; Y167-C171 PolarHBondContact O-N 3.5Å; Y167-C171 PolarHBondContact O-SG 3.28Å; Y167-C171 VanDerWaalsContact O-SG 3.32Å; C171-L173 VanDerWaalsContact C-N 3.34Å; C171-L173 PolarHBondContact O-N 2.7Å; C171-V174 PolarHBondContact O-N 3.32Å; C171-V175 WeakPolarHBondContact O-CG2 2.86Å; C171-V175 PolarHBondContact O-N 3.42Å
172G97.6Very high95.4Very high13 Ų1353 Ų5313%0.13428%0.279CS..Hα-helixtrans-62.2-39.2175.800000113.1H168 A169 T170 V175 Y176H168-G172 PolarHBondContact O-N 3.11Å; A169-G172 PolarHBondContact O-N 3.43Å; T170-G172 VanDerWaalsContact C-N 3.28Å; T170-G172 PolarHBondContact O-N 3.3Å; G172-V175 PolarHBondContact O-N 3Å; G172-Y176 PolarHBondContact O-N 3.37Å
173L97.9Very high95.9Very high22 Ų2249.6 Ų49.612%0.11526%0.257CS..Hα-helixtrans-62.6-44.6172.8177.958.8000111.3A169 T170 C171 V175 Y176 L177 I215 M216 I219A169-L173 PolarHBondContact O-N 3.46Å; T170-L173 WeakPolarHBondContact O-CB 3.39Å; T170-L173 PolarHBondContact O-N 2.8Å; C171-L173 VanDerWaalsContact C-N 3.34Å; C171-L173 PolarHBondContact O-N 2.7Å; L173-V175 VanDerWaalsContact C-N 3.33Å; L173-V175 PolarHBondContact O-N 3.49Å; L173-Y176 WeakPolarHBondContact O-CB 3.31Å; L173-Y176 PolarHBondContact O-N 2.79Å; L173-L177 HydrophobicContact CD1-CD1 4.26Å; L173-L177 HydrophobicContact CD1-CD2 4.5Å; L173-L177 HydrophobicContact CD1-CG 4.12Å; L173-L177 HydrophobicContact CG-CD1 4.2Å; L173-L177 HydrophobicContact CG-CG 4.46Å; L173-L177 WeakPolarHBondContact O-CG 3.39Å; L173-L177 PolarHBondContact O-N 3.17Å; L173-I215 HydrophobicContact CD1-CG2 4.06Å; L173-M216 HydrophobicContact CD1-CB 4.03Å; L173-M216 HydrophobicContact CD1-CG 4.46Å; L173-M216 HydrophobicContact CD2-CG 4.25Å; L173-I219 HydrophobicContact CB-CD1 3.81Å; L173-I219 HydrophobicContact CB-CG2 4.47Å; L173-I219 HydrophobicContact CD1-CD1 4.24Å; L173-I219 HydrophobicContact CD2-CB 4.46Å; L173-I219 HydrophobicContact CD2-CG2 4.29Å; L173-I219 HydrophobicContact CG-CD1 4.48Å
174V98.1Very high96.4Very high92 Ų9243.7 Ų43.756%0.55824%0.238SC*.Hα-helixtrans-59.9-44.3176.6173.20000111.1T170 C171 Y176 L177 L178T170-V174 WeakPolarHBondContact O-CG2 3.44Å; T170-V174 PolarHBondContact O-N 2.91Å; C171-V174 PolarHBondContact O-N 3.32Å; V174-Y176 VanDerWaalsContact C-N 3.33Å; V174-Y176 PolarHBondContact O-N 3.46Å; V174-L177 PolarHBondContact O-N 3.29Å; V174-L178 WeakPolarHBondContact O-CB 3.22Å; V174-L178 PolarHBondContact O-N 3.45Å
175V98.6Very high96.8Very high13 Ų1343.9 Ų43.98%0.07924%0.241CC..Hα-helixtrans-60.8-42.3175.2172.80000111.6A140 Q144 C171 G172 L173 L178 A179A140-V175 HydrophobicContact CB-CG2 3.94Å; Q144-V175 HydrophobicContact CB-CG2 3.9Å; Q144-V175 HydrophobicContact CG-CG2 4.24Å; C171-V175 WeakPolarHBondContact O-CG2 2.86Å; C171-V175 PolarHBondContact O-N 3.42Å; G172-V175 PolarHBondContact O-N 3Å; L173-V175 VanDerWaalsContact C-N 3.33Å; L173-V175 PolarHBondContact O-N 3.49Å; V175-L178 PolarHBondContact O-N 2.87Å; V175-A179 WeakPolarHBondContact O-CB 3.23Å; V175-A179 PolarHBondContact O-N 3.47Å
176Y98.7Very high97.1Very high8 Ų839.4 Ų39.43%0.03123%0.225CC..Hα-helixtrans-63.2-44.2177.9-169.9-87.3000112.4L70 T71 I74 G172 L173 V174 A179 T180 P211 A212 I215L70-Y176 HydrophobicContact CD2-CD2 3.83Å; L70-Y176 HydrophobicContact CD2-CE2 4.38Å; L70-Y176 HydrophobicContact CG-CD2 3.8Å; L70-Y176 HydrophobicContact CG-CE2 4.18Å; T71-Y176 WeakPolarHBondContact OG1-CE2 3.44Å; T71-Y176 PolarHBondContact OG1-OH 2.96Å; I74-Y176 HydrophobicContact CD1-CD2 3.46Å; I74-Y176 VanDerWaalsContact CD1-CD2 3.46Å; I74-Y176 HydrophobicContact CD1-CE2 4.24Å; I74-Y176 HydrophobicContact CD1-CG 4.03Å; G172-Y176 PolarHBondContact O-N 3.37Å; L173-Y176 WeakPolarHBondContact O-CB 3.31Å; L173-Y176 PolarHBondContact O-N 2.79Å; V174-Y176 VanDerWaalsContact C-N 3.33Å; V174-Y176 PolarHBondContact O-N 3.46Å; Y176-A179 PolarHBondContact O-N 3.38Å; Y176-T180 PolarHBondContact O-N 2.93Å; Y176-T180 PolarHBondContact O-OG1 3.4Å; Y176-P211 WeakPolarHBondContact OH-CB 3.28Å; Y176-A212 HydrophobicContact CD1-CB 4.27Å; Y176-A212 HydrophobicContact CE1-CB 3.8Å; Y176-I215 HydrophobicContact CD1-CD1 4.23Å; Y176-I215 HydrophobicContact CD1-CG2 4.26Å; Y176-I215 HydrophobicContact CD2-CD1 3.91Å; Y176-I215 HydrophobicContact CE1-CB 4.49Å; Y176-I215 HydrophobicContact CE1-CD1 3.77Å; Y176-I215 HydrophobicContact CE2-CD1 3.39Å; Y176-I215 HydrophobicContact CG-CD1 4.29Å; Y176-I215 HydrophobicContact CG-CG2 4.31Å
177L98.6Very high97.4Very high65 Ų6537 Ų3734%0.3421%0.212SC..Hα-helixtrans-65.6-41.2177.3-66177000111.2L173 V174 A179 T180 V181 A212L173-L177 HydrophobicContact CD1-CD1 4.26Å; L173-L177 HydrophobicContact CD1-CD2 4.5Å; L173-L177 HydrophobicContact CD1-CG 4.12Å; L173-L177 HydrophobicContact CG-CD1 4.2Å; L173-L177 HydrophobicContact CG-CG 4.46Å; L173-L177 WeakPolarHBondContact O-CG 3.39Å; L173-L177 PolarHBondContact O-N 3.17Å; V174-L177 PolarHBondContact O-N 3.29Å; L177-A179 PolarHBondContact O-N 2.84Å; L177-T180 WeakPolarHBondContact O-CB 3.38Å; L177-T180 PolarHBondContact O-N 3.34Å; L177-V181 WeakPolarHBondContact O-CG2 3.25Å; L177-V181 PolarHBondContact O-N 3.12Å; L177-A212 HydrophobicContact CD2-CB 4.17Å
178L98.5Very high97.6Very high51 Ų5136.6 Ų36.627%0.26721%0.213SC..Hα-helixtrans-61.6-43.4174.1-178.961.5000111.4L133 T137 A140 V174 V175 T180 V181 T182L133-L178 HydrophobicContact CD2-CD1 4.43Å; T137-L178 WeakPolarHBondContact OG1-CG 3.37Å; A140-L178 HydrophobicContact CB-CD2 4.18Å; V174-L178 WeakPolarHBondContact O-CB 3.22Å; V174-L178 PolarHBondContact O-N 3.45Å; V175-L178 PolarHBondContact O-N 2.87Å; L178-T180 VanDerWaalsContact C-N 3.31Å; L178-T180 PolarHBondContact O-N 3.41Å; L178-V181 PolarHBondContact O-N 3.29Å; L178-T182 PolarHBondContact O-N 2.9Å; L178-T182 PolarHBondContact O-OG1 3.33Å; L178-T182 VanDerWaalsContact O-OG1 3.1Å
179A98.7Very high97.7Very high3 Ų336.3 Ų36.33%0.02522%0.216CC..Hα-helixtrans-61.4-40174.100000112Y66 L70 T137 V175 Y176 L177 T182 V183Y66-A179 HydrophobicContact CD1-CB 3.71Å; Y66-A179 HydrophobicContact CE1-CB 4.37Å; Y66-A179 HydrophobicContact CG-CB 4.36Å; L70-A179 HydrophobicContact CD2-CB 4.02Å; T137-A179 HydrophobicContact CG2-CB 3.75Å; V175-A179 WeakPolarHBondContact O-CB 3.23Å; V175-A179 PolarHBondContact O-N 3.47Å; Y176-A179 PolarHBondContact O-N 3.38Å; L177-A179 PolarHBondContact O-N 2.84Å; A179-T182 WeakPolarHBondContact O-CB 3.48Å; A179-T182 PolarHBondContact O-N 2.96Å; A179-V183 WeakPolarHBondContact O-CG2 3.41Å; A179-V183 PolarHBondContact O-N 3.44Å
180T98.8Very high97.7Very high13 Ų1342.8 Ų42.88%0.0825%0.249CC..Hα-helixtrans-61.5-46.6175.4-54.90000111.1Y176 L177 L178 T182 V183 V184 P208 L209 A212Y176-T180 PolarHBondContact O-N 2.93Å; Y176-T180 PolarHBondContact O-OG1 3.4Å; L177-T180 WeakPolarHBondContact O-CB 3.38Å; L177-T180 PolarHBondContact O-N 3.34Å; L178-T180 VanDerWaalsContact C-N 3.31Å; L178-T180 PolarHBondContact O-N 3.41Å; T180-T182 VanDerWaalsContact C-N 3.31Å; T180-T182 PolarHBondContact O-N 2.85Å; T180-V183 PolarHBondContact O-N 3.17Å; T180-V184 WeakPolarHBondContact O-CB 3.42Å; T180-V184 WeakPolarHBondContact O-CG2 3.38Å; T180-V184 PolarHBondContact O-N 2.99Å; T180-P208 HydrophobicContact CG2-CB 4.28Å; T180-L209 HydrophobicContact CG2-CD2 3.95Å; T180-A212 HydrophobicContact CG2-CB 4.06Å
181V98.6Very high97.7Very high79 Ų7942.8 Ų42.848%0.47924%0.241SC..Hα-helixtrans-60.3-41.9175172.70000111L133 L177 L178 V184 S185L133-V181 HydrophobicContact CD1-CG1 4.24Å; L177-V181 WeakPolarHBondContact O-CG2 3.25Å; L177-V181 PolarHBondContact O-N 3.12Å; L178-V181 PolarHBondContact O-N 3.29Å; V181-V184 PolarHBondContact O-N 3.38Å; V181-S185 WeakPolarHBondContact O-CB 3.48Å; V181-S185 PolarHBondContact O-N 3.34Å
182T98.6Very high97.8Very high13 Ų1340 Ų408%0.0822%0.222CC..Hα-helixtrans-63-44176.7-65.90000112H130 L133 T137 L178 A179 T180 S185 A186H130-T182 PolarHBondContact ND1-O 3.29Å; L133-T182 PolarHBondContact O-OG1 3.03Å; T137-T182 PolarHBondContact OG1-OG1 3.25Å; L178-T182 PolarHBondContact O-N 2.9Å; L178-T182 PolarHBondContact O-OG1 3.33Å; L178-T182 VanDerWaalsContact O-OG1 3.1Å; A179-T182 WeakPolarHBondContact O-CB 3.48Å; A179-T182 PolarHBondContact O-N 2.96Å; T180-T182 VanDerWaalsContact C-N 3.31Å; T180-T182 PolarHBondContact O-N 2.85Å; T182-S185 PolarHBondContact O-N 2.91Å; T182-S185 PolarHBondContact O-OG 3.33Å; T182-A186 PolarHBondContact O-N 3.49Å; T182-A186 VanDerWaalsContact O-N 3.12Å
183V98.4Very high97.7Very high20 Ų2043.4 Ų43.412%0.12123%0.234CC..Hα-helixtrans-61.5-48174.7168.20000110.5I67 A179 T180 S185 A186 M187 P208I67-V183 HydrophobicContact CD1-CG1 3.88Å; I67-V183 HydrophobicContact CD1-CG2 4.34Å; I67-V183 HydrophobicContact CG1-CG1 4.2Å; I67-V183 HydrophobicContact CG1-CG2 3.98Å; A179-V183 WeakPolarHBondContact O-CG2 3.41Å; A179-V183 PolarHBondContact O-N 3.44Å; T180-V183 PolarHBondContact O-N 3.17Å; V183-S185 VanDerWaalsContact C-N 3.31Å; V183-S185 PolarHBondContact O-N 3.49Å; V183-A186 WeakPolarHBondContact O-CB 3.41Å; V183-A186 PolarHBondContact O-N 2.88Å; V183-M187 HydrophobicContact CG1-CE 3.74Å; V183-M187 WeakPolarHBondContact O-CE 3.5Å; V183-P208 HydrophobicContact CG1-CB 4.29Å; V183-P208 HydrophobicContact CG1-CG 4Å
184V98.3Very high97.7Very high30 Ų3045.8 Ų45.818%0.18226%0.257CS..Hα-helixtrans-58.9-42.8176.8166.40000111.1T180 V181 A186 M187 F188 L205 L209T180-V184 WeakPolarHBondContact O-CB 3.42Å; T180-V184 WeakPolarHBondContact O-CG2 3.38Å; T180-V184 PolarHBondContact O-N 2.99Å; V181-V184 PolarHBondContact O-N 3.38Å; V184-A186 PolarHBondContact O-N 2.89Å; V184-M187 WeakPolarHBondContact O-CB 3.33Å; V184-M187 WeakPolarHBondContact O-CG 3.49Å; V184-M187 PolarHBondContact O-N 3.39Å; V184-M187 VanDerWaalsContact O-N 3.09Å; V184-F188 HydrophobicContact CG1-CE2 4.2Å; V184-F188 VanDerWaalsContact O-CD2 3.3Å; V184-F188 WeakPolarHBondContact O-CD2 3.36Å; V184-L205 HydrophobicContact CG1-CD1 3.75Å; V184-L209 HydrophobicContact CG2-CD2 4.14Å
185S98.3Very high97.6Very high22 Ų2243.9 Ų43.915%0.15425%0.246CC..Hα-helixtrans-62.2-29.1177.177.60000112.8H130 V181 T182 V183 M187 F188H130-S185 PolarHBondContact ND1-OG 3.25Å; H130-S185 VanDerWaalsContact ND1-OG 3.14Å; V181-S185 WeakPolarHBondContact O-CB 3.48Å; V181-S185 PolarHBondContact O-N 3.34Å; T182-S185 PolarHBondContact O-N 2.91Å; T182-S185 PolarHBondContact O-OG 3.33Å; V183-S185 VanDerWaalsContact C-N 3.31Å; V183-S185 PolarHBondContact O-N 3.49Å; S185-M187 PolarHBondContact O-N 3.45Å; S185-F188 PolarHBondContact O-N 2.9Å
186A97.4Very high97.6Very high21 Ų2143.7 Ų43.717%0.17425%0.245CC..Hα-helixtrans-65.8-27.8177.100000112.3H130 T182 V183 V184 F188 S189 F192H130-A186 VanDerWaalsContact CE1-CB 3.41Å; H130-A186 WeakPolarHBondContact CE1-CB 3.5Å; T182-A186 PolarHBondContact O-N 3.49Å; T182-A186 VanDerWaalsContact O-N 3.12Å; V183-A186 WeakPolarHBondContact O-CB 3.41Å; V183-A186 PolarHBondContact O-N 2.88Å; V184-A186 PolarHBondContact O-N 2.89Å; A186-F188 PolarHBondContact O-N 3.45Å; A186-S189 VanDerWaalsContact O-CB 3.25Å; A186-S189 WeakPolarHBondContact O-CB 3.34Å; A186-S189 PolarHBondContact O-N 2.88Å; A186-S189 PolarHBondContact O-OG 2.88Å; A186-F192 WeakPolarHBondContact O-CB 3.48Å
187M97.2Very high97.3Very high7 Ų749.9 Ų49.93%0.03427%0.272CS..THydrogen-bonded Turntrans-66.9-16.9178.4-49.6-55.7142.900112.6V183 V184 S185 F192 W201 F204 L205V183-M187 HydrophobicContact CG1-CE 3.74Å; V183-M187 WeakPolarHBondContact O-CE 3.5Å; V184-M187 WeakPolarHBondContact O-CB 3.33Å; V184-M187 WeakPolarHBondContact O-CG 3.49Å; V184-M187 PolarHBondContact O-N 3.39Å; V184-M187 VanDerWaalsContact O-N 3.09Å; S185-M187 PolarHBondContact O-N 3.45Å; M187-F192 VanDerWaalsContact CA-CD1 3.48Å; M187-F192 HydrophobicContact CB-CD1 3.88Å; M187-F192 HydrophobicContact CB-CE1 4Å; M187-F192 HydrophobicContact CB-CG 4.48Å; M187-F192 HydrophobicContact CE-CE2 4.46Å; M187-F192 HydrophobicContact CG-CD1 4.49Å; M187-F192 HydrophobicContact CG-CE1 4.3Å; M187-F192 VanDerWaalsContact O-CD1 3.3Å; M187-F192 WeakPolarHBondContact O-CD1 3.45Å; M187-F192 HydrophobicContact SD-CD1 3.86Å; M187-F192 HydrophobicContact SD-CD2 3.73Å; M187-F192 HydrophobicContact SD-CE1 3.52Å; M187-F192 VanDerWaalsContact SD-CE1 3.52Å; M187-F192 HydrophobicContact SD-CE2 3.41Å; M187-F192 WeakPolarHBondContact SD-CE2 3.46Å; M187-F192 HydrophobicContact SD-CG 3.95Å; M187-F192 HydrophobicContact SD-CZ 3.29Å; M187-F192 WeakPolarHBondContact SD-CZ 3.43Å; M187-W201 HydrophobicContact CB-CZ2 4.36Å; M187-W201 PolarHBondContact O-NE1 2.98Å; M187-F204 HydrophobicContact SD-CB 4.11Å; M187-L205 HydrophobicContact CB-CD1 4.47Å
188F97.1Very high97.2Very high111 Ų11149.4 Ų49.449%0.48728%0.283SS..THydrogen-bonded Turntrans-95.20.1174.9-59.7-91000113.2V184 S185 A186 W201 L205V184-F188 HydrophobicContact CG1-CE2 4.2Å; V184-F188 VanDerWaalsContact O-CD2 3.3Å; V184-F188 WeakPolarHBondContact O-CD2 3.36Å; S185-F188 PolarHBondContact O-N 2.9Å; A186-F188 PolarHBondContact O-N 3.45Å; F188-W201 HydrophobicContact CD1-CH2 4.27Å; F188-W201 AromaticContact CD1-CZ2 3.93Å; F188-W201 HydrophobicContact CD1-CZ2 3.93Å; F188-W201 AromaticContact CE1-CH2 3.53Å; F188-W201 HydrophobicContact CE1-CH2 3.53Å; F188-W201 AromaticContact CE1-CZ2 3.65Å; F188-W201 HydrophobicContact CE1-CZ2 3.65Å; F188-W201 HydrophobicContact CE2-CH2 4.44Å; F188-W201 HydrophobicContact CE2-CZ2 4.35Å; F188-W201 HydrophobicContact CG-CZ2 4.4Å; F188-W201 AromaticContact CZ-CH2 3.63Å; F188-W201 HydrophobicContact CZ-CH2 3.63Å; F188-W201 AromaticContact CZ-CZ2 3.88Å; F188-W201 HydrophobicContact CZ-CZ2 3.88Å; F188-L205 HydrophobicContact CE2-CD1 3.6Å; F188-L205 HydrophobicContact CZ-CD1 3.72Å
189S96.1Very high97Very high35 Ų3553.1 Ų53.125%0.24531%0.307CS..SBendtrans-68.2150.9174.368.10000111.4A186 W191 F192 Q193A186-S189 VanDerWaalsContact O-CB 3.25Å; A186-S189 WeakPolarHBondContact O-CB 3.34Å; A186-S189 PolarHBondContact O-N 2.88Å; A186-S189 PolarHBondContact O-OG 2.88Å; S189-W191 PolarHBondContact O-N 2.89Å; S189-F192 PolarHBondContact O-N 2.96Å; S189-F192 VanDerWaalsContact O-N 3.1Å; S189-F192 WeakPolarHBondContact OG-CB 3.3Å; S189-F192 PolarHBondContact OG-N 3.34Å; S189-Q193 PolarHBondContact O-N 2.9Å
190D94.9Very high96.9Very high148 Ų14856.8 Ų56.879%0.79133%0.329SS*.Hα-helixtrans-54.2-41.1177.7-60.2-26.5000111.8A194D190-A194 VanDerWaalsContact O-CB 3.23Å; D190-A194 WeakPolarHBondContact O-CB 3.35Å; D190-A194 PolarHBondContact O-N 3.16Å
191W95.4Very high96.8Very high69 Ų6957.9 Ų57.926%0.26133%0.332SS..Hα-helixtrans-61.9-49.3177.8172.578.3000111.9F55 P59 S189 A194 T195F55-W191 HydrophobicContact CD1-CG 4.35Å; F55-W191 HydrophobicContact CE1-CB 3.91Å; F55-W191 AromaticContact CE1-CD1 3.58Å; F55-W191 AromaticContact CE1-CD2 3.56Å; F55-W191 HydrophobicContact CE1-CD2 3.56Å; F55-W191 AromaticContact CE1-CE2 3.93Å; F55-W191 HydrophobicContact CE1-CE3 4.16Å; F55-W191 AromaticContact CE1-CG 3.36Å; F55-W191 HydrophobicContact CE1-CG 3.36Å; F55-W191 AromaticContact CE1-NE1 3.89Å; F55-W191 HydrophobicContact CZ-CB 4Å; F55-W191 HydrophobicContact CZ-CD2 4.08Å; F55-W191 HydrophobicContact CZ-CE3 4.32Å; F55-W191 AromaticContact CZ-CG 3.9Å; F55-W191 HydrophobicContact CZ-CG 3.9Å; P59-W191 HydrophobicContact CB-CH2 4.09Å; P59-W191 HydrophobicContact CB-CZ3 4.05Å; P59-W191 HydrophobicContact CG-CH2 4.01Å; P59-W191 HydrophobicContact CG-CZ2 4.4Å; P59-W191 HydrophobicContact CG-CZ3 4.22Å; S189-W191 PolarHBondContact O-N 2.89Å; W191-A194 PolarHBondContact O-N 3.42Å; W191-T195 HydrophobicContact CZ2-CG2 4.44Å; W191-T195 WeakPolarHBondContact O-CB 3.3Å; W191-T195 PolarHBondContact O-N 3.18Å; W191-T195 PolarHBondContact O-OG1 3.36Å
192F97.3Very high96.7Very high4 Ų460.8 Ų60.82%0.01834%0.335CS..Hα-helixtrans-68.1-43.5-177-167.6-90.2000111A186 M187 S189 A194 T195 V196 W201 F204A186-F192 WeakPolarHBondContact O-CB 3.48Å; M187-F192 VanDerWaalsContact CA-CD1 3.48Å; M187-F192 HydrophobicContact CB-CD1 3.88Å; M187-F192 HydrophobicContact CB-CE1 4Å; M187-F192 HydrophobicContact CB-CG 4.48Å; M187-F192 HydrophobicContact CE-CE2 4.46Å; M187-F192 HydrophobicContact CG-CD1 4.49Å; M187-F192 HydrophobicContact CG-CE1 4.3Å; M187-F192 VanDerWaalsContact O-CD1 3.3Å; M187-F192 WeakPolarHBondContact O-CD1 3.45Å; M187-F192 HydrophobicContact SD-CD1 3.86Å; M187-F192 HydrophobicContact SD-CD2 3.73Å; M187-F192 HydrophobicContact SD-CE1 3.52Å; M187-F192 VanDerWaalsContact SD-CE1 3.52Å; M187-F192 HydrophobicContact SD-CE2 3.41Å; M187-F192 WeakPolarHBondContact SD-CE2 3.46Å; M187-F192 HydrophobicContact SD-CG 3.95Å; M187-F192 HydrophobicContact SD-CZ 3.29Å; M187-F192 WeakPolarHBondContact SD-CZ 3.43Å; S189-F192 PolarHBondContact O-N 2.96Å; S189-F192 VanDerWaalsContact O-N 3.1Å; S189-F192 WeakPolarHBondContact OG-CB 3.3Å; S189-F192 PolarHBondContact OG-N 3.34Å; F192-A194 VanDerWaalsContact C-N 3.27Å; F192-A194 PolarHBondContact O-N 2.98Å; F192-T195 PolarHBondContact O-N 2.99Å; F192-V196 HydrophobicContact CD1-CB 4.43Å; F192-V196 HydrophobicContact CE1-CB 3.84Å; F192-V196 HydrophobicContact CE1-CG1 4.37Å; F192-V196 HydrophobicContact CE1-CG2 4.09Å; F192-V196 HydrophobicContact CE2-CG2 4.02Å; F192-V196 HydrophobicContact CZ-CB 3.95Å; F192-V196 HydrophobicContact CZ-CG1 4.41Å; F192-V196 HydrophobicContact CZ-CG2 3.69Å; F192-V196 PolarHBondContact O-N 3.41Å; F192-W201 AromaticContact CD1-CD1 3.78Å; F192-W201 AromaticContact CD1-NE1 3.76Å; F192-W201 AromaticContact CE1-CD1 3.58Å; F192-W201 AromaticContact CE1-NE1 3.87Å; F192-F204 HydrophobicContact CE1-CB 4.11Å; F192-F204 HydrophobicContact CE1-CG 4.45Å; F192-F204 HydrophobicContact CE2-CD1 4.22Å; F192-F204 HydrophobicContact CE2-CG 4.4Å; F192-F204 HydrophobicContact CZ-CB 3.6Å; F192-F204 AromaticContact CZ-CD1 3.83Å; F192-F204 HydrophobicContact CZ-CD1 3.83Å; F192-F204 HydrophobicContact CZ-CD2 4.03Å; F192-F204 HydrophobicContact CZ-CE1 4.49Å; F192-F204 AromaticContact CZ-CG 3.57Å; F192-F204 HydrophobicContact CZ-CG 3.57Å
193Q97Very high96.6Very high85 Ų8562.2 Ų62.240%0.39735%0.349SS..Hα-helixtrans-62.4-35.2175.8-71.5-147.38.600112S189 T195 K197S189-Q193 PolarHBondContact O-N 2.9Å; Q193-T195 VanDerWaalsContact C-N 3.29Å; Q193-K197 WeakPolarHBondContact O-CD 3.46Å; Q193-K197 WeakPolarHBondContact O-CE 3.27Å; Q193-K197 PolarHBondContact O-NZ 3.08Å
194A96.8Very high96.5Very high73 Ų7361.9 Ų61.960%0.60335%0.345SS*.Hα-helixtrans-68.7-29.2173.800000112.7D190 W191 F192D190-A194 VanDerWaalsContact O-CB 3.23Å; D190-A194 WeakPolarHBondContact O-CB 3.35Å; D190-A194 PolarHBondContact O-N 3.16Å; W191-A194 PolarHBondContact O-N 3.42Å; F192-A194 VanDerWaalsContact C-N 3.27Å; F192-A194 PolarHBondContact O-N 2.98Å
195T96.9Very high96.4Very high51 Ų5162 Ų6231%0.31335%0.345SS..Hα-helixtrans-87.3-40.4-173.7-56.60000113.2L47 W191 F192 Q193L47-T195 HydrophobicContact CB-CG2 4.08Å; L47-T195 HydrophobicContact CD2-CG2 4.14Å; W191-T195 HydrophobicContact CZ2-CG2 4.44Å; W191-T195 WeakPolarHBondContact O-CB 3.3Å; W191-T195 PolarHBondContact O-N 3.18Å; W191-T195 PolarHBondContact O-OG1 3.36Å; F192-T195 PolarHBondContact O-N 2.99Å; Q193-T195 VanDerWaalsContact C-N 3.29Å
196V97.4Very high96.4Very high10 Ų1065.8 Ų65.86%0.06136%0.363CS..  trans-122.8126.9-174.8-176.10000110.1L47 F192 V200 W201 F204L47-V196 HydrophobicContact CD1-CG2 3.71Å; F192-V196 HydrophobicContact CD1-CB 4.43Å; F192-V196 HydrophobicContact CE1-CB 3.84Å; F192-V196 HydrophobicContact CE1-CG1 4.37Å; F192-V196 HydrophobicContact CE1-CG2 4.09Å; F192-V196 HydrophobicContact CE2-CG2 4.02Å; F192-V196 HydrophobicContact CZ-CB 3.95Å; F192-V196 HydrophobicContact CZ-CG1 4.41Å; F192-V196 HydrophobicContact CZ-CG2 3.69Å; F192-V196 PolarHBondContact O-N 3.41Å; V196-V200 HydrophobicContact CG1-CB 4.25Å; V196-V200 HydrophobicContact CG1-CG1 3.98Å; V196-W201 HydrophobicContact CG1-CB 4.18Å; V196-F204 HydrophobicContact CG1-CD2 3.98Å; V196-F204 HydrophobicContact CG1-CE2 4.17Å; V196-F204 HydrophobicContact CG2-CE2 4.32Å
197K93.8Very high96.4Very high138 Ų13867.7 Ų67.760%0.637%0.37SS*.  trans-127.9163.6-174.7-60.8-64.5-168.4-174.80112.3Q193Q193-K197 WeakPolarHBondContact O-CD 3.46Å; Q193-K197 WeakPolarHBondContact O-CE 3.27Å; Q193-K197 PolarHBondContact O-NZ 3.08Å
198G95.3Very high96.4Very high55 Ų5567.8 Ų67.857%0.56737%0.371SS*.THydrogen-bonded Turntrans65.1-151.917300000113.4V200 W201G198-V200 PolarHBondContact O-N 2.97Å; G198-V200 VanDerWaalsContact O-N 3.16Å; G198-W201 WeakPolarHBondContact O-CB 3.14Å; G198-W201 PolarHBondContact O-N 2.91Å; G198-W201 VanDerWaalsContact O-N 3.1Å
199V95Very high96.4Very high128 Ų12866 Ų6678%0.77637%0.366SS*.Hα-helixtrans-58.1-29.4-175.5-78.60000114.2W201 Y202V199-W201 VanDerWaalsContact C-N 3.26Å; V199-W201 PolarHBondContact O-N 3.46Å; V199-Y202 PolarHBondContact O-N 3.05Å
200V95.4Very high96.5Very high81 Ų8168 Ų6849%0.49137%0.371SS..Hα-helixtrans-65.6-30.2179.8-178.90000111.8V196 G198 Y202 A203 F204V196-V200 HydrophobicContact CG1-CB 4.25Å; V196-V200 HydrophobicContact CG1-CG1 3.98Å; G198-V200 PolarHBondContact O-N 2.97Å; G198-V200 VanDerWaalsContact O-N 3.16Å; V200-Y202 VanDerWaalsContact C-N 3.29Å; V200-Y202 PolarHBondContact O-N 2.58Å; V200-A203 WeakPolarHBondContact O-CB 3.28Å; V200-A203 PolarHBondContact O-N 3.37Å; V200-A203 VanDerWaalsContact O-N 3.09Å; V200-F204 HydrophobicContact CG1-CD2 4.06Å; V200-F204 HydrophobicContact CG1-CE2 3.84Å; V200-F204 WeakPolarHBondContact O-CD2 3.45Å; V200-F204 PolarHBondContact O-N 3.46Å
201W97.4Very high96.7Very high35 Ų3561.1 Ų61.113%0.13333%0.334CS..Hα-helixtrans-59.7-40.4177.6-179.292.5000112M187 F188 F192 V196 G198 V199 A203 F204 L205M187-W201 HydrophobicContact CB-CZ2 4.36Å; M187-W201 PolarHBondContact O-NE1 2.98Å; F188-W201 HydrophobicContact CD1-CH2 4.27Å; F188-W201 AromaticContact CD1-CZ2 3.93Å; F188-W201 HydrophobicContact CD1-CZ2 3.93Å; F188-W201 AromaticContact CE1-CH2 3.53Å; F188-W201 HydrophobicContact CE1-CH2 3.53Å; F188-W201 AromaticContact CE1-CZ2 3.65Å; F188-W201 HydrophobicContact CE1-CZ2 3.65Å; F188-W201 HydrophobicContact CE2-CH2 4.44Å; F188-W201 HydrophobicContact CE2-CZ2 4.35Å; F188-W201 HydrophobicContact CG-CZ2 4.4Å; F188-W201 AromaticContact CZ-CH2 3.63Å; F188-W201 HydrophobicContact CZ-CH2 3.63Å; F188-W201 AromaticContact CZ-CZ2 3.88Å; F188-W201 HydrophobicContact CZ-CZ2 3.88Å; F192-W201 AromaticContact CD1-CD1 3.78Å; F192-W201 AromaticContact CD1-NE1 3.76Å; F192-W201 AromaticContact CE1-CD1 3.58Å; F192-W201 AromaticContact CE1-NE1 3.87Å; V196-W201 HydrophobicContact CG1-CB 4.18Å; G198-W201 WeakPolarHBondContact O-CB 3.14Å; G198-W201 PolarHBondContact O-N 2.91Å; G198-W201 VanDerWaalsContact O-N 3.1Å; V199-W201 VanDerWaalsContact C-N 3.26Å; V199-W201 PolarHBondContact O-N 3.46Å; W201-A203 VanDerWaalsContact C-N 3.28Å; W201-A203 PolarHBondContact O-N 3.18Å; W201-F204 PolarHBondContact O-N 3.03Å; W201-L205 HydrophobicContact CH2-CD1 3.88Å; W201-L205 HydrophobicContact CH2-CD2 3.94Å; W201-L205 HydrophobicContact CH2-CG 4.36Å; W201-L205 HydrophobicContact CZ2-CD1 4.23Å; W201-L205 HydrophobicContact CZ3-CB 4.39Å; W201-L205 HydrophobicContact CZ3-CD1 4.45Å; W201-L205 HydrophobicContact CZ3-CD2 3.81Å; W201-L205 HydrophobicContact CZ3-CG 4.46Å; W201-L205 PolarHBondContact O-N 2.69Å
202Y97Very high96.8Very high140 Ų14058.2 Ų58.255%0.54932%0.324SS..Hα-helixtrans-66.1-30.2177-63.2-80.1000112.6V199 V200 L205 L206V199-Y202 PolarHBondContact O-N 3.05Å; V200-Y202 VanDerWaalsContact C-N 3.29Å; V200-Y202 PolarHBondContact O-N 2.58Å; Y202-L205 WeakPolarHBondContact O-CB 3.14Å; Y202-L205 PolarHBondContact O-N 3.08Å; Y202-L206 WeakPolarHBondContact O-CB 3.08Å; Y202-L206 VanDerWaalsContact O-CG 3.29Å; Y202-L206 WeakPolarHBondContact O-CG 3.19Å; Y202-L206 PolarHBondContact O-N 3.16Å
203A96.1Very high96.8Very high44 Ų4462.9 Ų62.936%0.36435%0.349SS..Hα-helixtrans-63.7-46.2173.600000110.8V200 W201 L205 L206 L207V200-A203 WeakPolarHBondContact O-CB 3.28Å; V200-A203 PolarHBondContact O-N 3.37Å; V200-A203 VanDerWaalsContact O-N 3.09Å; W201-A203 VanDerWaalsContact C-N 3.28Å; W201-A203 PolarHBondContact O-N 3.18Å; A203-L205 VanDerWaalsContact C-N 3.26Å; A203-L205 PolarHBondContact O-N 3.08Å; A203-L206 PolarHBondContact O-N 3.3Å; A203-L207 HydrophobicContact CB-CD1 4.37Å; A203-L207 VanDerWaalsContact O-CB 3.29Å; A203-L207 WeakPolarHBondContact O-CB 3.28Å; A203-L207 WeakPolarHBondContact O-CD1 3.48Å; A203-L207 WeakPolarHBondContact O-CG 3.45Å; A203-L207 PolarHBondContact O-N 3.03Å
204F96.9Very high96.8Very high12 Ų1259.6 Ų59.65%0.05334%0.335CS..Hα-helixtrans-63.5-31175.1-80.1-87.9000113.3L40 L43 I44 L47 M187 F192 V196 V200 W201 P208L40-F204 HydrophobicContact CD2-CD1 3.89Å; L40-F204 HydrophobicContact CD2-CE1 4.11Å; L43-F204 HydrophobicContact CB-CE1 4.1Å; L43-F204 HydrophobicContact CB-CZ 3.99Å; L43-F204 HydrophobicContact CD1-CZ 4.23Å; I44-F204 HydrophobicContact CG1-CD1 4.49Å; I44-F204 HydrophobicContact CG1-CE1 4.1Å; L47-F204 HydrophobicContact CD1-CE1 4.27Å; L47-F204 HydrophobicContact CD1-CE2 4.3Å; L47-F204 HydrophobicContact CD1-CZ 3.67Å; M187-F204 HydrophobicContact SD-CB 4.11Å; F192-F204 HydrophobicContact CE1-CB 4.11Å; F192-F204 HydrophobicContact CE1-CG 4.45Å; F192-F204 HydrophobicContact CE2-CD1 4.22Å; F192-F204 HydrophobicContact CE2-CG 4.4Å; F192-F204 HydrophobicContact CZ-CB 3.6Å; F192-F204 AromaticContact CZ-CD1 3.83Å; F192-F204 HydrophobicContact CZ-CD1 3.83Å; F192-F204 HydrophobicContact CZ-CD2 4.03Å; F192-F204 HydrophobicContact CZ-CE1 4.49Å; F192-F204 AromaticContact CZ-CG 3.57Å; F192-F204 HydrophobicContact CZ-CG 3.57Å; V196-F204 HydrophobicContact CG1-CD2 3.98Å; V196-F204 HydrophobicContact CG1-CE2 4.17Å; V196-F204 HydrophobicContact CG2-CE2 4.32Å; V200-F204 HydrophobicContact CG1-CD2 4.06Å; V200-F204 HydrophobicContact CG1-CE2 3.84Å; V200-F204 WeakPolarHBondContact O-CD2 3.45Å; V200-F204 PolarHBondContact O-N 3.46Å; W201-F204 PolarHBondContact O-N 3.03Å; F204-P208 WeakPolarHBondContact O-CD 3.26Å; F204-P208 WeakPolarHBondContact O-CG 3.38Å
205L96.2Very high96.8Very high32 Ų3256.1 Ų56.117%0.16831%0.306CS..Hα-helixtrans-67.4-44.2174.4-170.378.2000112.2V184 M187 F188 W201 Y202 A203V184-L205 HydrophobicContact CG1-CD1 3.75Å; M187-L205 HydrophobicContact CB-CD1 4.47Å; F188-L205 HydrophobicContact CE2-CD1 3.6Å; F188-L205 HydrophobicContact CZ-CD1 3.72Å; W201-L205 HydrophobicContact CH2-CD1 3.88Å; W201-L205 HydrophobicContact CH2-CD2 3.94Å; W201-L205 HydrophobicContact CH2-CG 4.36Å; W201-L205 HydrophobicContact CZ2-CD1 4.23Å; W201-L205 HydrophobicContact CZ3-CB 4.39Å; W201-L205 HydrophobicContact CZ3-CD1 4.45Å; W201-L205 HydrophobicContact CZ3-CD2 3.81Å; W201-L205 HydrophobicContact CZ3-CG 4.46Å; W201-L205 PolarHBondContact O-N 2.69Å; Y202-L205 WeakPolarHBondContact O-CB 3.14Å; Y202-L205 PolarHBondContact O-N 3.08Å; A203-L205 VanDerWaalsContact C-N 3.26Å; A203-L205 PolarHBondContact O-N 3.08Å
206L97.1Very high96.8Very high103 Ų10357.1 Ų57.154%0.53931%0.308SS..Hα-helixtrans-88.7-35-170.2-66.4174.3000113.7Y202 A203 P208 L209Y202-L206 WeakPolarHBondContact O-CB 3.08Å; Y202-L206 VanDerWaalsContact O-CG 3.29Å; Y202-L206 WeakPolarHBondContact O-CG 3.19Å; Y202-L206 PolarHBondContact O-N 3.16Å; A203-L206 PolarHBondContact O-N 3.3Å; L206-P208 VanDerWaalsContact C-CD 3.49Å; L206-L209 HydrophobicContact CD2-CD1 4.11Å; L206-L209 VanDerWaalsContact O-CB 3.29Å; L206-L209 WeakPolarHBondContact O-CB 3.27Å; L206-L209 PolarHBondContact O-N 3.32Å
207L97.4Very high96.6Very high60 Ų6059.9 Ų59.931%0.31432%0.322SS..THydrogen-bonded Turntrans-56.5-41.8-175-76.3168.8000113.8I36 L40 A203 L209 F210 P211I36-L207 HydrophobicContact CD1-CD2 4.12Å; I36-L207 HydrophobicContact CG1-CD2 4.13Å; I36-L207 HydrophobicContact CG2-CB 4.11Å; I36-L207 HydrophobicContact CG2-CD2 4.38Å; L40-L207 HydrophobicContact CD1-CB 3.79Å; L40-L207 HydrophobicContact CD2-CB 4.04Å; L40-L207 HydrophobicContact CD2-CD1 3.81Å; L40-L207 HydrophobicContact CG-CB 4.19Å; L40-L207 HydrophobicContact CG-CD1 4.43Å; A203-L207 HydrophobicContact CB-CD1 4.37Å; A203-L207 VanDerWaalsContact O-CB 3.29Å; A203-L207 WeakPolarHBondContact O-CB 3.28Å; A203-L207 WeakPolarHBondContact O-CD1 3.48Å; A203-L207 WeakPolarHBondContact O-CG 3.45Å; A203-L207 PolarHBondContact O-N 3.03Å; L207-L209 PolarHBondContact O-N 3.43Å; L207-F210 PolarHBondContact O-N 3.35Å; L207-P211 WeakPolarHBondContact O-CD 3.2Å
208P97.8Very high96.6Very high10 Ų1054.3 Ų54.37%0.06530%0.298CS..THydrogen-bonded Turntrans-61.1-25.2176.5-23.333.7000114.1L40 T180 V183 F204 L206 F210L40-P208 HydrophobicContact CD1-CG 3.88Å; T180-P208 HydrophobicContact CG2-CB 4.28Å; V183-P208 HydrophobicContact CG1-CB 4.29Å; V183-P208 HydrophobicContact CG1-CG 4Å; F204-P208 WeakPolarHBondContact O-CD 3.26Å; F204-P208 WeakPolarHBondContact O-CG 3.38Å; L206-P208 VanDerWaalsContact C-CD 3.49Å; P208-F210 VanDerWaalsContact C-N 3.3Å; P208-F210 PolarHBondContact O-N 2.99Å
209L98.3Very high96.5Very high74 Ų7452.5 Ų52.539%0.38728%0.276SS..Hα-helixtrans-70.6-28-179.3-54.5179.6000111.9T180 V184 L206 L207 A212 L213T180-L209 HydrophobicContact CG2-CD2 3.95Å; V184-L209 HydrophobicContact CG2-CD2 4.14Å; L206-L209 HydrophobicContact CD2-CD1 4.11Å; L206-L209 VanDerWaalsContact O-CB 3.29Å; L206-L209 WeakPolarHBondContact O-CB 3.27Å; L206-L209 PolarHBondContact O-N 3.32Å; L207-L209 PolarHBondContact O-N 3.43Å; L209-A212 WeakPolarHBondContact O-CB 3.42Å; L209-A212 PolarHBondContact O-N 3.5Å; L209-L213 WeakPolarHBondContact O-CG 3.23Å; L209-L213 PolarHBondContact O-N 3.2Å
210F98.2Very high96.3Very high76 Ų7648.6 Ų48.633%0.33325%0.252SS..Hα-helixtrans-67.9-52.8-176.8-177.8-82.5000112.6A29 A32 I36 L207 P208 A212 L213 V214A29-F210 HydrophobicContact CB-CZ 4.16Å; A29-F210 WeakPolarHBondContact O-CE1 3.45Å; A32-F210 HydrophobicContact CB-CE1 3.65Å; A32-F210 HydrophobicContact CB-CZ 4.01Å; I36-F210 HydrophobicContact CD1-CB 4.05Å; I36-F210 HydrophobicContact CD1-CD1 3.55Å; I36-F210 HydrophobicContact CD1-CE1 4.24Å; I36-F210 HydrophobicContact CD1-CG 3.93Å; L207-F210 PolarHBondContact O-N 3.35Å; P208-F210 VanDerWaalsContact C-N 3.3Å; P208-F210 PolarHBondContact O-N 2.99Å; F210-A212 PolarHBondContact O-N 3.28Å; F210-L213 PolarHBondContact O-N 3.4Å; F210-L213 VanDerWaalsContact O-N 3.15Å; F210-V214 HydrophobicContact CD1-CG2 4.18Å; F210-V214 HydrophobicContact CE1-CG2 3.81Å; F210-V214 HydrophobicContact CZ-CG2 4.28Å; F210-V214 WeakPolarHBondContact O-CG2 3.43Å; F210-V214 PolarHBondContact O-N 3.03Å; F210-V214 VanDerWaalsContact O-N 3.07Å
211P97.9Very high95.9Very high4 Ų447.7 Ų47.73%0.02625%0.245CC..Hα-helixtrans-55.2-35170.9-26.634.8000113.6A33 I36 T71 Y176 L207 V214 I215A33-P211 HydrophobicContact CB-CB 4.14Å; A33-P211 HydrophobicContact CB-CG 4.28Å; I36-P211 HydrophobicContact CB-CG 4.22Å; I36-P211 HydrophobicContact CG2-CG 3.84Å; T71-P211 HydrophobicContact CG2-CB 4.1Å; Y176-P211 WeakPolarHBondContact OH-CB 3.28Å; L207-P211 WeakPolarHBondContact O-CD 3.2Å; P211-V214 PolarHBondContact O-N 2.93Å; P211-I215 WeakPolarHBondContact O-CB 3.48Å; P211-I215 PolarHBondContact O-N 3.39Å
212A98.1Very high95.5Very high7 Ų749.4 Ų49.46%0.05827%0.266CS..Hα-helixtrans-62.5-43.7176.300000112.8Y176 L177 T180 L209 F210 I215 M216Y176-A212 HydrophobicContact CD1-CB 4.27Å; Y176-A212 HydrophobicContact CE1-CB 3.8Å; L177-A212 HydrophobicContact CD2-CB 4.17Å; T180-A212 HydrophobicContact CG2-CB 4.06Å; L209-A212 WeakPolarHBondContact O-CB 3.42Å; L209-A212 PolarHBondContact O-N 3.5Å; F210-A212 PolarHBondContact O-N 3.28Å; A212-I215 PolarHBondContact O-N 2.83Å; A212-M216 VanDerWaalsContact O-CB 3.22Å; A212-M216 WeakPolarHBondContact O-CB 3.34Å; A212-M216 PolarHBondContact O-N 3.4Å
213L97.5Very high94.8Very high103 Ų10346.9 Ų46.954%0.53926%0.256SS..Hα-helixtrans-63.8-41.5174-68.2174.5000111.7L209 F210 M216 N217L209-L213 WeakPolarHBondContact O-CG 3.23Å; L209-L213 PolarHBondContact O-N 3.2Å; F210-L213 PolarHBondContact O-N 3.4Å; F210-L213 VanDerWaalsContact O-N 3.15Å; L213-M216 HydrophobicContact CD2-CE 3.75Å; L213-M216 PolarHBondContact O-N 3.47Å; L213-N217 VanDerWaalsContact O-CB 3.25Å; L213-N217 WeakPolarHBondContact O-CB 3.39Å; L213-N217 PolarHBondContact O-N 2.97Å
214V96.9Very high93.9Very high15 Ų1550 Ų509%0.09127%0.267CS..Hα-helixtrans-62.9-46.1177.7174.30000111.2A29 V30 A33 L75 F210 P211 N217 Q218A29-V214 HydrophobicContact CB-CG2 4.11Å; V30-V214 HydrophobicContact CG2-CG1 3.87Å; A33-V214 HydrophobicContact CB-CB 4.19Å; A33-V214 HydrophobicContact CB-CG1 4.16Å; A33-V214 HydrophobicContact CB-CG2 4.21Å; L75-V214 HydrophobicContact CD2-CG1 4.11Å; F210-V214 HydrophobicContact CD1-CG2 4.18Å; F210-V214 HydrophobicContact CE1-CG2 3.81Å; F210-V214 HydrophobicContact CZ-CG2 4.28Å; F210-V214 WeakPolarHBondContact O-CG2 3.43Å; F210-V214 PolarHBondContact O-N 3.03Å; F210-V214 VanDerWaalsContact O-N 3.07Å; P211-V214 PolarHBondContact O-N 2.93Å; V214-N217 PolarHBondContact O-N 3.49Å; V214-Q218 WeakPolarHBondContact O-CB 3.48Å; V214-Q218 PolarHBondContact O-N 3.3Å
215I96.6Very high92.4Very high0 Ų055.3 Ų55.30%030%0.302CS..Hα-helixtrans-66.4-43.4178-79167.5000111.5T71 I74 L75 L173 Y176 P211 A212 N217 Q218 I219T71-I215 HydrophobicContact CG2-CD1 4.07Å; I74-I215 HydrophobicContact CB-CD1 4.14Å; I74-I215 HydrophobicContact CB-CG1 4.44Å; I74-I215 HydrophobicContact CD1-CD1 4.36Å; I74-I215 HydrophobicContact CD1-CG2 4.4Å; I74-I215 HydrophobicContact CG2-CB 4.47Å; I74-I215 HydrophobicContact CG2-CD1 4.17Å; I74-I215 HydrophobicContact CG2-CG1 3.96Å; I74-I215 HydrophobicContact CG2-CG2 3.78Å; L75-I215 HydrophobicContact CD2-CD1 4.36Å; L75-I215 HydrophobicContact CD2-CG1 3.62Å; L75-I215 HydrophobicContact CG-CD1 4.28Å; L75-I215 HydrophobicContact CG-CG1 4.08Å; L173-I215 HydrophobicContact CD1-CG2 4.06Å; Y176-I215 HydrophobicContact CD1-CD1 4.23Å; Y176-I215 HydrophobicContact CD1-CG2 4.26Å; Y176-I215 HydrophobicContact CD2-CD1 3.91Å; Y176-I215 HydrophobicContact CE1-CB 4.49Å; Y176-I215 HydrophobicContact CE1-CD1 3.77Å; Y176-I215 HydrophobicContact CE2-CD1 3.39Å; Y176-I215 HydrophobicContact CG-CD1 4.29Å; Y176-I215 HydrophobicContact CG-CG2 4.31Å; P211-I215 WeakPolarHBondContact O-CB 3.48Å; P211-I215 PolarHBondContact O-N 3.39Å; A212-I215 PolarHBondContact O-N 2.83Å; I215-N217 VanDerWaalsContact C-N 3.31Å; I215-N217 PolarHBondContact O-N 3.17Å; I215-Q218 WeakPolarHBondContact O-CB 3.42Å; I215-Q218 PolarHBondContact O-N 2.88Å; I215-I219 HydrophobicContact CG2-CD1 3.88Å; I215-I219 WeakPolarHBondContact O-CG1 3.38Å; I215-I219 PolarHBondContact O-N 3.06Å
216M96.4Very high90.8Very high73 Ų7363.8 Ų63.836%0.3633%0.332SS..Hα-helixtrans-58-47.2174.9-177.8176.970.500110.5L173 A212 L213 Q218 I219 T220L173-M216 HydrophobicContact CD1-CB 4.03Å; L173-M216 HydrophobicContact CD1-CG 4.46Å; L173-M216 HydrophobicContact CD2-CG 4.25Å; A212-M216 VanDerWaalsContact O-CB 3.22Å; A212-M216 WeakPolarHBondContact O-CB 3.34Å; A212-M216 PolarHBondContact O-N 3.4Å; L213-M216 HydrophobicContact CD2-CE 3.75Å; L213-M216 PolarHBondContact O-N 3.47Å; M216-Q218 PolarHBondContact O-N 3.41Å; M216-I219 PolarHBondContact O-N 3.42Å; M216-T220 HydrophobicContact CG-CG2 4.37Å; M216-T220 WeakPolarHBondContact O-CB 3.46Å; M216-T220 VanDerWaalsContact O-CG2 3.3Å; M216-T220 WeakPolarHBondContact O-CG2 3.45Å; M216-T220 PolarHBondContact O-N 3.43Å; M216-T220 PolarHBondContact O-OG1 3.2Å
217N94Very high88.6Confident67 Ų6768.3 Ų68.336%0.35835%0.347SS..Hα-helixtrans-63.2-39.7176.3-174.258.1000112.1L213 V214 I215 T220 N221L213-N217 VanDerWaalsContact O-CB 3.25Å; L213-N217 WeakPolarHBondContact O-CB 3.39Å; L213-N217 PolarHBondContact O-N 2.97Å; V214-N217 PolarHBondContact O-N 3.49Å; I215-N217 VanDerWaalsContact C-N 3.31Å; I215-N217 PolarHBondContact O-N 3.17Å; N217-T220 WeakPolarHBondContact CA-OG1 3.45Å; N217-T220 PolarHBondContact O-OG1 3.41Å; N217-N221 VanDerWaalsContact CG-ND2 3.28Å; N217-N221 PolarHBondContact ND2-ND2 3.48Å; N217-N221 VanDerWaalsContact O-CB 3.28Å; N217-N221 WeakPolarHBondContact O-CB 3.36Å; N217-N221 PolarHBondContact O-N 2.86Å; N217-N221 VanDerWaalsContact O-N 3.11Å; N217-N221 PolarHBondContact O-ND2 3.3Å; N217-N221 PolarHBondContact OD1-ND2 3.11Å
218Q92.9Very high86.2Confident21 Ų2174.6 Ų74.610%0.09837%0.372CS..Hα-helixtrans-60.4-50.3175.6177.9-174.4-60.300111.5I74 S78 V214 I215 M216 A222I74-Q218 PolarHBondContact O-NE2 3.17Å; S78-Q218 VanDerWaalsContact CB-OE1 3.26Å; V214-Q218 WeakPolarHBondContact O-CB 3.48Å; V214-Q218 PolarHBondContact O-N 3.3Å; I215-Q218 WeakPolarHBondContact O-CB 3.42Å; I215-Q218 PolarHBondContact O-N 2.88Å; M216-Q218 PolarHBondContact O-N 3.41Å; Q218-A222 WeakPolarHBondContact O-CB 3.3Å; Q218-A222 PolarHBondContact O-N 2.79Å
219I92.6Very high83.8Confident18 Ų1881.2 Ų81.29%0.09241%0.405CS..Hα-helixtrans-70.8-45.4-174.8-68.3174.3000110.6I74 A169 L173 I215 M216 N221 A222 Y223I74-I219 HydrophobicContact CG2-CD1 4.29Å; A169-I219 HydrophobicContact CB-CG2 4.18Å; L173-I219 HydrophobicContact CB-CD1 3.81Å; L173-I219 HydrophobicContact CB-CG2 4.47Å; L173-I219 HydrophobicContact CD1-CD1 4.24Å; L173-I219 HydrophobicContact CD2-CB 4.46Å; L173-I219 HydrophobicContact CD2-CG2 4.29Å; L173-I219 HydrophobicContact CG-CD1 4.48Å; I215-I219 HydrophobicContact CG2-CD1 3.88Å; I215-I219 WeakPolarHBondContact O-CG1 3.38Å; I215-I219 PolarHBondContact O-N 3.06Å; M216-I219 PolarHBondContact O-N 3.42Å; I219-N221 PolarHBondContact O-N 3.04Å; I219-A222 PolarHBondContact O-N 3.49Å; I219-Y223 HydrophobicContact CG2-CD2 4.23Å; I219-Y223 WeakPolarHBondContact O-CD2 3.42Å; I219-Y223 PolarHBondContact O-N 3.4Å
220T91.4Very high81.2Confident45 Ų4583.9 Ų83.928%0.27643%0.425SS..Hα-helixtrans-61-46.3178.749.70000111.8M216 N217 A222 Y223 L224M216-T220 HydrophobicContact CG-CG2 4.37Å; M216-T220 WeakPolarHBondContact O-CB 3.46Å; M216-T220 VanDerWaalsContact O-CG2 3.3Å; M216-T220 WeakPolarHBondContact O-CG2 3.45Å; M216-T220 PolarHBondContact O-N 3.43Å; M216-T220 PolarHBondContact O-OG1 3.2Å; N217-T220 WeakPolarHBondContact CA-OG1 3.45Å; N217-T220 PolarHBondContact O-OG1 3.41Å; T220-A222 VanDerWaalsContact C-N 3.26Å; T220-A222 PolarHBondContact O-N 2.94Å; T220-Y223 PolarHBondContact O-N 2.95Å; T220-L224 HydrophobicContact CG2-CD1 3.95Å; T220-L224 VanDerWaalsContact O-CB 3.26Å; T220-L224 WeakPolarHBondContact O-CB 3.48Å; T220-L224 PolarHBondContact O-N 3.43Å
221N87.8Confident78.5Confident63 Ų6389.7 Ų89.734%0.33747%0.466SS..Hα-helixtrans-66.3-25.3177.5-76.1-51.8000114.1N217 I219N217-N221 VanDerWaalsContact CG-ND2 3.28Å; N217-N221 PolarHBondContact ND2-ND2 3.48Å; N217-N221 VanDerWaalsContact O-CB 3.28Å; N217-N221 WeakPolarHBondContact O-CB 3.36Å; N217-N221 PolarHBondContact O-N 2.86Å; N217-N221 VanDerWaalsContact O-N 3.11Å; N217-N221 PolarHBondContact O-ND2 3.3Å; N217-N221 PolarHBondContact OD1-ND2 3.11Å; I219-N221 PolarHBondContact O-N 3.04Å
222A87.5Confident77.5Confident71 Ų7194 Ų9459%0.58749%0.488SS*.Hα-helixtrans-80.9-25.1179.500000113.3Q218 I219 T220Q218-A222 WeakPolarHBondContact O-CB 3.3Å; Q218-A222 PolarHBondContact O-N 2.79Å; I219-A222 PolarHBondContact O-N 3.49Å; T220-A222 VanDerWaalsContact C-N 3.26Å; T220-A222 PolarHBondContact O-N 2.94Å
223Y84.3Confident76.5Confident86 Ų8698.5 Ų98.534%0.33751%0.511SS..Hα-helixtrans-127.3-20.9-168.3-73.2-77.7000115.3K165 L166 A169 I219 T220K165-Y223 HydrophobicContact CB-CE1 4.36Å; L166-Y223 HydrophobicContact CB-CD1 4.22Å; L166-Y223 HydrophobicContact CD1-CD1 3.86Å; L166-Y223 HydrophobicContact CD1-CG 3.97Å; A169-Y223 HydrophobicContact CB-CD2 3.83Å; A169-Y223 HydrophobicContact CB-CE1 4.49Å; A169-Y223 HydrophobicContact CB-CE2 3.37Å; I219-Y223 HydrophobicContact CG2-CD2 4.23Å; I219-Y223 WeakPolarHBondContact O-CD2 3.42Å; I219-Y223 PolarHBondContact O-N 3.4Å; T220-Y223 PolarHBondContact O-N 2.95Å
224L76.4Confident75.3Confident111 Ų11198.3 Ų98.358%0.58151%0.51SS*.SBendtrans-84137.7174.5-64.2179.6000110.6T220 R226T220-L224 HydrophobicContact CG2-CD1 3.95Å; T220-L224 VanDerWaalsContact O-CB 3.26Å; T220-L224 WeakPolarHBondContact O-CB 3.48Å; T220-L224 PolarHBondContact O-N 3.43Å; L224-R226 PolarHBondContact O-N 3.09Å
225P65.6Low74Confident122 Ų122103.2 Ų103.279%0.79253%0.534SS*.PPolyproline II helixtrans-59.8131.8175.2-18.229.2000110.6K227P225-K227 PolarHBondContact O-N 3Å
226R61.9Low72.6Confident211 Ų211109.6 Ų109.680%0.79657%0.568SS**PPolyproline II helixtrans-66.3121.9165.2-67.3-174.2-177.7-1750.4107.7L224 K228L224-R226 PolarHBondContact O-N 3.09Å; R226-K228 PolarHBondContact O-N 2.96Å; R226-K228 VanDerWaalsContact O-N 3.09Å
227K50.8Low71Confident198 Ų198112.1 Ų112.186%0.86158%0.581SS**PPolyproline II helixtrans-57.9117.8164.1-87.9-173.4175.1-176.70106.8P225 I229P225-K227 PolarHBondContact O-N 3Å; K227-I229 PolarHBondContact O-N 2.84Å; K227-I229 VanDerWaalsContact O-N 3.14Å
228K46.9Very low69.4Low192 Ų192115.3 Ų115.384%0.83560%0.597SS**  trans-65.5111.8163.2-73.8-175.2177.9-175.70105.7R226 T230R226-K228 PolarHBondContact O-N 2.96Å; R226-K228 VanDerWaalsContact O-N 3.09Å; K228-T230 VanDerWaalsContact C-N 3.3Å; K228-T230 PolarHBondContact O-N 3.34Å; K228-T230 VanDerWaalsContact O-N 3.1Å
229I47.4Very low67.6Low149 Ų149122.5 Ų122.576%0.76464%0.636SS**  trans-73.298164.4-57.1174.1000104.1K227 T231K227-I229 PolarHBondContact O-N 2.84Å; K227-I229 VanDerWaalsContact O-N 3.14Å; I229-T231 VanDerWaalsContact C-N 3.34Å; I229-T231 HydrophobicContact CG2-CG2 4.27Å; I229-T231 PolarHBondContact O-N 3.28Å
230T43.3Very low65.5Low130 Ų130131.3 Ų131.380%0.79868%0.681SS**  trans-73.595.6164.239.30000106.7K228K228-T230 VanDerWaalsContact C-N 3.3Å; K228-T230 PolarHBondContact O-N 3.34Å; K228-T230 VanDerWaalsContact O-N 3.1Å
231T42.4Very low63.1Low197 Ų197139.1 Ų139.1100%1.20972%0.718SS**  trans-80.60153.539.70000109.2I229I229-T231 VanDerWaalsContact C-N 3.34Å; I229-T231 HydrophobicContact CG2-CG2 4.27Å; I229-T231 PolarHBondContact O-N 3.28Å

Retrieved 231 of 231 residues in 1439.6 ms (Link to these results)