A0A078BS77_CAEEL Loading...

Serpentine Receptor, class Z

AlphaFold DB , UniProt , Accession A0A078BS77, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 161 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
1M42Very low40.8Very low238 Ų238137.5 Ų137.5100%1.17277%0.77SS**  0129.20-67.7167.7179.500107.2L3M1-L3 PolarHBondContact O-N 2.92Å; M1-L3 VanDerWaalsContact O-N 3.1Å
2S45.6Very low40.6Very low124 Ų124138.6 Ų138.687%0.86777%0.772SS**  trans-76.693.5172.551.70000108.6S4S2-S4 VanDerWaalsContact C-N 3.3Å; S2-S4 PolarHBondContact O-N 3.44Å
3L46.6Very low40.6Very low157 Ų157140.2 Ų140.282%0.82277%0.771SS**  trans-66.696.7164.4-77.4158.6000106.8M1M1-L3 PolarHBondContact O-N 2.92Å; M1-L3 VanDerWaalsContact O-N 3.1Å
4S40.6Very low41.1Very low94 Ų94134.8 Ų134.866%0.65776%0.763SS**PPolyproline II helixtrans-51.7130.1156.8490000106.7S2S2-S4 VanDerWaalsContact C-N 3.3Å; S2-S4 PolarHBondContact O-N 3.44Å
5P42.5Very low41.7Very low111 Ų111132 Ų13272%0.72176%0.755SS**PPolyproline II helixtrans-52.2137.9176.322.9-32.8000108.3
6P38.7Very low42.4Very low92 Ų92130.1 Ų130.160%0.59773%0.732SS**PPolyproline II helixtrans-51.5138.1179.422.8-33000108.1L8P6-L8 PolarHBondContact O-N 3.15Å
7P40.2Very low43.3Very low104 Ų104124 Ų12468%0.67570%0.7SS**PPolyproline II helixtrans-52.1121.2-171.422-33.4000108.2F9P7-F9 VanDerWaalsContact C-N 3.33Å; P7-F9 WeakPolarHBondContact O-CA 2.96Å; P7-F9 PolarHBondContact O-N 2.79Å
8L40.1Very low43.9Very low151 Ų151122.7 Ų122.779%0.79170%0.697SS**  trans-44.198.9-178.9-107.8155000108.1P6 N10 L11P6-L8 PolarHBondContact O-N 3.15Å; L8-N10 PolarHBondContact O-N 2.8Å; L8-L11 HydrophobicContact CD2-CD1 4.39Å
9F39.3Very low44.5Very low193 Ų193119.8 Ų119.885%0.84668%0.679SS**  trans-72105.3-155.8-144.2-84.2000107.4P7 L11P7-F9 VanDerWaalsContact C-N 3.33Å; P7-F9 WeakPolarHBondContact O-CA 2.96Å; P7-F9 PolarHBondContact O-N 2.79Å; F9-L11 PolarHBondContact O-N 2.78Å
10N33.6Very low45.3Very low124 Ų124114.2 Ų114.266%0.66365%0.648SS**  trans-10.387.3-168.6-71.2-24.9000115L8 D12 Q13L8-N10 PolarHBondContact O-N 2.8Å; N10-D12 HydrophobicContact CB-CB 4.39Å; N10-D12 PolarHBondContact O-N 2.74Å; N10-Q13 PolarHBondContact O-N 3.34Å
11L39.3Very low46Very low125 Ų125112.6 Ų112.665%0.65464%0.637SS**THydrogen-bonded Turntrans-59.6-6.7164.9-93.1158.8000112.2L8 F9 Q13L8-L11 HydrophobicContact CD2-CD1 4.39Å; F9-L11 PolarHBondContact O-N 2.78Å; L11-Q13 PolarHBondContact O-N 3.27Å
12D38.2Very low46.6Very low150 Ų150106.2 Ų106.280%0.80261%0.607SS**THydrogen-bonded Turntrans-63-7.3169.9-77.1-10.2000115N10 G14N10-D12 HydrophobicContact CB-CB 4.39Å; N10-D12 PolarHBondContact O-N 2.74Å; D12-G14 PolarHBondContact O-N 3.27Å
13Q41.8Very low47.4Very low160 Ų160101.4 Ų101.475%0.74857%0.571SS**  trans-92.980159-67.5-162.73.200110.5N10 L11 S15N10-Q13 PolarHBondContact O-N 3.34Å; L11-Q13 PolarHBondContact O-N 3.27Å; Q13-S15 PolarHBondContact O-N 3.32Å; Q13-S15 PolarHBondContact O-OG 3.26Å
14G47.1Very low48.3Very low64 Ų6495.6 Ų95.666%0.6654%0.541SS*.  trans-6543162.500000113.3D12 W16D12-G14 PolarHBondContact O-N 3.27Å; G14-W16 PolarHBondContact O-N 3.41Å
15S49.6Very low49.2Very low93 Ų9394.5 Ų94.565%0.6553%0.532SS*.  trans-69.9107.9169.256.20000107.9Q13 S17Q13-S15 PolarHBondContact O-N 3.32Å; Q13-S15 PolarHBondContact O-OG 3.26Å; S15-S17 PolarHBondContact O-N 3.41Å
16W53Low50Low102 Ų10293 Ų9339%0.38652%0.518SS..  trans-57.9134.2170.6-64.273.5000108.3G14 A20 I21 I24 I135 C138G14-W16 PolarHBondContact O-N 3.41Å; W16-A20 HydrophobicContact CE3-CB 4.15Å; W16-I21 HydrophobicContact CB-CD1 4.12Å; W16-I21 HydrophobicContact CB-CG1 3.6Å; W16-I24 HydrophobicContact CD2-CD1 4.12Å; W16-I24 HydrophobicContact CE3-CD1 3.45Å; W16-I24 VanDerWaalsContact CE3-CD1 3.45Å; W16-I24 HydrophobicContact CH2-CD1 4.05Å; W16-I24 HydrophobicContact CZ3-CD1 3.43Å; W16-I24 VanDerWaalsContact CZ3-CD1 3.43Å; W16-I135 HydrophobicContact CH2-CG2 4.38Å; W16-C138 HydrophobicContact CZ3-CB 3.99Å
17S58.1Low51.1Low26 Ų2688.9 Ų88.918%0.18249%0.491CS..  trans-58.5146.3176.271.90000109.3S15 I19 A20 I21S15-S17 PolarHBondContact O-N 3.41Å; S17-I19 PolarHBondContact O-N 3.34Å; S17-A20 WeakPolarHBondContact O-CA 3.29Å; S17-A20 WeakPolarHBondContact O-CB 3.21Å; S17-A20 PolarHBondContact O-N 3.37Å; S17-A20 WeakPolarHBondContact OG-CB 3.03Å; S17-A20 PolarHBondContact OG-N 2.62Å; S17-I21 PolarHBondContact O-N 3.44Å
18P53.8Low52.1Low100 Ų10086.1 Ų86.165%0.64948%0.477SS*.Hα-helixtrans-54.8-29.1179-2835.4000113N22P18-N22 WeakPolarHBondContact O-CB 3.05Å; P18-N22 VanDerWaalsContact O-CG 3.25Å; P18-N22 PolarHBondContact O-N 2.85Å; P18-N22 PolarHBondContact O-ND2 3.23Å
19I55.5Low52.9Low68 Ų6884 Ų8435%0.34947%0.465SS..Hα-helixtrans-65.7-47.5172.7-60.9172.1000111S17 N22 M23 V80S17-I19 PolarHBondContact O-N 3.34Å; I19-N22 PolarHBondContact O-N 3.42Å; I19-M23 WeakPolarHBondContact O-CB 3.05Å; I19-M23 PolarHBondContact O-N 3.47Å; I19-V80 HydrophobicContact CD1-CG1 4Å
20A59.9Low53.9Low7 Ų775.9 Ų75.96%0.05843%0.43CS..Hα-helixtrans-63.9-38.8176.500000112.1W16 S17 M23 I24W16-A20 HydrophobicContact CE3-CB 4.15Å; S17-A20 WeakPolarHBondContact O-CA 3.29Å; S17-A20 WeakPolarHBondContact O-CB 3.21Å; S17-A20 PolarHBondContact O-N 3.37Å; S17-A20 WeakPolarHBondContact OG-CB 3.03Å; S17-A20 PolarHBondContact OG-N 2.62Å; A20-M23 WeakPolarHBondContact O-CB 3.42Å; A20-M23 PolarHBondContact O-N 2.85Å; A20-I24 WeakPolarHBondContact O-CD1 3.39Å; A20-I24 VanDerWaalsContact O-CG1 3.26Å; A20-I24 WeakPolarHBondContact O-CG1 3.1Å; A20-I24 PolarHBondContact O-N 3.24Å
21I60Low55.2Low82 Ų8271.7 Ų71.742%0.42141%0.409SS..Hα-helixtrans-62.1-50.7173.8-60.9174.5000110.3W16 S17 M23 I24 C25W16-I21 HydrophobicContact CB-CD1 4.12Å; W16-I21 HydrophobicContact CB-CG1 3.6Å; S17-I21 PolarHBondContact O-N 3.44Å; I21-M23 VanDerWaalsContact C-N 3.28Å; I21-M23 PolarHBondContact O-N 3.12Å; I21-I24 PolarHBondContact O-N 3.16Å; I21-I24 VanDerWaalsContact O-N 3.14Å; I21-C25 PolarHBondContact O-N 3.19Å; I21-C25 PolarHBondContact O-SG 3.31Å; I21-C25 VanDerWaalsContact O-SG 3.35Å
22N56.3Low56Low103 Ų10373.7 Ų73.755%0.55141%0.408SS*.Hα-helixtrans-58-40.7177-76.6-22000112.1P18 I19 C25 L26P18-N22 WeakPolarHBondContact O-CB 3.05Å; P18-N22 VanDerWaalsContact O-CG 3.25Å; P18-N22 PolarHBondContact O-N 2.85Å; P18-N22 PolarHBondContact O-ND2 3.23Å; I19-N22 PolarHBondContact O-N 3.42Å; N22-C25 PolarHBondContact O-N 2.68Å; N22-L26 WeakPolarHBondContact O-CB 3.35Å; N22-L26 VanDerWaalsContact O-CG 3.27Å; N22-L26 WeakPolarHBondContact O-CG 3.33Å; N22-L26 PolarHBondContact O-N 2.88Å
23M61.7Low56.6Low23 Ų2369.3 Ų69.311%0.11338%0.381CS..Hα-helixtrans-59.8-47.5173.8-90.7-163.3-173.800112.5I19 A20 I21 L26 E27 Y73 N84 F134I19-M23 WeakPolarHBondContact O-CB 3.05Å; I19-M23 PolarHBondContact O-N 3.47Å; A20-M23 WeakPolarHBondContact O-CB 3.42Å; A20-M23 PolarHBondContact O-N 2.85Å; I21-M23 VanDerWaalsContact C-N 3.28Å; I21-M23 PolarHBondContact O-N 3.12Å; M23-L26 PolarHBondContact O-N 2.79Å; M23-E27 PolarHBondContact O-N 2.94Å; M23-Y73 HydrophobicContact CE-CD1 4.41Å; M23-Y73 HydrophobicContact CE-CD2 4.15Å; M23-Y73 HydrophobicContact CE-CE1 4Å; M23-Y73 HydrophobicContact CE-CE2 3.76Å; M23-Y73 HydrophobicContact CE-CG 4.5Å; M23-N84 WeakPolarHBondContact CE-OD1 3.28Å; M23-F134 HydrophobicContact CB-CE1 3.95Å; M23-F134 HydrophobicContact CB-CZ 3.78Å; M23-F134 HydrophobicContact CG-CZ 4.18Å; M23-F134 HydrophobicContact SD-CZ 3.93Å
24I64.4Low57.4Low35 Ų3562.1 Ų62.118%0.17935%0.347CS..Hα-helixtrans-64.2-42.4177.5-67159.4000111W16 A20 I21 L26 E27 A28 F131 F134W16-I24 HydrophobicContact CD2-CD1 4.12Å; W16-I24 HydrophobicContact CE3-CD1 3.45Å; W16-I24 VanDerWaalsContact CE3-CD1 3.45Å; W16-I24 HydrophobicContact CH2-CD1 4.05Å; W16-I24 HydrophobicContact CZ3-CD1 3.43Å; W16-I24 VanDerWaalsContact CZ3-CD1 3.43Å; A20-I24 WeakPolarHBondContact O-CD1 3.39Å; A20-I24 VanDerWaalsContact O-CG1 3.26Å; A20-I24 WeakPolarHBondContact O-CG1 3.1Å; A20-I24 PolarHBondContact O-N 3.24Å; I21-I24 PolarHBondContact O-N 3.16Å; I21-I24 VanDerWaalsContact O-N 3.14Å; I24-L26 VanDerWaalsContact C-N 3.34Å; I24-L26 PolarHBondContact O-N 3.39Å; I24-E27 PolarHBondContact O-N 2.73Å; I24-A28 VanDerWaalsContact O-CB 3.26Å; I24-A28 WeakPolarHBondContact O-CB 3.13Å; I24-A28 PolarHBondContact O-N 3Å; I24-F131 HydrophobicContact CG2-CE2 4.38Å; I24-F131 HydrophobicContact CG2-CZ 4.45Å; I24-F134 HydrophobicContact CG1-CE1 4.41Å
25C60.4Low57.7Low71 Ų7162.4 Ų62.448%0.4834%0.339SS..Hα-helixtrans-61.6-41.4175.8-69.70000111.7I21 N22 L29I21-C25 PolarHBondContact O-N 3.19Å; I21-C25 PolarHBondContact O-SG 3.31Å; I21-C25 VanDerWaalsContact O-SG 3.35Å; N22-C25 PolarHBondContact O-N 2.68Å; C25-L29 WeakPolarHBondContact O-CB 3.27Å; C25-L29 PolarHBondContact O-N 3.31Å
26L59.7Low57.7Low81 Ų8161.1 Ų61.142%0.42433%0.327SS..Hα-helixtrans-65-44175.2-74.8167.8000112.1N22 M23 I24 L29 Q30 I88N22-L26 WeakPolarHBondContact O-CB 3.35Å; N22-L26 VanDerWaalsContact O-CG 3.27Å; N22-L26 WeakPolarHBondContact O-CG 3.33Å; N22-L26 PolarHBondContact O-N 2.88Å; M23-L26 PolarHBondContact O-N 2.79Å; I24-L26 VanDerWaalsContact C-N 3.34Å; I24-L26 PolarHBondContact O-N 3.39Å; L26-L29 PolarHBondContact O-N 3.47Å; L26-Q30 WeakPolarHBondContact O-CB 3.43Å; L26-Q30 PolarHBondContact O-N 2.96Å; L26-I88 HydrophobicContact CD1-CG1 4.3Å
27E61.1Low57.5Low5 Ų556.8 Ų56.82%0.02331%0.311CS..Hα-helixtrans-64.5-42.6175.7-101-76.4167.400112.7M23 I24 Q30 T31 R130 F134M23-E27 PolarHBondContact O-N 2.94Å; I24-E27 PolarHBondContact O-N 2.73Å; E27-Q30 PolarHBondContact O-N 3.27Å; E27-T31 WeakPolarHBondContact O-CB 3.37Å; E27-T31 PolarHBondContact O-N 3.49Å; E27-T31 PolarHBondContact O-OG1 3.39Å; E27-R130 VanDerWaalsContact CD-NE 3.32Å; E27-R130 IonicContact OE1-CZ 3.25Å; E27-R130 IonicContact OE1-NE 3Å; E27-R130 PolarHBondContact OE1-NE 3.22Å; E27-R130 IonicContact OE1-NH2 2.69Å; E27-R130 IonicContact OE2-CZ 3.27Å; E27-R130 VanDerWaalsContact OE2-CZ 3.25Å; E27-R130 IonicContact OE2-NE 2.85Å; E27-R130 PolarHBondContact OE2-NE 3.02Å; E27-R130 IonicContact OE2-NH2 3.76Å; E27-R130 PolarHBondContact OE2-NH2 3.17Å; E27-F134 HydrophobicContact CB-CD1 4.17Å; E27-F134 HydrophobicContact CB-CE1 4.15Å; E27-F134 HydrophobicContact CG-CD1 3.77Å; E27-F134 HydrophobicContact CG-CD2 4.06Å; E27-F134 HydrophobicContact CG-CE1 3.76Å; E27-F134 HydrophobicContact CG-CE2 4.08Å; E27-F134 HydrophobicContact CG-CG 3.9Å; E27-F134 HydrophobicContact CG-CZ 3.91Å
28A61.5Low57.1Low46 Ų4657.4 Ų57.438%0.3831%0.312SS..Hα-helixtrans-65.5-43176.500000111.8I24 T31 W32 F131I24-A28 VanDerWaalsContact O-CB 3.26Å; I24-A28 WeakPolarHBondContact O-CB 3.13Å; I24-A28 PolarHBondContact O-N 3Å; A28-T31 PolarHBondContact O-N 2.92Å; A28-W32 WeakPolarHBondContact O-CB 3.46Å; A28-W32 PolarHBondContact O-N 3.47Å; A28-F131 HydrophobicContact CB-CE2 4.42Å
29L56.6Low57Low106 Ų10654.4 Ų54.456%0.55530%0.299SS*.Hα-helixtrans-68.3-37.5176.8-166.4151.9000111.3C25 L26 W32 Y33C25-L29 WeakPolarHBondContact O-CB 3.27Å; C25-L29 PolarHBondContact O-N 3.31Å; L26-L29 PolarHBondContact O-N 3.47Å; L29-W32 PolarHBondContact O-N 3.23Å; L29-Y33 VanDerWaalsContact O-CB 3.28Å; L29-Y33 WeakPolarHBondContact O-CB 3.25Å; L29-Y33 PolarHBondContact O-N 2.97Å
30Q60Low56.7Low22 Ų2252.8 Ų52.810%0.10329%0.294CS..Hα-helixtrans-62.9-42171.3-175.2176.8-71.700111.4L26 E27 Y33 Q34L26-Q30 WeakPolarHBondContact O-CB 3.43Å; L26-Q30 PolarHBondContact O-N 2.96Å; E27-Q30 PolarHBondContact O-N 3.27Å; Q30-Y33 PolarHBondContact O-N 3.37Å; Q30-Q34 WeakPolarHBondContact O-CB 3.35Å; Q30-Q34 VanDerWaalsContact O-CG 3.25Å; Q30-Q34 WeakPolarHBondContact O-CG 3.48Å; Q30-Q34 PolarHBondContact O-N 3.03Å
31T61.3Low56.2Low37 Ų3752.6 Ų52.623%0.22729%0.293CS..Hα-helixtrans-68.8-38.5178.3-58.10000112E27 A28 Q34 S35 Q127 R130E27-T31 WeakPolarHBondContact O-CB 3.37Å; E27-T31 PolarHBondContact O-N 3.49Å; E27-T31 PolarHBondContact O-OG1 3.39Å; A28-T31 PolarHBondContact O-N 2.92Å; T31-Q34 PolarHBondContact O-N 2.99Å; T31-S35 PolarHBondContact O-N 3.48Å; T31-Q127 HydrophobicContact CG2-CB 4.21Å; T31-R130 PolarHBondContact OG1-NH2 3.34Å; T31-R130 VanDerWaalsContact OG1-NH2 3.1Å
32W56.6Low55.6Low166 Ų16655.5 Ų55.563%0.62930%0.299SS*.Hα-helixtrans-64.8-45.1170.9177.283.4000111.9A28 L29 Q34 S35 V36A28-W32 WeakPolarHBondContact O-CB 3.46Å; A28-W32 PolarHBondContact O-N 3.47Å; L29-W32 PolarHBondContact O-N 3.23Å; W32-Q34 VanDerWaalsContact C-N 3.27Å; W32-Q34 PolarHBondContact O-N 3.07Å; W32-S35 PolarHBondContact O-N 3.09Å; W32-S35 PolarHBondContact O-OG 3.39Å; W32-V36 HydrophobicContact CD2-CG2 4.2Å; W32-V36 HydrophobicContact CH2-CG2 4.41Å; W32-V36 HydrophobicContact CZ2-CG2 3.93Å; W32-V36 WeakPolarHBondContact O-CG2 3.43Å; W32-V36 PolarHBondContact O-N 2.82Å
33Y51.3Low55Low59 Ų5957.5 Ų57.523%0.23130%0.303CS..Hα-helixtrans-60.3-40.3175.6-176-97.6000111.2L29 Q30 V36 Y37 M95 D98 V99L29-Y33 VanDerWaalsContact O-CB 3.28Å; L29-Y33 WeakPolarHBondContact O-CB 3.25Å; L29-Y33 PolarHBondContact O-N 2.97Å; Q30-Y33 PolarHBondContact O-N 3.37Å; Y33-V36 PolarHBondContact O-N 2.8Å; Y33-Y37 VanDerWaalsContact O-CB 3.25Å; Y33-Y37 WeakPolarHBondContact O-CB 3.2Å; Y33-Y37 PolarHBondContact O-N 2.88Å; Y33-M95 HydrophobicContact CE1-CG 4.43Å; Y33-D98 HydrophobicContact CE1-CB 4.11Å; Y33-V99 WeakPolarHBondContact OH-CG2 3.46Å
34Q56.8Low54.1Low8 Ų859.6 Ų59.64%0.03731%0.31CS..Hα-helixtrans-70-34.2177.3-75-174-31.700113.5Q30 T31 W32 Y37 L38 K94Q30-Q34 WeakPolarHBondContact O-CB 3.35Å; Q30-Q34 VanDerWaalsContact O-CG 3.25Å; Q30-Q34 WeakPolarHBondContact O-CG 3.48Å; Q30-Q34 PolarHBondContact O-N 3.03Å; T31-Q34 PolarHBondContact O-N 2.99Å; W32-Q34 VanDerWaalsContact C-N 3.27Å; W32-Q34 PolarHBondContact O-N 3.07Å; Q34-Y37 PolarHBondContact O-N 3.44Å; Q34-L38 WeakPolarHBondContact O-CB 2.96Å; Q34-L38 VanDerWaalsContact O-CG 3.27Å; Q34-L38 WeakPolarHBondContact O-CG 3.23Å; Q34-L38 PolarHBondContact O-N 3.25Å; Q34-K94 VanDerWaalsContact NE2-CE 3.31Å
35S53.4Low53.3Low70 Ų7059 Ų5949%0.4931%0.307SS..Hα-helixtrans-71.1-38.217468.40000112T31 W32 L38 G39T31-S35 PolarHBondContact O-N 3.48Å; W32-S35 PolarHBondContact O-N 3.09Å; W32-S35 PolarHBondContact O-OG 3.39Å; S35-L38 PolarHBondContact O-N 3.06Å; S35-G39 PolarHBondContact O-N 3.15Å
36V49.5Very low52.6Low67 Ų6760.2 Ų60.241%0.40630%0.304SS..Hα-helixtrans-64.5-42.6170.9174.50000111.2W32 Y33 G39 S40W32-V36 HydrophobicContact CD2-CG2 4.2Å; W32-V36 HydrophobicContact CH2-CG2 4.41Å; W32-V36 HydrophobicContact CZ2-CG2 3.93Å; W32-V36 WeakPolarHBondContact O-CG2 3.43Å; W32-V36 PolarHBondContact O-N 2.82Å; Y33-V36 PolarHBondContact O-N 2.8Å; V36-G39 PolarHBondContact O-N 3.47Å; V36-S40 WeakPolarHBondContact O-CB 3.39Å; V36-S40 PolarHBondContact O-N 2.95Å; V36-S40 PolarHBondContact O-OG 3.39Å
37Y49Very low52.2Low11 Ų1158.1 Ų58.14%0.04330%0.295CS..Hα-helixtrans-61.5-43.9174.5173.5-90.6000112.1Y33 Q34 S40 A41 D98 F102Y33-Y37 VanDerWaalsContact O-CB 3.25Å; Y33-Y37 WeakPolarHBondContact O-CB 3.2Å; Y33-Y37 PolarHBondContact O-N 2.88Å; Q34-Y37 PolarHBondContact O-N 3.44Å; Y37-S40 PolarHBondContact O-N 3.34Å; Y37-S40 PolarHBondContact O-OG 2.9Å; Y37-S40 VanDerWaalsContact O-OG 3.12Å; Y37-A41 WeakPolarHBondContact O-CB 3.27Å; Y37-A41 PolarHBondContact O-N 2.95Å; Y37-D98 WeakPolarHBondContact CE2-O 3.33Å; Y37-F102 HydrophobicContact CD2-CB 4.21Å; Y37-F102 HydrophobicContact CE2-CB 3.91Å
38L51.4Low51.6Low38 Ų3862.7 Ų62.720%0.19932%0.316CS..Hα-helixtrans-65.6-39.3176-74.8164.6000111.6Q34 S35 Y42 N123Q34-L38 WeakPolarHBondContact O-CB 2.96Å; Q34-L38 VanDerWaalsContact O-CG 3.27Å; Q34-L38 WeakPolarHBondContact O-CG 3.23Å; Q34-L38 PolarHBondContact O-N 3.25Å; S35-L38 PolarHBondContact O-N 3.06Å; L38-Y42 VanDerWaalsContact O-CB 3.25Å; L38-Y42 WeakPolarHBondContact O-CB 3.39Å; L38-Y42 PolarHBondContact O-N 3.46Å; L38-N123 HydrophobicContact CD1-CB 3.53Å
39G51.1Low51.3Low37 Ų3764.5 Ų64.538%0.38133%0.326SS..Hα-helixtrans-65.1-39.4174.400000113.4S35 V36 Y42 F43S35-G39 PolarHBondContact O-N 3.15Å; V36-G39 PolarHBondContact O-N 3.47Å; G39-Y42 WeakPolarHBondContact O-CB 3.21Å; G39-F43 WeakPolarHBondContact O-CD2 3.49Å; G39-F43 PolarHBondContact O-N 2.7Å
40S49.3Very low51Low34 Ų3467.4 Ų67.424%0.23833%0.334CS..Hα-helixtrans-78.4-37.5178.567.10000112.4V36 Y37 Y42 F43 Y44 F102V36-S40 WeakPolarHBondContact O-CB 3.39Å; V36-S40 PolarHBondContact O-N 2.95Å; V36-S40 PolarHBondContact O-OG 3.39Å; Y37-S40 PolarHBondContact O-N 3.34Å; Y37-S40 PolarHBondContact O-OG 2.9Å; Y37-S40 VanDerWaalsContact O-OG 3.12Å; S40-Y42 VanDerWaalsContact C-N 3.34Å; S40-F43 PolarHBondContact O-N 3.42Å; S40-Y44 PolarHBondContact O-N 3.44Å; S40-Y44 VanDerWaalsContact O-N 3.15Å; S40-F102 VanDerWaalsContact OG-CE2 3.27Å; S40-F102 WeakPolarHBondContact OG-CE2 3.4Å
41A49.3Very low50.5Low4 Ų468.6 Ų68.63%0.03334%0.343CS..Hα-helixtrans-59.3-44.2168.500000110.7Y37 F43 Y44 M45Y37-A41 WeakPolarHBondContact O-CB 3.27Å; Y37-A41 PolarHBondContact O-N 2.95Å; A41-F43 VanDerWaalsContact C-N 3.27Å; A41-F43 PolarHBondContact O-N 2.85Å; A41-Y44 CarbonylContact O-C 3.43Å; A41-Y44 WeakPolarHBondContact O-CA 3.25Å; A41-Y44 PolarHBondContact O-N 3.3Å; A41-M45 WeakPolarHBondContact O-CA 3.12Å; A41-M45 VanDerWaalsContact O-CB 3.23Å; A41-M45 WeakPolarHBondContact O-CB 3.27Å; A41-M45 WeakPolarHBondContact O-CG 3.48Å; A41-M45 PolarHBondContact O-N 3.01Å
42Y47.1Very low50Low143 Ų14368.1 Ų68.156%0.56134%0.337SS*.Hα-helixtrans-52.4-42.6173.1169.4-87000112.6L38 G39 S40 Y44 I116L38-Y42 VanDerWaalsContact O-CB 3.25Å; L38-Y42 WeakPolarHBondContact O-CB 3.39Å; L38-Y42 PolarHBondContact O-N 3.46Å; G39-Y42 WeakPolarHBondContact O-CB 3.21Å; S40-Y42 VanDerWaalsContact C-N 3.34Å; Y42-Y44 VanDerWaalsContact C-N 3.31Å; Y42-Y44 PolarHBondContact O-N 2.82Å; Y42-I116 HydrophobicContact CD2-CG2 3.68Å; Y42-I116 HydrophobicContact CE2-CG2 4.41Å
43F44.6Very low49.8Very low144 Ų14466 Ų6663%0.63234%0.338SS*.Hα-helixtrans-67.4-28.4175-92-80.2000113.9G39 S40 A41 K46G39-F43 WeakPolarHBondContact O-CD2 3.49Å; G39-F43 PolarHBondContact O-N 2.7Å; S40-F43 PolarHBondContact O-N 3.42Å; A41-F43 VanDerWaalsContact C-N 3.27Å; A41-F43 PolarHBondContact O-N 2.85Å; F43-K46 WeakPolarHBondContact O-CE 3.12Å; F43-K46 PolarHBondContact O-NZ 3.25Å
44Y41.3Very low49.7Very low67 Ų6766.4 Ų66.426%0.26335%0.349SS..Hα-helixtrans-101.7-11.2-175.8-102.1-79.9000116S40 A41 Y42 K46 Y52 I105 Y106S40-Y44 PolarHBondContact O-N 3.44Å; S40-Y44 VanDerWaalsContact O-N 3.15Å; A41-Y44 CarbonylContact O-C 3.43Å; A41-Y44 WeakPolarHBondContact O-CA 3.25Å; A41-Y44 PolarHBondContact O-N 3.3Å; Y42-Y44 VanDerWaalsContact C-N 3.31Å; Y42-Y44 PolarHBondContact O-N 2.82Å; Y44-K46 PolarHBondContact O-N 3.5Å; Y44-Y52 PolarHBondContact O-OH 3.42Å; Y44-I105 VanDerWaalsContact CB-CG2 3.41Å; Y44-I105 HydrophobicContact CD1-CG2 4.47Å; Y44-I105 HydrophobicContact CG-CG2 4.14Å; Y44-Y106 HydrophobicContact CD2-CD2 4.42Å; Y44-Y106 HydrophobicContact CE1-CD2 4.03Å; Y44-Y106 HydrophobicContact CE1-CE2 4.5Å; Y44-Y106 HydrophobicContact CE1-CG 4.09Å; Y44-Y106 WeakPolarHBondContact CE1-O 3.27Å; Y44-Y106 AromaticContact CE2-CD2 3.58Å; Y44-Y106 HydrophobicContact CE2-CD2 3.58Å; Y44-Y106 AromaticContact CE2-CE2 3.86Å; Y44-Y106 HydrophobicContact CE2-CE2 3.86Å; Y44-Y106 HydrophobicContact CE2-CG 4.41Å; Y44-Y106 AromaticContact CZ-CD2 3.35Å; Y44-Y106 AromaticContact CZ-CE2 3.54Å; Y44-Y106 AromaticContact CZ-CG 3.88Å; Y44-Y106 VanDerWaalsContact OH-CD2 3.29Å; Y44-Y106 WeakPolarHBondContact OH-CD2 3.41Å; Y44-Y106 WeakPolarHBondContact OH-CE2 3.47Å; Y44-Y106 VanDerWaalsContact OH-CZ 3.27Å
45M47.6Very low49.5Very low23 Ų2366.8 Ų66.811%0.11335%0.351CS..  trans-60.514-170.1-93.3-103.6-141.700116.6A41 T47 Y52 I116 L119A41-M45 WeakPolarHBondContact O-CA 3.12Å; A41-M45 VanDerWaalsContact O-CB 3.23Å; A41-M45 WeakPolarHBondContact O-CB 3.27Å; A41-M45 WeakPolarHBondContact O-CG 3.48Å; A41-M45 PolarHBondContact O-N 3.01Å; M45-T47 VanDerWaalsContact C-N 3.3Å; M45-T47 PolarHBondContact O-N 2.78Å; M45-Y52 WeakPolarHBondContact CA-OH 3.13Å; M45-Y52 HydrophobicContact CE-CD1 4.37Å; M45-Y52 HydrophobicContact CG-CD1 4.35Å; M45-Y52 HydrophobicContact CG-CE1 3.84Å; M45-Y52 HydrophobicContact SD-CD1 3.53Å; M45-Y52 VanDerWaalsContact SD-CD1 3.53Å; M45-Y52 HydrophobicContact SD-CD2 4.27Å; M45-Y52 HydrophobicContact SD-CE1 3.62Å; M45-Y52 HydrophobicContact SD-CE2 4.38Å; M45-Y52 HydrophobicContact SD-CG 3.9Å; M45-I116 HydrophobicContact CB-CD1 3.45Å; M45-I116 VanDerWaalsContact CB-CD1 3.45Å; M45-I116 HydrophobicContact CB-CG1 4.05Å; M45-I116 HydrophobicContact CE-CB 4.43Å; M45-I116 HydrophobicContact CE-CG1 4.12Å; M45-I116 HydrophobicContact CE-CG2 4.04Å; M45-I116 HydrophobicContact CG-CD1 4.12Å; M45-I116 HydrophobicContact CG-CG1 4.23Å; M45-I116 HydrophobicContact SD-CD1 4.33Å; M45-I116 HydrophobicContact SD-CG1 3.85Å; M45-L119 HydrophobicContact CE-CD2 4.13Å
46K46.4Very low49.7Very low96 Ų9665.9 Ų65.942%0.41734%0.343SS..SBendtrans-77.9-5.9-163.9-65.1163.4-177.5159.10112.8F43 Y44 S110 S111 K112F43-K46 WeakPolarHBondContact O-CE 3.12Å; F43-K46 PolarHBondContact O-NZ 3.25Å; Y44-K46 PolarHBondContact O-N 3.5Å; K46-S110 CarbonylContact O-C 2.66Å; K46-S111 CarbonylContact O-C 2.85Å; K46-S111 WeakPolarHBondContact O-CA 3.42Å; K46-S111 PolarHBondContact O-N 2.93Å; K46-K112 PolarHBondContact O-N 3.01Å
47T51.1Low49.7Very low37 Ų3770.5 Ų70.523%0.22735%0.354CS..SBendtrans-116.9-94.8-170.7-13.60000114.4M45 S49 V108 G109 S110M45-T47 VanDerWaalsContact C-N 3.3Å; M45-T47 PolarHBondContact O-N 2.78Å; T47-S49 PolarHBondContact O-N 2.87Å; T47-V108 WeakPolarHBondContact CB-O 3.32Å; T47-V108 HydrophobicContact CG2-CG1 3.91Å; T47-V108 WeakPolarHBondContact CG2-O 3.47Å; T47-V108 PolarHBondContact OG1-O 3.02Å; T47-G109 VanDerWaalsContact OG1-C 3.32Å; T47-G109 WeakPolarHBondContact OG1-CA 3.35Å; T47-G109 PolarHBondContact OG1-N 2.85Å; T47-S110 WeakPolarHBondContact CG2-O 3.48Å; T47-S110 PolarHBondContact OG1-N 3.06Å
48E48.1Very low49.8Very low101 Ų10173 Ų7347%0.47237%0.367SS..  trans-107.297.6-147.7-74.8-176.6178.600110.8F50 V51 Y52 V108E48-F50 PolarHBondContact O-N 3.37Å; E48-F50 VanDerWaalsContact O-N 3.09Å; E48-V51 HydrophobicContact CB-CG2 4.13Å; E48-V51 PolarHBondContact O-N 2.9Å; E48-V51 VanDerWaalsContact O-N 3.07Å; E48-Y52 WeakPolarHBondContact O-CD2 3.23Å; E48-Y52 PolarHBondContact O-N 3.13Å; E48-V108 HydrophobicContact CB-CG1 4.38Å; E48-V108 HydrophobicContact CG-CG1 3.89Å
49S56.6Low50.3Low84 Ų8472.2 Ų72.259%0.58736%0.363SS*.Hα-helixtrans-51.1-33.2-177.150.50000114.8T47 Y52 L53T47-S49 PolarHBondContact O-N 2.87Å; S49-Y52 PolarHBondContact O-N 3.07Å; S49-L53 PolarHBondContact O-N 2.94Å
50F50.5Low50.5Low167 Ų16775.6 Ų75.673%0.73237%0.367SS*.Hα-helixtrans-70.1-38.1179-95.5-82.2000113.7E48 L53 S54E48-F50 PolarHBondContact O-N 3.37Å; E48-F50 VanDerWaalsContact O-N 3.09Å; F50-L53 PolarHBondContact O-N 3.49Å; F50-S54 PolarHBondContact O-N 3.33Å; F50-S54 PolarHBondContact O-OG 2.87Å; F50-S54 VanDerWaalsContact O-OG 3.13Å
51V49.5Very low50.5Low47 Ų4776.3 Ų76.329%0.28537%0.372SS..Hα-helixtrans-63.6-47.4174.3-179.30000108.4E48 L53 S54 L55E48-V51 HydrophobicContact CB-CG2 4.13Å; E48-V51 PolarHBondContact O-N 2.9Å; E48-V51 VanDerWaalsContact O-N 3.07Å; V51-L53 PolarHBondContact O-N 3.19Å; V51-S54 WeakPolarHBondContact O-CB 3.48Å; V51-S54 PolarHBondContact O-N 3.44Å; V51-S54 VanDerWaalsContact O-N 3.07Å; V51-L55 HydrophobicContact CG1-CD1 4.25Å; V51-L55 HydrophobicContact CG1-CG 4.34Å; V51-L55 WeakPolarHBondContact O-CG 3.41Å; V51-L55 PolarHBondContact O-N 3.29Å
52Y50Low50.9Low28 Ų2877 Ų7711%0.1138%0.375CS..Hα-helixtrans-57.9-40.6177.2-68.1-69.4000114Y44 M45 E48 S49 S54 L55 V56 I105Y44-Y52 PolarHBondContact O-OH 3.42Å; M45-Y52 WeakPolarHBondContact CA-OH 3.13Å; M45-Y52 HydrophobicContact CE-CD1 4.37Å; M45-Y52 HydrophobicContact CG-CD1 4.35Å; M45-Y52 HydrophobicContact CG-CE1 3.84Å; M45-Y52 HydrophobicContact SD-CD1 3.53Å; M45-Y52 VanDerWaalsContact SD-CD1 3.53Å; M45-Y52 HydrophobicContact SD-CD2 4.27Å; M45-Y52 HydrophobicContact SD-CE1 3.62Å; M45-Y52 HydrophobicContact SD-CE2 4.38Å; M45-Y52 HydrophobicContact SD-CG 3.9Å; E48-Y52 WeakPolarHBondContact O-CD2 3.23Å; E48-Y52 PolarHBondContact O-N 3.13Å; S49-Y52 PolarHBondContact O-N 3.07Å; Y52-S54 VanDerWaalsContact C-N 3.3Å; Y52-S54 PolarHBondContact O-N 2.9Å; Y52-L55 HydrophobicContact CD1-CD1 4.38Å; Y52-L55 WeakPolarHBondContact O-CB 3.34Å; Y52-L55 PolarHBondContact O-N 2.85Å; Y52-V56 WeakPolarHBondContact O-CG2 3.47Å; Y52-V56 PolarHBondContact O-N 3.42Å; Y52-I105 HydrophobicContact CD1-CD1 4.39Å; Y52-I105 HydrophobicContact CE1-CD1 3.74Å; Y52-I105 HydrophobicContact CE1-CG1 3.67Å; Y52-I105 HydrophobicContact CE1-CG2 4.41Å
53L51.7Low51.5Low122 Ų12272.9 Ų72.964%0.63936%0.36SS*.Hα-helixtrans-61.2-41.7175.8-166.181.6000111.6S49 F50 V51 L55 V56 Y57S49-L53 PolarHBondContact O-N 2.94Å; F50-L53 PolarHBondContact O-N 3.49Å; V51-L53 PolarHBondContact O-N 3.19Å; L53-L55 VanDerWaalsContact C-N 3.33Å; L53-L55 PolarHBondContact O-N 2.84Å; L53-V56 PolarHBondContact O-N 3.37Å; L53-Y57 PolarHBondContact O-N 3.23Å
54S49.5Very low51.9Low66 Ų6672 Ų7246%0.46236%0.356SS..Hα-helixtrans-64.6-38.5176.3-55.60000111.4F50 V51 Y52 Y57 I58F50-S54 PolarHBondContact O-N 3.33Å; F50-S54 PolarHBondContact O-OG 2.87Å; F50-S54 VanDerWaalsContact O-OG 3.13Å; V51-S54 WeakPolarHBondContact O-CB 3.48Å; V51-S54 PolarHBondContact O-N 3.44Å; V51-S54 VanDerWaalsContact O-N 3.07Å; Y52-S54 VanDerWaalsContact C-N 3.3Å; Y52-S54 PolarHBondContact O-N 2.9Å; S54-Y57 PolarHBondContact O-N 3.49Å; S54-I58 WeakPolarHBondContact O-CB 3.33Å; S54-I58 WeakPolarHBondContact O-CD1 3.39Å; S54-I58 WeakPolarHBondContact O-CG1 3.48Å; S54-I58 PolarHBondContact O-N 2.97Å
55L52.4Low52.5Low16 Ų1672.8 Ų72.88%0.08437%0.365CS..Hα-helixtrans-65-43175.3-64.4-175.8000112.6V51 Y52 L53 Y57 I58 Q59 C101 I105V51-L55 HydrophobicContact CG1-CD1 4.25Å; V51-L55 HydrophobicContact CG1-CG 4.34Å; V51-L55 WeakPolarHBondContact O-CG 3.41Å; V51-L55 PolarHBondContact O-N 3.29Å; Y52-L55 HydrophobicContact CD1-CD1 4.38Å; Y52-L55 WeakPolarHBondContact O-CB 3.34Å; Y52-L55 PolarHBondContact O-N 2.85Å; L53-L55 VanDerWaalsContact C-N 3.33Å; L53-L55 PolarHBondContact O-N 2.84Å; L55-Y57 VanDerWaalsContact C-N 3.34Å; L55-I58 PolarHBondContact O-N 3.43Å; L55-Q59 WeakPolarHBondContact O-CB 3.34Å; L55-Q59 WeakPolarHBondContact O-CG 3.21Å; L55-Q59 PolarHBondContact O-N 3.46Å; L55-C101 HydrophobicContact CD1-CB 4.21Å; L55-C101 HydrophobicContact CD2-CB 3.46Å; L55-C101 VanDerWaalsContact CD2-CB 3.46Å; L55-C101 WeakPolarHBondContact CD2-SG 3.37Å; L55-C101 HydrophobicContact CG-CB 4.44Å; L55-I105 HydrophobicContact CD1-CD1 3.36Å; L55-I105 HydrophobicContact CD1-CG1 3.64Å
56V57.1Low53.2Low51 Ų5171.9 Ų71.931%0.30936%0.36SS..Hα-helixtrans-61-44.9173.7173.30000110.7Y52 L53 Q59 F60 L119Y52-V56 WeakPolarHBondContact O-CG2 3.47Å; Y52-V56 PolarHBondContact O-N 3.42Å; L53-V56 PolarHBondContact O-N 3.37Å; V56-Q59 PolarHBondContact O-N 3.07Å; V56-F60 WeakPolarHBondContact O-CB 3.28Å; V56-F60 PolarHBondContact O-N 3.43Å; V56-L119 HydrophobicContact CG1-CD1 4.01Å; V56-L119 HydrophobicContact CG2-CD1 3.65Å; V56-L119 HydrophobicContact CG2-CD2 3.49Å; V56-L119 VanDerWaalsContact CG2-CD2 3.49Å; V56-L119 HydrophobicContact CG2-CG 4.22Å
57Y49.4Very low53.8Low165 Ų16569.5 Ų69.565%0.64736%0.356SS*.Hα-helixtrans-60.3-47.9176.7-174.1-94.5000111.7L53 S54 L55 Q59 F60 S61L53-Y57 PolarHBondContact O-N 3.23Å; S54-Y57 PolarHBondContact O-N 3.49Å; L55-Y57 VanDerWaalsContact C-N 3.34Å; Y57-Q59 PolarHBondContact O-N 3.04Å; Y57-F60 WeakPolarHBondContact O-CB 3.25Å; Y57-F60 PolarHBondContact O-N 3Å; Y57-F60 VanDerWaalsContact O-N 3.16Å; Y57-S61 WeakPolarHBondContact CE1-OG 3.34Å; Y57-S61 PolarHBondContact O-N 2.92Å; Y57-S61 PolarHBondContact O-OG 3.26Å; Y57-S61 VanDerWaalsContact O-OG 3.11Å
58I53Low54Low63 Ų6371.3 Ų71.332%0.32336%0.363SS..Hα-helixtrans-59.1-45.2176.8-72.8164.2000111.3S54 L55 F60 S61 L62 V97S54-I58 WeakPolarHBondContact O-CB 3.33Å; S54-I58 WeakPolarHBondContact O-CD1 3.39Å; S54-I58 WeakPolarHBondContact O-CG1 3.48Å; S54-I58 PolarHBondContact O-N 2.97Å; L55-I58 PolarHBondContact O-N 3.43Å; I58-F60 VanDerWaalsContact C-N 3.3Å; I58-F60 PolarHBondContact O-N 2.88Å; I58-S61 PolarHBondContact O-N 2.83Å; I58-L62 HydrophobicContact CG2-CD1 3.7Å; I58-L62 WeakPolarHBondContact O-CB 3.49Å; I58-L62 WeakPolarHBondContact O-CD1 3.39Å; I58-L62 VanDerWaalsContact O-CG 3.28Å; I58-L62 WeakPolarHBondContact O-CG 3.42Å; I58-L62 PolarHBondContact O-N 3.1Å; I58-V97 HydrophobicContact CG2-CG1 3.42Å; I58-V97 VanDerWaalsContact CG2-CG1 3.42Å
59Q60.7Low54.4Low21 Ų2167.7 Ų67.710%0.09835%0.347CS..Hα-helixtrans-62.1-37.8176.7-76.5-168.4-23.900112.6L55 V56 Y57 F63 K94 D98L55-Q59 WeakPolarHBondContact O-CB 3.34Å; L55-Q59 WeakPolarHBondContact O-CG 3.21Å; L55-Q59 PolarHBondContact O-N 3.46Å; V56-Q59 PolarHBondContact O-N 3.07Å; Y57-Q59 PolarHBondContact O-N 3.04Å; Q59-F63 WeakPolarHBondContact O-CB 3.16Å; Q59-F63 PolarHBondContact O-N 3.19Å; Q59-K94 PolarHBondContact O-NZ 3.5Å; Q59-D98 WeakPolarHBondContact CG-OD1 3.4Å; Q59-D98 PolarHBondContact NE2-OD1 3.48Å
60F55.1Low54.6Low109 Ų10965 Ų6548%0.47833%0.325SS..Hα-helixtrans-70.3-44.7176.6-161-89.5000112.2V56 Y57 I58 L62 F63 F64V56-F60 WeakPolarHBondContact O-CB 3.28Å; V56-F60 PolarHBondContact O-N 3.43Å; Y57-F60 WeakPolarHBondContact O-CB 3.25Å; Y57-F60 PolarHBondContact O-N 3Å; Y57-F60 VanDerWaalsContact O-N 3.16Å; I58-F60 VanDerWaalsContact C-N 3.3Å; I58-F60 PolarHBondContact O-N 2.88Å; F60-L62 VanDerWaalsContact C-N 3.34Å; F60-L62 PolarHBondContact O-N 2.92Å; F60-F63 WeakPolarHBondContact O-CB 3.26Å; F60-F63 PolarHBondContact O-N 2.87Å; F60-F64 PolarHBondContact O-N 2.88Å
61S49.4Very low54.9Low49 Ų4960.3 Ų60.334%0.34331%0.31SS..Hα-helixtrans-59-44.4173.3-610000111.6Y57 I58 F63 F64 L65Y57-S61 WeakPolarHBondContact CE1-OG 3.34Å; Y57-S61 PolarHBondContact O-N 2.92Å; Y57-S61 PolarHBondContact O-OG 3.26Å; Y57-S61 VanDerWaalsContact O-OG 3.11Å; I58-S61 PolarHBondContact O-N 2.83Å; S61-F63 PolarHBondContact O-N 3.3Å; S61-F64 PolarHBondContact O-N 3.19Å; S61-L65 WeakPolarHBondContact O-CB 3.35Å; S61-L65 PolarHBondContact O-N 3.11Å
62L57.3Low54.9Low17 Ų1761.5 Ų61.59%0.08932%0.315CS..Hα-helixtrans-65.1-37.4176.6-73.3162.8000112I58 F60 L65 T66 I93 K94 V97I58-L62 HydrophobicContact CG2-CD1 3.7Å; I58-L62 WeakPolarHBondContact O-CB 3.49Å; I58-L62 WeakPolarHBondContact O-CD1 3.39Å; I58-L62 VanDerWaalsContact O-CG 3.28Å; I58-L62 WeakPolarHBondContact O-CG 3.42Å; I58-L62 PolarHBondContact O-N 3.1Å; F60-L62 VanDerWaalsContact C-N 3.34Å; F60-L62 PolarHBondContact O-N 2.92Å; L62-L65 PolarHBondContact O-N 3.4Å; L62-T66 WeakPolarHBondContact O-CG2 2.95Å; L62-T66 PolarHBondContact O-N 2.98Å; L62-T66 PolarHBondContact O-OG1 3.39Å; L62-T66 VanDerWaalsContact O-OG1 3.08Å; L62-I93 HydrophobicContact CD2-CG2 4.46Å; L62-K94 HydrophobicContact CB-CB 4.45Å; L62-K94 HydrophobicContact CB-CD 4.14Å; L62-K94 HydrophobicContact CB-CG 4.01Å; L62-K94 HydrophobicContact CD1-CB 4.39Å; L62-K94 HydrophobicContact CD1-CG 4.14Å; L62-K94 HydrophobicContact CD2-CB 4.27Å; L62-V97 HydrophobicContact CD1-CB 4.02Å; L62-V97 HydrophobicContact CD1-CG1 3.82Å; L62-V97 HydrophobicContact CD1-CG2 4.48Å
63F59.8Low55Low57 Ų5761.6 Ų61.625%0.2532%0.315CS..Hα-helixtrans-63.2-41.9173.3166.6-92.3000112.2Q59 F60 S61 T66 S67 I126 R130Q59-F63 WeakPolarHBondContact O-CB 3.16Å; Q59-F63 PolarHBondContact O-N 3.19Å; F60-F63 WeakPolarHBondContact O-CB 3.26Å; F60-F63 PolarHBondContact O-N 2.87Å; S61-F63 PolarHBondContact O-N 3.3Å; F63-T66 PolarHBondContact O-OG1 3.39Å; F63-S67 WeakPolarHBondContact O-CB 3.38Å; F63-S67 PolarHBondContact O-N 2.83Å; F63-S67 VanDerWaalsContact O-N 3.07Å; F63-S67 PolarHBondContact O-OG 3.48Å; F63-I126 HydrophobicContact CE2-CG2 4.38Å; F63-R130 HydrophobicContact CE2-CB 4.29Å; F63-R130 HydrophobicContact CE2-CG 3.95Å
64F53.9Low54.8Low126 Ų12658.7 Ų58.755%0.55330%0.297SS*.Hα-helixtrans-65.9-42.6176.7-152.9-100.8000111.1F60 S61 S67 I68F60-F64 PolarHBondContact O-N 2.88Å; S61-F64 PolarHBondContact O-N 3.19Å; F64-S67 PolarHBondContact O-N 2.85Å; F64-I68 HydrophobicContact CD1-CD1 3.61Å; F64-I68 HydrophobicContact CD1-CG1 4.38Å; F64-I68 HydrophobicContact CE1-CD1 3.71Å; F64-I68 HydrophobicContact CE1-CG1 4.44Å; F64-I68 WeakPolarHBondContact O-CG1 3.06Å; F64-I68 PolarHBondContact O-N 3.43Å
65L54.1Low54.8Low84 Ų8461.9 Ų61.944%0.4431%0.308SS..Hα-helixtrans-61.7-48.8176.8-16776.8000112.2S61 L62 S67 I68 L69 T90S61-L65 WeakPolarHBondContact O-CB 3.35Å; S61-L65 PolarHBondContact O-N 3.11Å; L62-L65 PolarHBondContact O-N 3.4Å; L65-S67 VanDerWaalsContact C-N 3.29Å; L65-S67 PolarHBondContact O-N 3.47Å; L65-I68 PolarHBondContact O-N 2.84Å; L65-L69 HydrophobicContact CG-CD1 4.38Å; L65-L69 WeakPolarHBondContact O-CG 3.46Å; L65-L69 PolarHBondContact O-N 3.4Å; L65-T90 HydrophobicContact CD2-CG2 3.65Å; L65-T90 HydrophobicContact CG-CG2 4.17Å
66T63Low54.6Low4 Ų463.7 Ų63.73%0.02532%0.322CS..Hα-helixtrans-62-38.1177.351.30000111.8L62 F63 L69 I70 T90 N91 K94L62-T66 WeakPolarHBondContact O-CG2 2.95Å; L62-T66 PolarHBondContact O-N 2.98Å; L62-T66 PolarHBondContact O-OG1 3.39Å; L62-T66 VanDerWaalsContact O-OG1 3.08Å; F63-T66 PolarHBondContact O-OG1 3.39Å; T66-L69 PolarHBondContact O-N 2.91Å; T66-I70 WeakPolarHBondContact O-CD1 3.29Å; T66-I70 WeakPolarHBondContact O-CG1 3.48Å; T66-I70 PolarHBondContact O-N 3.35Å; T66-T90 HydrophobicContact CG2-CG2 3.86Å; T66-N91 WeakPolarHBondContact CG2-OD1 3.24Å; T66-K94 HydrophobicContact CG2-CD 4.26Å
67S58Low54.3Low45 Ų4564.7 Ų64.732%0.31532%0.32SS..Hα-helixtrans-64.3-44.1177.5-56.90000112.1F63 F64 L65 L69 I70 V71F63-S67 WeakPolarHBondContact O-CB 3.38Å; F63-S67 PolarHBondContact O-N 2.83Å; F63-S67 VanDerWaalsContact O-N 3.07Å; F63-S67 PolarHBondContact O-OG 3.48Å; F64-S67 PolarHBondContact O-N 2.85Å; L65-S67 VanDerWaalsContact C-N 3.29Å; L65-S67 PolarHBondContact O-N 3.47Å; S67-L69 VanDerWaalsContact C-N 3.34Å; S67-L69 PolarHBondContact O-N 2.88Å; S67-I70 PolarHBondContact O-N 3.33Å; S67-V71 WeakPolarHBondContact O-CG2 3.23Å; S67-V71 PolarHBondContact O-N 2.9Å
68I55.2Low54.2Low76 Ų7664.3 Ų64.339%0.3933%0.33SS..Hα-helixtrans-60.7-43.6175-71.4167.7000110.9F64 L65 I70 V71 I72F64-I68 HydrophobicContact CD1-CD1 3.61Å; F64-I68 HydrophobicContact CD1-CG1 4.38Å; F64-I68 HydrophobicContact CE1-CD1 3.71Å; F64-I68 HydrophobicContact CE1-CG1 4.44Å; F64-I68 WeakPolarHBondContact O-CG1 3.06Å; F64-I68 PolarHBondContact O-N 3.43Å; L65-I68 PolarHBondContact O-N 2.84Å; I68-I70 PolarHBondContact O-N 3.14Å; I68-V71 WeakPolarHBondContact O-CB 3.41Å; I68-V71 PolarHBondContact O-N 3.39Å; I68-V71 VanDerWaalsContact O-N 3.14Å; I68-I72 HydrophobicContact CG2-CD1 3.68Å; I68-I72 HydrophobicContact CG2-CG1 4.3Å; I68-I72 WeakPolarHBondContact O-CG1 3.37Å; I68-I72 PolarHBondContact O-N 2.87Å
69L57.5Low53.8Low25 Ų2562.2 Ų62.213%0.13132%0.323CS..Hα-helixtrans-67.4-34.2-178.2-69.7172.5000113.2L65 T66 S67 V71 I72 Y73 I86 T90L65-L69 HydrophobicContact CG-CD1 4.38Å; L65-L69 WeakPolarHBondContact O-CG 3.46Å; L65-L69 PolarHBondContact O-N 3.4Å; T66-L69 PolarHBondContact O-N 2.91Å; S67-L69 VanDerWaalsContact C-N 3.34Å; S67-L69 PolarHBondContact O-N 2.88Å; L69-V71 VanDerWaalsContact C-N 3.33Å; L69-I72 HydrophobicContact CD2-CD1 4.41Å; L69-I72 PolarHBondContact O-N 3.36Å; L69-Y73 WeakPolarHBondContact O-CB 3.28Å; L69-Y73 PolarHBondContact O-N 2.95Å; L69-I86 HydrophobicContact CD1-CG2 3.96Å; L69-I86 HydrophobicContact CD2-CG2 3.61Å; L69-I86 HydrophobicContact CG-CG2 4.29Å; L69-T90 HydrophobicContact CD1-CG2 3.64Å; L69-T90 WeakPolarHBondContact CD1-OG1 3.49Å
70I60.3Low53.3Low26 Ų2664.5 Ų64.513%0.13334%0.339CS..Hα-helixtrans-65.6-37171.6-67.6160.9000111T66 S67 I68 Y73 F74 T87 F134T66-I70 WeakPolarHBondContact O-CD1 3.29Å; T66-I70 WeakPolarHBondContact O-CG1 3.48Å; T66-I70 PolarHBondContact O-N 3.35Å; S67-I70 PolarHBondContact O-N 3.33Å; I68-I70 PolarHBondContact O-N 3.14Å; I70-Y73 WeakPolarHBondContact O-CB 3.44Å; I70-Y73 PolarHBondContact O-N 3.35Å; I70-F74 WeakPolarHBondContact O-CD2 3.27Å; I70-F74 PolarHBondContact O-N 3.31Å; I70-T87 HydrophobicContact CG1-CG2 4.32Å; I70-F134 HydrophobicContact CD1-CD2 4.12Å; I70-F134 HydrophobicContact CD1-CE2 3.86Å; I70-F134 HydrophobicContact CG1-CE2 4.48Å
71V55.4Low53.1Low69 Ų6967.1 Ų67.142%0.41835%0.353SS..Hα-helixtrans-65.9-44.1172.7173.70000111S67 I68 L69 Y73 F74 I75S67-V71 WeakPolarHBondContact O-CG2 3.23Å; S67-V71 PolarHBondContact O-N 2.9Å; I68-V71 WeakPolarHBondContact O-CB 3.41Å; I68-V71 PolarHBondContact O-N 3.39Å; I68-V71 VanDerWaalsContact O-N 3.14Å; L69-V71 VanDerWaalsContact C-N 3.33Å; V71-Y73 VanDerWaalsContact C-N 3.3Å; V71-Y73 PolarHBondContact O-N 2.91Å; V71-F74 PolarHBondContact O-N 3.48Å; V71-I75 HydrophobicContact CG1-CD1 3.93Å; V71-I75 WeakPolarHBondContact O-CG1 3.26Å; V71-I75 PolarHBondContact O-N 3.18Å; V71-I75 VanDerWaalsContact O-N 3.1Å
72I51.4Low53Low73 Ų7374.8 Ų74.837%0.37437%0.374SS..Hα-helixtrans-64.2-35.2176.8-64.6170.2000111.2I68 L69 F74 I75 S76 L83I68-I72 HydrophobicContact CG2-CD1 3.68Å; I68-I72 HydrophobicContact CG2-CG1 4.3Å; I68-I72 WeakPolarHBondContact O-CG1 3.37Å; I68-I72 PolarHBondContact O-N 2.87Å; L69-I72 HydrophobicContact CD2-CD1 4.41Å; L69-I72 PolarHBondContact O-N 3.36Å; I72-F74 VanDerWaalsContact C-N 3.28Å; I72-F74 PolarHBondContact O-N 3.42Å; I72-I75 PolarHBondContact O-N 2.99Å; I72-S76 WeakPolarHBondContact O-CB 3.45Å; I72-S76 PolarHBondContact O-N 3.16Å; I72-L83 HydrophobicContact CB-CD2 4.19Å; I72-L83 HydrophobicContact CG2-CD1 3.81Å; I72-L83 HydrophobicContact CG2-CD2 3.74Å; I72-L83 HydrophobicContact CG2-CG 4.42Å
73Y50.5Low52.7Low30 Ų3074.5 Ų74.512%0.11837%0.372CS..Hα-helixtrans-54.5-43.3174.3176.1-83.9000111.7M23 L69 I70 V71 L83 N84M23-Y73 HydrophobicContact CE-CD1 4.41Å; M23-Y73 HydrophobicContact CE-CD2 4.15Å; M23-Y73 HydrophobicContact CE-CE1 4Å; M23-Y73 HydrophobicContact CE-CE2 3.76Å; M23-Y73 HydrophobicContact CE-CG 4.5Å; L69-Y73 WeakPolarHBondContact O-CB 3.28Å; L69-Y73 PolarHBondContact O-N 2.95Å; I70-Y73 WeakPolarHBondContact O-CB 3.44Å; I70-Y73 PolarHBondContact O-N 3.35Å; V71-Y73 VanDerWaalsContact C-N 3.3Å; V71-Y73 PolarHBondContact O-N 2.91Å; Y73-L83 HydrophobicContact CD2-CB 3.64Å; Y73-L83 HydrophobicContact CE2-CB 4.49Å; Y73-L83 HydrophobicContact CG-CB 4.26Å; Y73-N84 HydrophobicContact CE2-CB 4.21Å; Y73-N84 VanDerWaalsContact CE2-CG 3.5Å; Y73-N84 WeakPolarHBondContact CE2-ND2 3.2Å; Y73-N84 PolarHBondContact OH-ND2 2.96Å; Y73-N84 VanDerWaalsContact OH-ND2 3.12Å
74F48.1Very low52.5Low60 Ų6072.9 Ų72.926%0.26337%0.367SS..Hα-helixtrans-77.3-33.7177.5-81.7-67.4000114.3I70 V71 I72 S76I70-F74 WeakPolarHBondContact O-CD2 3.27Å; I70-F74 PolarHBondContact O-N 3.31Å; V71-F74 PolarHBondContact O-N 3.48Å; I72-F74 VanDerWaalsContact C-N 3.28Å; I72-F74 PolarHBondContact O-N 3.42Å; F74-S76 VanDerWaalsContact C-N 3.34Å
75I50.4Low52.4Low134 Ų13471.2 Ų71.269%0.68737%0.366SS*.Hα-helixtrans-67.6-36.7175.2-65.9170.5000110.8V71 I72 Y77V71-I75 HydrophobicContact CG1-CD1 3.93Å; V71-I75 WeakPolarHBondContact O-CG1 3.26Å; V71-I75 PolarHBondContact O-N 3.18Å; V71-I75 VanDerWaalsContact O-N 3.1Å; I72-I75 PolarHBondContact O-N 2.99Å; I75-Y77 PolarHBondContact O-N 2.97Å
76S47.5Very low52.5Low54 Ų5470.7 Ų70.738%0.37836%0.363SS..  trans-84.350.4-180-155.30000112.5I72 F74 N78 G79I72-S76 WeakPolarHBondContact O-CB 3.45Å; I72-S76 PolarHBondContact O-N 3.16Å; F74-S76 VanDerWaalsContact C-N 3.34Å; S76-N78 PolarHBondContact O-N 3.44Å; S76-G79 WeakPolarHBondContact O-CA 3.31Å; S76-G79 PolarHBondContact O-N 3.35Å
77Y49.7Very low52.4Low71 Ų7170.9 Ų70.928%0.27837%0.365SS..G310 helixtrans-53.3-31.7-172.3-149.2-91.7000113.9I75 G79 C144 D145 H148I75-Y77 PolarHBondContact O-N 2.97Å; Y77-G79 PolarHBondContact O-N 2.82Å; Y77-G79 VanDerWaalsContact O-N 3.1Å; Y77-C144 HydrophobicContact CE2-CB 3.89Å; Y77-C144 WeakPolarHBondContact OH-CB 3.5Å; Y77-C144 PolarHBondContact OH-O 3.25Å; Y77-D145 VanDerWaalsContact OH-CA 3.25Å; Y77-D145 WeakPolarHBondContact OH-CA 3.35Å; Y77-D145 PolarHBondContact OH-N 2.87Å; Y77-H148 HydrophobicContact CE1-CB 3.55Å; Y77-H148 AromaticContact CE1-CD2 3.56Å; Y77-H148 AromaticContact CE1-CG 3.61Å
78N47.2Very low52.5Low158 Ų15873 Ų7385%0.84537%0.371SS*.G310 helixtrans-76.919175.1-68-6.8000114.6S76S76-N78 PolarHBondContact O-N 3.44Å
79G45.1Very low52.5Low18 Ų1872.5 Ų72.519%0.18637%0.372CS..G310 helixtrans-149.927-163.700000116.9S76 Y77 Q81 R82 L83S76-G79 WeakPolarHBondContact O-CA 3.31Å; S76-G79 PolarHBondContact O-N 3.35Å; Y77-G79 PolarHBondContact O-N 2.82Å; Y77-G79 VanDerWaalsContact O-N 3.1Å; G79-Q81 PolarHBondContact O-N 2.84Å; G79-R82 PolarHBondContact O-N 2.69Å; G79-L83 PolarHBondContact O-N 2.82Å
80V51.4Low52.5Low70 Ų7071.9 Ų71.942%0.42437%0.369SS..Hα-helixtrans-40.8-38.6-173.1178.10000115I19 N84I19-V80 HydrophobicContact CD1-CG1 4Å; V80-N84 WeakPolarHBondContact O-CB 3.42Å; V80-N84 PolarHBondContact O-ND2 3.28Å
81Q50.6Low52.7Low164 Ų16471.8 Ų71.877%0.76637%0.369SS*.Hα-helixtrans-76.2-42.4178.4-69.7-176.3-9.400113.9G79 L83 N84 V85G79-Q81 PolarHBondContact O-N 2.84Å; Q81-L83 PolarHBondContact O-N 2.85Å; Q81-N84 PolarHBondContact O-N 3.42Å; Q81-V85 WeakPolarHBondContact O-CG2 3.36Å; Q81-V85 PolarHBondContact O-N 2.81Å; Q81-V85 VanDerWaalsContact O-N 3.12Å
82R47.5Very low52.7Low209 Ų20974.2 Ų74.279%0.78937%0.374SS*.Hα-helixtrans-67.6-40.2-171.7-68.6-174.7179.9-176.31.2112.1G79 V85 I86G79-R82 PolarHBondContact O-N 2.69Å; R82-V85 PolarHBondContact O-N 3Å; R82-I86 WeakPolarHBondContact O-CG1 3.43Å; R82-I86 PolarHBondContact O-N 3.39Å; R82-I86 VanDerWaalsContact O-N 3.16Å
83L49.5Very low52.8Low11 Ų1174.6 Ų74.66%0.05838%0.376CS..Hα-helixtrans-83.2-21.2178.1-93.6143.3000114I72 Y73 G79 Q81 V85 I86 T87I72-L83 HydrophobicContact CB-CD2 4.19Å; I72-L83 HydrophobicContact CG2-CD1 3.81Å; I72-L83 HydrophobicContact CG2-CD2 3.74Å; I72-L83 HydrophobicContact CG2-CG 4.42Å; Y73-L83 HydrophobicContact CD2-CB 3.64Å; Y73-L83 HydrophobicContact CE2-CB 4.49Å; Y73-L83 HydrophobicContact CG-CB 4.26Å; G79-L83 PolarHBondContact O-N 2.82Å; Q81-L83 PolarHBondContact O-N 2.85Å; L83-V85 VanDerWaalsContact C-N 3.34Å; L83-I86 HydrophobicContact CD2-CB 4.22Å; L83-I86 HydrophobicContact CD2-CD1 4.16Å; L83-I86 HydrophobicContact CD2-CG2 4.31Å; L83-I86 HydrophobicContact CG-CD1 4.13Å; L83-I86 PolarHBondContact O-N 3.26Å; L83-T87 WeakPolarHBondContact O-CB 3.4Å; L83-T87 PolarHBondContact O-N 3.41Å; L83-T87 PolarHBondContact O-OG1 3.47Å
84N56.2Low53.2Low24 Ų2473.3 Ų73.313%0.12837%0.371CS..Hα-helixtrans-59.9-46.9162.9-95.6-50.7000110.5M23 Y73 V80 Q81 I86 T87 I88M23-N84 WeakPolarHBondContact CE-OD1 3.28Å; Y73-N84 HydrophobicContact CE2-CB 4.21Å; Y73-N84 VanDerWaalsContact CE2-CG 3.5Å; Y73-N84 WeakPolarHBondContact CE2-ND2 3.2Å; Y73-N84 PolarHBondContact OH-ND2 2.96Å; Y73-N84 VanDerWaalsContact OH-ND2 3.12Å; V80-N84 WeakPolarHBondContact O-CB 3.42Å; V80-N84 PolarHBondContact O-ND2 3.28Å; Q81-N84 PolarHBondContact O-N 3.42Å; N84-I86 VanDerWaalsContact C-N 3.33Å; N84-I86 PolarHBondContact O-N 3.2Å; N84-T87 PolarHBondContact O-N 3.34Å; N84-I88 WeakPolarHBondContact O-CB 3.42Å; N84-I88 WeakPolarHBondContact O-CD1 3.43Å; N84-I88 VanDerWaalsContact O-CG1 3.22Å; N84-I88 WeakPolarHBondContact O-CG1 3.2Å; N84-I88 PolarHBondContact O-N 2.83Å
85V53.1Low53.7Low90 Ų9074.1 Ų74.155%0.54538%0.377SS..Hα-helixtrans-59-43175.7173.60000111.4Q81 R82 L83 T89Q81-V85 WeakPolarHBondContact O-CG2 3.36Å; Q81-V85 PolarHBondContact O-N 2.81Å; Q81-V85 VanDerWaalsContact O-N 3.12Å; R82-V85 PolarHBondContact O-N 3Å; L83-V85 VanDerWaalsContact C-N 3.34Å; V85-T89 WeakPolarHBondContact O-CB 3.49Å; V85-T89 PolarHBondContact O-N 3.35Å; V85-T89 PolarHBondContact O-OG1 2.89Å
86I55.7Low53.7Low73 Ų7370.7 Ų70.737%0.37436%0.362SS..Hα-helixtrans-66.5-42.8179-68165.1000112.2L69 R82 L83 N84 T89 T90L69-I86 HydrophobicContact CD1-CG2 3.96Å; L69-I86 HydrophobicContact CD2-CG2 3.61Å; L69-I86 HydrophobicContact CG-CG2 4.29Å; R82-I86 WeakPolarHBondContact O-CG1 3.43Å; R82-I86 PolarHBondContact O-N 3.39Å; R82-I86 VanDerWaalsContact O-N 3.16Å; L83-I86 HydrophobicContact CD2-CB 4.22Å; L83-I86 HydrophobicContact CD2-CD1 4.16Å; L83-I86 HydrophobicContact CD2-CG2 4.31Å; L83-I86 HydrophobicContact CG-CD1 4.13Å; L83-I86 PolarHBondContact O-N 3.26Å; N84-I86 VanDerWaalsContact C-N 3.33Å; N84-I86 PolarHBondContact O-N 3.2Å; I86-T89 PolarHBondContact O-N 3.43Å; I86-T90 WeakPolarHBondContact O-CB 3.4Å; I86-T90 PolarHBondContact O-N 3.37Å; I86-T90 PolarHBondContact O-OG1 2.82Å
87T61.2Low54Low9 Ų970 Ų706%0.05536%0.355CS..Hα-helixtrans-64.1-46.5175.9-60.20000111.2I70 L83 N84 T89 T90 N91I70-T87 HydrophobicContact CG1-CG2 4.32Å; L83-T87 WeakPolarHBondContact O-CB 3.4Å; L83-T87 PolarHBondContact O-N 3.41Å; L83-T87 PolarHBondContact O-OG1 3.47Å; N84-T87 PolarHBondContact O-N 3.34Å; T87-T89 PolarHBondContact O-N 3.33Å; T87-T90 PolarHBondContact O-N 3.22Å; T87-N91 WeakPolarHBondContact O-CB 3.38Å; T87-N91 PolarHBondContact O-N 2.88Å
88I60Low54.2Low88 Ų8866.7 Ų66.745%0.45134%0.342SS..Hα-helixtrans-60.3-45.6175.3-68.4165.2000110.6L26 N84 T90 N91 F92L26-I88 HydrophobicContact CD1-CG1 4.3Å; N84-I88 WeakPolarHBondContact O-CB 3.42Å; N84-I88 WeakPolarHBondContact O-CD1 3.43Å; N84-I88 VanDerWaalsContact O-CG1 3.22Å; N84-I88 WeakPolarHBondContact O-CG1 3.2Å; N84-I88 PolarHBondContact O-N 2.83Å; I88-T90 VanDerWaalsContact C-N 3.28Å; I88-T90 PolarHBondContact O-N 2.91Å; I88-N91 PolarHBondContact O-N 3.11Å; I88-F92 VanDerWaalsContact O-CB 3.26Å; I88-F92 WeakPolarHBondContact O-CB 3.48Å; I88-F92 PolarHBondContact O-N 2.96Å
89T53.6Low54.3Low66 Ų6662.4 Ų62.441%0.40532%0.322SS..Hα-helixtrans-61.1-38.4177.9-59.40000111.2V85 I86 T87 F92 I93V85-T89 WeakPolarHBondContact O-CB 3.49Å; V85-T89 PolarHBondContact O-N 3.35Å; V85-T89 PolarHBondContact O-OG1 2.89Å; I86-T89 PolarHBondContact O-N 3.43Å; T87-T89 PolarHBondContact O-N 3.33Å; T89-F92 PolarHBondContact O-N 3.43Å; T89-I93 HydrophobicContact CG2-CD1 3.97Å; T89-I93 VanDerWaalsContact O-CG1 3.24Å; T89-I93 WeakPolarHBondContact O-CG1 3.48Å; T89-I93 PolarHBondContact O-N 3.01Å
90T58.7Low54.4Low12 Ų1264.9 Ų64.97%0.07434%0.336CS..Hα-helixtrans-78.1-37.7-178.3-52.30000112.4L65 T66 L69 I86 T87 I88 F92 I93 K94L65-T90 HydrophobicContact CD2-CG2 3.65Å; L65-T90 HydrophobicContact CG-CG2 4.17Å; T66-T90 HydrophobicContact CG2-CG2 3.86Å; L69-T90 HydrophobicContact CD1-CG2 3.64Å; L69-T90 WeakPolarHBondContact CD1-OG1 3.49Å; I86-T90 WeakPolarHBondContact O-CB 3.4Å; I86-T90 PolarHBondContact O-N 3.37Å; I86-T90 PolarHBondContact O-OG1 2.82Å; T87-T90 PolarHBondContact O-N 3.22Å; I88-T90 VanDerWaalsContact C-N 3.28Å; I88-T90 PolarHBondContact O-N 2.91Å; T90-F92 VanDerWaalsContact C-N 3.27Å; T90-F92 PolarHBondContact O-N 2.88Å; T90-I93 PolarHBondContact O-N 3.08Å; T90-K94 VanDerWaalsContact O-CB 3.31Å; T90-K94 WeakPolarHBondContact O-CB 3.43Å; T90-K94 PolarHBondContact O-N 3.07Å
91N63.6Low54.2Low24 Ų2462.2 Ų62.213%0.12832%0.32CS..Hα-helixtrans-64.2-35.5170.1-70.5-2.5000110.8T66 T87 I88 K94 M95T66-N91 WeakPolarHBondContact CG2-OD1 3.24Å; T87-N91 WeakPolarHBondContact O-CB 3.38Å; T87-N91 PolarHBondContact O-N 2.88Å; I88-N91 PolarHBondContact O-N 3.11Å; N91-K94 WeakPolarHBondContact O-CB 3.44Å; N91-K94 PolarHBondContact O-N 2.72Å; N91-M95 WeakPolarHBondContact O-CB 3.39Å; N91-M95 PolarHBondContact O-N 3.21Å
92F57Low54.1Low121 Ų12157.4 Ų57.453%0.53130%0.297SS..Hα-helixtrans-66.9-46.3172.4179.7-99.4000112.4I88 T89 T90 K94 M95 V96I88-F92 VanDerWaalsContact O-CB 3.26Å; I88-F92 WeakPolarHBondContact O-CB 3.48Å; I88-F92 PolarHBondContact O-N 2.96Å; T89-F92 PolarHBondContact O-N 3.43Å; T90-F92 VanDerWaalsContact C-N 3.27Å; T90-F92 PolarHBondContact O-N 2.88Å; F92-K94 VanDerWaalsContact C-N 3.28Å; F92-K94 PolarHBondContact O-N 3.37Å; F92-M95 HydrophobicContact CD2-CE 3.81Å; F92-M95 HydrophobicContact CE2-CE 3.84Å; F92-M95 PolarHBondContact O-N 3.36Å; F92-V96 HydrophobicContact CD1-CG2 4.11Å; F92-V96 HydrophobicContact CD2-CG2 4.49Å; F92-V96 HydrophobicContact CE1-CG2 3.65Å; F92-V96 HydrophobicContact CE2-CG2 4.08Å; F92-V96 HydrophobicContact CZ-CG2 3.63Å; F92-V96 WeakPolarHBondContact O-CG2 3.38Å; F92-V96 PolarHBondContact O-N 3.45Å
93I52.4Low53.9Low80 Ų8049.3 Ų49.341%0.4128%0.279SS..Hα-helixtrans-57.4-44.2172.9-72163.1000110.1L62 T89 T90 M95 V96 V97L62-I93 HydrophobicContact CD2-CG2 4.46Å; T89-I93 HydrophobicContact CG2-CD1 3.97Å; T89-I93 VanDerWaalsContact O-CG1 3.24Å; T89-I93 WeakPolarHBondContact O-CG1 3.48Å; T89-I93 PolarHBondContact O-N 3.01Å; T90-I93 PolarHBondContact O-N 3.08Å; I93-M95 PolarHBondContact O-N 3.29Å; I93-V96 PolarHBondContact O-N 2.92Å; I93-V97 HydrophobicContact CG2-CG2 4.4Å; I93-V97 WeakPolarHBondContact O-CB 3.22Å; I93-V97 VanDerWaalsContact O-CG2 3.28Å; I93-V97 WeakPolarHBondContact O-CG2 3.37Å; I93-V97 PolarHBondContact O-N 2.96Å
94K59.5Low53.6Low4 Ų452.4 Ų52.42%0.01730%0.298CS..Hα-helixtrans-58.8-46.6175.9-177.7175.5-177.665.90111.7Q34 Q59 L62 T66 T90 N91 F92 V97 D98Q34-K94 VanDerWaalsContact NE2-CE 3.31Å; Q59-K94 PolarHBondContact O-NZ 3.5Å; L62-K94 HydrophobicContact CB-CB 4.45Å; L62-K94 HydrophobicContact CB-CD 4.14Å; L62-K94 HydrophobicContact CB-CG 4.01Å; L62-K94 HydrophobicContact CD1-CB 4.39Å; L62-K94 HydrophobicContact CD1-CG 4.14Å; L62-K94 HydrophobicContact CD2-CB 4.27Å; T66-K94 HydrophobicContact CG2-CD 4.26Å; T90-K94 VanDerWaalsContact O-CB 3.31Å; T90-K94 WeakPolarHBondContact O-CB 3.43Å; T90-K94 PolarHBondContact O-N 3.07Å; N91-K94 WeakPolarHBondContact O-CB 3.44Å; N91-K94 PolarHBondContact O-N 2.72Å; F92-K94 VanDerWaalsContact C-N 3.28Å; F92-K94 PolarHBondContact O-N 3.37Å; K94-V97 PolarHBondContact O-N 2.95Å; K94-D98 WeakPolarHBondContact O-CB 3.21Å; K94-D98 PolarHBondContact O-N 3.2Å
95M57.9Low53.1Low77 Ų7751.5 Ų51.538%0.37929%0.293SS..Hα-helixtrans-62.9-45175.5-173.2-170.274.800112.3Y33 N91 F92 I93 V97 D98 V99Y33-M95 HydrophobicContact CE1-CG 4.43Å; N91-M95 WeakPolarHBondContact O-CB 3.39Å; N91-M95 PolarHBondContact O-N 3.21Å; F92-M95 HydrophobicContact CD2-CE 3.81Å; F92-M95 HydrophobicContact CE2-CE 3.84Å; F92-M95 PolarHBondContact O-N 3.36Å; I93-M95 PolarHBondContact O-N 3.29Å; M95-V97 VanDerWaalsContact C-N 3.31Å; M95-V97 PolarHBondContact O-N 3.45Å; M95-D98 PolarHBondContact O-N 2.95Å; M95-V99 HydrophobicContact CG-CG2 4.48Å; M95-V99 WeakPolarHBondContact O-CB 3.39Å; M95-V99 VanDerWaalsContact O-CG2 3.23Å; M95-V99 WeakPolarHBondContact O-CG2 3.44Å; M95-V99 PolarHBondContact O-N 3.16Å
96V50.6Low52.6Low61 Ų6153.6 Ų53.637%0.3729%0.292SS..Hα-helixtrans-62.4-39.5177.6169.20000111.3F92 I93 S100F92-V96 HydrophobicContact CD1-CG2 4.11Å; F92-V96 HydrophobicContact CD2-CG2 4.49Å; F92-V96 HydrophobicContact CE1-CG2 3.65Å; F92-V96 HydrophobicContact CE2-CG2 4.08Å; F92-V96 HydrophobicContact CZ-CG2 3.63Å; F92-V96 WeakPolarHBondContact O-CG2 3.38Å; F92-V96 PolarHBondContact O-N 3.45Å; I93-V96 PolarHBondContact O-N 2.92Å; V96-S100 WeakPolarHBondContact O-CB 3.43Å; V96-S100 PolarHBondContact O-N 3.44Å; V96-S100 PolarHBondContact O-OG 2.87Å
97V52.9Low52Low40 Ų4059 Ų5924%0.24231%0.313CS..Hα-helixtrans-64.6-53.1173.3172.20000110I58 L62 I93 K94 M95 V99 S100 C101I58-V97 HydrophobicContact CG2-CG1 3.42Å; I58-V97 VanDerWaalsContact CG2-CG1 3.42Å; L62-V97 HydrophobicContact CD1-CB 4.02Å; L62-V97 HydrophobicContact CD1-CG1 3.82Å; L62-V97 HydrophobicContact CD1-CG2 4.48Å; I93-V97 HydrophobicContact CG2-CG2 4.4Å; I93-V97 WeakPolarHBondContact O-CB 3.22Å; I93-V97 VanDerWaalsContact O-CG2 3.28Å; I93-V97 WeakPolarHBondContact O-CG2 3.37Å; I93-V97 PolarHBondContact O-N 2.96Å; K94-V97 PolarHBondContact O-N 2.95Å; M95-V97 VanDerWaalsContact C-N 3.31Å; M95-V97 PolarHBondContact O-N 3.45Å; V97-V99 VanDerWaalsContact C-N 3.29Å; V97-V99 PolarHBondContact O-N 3.01Å; V97-S100 PolarHBondContact O-N 3.47Å; V97-C101 WeakPolarHBondContact O-CB 3.45Å; V97-C101 PolarHBondContact O-N 2.8Å; V97-C101 PolarHBondContact O-SG 2.95Å
98D55.1Low51.2Low2 Ų260.9 Ų60.91%0.01133%0.325CS..Hα-helixtrans-54.3-42177.4-74.9-28.9000111.9Y33 Y37 Q59 K94 M95 C101 F102Y33-D98 HydrophobicContact CE1-CB 4.11Å; Y37-D98 WeakPolarHBondContact CE2-O 3.33Å; Q59-D98 WeakPolarHBondContact CG-OD1 3.4Å; Q59-D98 PolarHBondContact NE2-OD1 3.48Å; K94-D98 WeakPolarHBondContact O-CB 3.21Å; K94-D98 PolarHBondContact O-N 3.2Å; M95-D98 PolarHBondContact O-N 2.95Å; D98-C101 PolarHBondContact O-N 3.31Å; D98-F102 PolarHBondContact O-N 3.48Å
99V50Low50.4Low68 Ų6858.2 Ų58.241%0.41232%0.319SS..Hα-helixtrans-63.3-45.3173.3172.40000112.3Y33 M95 V97 C101 F102 G103Y33-V99 WeakPolarHBondContact OH-CG2 3.46Å; M95-V99 HydrophobicContact CG-CG2 4.48Å; M95-V99 WeakPolarHBondContact O-CB 3.39Å; M95-V99 VanDerWaalsContact O-CG2 3.23Å; M95-V99 WeakPolarHBondContact O-CG2 3.44Å; M95-V99 PolarHBondContact O-N 3.16Å; V97-V99 VanDerWaalsContact C-N 3.29Å; V97-V99 PolarHBondContact O-N 3.01Å; V99-C101 VanDerWaalsContact C-N 3.32Å; V99-C101 PolarHBondContact O-N 2.94Å; V99-F102 WeakPolarHBondContact O-CB 3.28Å; V99-F102 PolarHBondContact O-N 3.36Å; V99-G103 PolarHBondContact O-N 2.92Å
100S46.1Very low50Low69 Ų6958.9 Ų58.948%0.48333%0.326SS..Hα-helixtrans-65.4-40-179.6-57.90000111V96 V97 F102 G103 T104V96-S100 WeakPolarHBondContact O-CB 3.43Å; V96-S100 PolarHBondContact O-N 3.44Å; V96-S100 PolarHBondContact O-OG 2.87Å; V97-S100 PolarHBondContact O-N 3.47Å; S100-F102 VanDerWaalsContact C-N 3.35Å; S100-G103 PolarHBondContact O-N 2.66Å; S100-T104 PolarHBondContact O-N 3.39Å; S100-T104 PolarHBondContact O-OG1 3.39Å
101C48.3Very low49.5Very low14 Ų1462.6 Ų62.610%0.09535%0.353CS..Hα-helixtrans-62.3-40.5173.7-63.50000111.5L55 V97 D98 V99 T104 I105L55-C101 HydrophobicContact CD1-CB 4.21Å; L55-C101 HydrophobicContact CD2-CB 3.46Å; L55-C101 VanDerWaalsContact CD2-CB 3.46Å; L55-C101 WeakPolarHBondContact CD2-SG 3.37Å; L55-C101 HydrophobicContact CG-CB 4.44Å; V97-C101 WeakPolarHBondContact O-CB 3.45Å; V97-C101 PolarHBondContact O-N 2.8Å; V97-C101 PolarHBondContact O-SG 2.95Å; D98-C101 PolarHBondContact O-N 3.31Å; V99-C101 VanDerWaalsContact C-N 3.32Å; V99-C101 PolarHBondContact O-N 2.94Å; C101-T104 PolarHBondContact O-N 3.38Å; C101-I105 WeakPolarHBondContact O-CB 3.41Å; C101-I105 VanDerWaalsContact O-CG1 3.27Å; C101-I105 WeakPolarHBondContact O-CG1 3.26Å; C101-I105 PolarHBondContact O-N 3.16Å
102F47.2Very low48.6Very low63 Ų6369.6 Ų69.628%0.27638%0.382SS..Hα-helixtrans-60.5-43.2170.9-177.8-101.6000112.2Y37 S40 D98 V99 S100 T104 I105 Y106Y37-F102 HydrophobicContact CD2-CB 4.21Å; Y37-F102 HydrophobicContact CE2-CB 3.91Å; S40-F102 VanDerWaalsContact OG-CE2 3.27Å; S40-F102 WeakPolarHBondContact OG-CE2 3.4Å; D98-F102 PolarHBondContact O-N 3.48Å; V99-F102 WeakPolarHBondContact O-CB 3.28Å; V99-F102 PolarHBondContact O-N 3.36Å; S100-F102 VanDerWaalsContact C-N 3.35Å; F102-T104 PolarHBondContact O-N 2.81Å; F102-I105 PolarHBondContact O-N 3.41Å; F102-Y106 HydrophobicContact CE1-CD2 4.45Å; F102-Y106 HydrophobicContact CZ-CD2 4.43Å; F102-Y106 WeakPolarHBondContact O-CB 3.3Å; F102-Y106 PolarHBondContact O-N 2.83Å
103G43Very low48.2Very low40 Ų4069.8 Ų69.841%0.41239%0.388SS..Hα-helixtrans-59.3-44.1176.100000113.1V99 S100 Y106 F107V99-G103 PolarHBondContact O-N 2.92Å; S100-G103 PolarHBondContact O-N 2.66Å; G103-Y106 PolarHBondContact O-N 3.12Å; G103-F107 PolarHBondContact O-N 3.03Å
104T43.2Very low47.6Very low76 Ų7673.5 Ų73.547%0.46641%0.407SS..Hα-helixtrans-66.6-43.2175.4-54.50000111.9S100 C101 F102 Y106 F107 V108S100-T104 PolarHBondContact O-N 3.39Å; S100-T104 PolarHBondContact O-OG1 3.39Å; C101-T104 PolarHBondContact O-N 3.38Å; F102-T104 PolarHBondContact O-N 2.81Å; T104-Y106 VanDerWaalsContact C-N 3.32Å; T104-Y106 PolarHBondContact O-N 3.12Å; T104-F107 PolarHBondContact O-N 2.93Å; T104-V108 WeakPolarHBondContact O-CG2 3.2Å
105I47.1Very low46.7Very low4 Ų478 Ų782%0.02144%0.437CS..Hα-helixtrans-57.7-45174.3-77.2166000111.1Y44 Y52 L55 C101 F102 F107 V108Y44-I105 VanDerWaalsContact CB-CG2 3.41Å; Y44-I105 HydrophobicContact CD1-CG2 4.47Å; Y44-I105 HydrophobicContact CG-CG2 4.14Å; Y52-I105 HydrophobicContact CD1-CD1 4.39Å; Y52-I105 HydrophobicContact CE1-CD1 3.74Å; Y52-I105 HydrophobicContact CE1-CG1 3.67Å; Y52-I105 HydrophobicContact CE1-CG2 4.41Å; L55-I105 HydrophobicContact CD1-CD1 3.36Å; L55-I105 HydrophobicContact CD1-CG1 3.64Å; C101-I105 WeakPolarHBondContact O-CB 3.41Å; C101-I105 VanDerWaalsContact O-CG1 3.27Å; C101-I105 WeakPolarHBondContact O-CG1 3.26Å; C101-I105 PolarHBondContact O-N 3.16Å; F102-I105 PolarHBondContact O-N 3.41Å; I105-F107 VanDerWaalsContact C-N 3.26Å; I105-F107 PolarHBondContact O-N 2.81Å; I105-V108 PolarHBondContact O-N 3.4Å
106Y41.2Very low46.2Very low134 Ų13474.9 Ų74.953%0.52542%0.422SS..Hα-helixtrans-57.9-39.9179.8-174.5-78.6000111.7Y44 F102 G103 T104 V108Y44-Y106 HydrophobicContact CD2-CD2 4.42Å; Y44-Y106 HydrophobicContact CE1-CD2 4.03Å; Y44-Y106 HydrophobicContact CE1-CE2 4.5Å; Y44-Y106 HydrophobicContact CE1-CG 4.09Å; Y44-Y106 WeakPolarHBondContact CE1-O 3.27Å; Y44-Y106 AromaticContact CE2-CD2 3.58Å; Y44-Y106 HydrophobicContact CE2-CD2 3.58Å; Y44-Y106 AromaticContact CE2-CE2 3.86Å; Y44-Y106 HydrophobicContact CE2-CE2 3.86Å; Y44-Y106 HydrophobicContact CE2-CG 4.41Å; Y44-Y106 AromaticContact CZ-CD2 3.35Å; Y44-Y106 AromaticContact CZ-CE2 3.54Å; Y44-Y106 AromaticContact CZ-CG 3.88Å; Y44-Y106 VanDerWaalsContact OH-CD2 3.29Å; Y44-Y106 WeakPolarHBondContact OH-CD2 3.41Å; Y44-Y106 WeakPolarHBondContact OH-CE2 3.47Å; Y44-Y106 VanDerWaalsContact OH-CZ 3.27Å; F102-Y106 HydrophobicContact CE1-CD2 4.45Å; F102-Y106 HydrophobicContact CZ-CD2 4.43Å; F102-Y106 WeakPolarHBondContact O-CB 3.3Å; F102-Y106 PolarHBondContact O-N 2.83Å; G103-Y106 PolarHBondContact O-N 3.12Å; T104-Y106 VanDerWaalsContact C-N 3.32Å; T104-Y106 PolarHBondContact O-N 3.12Å; Y106-V108 VanDerWaalsContact C-N 3.33Å; Y106-V108 PolarHBondContact O-N 3.34Å
107F43.2Very low45.8Very low186 Ų18677 Ų7782%0.81643%0.434SS*.Hα-helixtrans-73.8-20.6-173.8-150.7-92000114.2G103 T104 I105G103-F107 PolarHBondContact O-N 3.03Å; T104-F107 PolarHBondContact O-N 2.93Å; I105-F107 VanDerWaalsContact C-N 3.26Å; I105-F107 PolarHBondContact O-N 2.81Å
108V44.1Very low45.4Very low50 Ų5080.9 Ų80.930%0.30345%0.454SS..Hα-helixtrans-105.9-8.8-166.1-178.30000113.4T47 E48 T104 I105 Y106 S110T47-V108 WeakPolarHBondContact CB-O 3.32Å; T47-V108 HydrophobicContact CG2-CG1 3.91Å; T47-V108 WeakPolarHBondContact CG2-O 3.47Å; T47-V108 PolarHBondContact OG1-O 3.02Å; E48-V108 HydrophobicContact CB-CG1 4.38Å; E48-V108 HydrophobicContact CG-CG1 3.89Å; T104-V108 WeakPolarHBondContact O-CG2 3.2Å; I105-V108 PolarHBondContact O-N 3.4Å; Y106-V108 VanDerWaalsContact C-N 3.33Å; Y106-V108 PolarHBondContact O-N 3.34Å; V108-S110 PolarHBondContact O-N 3.19Å
109G43.2Very low45Very low31 Ų3182.5 Ų82.532%0.3246%0.462SS..  trans-52.2105.4-165.900000120.3T47T47-G109 VanDerWaalsContact OG1-C 3.32Å; T47-G109 WeakPolarHBondContact OG1-CA 3.35Å; T47-G109 PolarHBondContact OG1-N 2.85Å
110S46.9Very low44.8Very low80 Ų8081.5 Ų81.556%0.55946%0.461SS*.  trans-173.6123.4165.3-85.10000116.7K46 T47 V108K46-S110 CarbonylContact O-C 2.66Å; T47-S110 WeakPolarHBondContact CG2-O 3.48Å; T47-S110 PolarHBondContact OG1-N 3.06Å; V108-S110 PolarHBondContact O-N 3.19Å
111S46.9Very low44.8Very low91 Ų9186.2 Ų86.264%0.63647%0.469SS*.SBendtrans73.677.716874.70000125.9K46K46-S111 CarbonylContact O-C 2.85Å; K46-S111 WeakPolarHBondContact O-CA 3.42Å; K46-S111 PolarHBondContact O-N 2.93Å
112K46Very low44.8Very low171 Ų17191 Ų9174%0.74349%0.489SS*.  trans149.2158.2142-78.5153.1-166.8173.80114.9K46K46-K112 PolarHBondContact O-N 3.01Å
113I48Very low44.9Very low125 Ų12589 Ų8964%0.64148%0.481SS*.  trans-131.2-15.6-152.1-71.3170000116.6I116I113-I116 WeakPolarHBondContact O-CD1 3.41Å; I113-I116 WeakPolarHBondContact O-CG1 3.2Å
114L38.5Very low45.2Very low157 Ų15791.5 Ų91.582%0.82249%0.491SS*.THydrogen-bonded Turntrans-73.6-45.5-158.1-154.467.8000118.3I116L114-I116 PolarHBondContact O-N 3.46Å
115P42.3Very low45.4Very low98 Ų9891.3 Ų91.364%0.63649%0.49SS*.THydrogen-bonded Turntrans-79.517.1-170.732.8-36.4000115
116I46.2Very low45.5Very low12 Ų1293.3 Ų93.36%0.06250%0.5CS..Hα-helixtrans-84.1-36.1-171.7-58.1172.6000112.1Y42 M45 I113 L114 L119 A120Y42-I116 HydrophobicContact CD2-CG2 3.68Å; Y42-I116 HydrophobicContact CE2-CG2 4.41Å; M45-I116 HydrophobicContact CB-CD1 3.45Å; M45-I116 VanDerWaalsContact CB-CD1 3.45Å; M45-I116 HydrophobicContact CB-CG1 4.05Å; M45-I116 HydrophobicContact CE-CB 4.43Å; M45-I116 HydrophobicContact CE-CG1 4.12Å; M45-I116 HydrophobicContact CE-CG2 4.04Å; M45-I116 HydrophobicContact CG-CD1 4.12Å; M45-I116 HydrophobicContact CG-CG1 4.23Å; M45-I116 HydrophobicContact SD-CD1 4.33Å; M45-I116 HydrophobicContact SD-CG1 3.85Å; I113-I116 WeakPolarHBondContact O-CD1 3.41Å; I113-I116 WeakPolarHBondContact O-CG1 3.2Å; L114-I116 PolarHBondContact O-N 3.46Å; I116-L119 PolarHBondContact O-N 3.41Å; I116-A120 PolarHBondContact O-N 3.47Å; I116-A120 VanDerWaalsContact O-N 3.15Å
117V43.2Very low46.1Very low106 Ų10687.9 Ų87.964%0.64248%0.48SS*.Hα-helixtrans-65.5-43.5-172.8-179.90000111.1L119 A120 Y121V117-L119 VanDerWaalsContact C-N 3.33Å; V117-L119 PolarHBondContact O-N 3.33Å; V117-A120 PolarHBondContact O-N 3.31Å; V117-Y121 WeakPolarHBondContact O-CB 3.15Å; V117-Y121 PolarHBondContact O-N 3.39Å
118D43.4Very low46.5Very low122 Ų12282.5 Ų82.565%0.65246%0.463SS*.Hα-helixtrans-62.3-39.5-179.2-58.9-33000111.8Y121 F122D118-Y121 PolarHBondContact O-N 3.34Å; D118-F122 VanDerWaalsContact O-CB 3.29Å; D118-F122 WeakPolarHBondContact O-CB 3.45Å; D118-F122 PolarHBondContact O-N 3.4Å
119L46.7Very low46.8Very low35 Ų3583.3 Ų83.318%0.18347%0.47CS..Hα-helixtrans-73.3-37.3179.8-174.168.2000112.7M45 V56 I116 V117 Y121 N123M45-L119 HydrophobicContact CE-CD2 4.13Å; V56-L119 HydrophobicContact CG1-CD1 4.01Å; V56-L119 HydrophobicContact CG2-CD1 3.65Å; V56-L119 HydrophobicContact CG2-CD2 3.49Å; V56-L119 VanDerWaalsContact CG2-CD2 3.49Å; V56-L119 HydrophobicContact CG2-CG 4.22Å; I116-L119 PolarHBondContact O-N 3.41Å; V117-L119 VanDerWaalsContact C-N 3.33Å; V117-L119 PolarHBondContact O-N 3.33Å; L119-Y121 VanDerWaalsContact C-N 3.34Å; L119-N123 PolarHBondContact O-N 3.05Å; L119-N123 PolarHBondContact O-ND2 3.26Å
120A46.9Very low47.3Very low47 Ų4782.8 Ų82.839%0.38846%0.459SS..Hα-helixtrans-64.5-42173.200000110.7I116 V117 C124I116-A120 PolarHBondContact O-N 3.47Å; I116-A120 VanDerWaalsContact O-N 3.15Å; V117-A120 PolarHBondContact O-N 3.31Å; A120-C124 VanDerWaalsContact O-CB 3.27Å; A120-C124 WeakPolarHBondContact O-CB 3.41Å; A120-C124 PolarHBondContact O-N 3Å
121Y46.1Very low47.8Very low168 Ų16882.1 Ų82.166%0.65945%0.446SS*.Hα-helixtrans-63.9-46.7175-168.6-95.9000111.9V117 D118 L119 N123 C124 V125V117-Y121 WeakPolarHBondContact O-CB 3.15Å; V117-Y121 PolarHBondContact O-N 3.39Å; D118-Y121 PolarHBondContact O-N 3.34Å; L119-Y121 VanDerWaalsContact C-N 3.34Å; Y121-N123 PolarHBondContact O-N 3.18Å; Y121-C124 WeakPolarHBondContact O-CB 3.47Å; Y121-C124 PolarHBondContact O-N 2.88Å; Y121-C124 VanDerWaalsContact O-N 3.11Å; Y121-V125 HydrophobicContact CD1-CG2 4.3Å; Y121-V125 HydrophobicContact CE1-CG2 3.99Å; Y121-V125 WeakPolarHBondContact O-CG2 3.44Å; Y121-V125 PolarHBondContact O-N 3.28Å
122F48.1Very low48.1Very low114 Ų11483.1 Ų83.150%0.544%0.444SS..Hα-helixtrans-59.5-43.4178.7-163.3-110.1000112.1D118 V125 I126D118-F122 VanDerWaalsContact O-CB 3.29Å; D118-F122 WeakPolarHBondContact O-CB 3.45Å; D118-F122 PolarHBondContact O-N 3.4Å; F122-V125 PolarHBondContact O-N 3.38Å; F122-I126 HydrophobicContact CD1-CD1 3.64Å; F122-I126 HydrophobicContact CD2-CD1 4.5Å; F122-I126 HydrophobicContact CE1-CD1 3.25Å; F122-I126 HydrophobicContact CE2-CD1 4.18Å; F122-I126 HydrophobicContact CG-CD1 4.26Å; F122-I126 HydrophobicContact CZ-CD1 3.57Å; F122-I126 WeakPolarHBondContact O-CB 3Å; F122-I126 WeakPolarHBondContact O-CG1 3.34Å; F122-I126 PolarHBondContact O-N 3.47Å
123N49.6Very low48.5Very low22 Ų2279.8 Ų79.812%0.11843%0.433CS..Hα-helixtrans-66.2-42.7172.1-83.8-69000112.4L38 L119 Y121 V125 I126 Q127L38-N123 HydrophobicContact CD1-CB 3.53Å; L119-N123 PolarHBondContact O-N 3.05Å; L119-N123 PolarHBondContact O-ND2 3.26Å; Y121-N123 PolarHBondContact O-N 3.18Å; N123-V125 PolarHBondContact O-N 2.96Å; N123-I126 PolarHBondContact O-N 3.47Å; N123-Q127 WeakPolarHBondContact O-CB 3.33Å; N123-Q127 WeakPolarHBondContact O-CG 3.39Å; N123-Q127 PolarHBondContact O-N 2.78Å
124C47.5Very low48.8Very low92 Ų9274.5 Ų74.562%0.62241%0.405SS*.Hα-helixtrans-59.9-28178.1-1650000112.8A120 Y121 P128A120-C124 VanDerWaalsContact O-CB 3.27Å; A120-C124 WeakPolarHBondContact O-CB 3.41Å; A120-C124 PolarHBondContact O-N 3Å; Y121-C124 WeakPolarHBondContact O-CB 3.47Å; Y121-C124 PolarHBondContact O-N 2.88Å; Y121-C124 VanDerWaalsContact O-N 3.11Å; C124-P128 WeakPolarHBondContact O-CD 3.5Å; C124-P128 VanDerWaalsContact O-CG 3.23Å; C124-P128 WeakPolarHBondContact O-CG 3.39Å
125V47.8Very low49.6Very low72 Ų7269.7 Ų69.744%0.43638%0.38SS..Hα-helixtrans-84.4-44174175.70000112.5Y121 F122 N123 C129Y121-V125 HydrophobicContact CD1-CG2 4.3Å; Y121-V125 HydrophobicContact CE1-CG2 3.99Å; Y121-V125 WeakPolarHBondContact O-CG2 3.44Å; Y121-V125 PolarHBondContact O-N 3.28Å; F122-V125 PolarHBondContact O-N 3.38Å; N123-V125 PolarHBondContact O-N 2.96Å; V125-C129 PolarHBondContact O-SG 3.49Å
126I50.2Low50.1Low46 Ų4668.3 Ų68.324%0.23637%0.369CS..Hα-helixtrans-70.8-35.9-176.9-72.4-179.8000112.6F63 F122 N123 C129 R130F63-I126 HydrophobicContact CE2-CG2 4.38Å; F122-I126 HydrophobicContact CD1-CD1 3.64Å; F122-I126 HydrophobicContact CD2-CD1 4.5Å; F122-I126 HydrophobicContact CE1-CD1 3.25Å; F122-I126 HydrophobicContact CE2-CD1 4.18Å; F122-I126 HydrophobicContact CG-CD1 4.26Å; F122-I126 HydrophobicContact CZ-CD1 3.57Å; F122-I126 WeakPolarHBondContact O-CB 3Å; F122-I126 WeakPolarHBondContact O-CG1 3.34Å; F122-I126 PolarHBondContact O-N 3.47Å; N123-I126 PolarHBondContact O-N 3.47Å; I126-C129 PolarHBondContact O-N 2.84Å; I126-R130 PolarHBondContact O-N 2.84Å
127Q54.2Low50.5Low21 Ų2173.4 Ų73.410%0.09839%0.389CS..Hα-helixtrans-66.7-47.2-174-62.6-77.8-11.700112.8T31 N123 C129 R130 F131T31-Q127 HydrophobicContact CG2-CB 4.21Å; N123-Q127 WeakPolarHBondContact O-CB 3.33Å; N123-Q127 WeakPolarHBondContact O-CG 3.39Å; N123-Q127 PolarHBondContact O-N 2.78Å; Q127-C129 VanDerWaalsContact C-N 3.29Å; Q127-C129 PolarHBondContact O-N 3.39Å; Q127-R130 PolarHBondContact O-N 3.39Å; Q127-R130 VanDerWaalsContact OE1-CZ 3.28Å; Q127-F131 WeakPolarHBondContact O-CB 3.45Å; Q127-F131 PolarHBondContact O-N 3.25Å
128P51.1Low51Low72 Ų7268.8 Ų68.847%0.46836%0.361SS..Hα-helixtrans-60.3-38.3171.2-23.534.5000112.5C124 F131 L132C124-P128 WeakPolarHBondContact O-CD 3.5Å; C124-P128 VanDerWaalsContact O-CG 3.23Å; C124-P128 WeakPolarHBondContact O-CG 3.39Å; P128-F131 PolarHBondContact O-N 2.98Å; P128-L132 WeakPolarHBondContact O-CB 3.46Å; P128-L132 PolarHBondContact O-N 3.37Å
129C50.8Low51.5Low67 Ų6766.7 Ų66.745%0.45335%0.347SS..Hα-helixtrans-64.5-43.2176.9-66.40000111.8V125 I126 Q127 L132 I133V125-C129 PolarHBondContact O-SG 3.49Å; I126-C129 PolarHBondContact O-N 2.84Å; Q127-C129 VanDerWaalsContact C-N 3.29Å; Q127-C129 PolarHBondContact O-N 3.39Å; C129-L132 PolarHBondContact O-N 3.29Å; C129-I133 WeakPolarHBondContact O-CB 3.22Å; C129-I133 WeakPolarHBondContact O-CD1 3.45Å; C129-I133 WeakPolarHBondContact O-CG1 3.43Å; C129-I133 PolarHBondContact O-N 3.3Å
130R53.2Low51.8Low20 Ų2070.4 Ų70.48%0.07536%0.363CS..Hα-helixtrans-59.7-46.6173.5-169.9-179.587.7-129.5-8.1110.8E27 T31 F63 I126 Q127 I133 F134E27-R130 VanDerWaalsContact CD-NE 3.32Å; E27-R130 IonicContact OE1-CZ 3.25Å; E27-R130 IonicContact OE1-NE 3Å; E27-R130 PolarHBondContact OE1-NE 3.22Å; E27-R130 IonicContact OE1-NH2 2.69Å; E27-R130 IonicContact OE2-CZ 3.27Å; E27-R130 VanDerWaalsContact OE2-CZ 3.25Å; E27-R130 IonicContact OE2-NE 2.85Å; E27-R130 PolarHBondContact OE2-NE 3.02Å; E27-R130 IonicContact OE2-NH2 3.76Å; E27-R130 PolarHBondContact OE2-NH2 3.17Å; T31-R130 PolarHBondContact OG1-NH2 3.34Å; T31-R130 VanDerWaalsContact OG1-NH2 3.1Å; F63-R130 HydrophobicContact CE2-CB 4.29Å; F63-R130 HydrophobicContact CE2-CG 3.95Å; I126-R130 PolarHBondContact O-N 2.84Å; Q127-R130 PolarHBondContact O-N 3.39Å; Q127-R130 VanDerWaalsContact OE1-CZ 3.28Å; R130-I133 PolarHBondContact O-N 3.19Å; R130-F134 VanDerWaalsContact O-CB 3.28Å; R130-F134 WeakPolarHBondContact O-CB 3.42Å; R130-F134 PolarHBondContact O-N 3.43Å
131F56.7Low52.2Low66 Ų6668.6 Ų68.629%0.28935%0.349SS..Hα-helixtrans-65.3-40.2-179.7-170.3-110.2000112.5I24 A28 Q127 P128 F134 I135I24-F131 HydrophobicContact CG2-CE2 4.38Å; I24-F131 HydrophobicContact CG2-CZ 4.45Å; A28-F131 HydrophobicContact CB-CE2 4.42Å; Q127-F131 WeakPolarHBondContact O-CB 3.45Å; Q127-F131 PolarHBondContact O-N 3.25Å; P128-F131 PolarHBondContact O-N 2.98Å; F131-F134 PolarHBondContact O-N 2.92Å; F131-I135 HydrophobicContact CD1-CD1 3.73Å; F131-I135 HydrophobicContact CE1-CD1 3.36Å; F131-I135 HydrophobicContact CE1-CG1 4.35Å; F131-I135 HydrophobicContact CG-CD1 4.47Å; F131-I135 HydrophobicContact CZ-CD1 3.8Å; F131-I135 HydrophobicContact CZ-CG1 4.44Å; F131-I135 WeakPolarHBondContact O-CB 3.37Å; F131-I135 WeakPolarHBondContact O-CG1 3.46Å; F131-I135 PolarHBondContact O-N 2.9Å
132L53.7Low52.5Low113 Ų11362.3 Ų62.359%0.59233%0.332SS*.Hα-helixtrans-63.9-47.5174.2-114163.7000112P128 C129 F134 I135 V136P128-L132 WeakPolarHBondContact O-CB 3.46Å; P128-L132 PolarHBondContact O-N 3.37Å; C129-L132 PolarHBondContact O-N 3.29Å; L132-F134 VanDerWaalsContact C-N 3.32Å; L132-F134 PolarHBondContact O-N 3.37Å; L132-I135 PolarHBondContact O-N 3.34Å; L132-V136 WeakPolarHBondContact O-CG2 3.44Å; L132-V136 PolarHBondContact O-N 3.42Å
133I54.3Low52.8Low100 Ų10063.1 Ų63.151%0.51333%0.332SS..Hα-helixtrans-56.3-50.8173.3-72167.5000108.8C129 R130 I135 V136 Y137C129-I133 WeakPolarHBondContact O-CB 3.22Å; C129-I133 WeakPolarHBondContact O-CD1 3.45Å; C129-I133 WeakPolarHBondContact O-CG1 3.43Å; C129-I133 PolarHBondContact O-N 3.3Å; R130-I133 PolarHBondContact O-N 3.19Å; I133-I135 PolarHBondContact O-N 3.23Å; I133-V136 PolarHBondContact O-N 3.33Å; I133-V136 VanDerWaalsContact O-N 3.16Å; I133-Y137 HydrophobicContact CG2-CD2 3.64Å; I133-Y137 HydrophobicContact CG2-CE2 3.69Å; I133-Y137 WeakPolarHBondContact O-CB 3.48Å; I133-Y137 WeakPolarHBondContact O-CD2 3.47Å; I133-Y137 PolarHBondContact O-N 2.74Å
134F54.1Low52.9Low15 Ų1564.8 Ų64.87%0.06634%0.344CS..Hα-helixtrans-59.9-43.7-179.2-165.7-99.7000113.1M23 I24 E27 I70 R130 F131 L132 V136 Y137 C138M23-F134 HydrophobicContact CB-CE1 3.95Å; M23-F134 HydrophobicContact CB-CZ 3.78Å; M23-F134 HydrophobicContact CG-CZ 4.18Å; M23-F134 HydrophobicContact SD-CZ 3.93Å; I24-F134 HydrophobicContact CG1-CE1 4.41Å; E27-F134 HydrophobicContact CB-CD1 4.17Å; E27-F134 HydrophobicContact CB-CE1 4.15Å; E27-F134 HydrophobicContact CG-CD1 3.77Å; E27-F134 HydrophobicContact CG-CD2 4.06Å; E27-F134 HydrophobicContact CG-CE1 3.76Å; E27-F134 HydrophobicContact CG-CE2 4.08Å; E27-F134 HydrophobicContact CG-CG 3.9Å; E27-F134 HydrophobicContact CG-CZ 3.91Å; I70-F134 HydrophobicContact CD1-CD2 4.12Å; I70-F134 HydrophobicContact CD1-CE2 3.86Å; I70-F134 HydrophobicContact CG1-CE2 4.48Å; R130-F134 VanDerWaalsContact O-CB 3.28Å; R130-F134 WeakPolarHBondContact O-CB 3.42Å; R130-F134 PolarHBondContact O-N 3.43Å; F131-F134 PolarHBondContact O-N 2.92Å; L132-F134 VanDerWaalsContact C-N 3.32Å; L132-F134 PolarHBondContact O-N 3.37Å; F134-V136 PolarHBondContact O-N 2.9Å; F134-Y137 PolarHBondContact O-N 3.47Å; F134-C138 WeakPolarHBondContact CE1-SG 3.39Å; F134-C138 WeakPolarHBondContact O-CB 3.44Å; F134-C138 PolarHBondContact O-N 3.49Å; F134-C138 PolarHBondContact O-SG 3.21Å
135I54.5Low53.1Low56 Ų5662.6 Ų62.629%0.28733%0.326SS..Hα-helixtrans-57.8-48.9173.7-79173.1000111.2W16 F131 L132 I133 Y137 C138 H139W16-I135 HydrophobicContact CH2-CG2 4.38Å; F131-I135 HydrophobicContact CD1-CD1 3.73Å; F131-I135 HydrophobicContact CE1-CD1 3.36Å; F131-I135 HydrophobicContact CE1-CG1 4.35Å; F131-I135 HydrophobicContact CG-CD1 4.47Å; F131-I135 HydrophobicContact CZ-CD1 3.8Å; F131-I135 HydrophobicContact CZ-CG1 4.44Å; F131-I135 WeakPolarHBondContact O-CB 3.37Å; F131-I135 WeakPolarHBondContact O-CG1 3.46Å; F131-I135 PolarHBondContact O-N 2.9Å; L132-I135 PolarHBondContact O-N 3.34Å; I133-I135 PolarHBondContact O-N 3.23Å; I135-Y137 VanDerWaalsContact C-N 3.33Å; I135-Y137 PolarHBondContact O-N 3.4Å; I135-C138 PolarHBondContact O-N 2.82Å; I135-H139 VanDerWaalsContact O-CB 3.3Å; I135-H139 WeakPolarHBondContact O-CB 3.46Å; I135-H139 PolarHBondContact O-N 3.41Å
136V54.3Low53.6Low69 Ų6961.6 Ų61.642%0.41833%0.325SS..Hα-helixtrans-62.8-41.7179.4171.70000110.8L132 I133 F134 H139 H140L132-V136 WeakPolarHBondContact O-CG2 3.44Å; L132-V136 PolarHBondContact O-N 3.42Å; I133-V136 PolarHBondContact O-N 3.33Å; I133-V136 VanDerWaalsContact O-N 3.16Å; F134-V136 PolarHBondContact O-N 2.9Å; V136-H139 PolarHBondContact O-N 3.46Å; V136-H140 PolarHBondContact O-CD2 3.14Å; V136-H140 PolarHBondContact O-N 3.1Å
137Y53.6Low53.8Low119 Ų11967.4 Ų67.447%0.46735%0.346SS..Hα-helixtrans-68.4-42.7177.8-89-105.8000112.7I133 F134 I135 H140 G141I133-Y137 HydrophobicContact CG2-CD2 3.64Å; I133-Y137 HydrophobicContact CG2-CE2 3.69Å; I133-Y137 WeakPolarHBondContact O-CB 3.48Å; I133-Y137 WeakPolarHBondContact O-CD2 3.47Å; I133-Y137 PolarHBondContact O-N 2.74Å; F134-Y137 PolarHBondContact O-N 3.47Å; I135-Y137 VanDerWaalsContact C-N 3.33Å; I135-Y137 PolarHBondContact O-N 3.4Å; Y137-H140 PolarHBondContact O-N 2.92Å; Y137-G141 PolarHBondContact O-N 3.27Å
138C54.4Low53.9Low8 Ų870 Ų705%0.05436%0.358CS..Hα-helixtrans-64.1-40.1174.1-76.90000112.1W16 F134 I135 G141 A142W16-C138 HydrophobicContact CZ3-CB 3.99Å; F134-C138 WeakPolarHBondContact CE1-SG 3.39Å; F134-C138 WeakPolarHBondContact O-CB 3.44Å; F134-C138 PolarHBondContact O-N 3.49Å; F134-C138 PolarHBondContact O-SG 3.21Å; I135-C138 PolarHBondContact O-N 2.82Å; C138-G141 PolarHBondContact O-N 2.85Å; C138-A142 WeakPolarHBondContact O-CB 3.44Å; C138-A142 PolarHBondContact O-N 2.96Å
139H53.6Low54.3Low79 Ų7973 Ų7337%0.36636%0.36SS..Hα-helixtrans-65.3-41175.7171.9-104.1000112I135 V136 R143I135-H139 VanDerWaalsContact O-CB 3.3Å; I135-H139 WeakPolarHBondContact O-CB 3.46Å; I135-H139 PolarHBondContact O-N 3.41Å; V136-H139 PolarHBondContact O-N 3.46Å; H139-R143 PolarHBondContact CE1-NE 3.23Å; H139-R143 PolarHBondContact CE1-NH2 3.4Å; H139-R143 VanDerWaalsContact CE1-NH2 3.3Å; H139-R143 PolarHBondContact NE2-NE 2.9Å; H139-R143 PolarHBondContact NE2-NH2 2.93Å; H139-R143 WeakPolarHBondContact O-CG 3.44Å; H139-R143 PolarHBondContact O-N 3.01Å
140H53.8Low54.8Low112 Ų11275 Ų7552%0.51936%0.361SS..Hα-helixtrans-63.1-42.6170.3-93.1-81.5000112.3V136 Y137 R143 C144V136-H140 PolarHBondContact O-CD2 3.14Å; V136-H140 PolarHBondContact O-N 3.1Å; Y137-H140 PolarHBondContact O-N 2.92Å; H140-R143 WeakPolarHBondContact O-CB 3.25Å; H140-R143 PolarHBondContact O-N 3.1Å; H140-C144 PolarHBondContact O-N 3.02Å; H140-C144 PolarHBondContact O-SG 3.03Å; H140-C144 VanDerWaalsContact O-SG 3.4Å
141G53.7Low55.4Low10 Ų1078.5 Ų78.510%0.10338%0.38CS..Hα-helixtrans-63.2-41.8178.900000114.4Y137 C138 R143 C144 D145Y137-G141 PolarHBondContact O-N 3.27Å; C138-G141 PolarHBondContact O-N 2.85Å; G141-R143 VanDerWaalsContact C-N 3.3Å; G141-R143 PolarHBondContact O-N 2.97Å; G141-C144 WeakPolarHBondContact O-CB 3.39Å; G141-C144 PolarHBondContact O-N 2.9Å; G141-D145 PolarHBondContact O-N 3.23Å
142A54Low56Low35 Ų3577.8 Ų77.829%0.28938%0.382SS..Hα-helixtrans-64.1-35.1174.900000112.1C138 D145 A146C138-A142 WeakPolarHBondContact O-CB 3.44Å; C138-A142 PolarHBondContact O-N 2.96Å; A142-D145 PolarHBondContact O-N 3.42Å; A142-A146 PolarHBondContact O-N 3.42Å; A142-A146 VanDerWaalsContact O-N 3.13Å
143R53.2Low56.8Low132 Ų13278.4 Ų78.450%0.49838%0.381SS..Hα-helixtrans-65.3-43171.6-72177.7176.8-151.1-4.7111.8H139 H140 G141 D145 A146 Y147H139-R143 PolarHBondContact CE1-NE 3.23Å; H139-R143 PolarHBondContact CE1-NH2 3.4Å; H139-R143 VanDerWaalsContact CE1-NH2 3.3Å; H139-R143 PolarHBondContact NE2-NE 2.9Å; H139-R143 PolarHBondContact NE2-NH2 2.93Å; H139-R143 WeakPolarHBondContact O-CG 3.44Å; H139-R143 PolarHBondContact O-N 3.01Å; H140-R143 WeakPolarHBondContact O-CB 3.25Å; H140-R143 PolarHBondContact O-N 3.1Å; G141-R143 VanDerWaalsContact C-N 3.3Å; G141-R143 PolarHBondContact O-N 2.97Å; R143-D145 VanDerWaalsContact C-N 3.33Å; R143-D145 PolarHBondContact O-N 3.13Å; R143-A146 PolarHBondContact O-N 2.99Å; R143-Y147 WeakPolarHBondContact O-CD2 3.35Å; R143-Y147 PolarHBondContact O-N 3.39Å
144C52.1Low57.7Low56 Ų5678.9 Ų78.938%0.37838%0.377SS..Hα-helixtrans-59-44.7173.7-65.50000111.3Y77 H140 G141 A146 Y147 H148Y77-C144 HydrophobicContact CE2-CB 3.89Å; Y77-C144 WeakPolarHBondContact OH-CB 3.5Å; Y77-C144 PolarHBondContact OH-O 3.25Å; H140-C144 PolarHBondContact O-N 3.02Å; H140-C144 PolarHBondContact O-SG 3.03Å; H140-C144 VanDerWaalsContact O-SG 3.4Å; G141-C144 WeakPolarHBondContact O-CB 3.39Å; G141-C144 PolarHBondContact O-N 2.9Å; C144-A146 VanDerWaalsContact C-N 3.35Å; C144-A146 PolarHBondContact O-N 3.48Å; C144-Y147 PolarHBondContact O-N 3.5Å; C144-Y147 VanDerWaalsContact O-N 3.1Å; C144-H148 PolarHBondContact O-N 2.85Å
145D52.8Low58.6Low47 Ų4784.1 Ų84.125%0.25140%0.402SS..Hα-helixtrans-57.7-47.7179.8-176.714.4000110.7Y77 G141 A142 R143 Y147 H148 R149Y77-D145 VanDerWaalsContact OH-CA 3.25Å; Y77-D145 WeakPolarHBondContact OH-CA 3.35Å; Y77-D145 PolarHBondContact OH-N 2.87Å; G141-D145 PolarHBondContact O-N 3.23Å; A142-D145 PolarHBondContact O-N 3.42Å; R143-D145 VanDerWaalsContact C-N 3.33Å; R143-D145 PolarHBondContact O-N 3.13Å; D145-Y147 PolarHBondContact O-N 3.43Å; D145-H148 PolarHBondContact O-N 3.1Å; D145-R149 WeakPolarHBondContact O-CG 3.21Å; D145-R149 PolarHBondContact O-N 2.75Å; D145-R149 IonicContact OD1-CZ 3.58Å; D145-R149 IonicContact OD1-NE 2.74Å; D145-R149 PolarHBondContact OD1-NE 3.37Å; D145-R149 IonicContact OD1-NH2 3.64Å; D145-R149 PolarHBondContact OD1-NH2 2.94Å; D145-R149 IonicContact OD2-CZ 3.57Å; D145-R149 IonicContact OD2-NE 3.49Å; D145-R149 IonicContact OD2-NH2 2.82Å; D145-R149 PolarHBondContact OD2-NH2 3.09Å
146A57Low59.5Low50 Ų5087.2 Ų87.241%0.41342%0.416SS..Hα-helixtrans-58.4-43.9173.300000113.1A142 R143 C144 H148 F150A142-A146 PolarHBondContact O-N 3.42Å; A142-A146 VanDerWaalsContact O-N 3.13Å; R143-A146 PolarHBondContact O-N 2.99Å; C144-A146 VanDerWaalsContact C-N 3.35Å; C144-A146 PolarHBondContact O-N 3.48Å; A146-H148 PolarHBondContact O-N 3.01Å; A146-F150 WeakPolarHBondContact O-CB 3.45Å; A146-F150 PolarHBondContact O-N 3.12Å; A146-F150 VanDerWaalsContact O-N 3.12Å
147Y54.8Low60.4Low169 Ų16989.4 Ų89.466%0.66342%0.419SS*.Hα-helixtrans-65-36.2177-94.6-72.8000113.5R143 C144 D145 L151R143-Y147 WeakPolarHBondContact O-CD2 3.35Å; R143-Y147 PolarHBondContact O-N 3.39Å; C144-Y147 PolarHBondContact O-N 3.5Å; C144-Y147 VanDerWaalsContact O-N 3.1Å; D145-Y147 PolarHBondContact O-N 3.43Å; Y147-L151 PolarHBondContact O-N 3.12Å; Y147-L151 VanDerWaalsContact O-N 3.12Å
148H56.2Low61.3Low75 Ų7588.8 Ų88.835%0.34742%0.421SS..Hα-helixtrans-76.4-39.5-179.7-175.347.9000112.3Y77 C144 D145 A146 F150 L151 V152Y77-H148 HydrophobicContact CE1-CB 3.55Å; Y77-H148 AromaticContact CE1-CD2 3.56Å; Y77-H148 AromaticContact CE1-CG 3.61Å; C144-H148 PolarHBondContact O-N 2.85Å; D145-H148 PolarHBondContact O-N 3.1Å; A146-H148 PolarHBondContact O-N 3.01Å; H148-F150 VanDerWaalsContact C-N 3.28Å; H148-F150 PolarHBondContact O-N 3.43Å; H148-L151 WeakPolarHBondContact O-CB 3.36Å; H148-L151 PolarHBondContact O-N 3.01Å; H148-L151 VanDerWaalsContact O-N 3.09Å; H148-V152 WeakPolarHBondContact O-CG2 3.38Å; H148-V152 PolarHBondContact O-N 3.5Å
149R58.8Low62.2Low136 Ų13695.4 Ų95.451%0.51346%0.455SS..Hα-helixtrans-59.6-42.5172.1-66.2-176-153.2-169.28.8111.3D145 L151 V152 E153D145-R149 WeakPolarHBondContact O-CG 3.21Å; D145-R149 PolarHBondContact O-N 2.75Å; D145-R149 IonicContact OD1-CZ 3.58Å; D145-R149 IonicContact OD1-NE 2.74Å; D145-R149 PolarHBondContact OD1-NE 3.37Å; D145-R149 IonicContact OD1-NH2 3.64Å; D145-R149 PolarHBondContact OD1-NH2 2.94Å; D145-R149 IonicContact OD2-CZ 3.57Å; D145-R149 IonicContact OD2-NE 3.49Å; D145-R149 IonicContact OD2-NH2 2.82Å; D145-R149 PolarHBondContact OD2-NH2 3.09Å; R149-L151 VanDerWaalsContact C-N 3.3Å; R149-L151 PolarHBondContact O-N 2.84Å; R149-V152 PolarHBondContact O-N 3.21Å; R149-E153 WeakPolarHBondContact O-CB 3.43Å; R149-E153 WeakPolarHBondContact O-CG 3.13Å; R149-E153 PolarHBondContact O-N 3.35Å
150F62.7Low63.1Low108 Ų10899.9 Ų99.947%0.47448%0.476SS..Hα-helixtrans-58.3-40173.2-178.8-91.8000112.7A146 H148 Y154A146-F150 WeakPolarHBondContact O-CB 3.45Å; A146-F150 PolarHBondContact O-N 3.12Å; A146-F150 VanDerWaalsContact O-N 3.12Å; H148-F150 VanDerWaalsContact C-N 3.28Å; H148-F150 PolarHBondContact O-N 3.43Å; F150-Y154 WeakPolarHBondContact O-CB 3.48Å; F150-Y154 PolarHBondContact O-N 3.03Å
151L66Low63.6Low93 Ų93103.6 Ų103.649%0.48749%0.491SS..Hα-helixtrans-65.5-43.6174.9-87.6159.1000112.6Y147 H148 R149 Y154 E155Y147-L151 PolarHBondContact O-N 3.12Å; Y147-L151 VanDerWaalsContact O-N 3.12Å; H148-L151 WeakPolarHBondContact O-CB 3.36Å; H148-L151 PolarHBondContact O-N 3.01Å; H148-L151 VanDerWaalsContact O-N 3.09Å; R149-L151 VanDerWaalsContact C-N 3.3Å; R149-L151 PolarHBondContact O-N 2.84Å; L151-Y154 PolarHBondContact O-N 3.49Å; L151-E155 WeakPolarHBondContact O-CG 3.24Å; L151-E155 PolarHBondContact O-N 3.22Å
152V68.3Low64.1Low52 Ų52108.3 Ų108.332%0.31551%0.51SS..Hα-helixtrans-67.4-46.4178.6175.80000111.2H148 R149 Y154 E155 E156H148-V152 WeakPolarHBondContact O-CG2 3.38Å; H148-V152 PolarHBondContact O-N 3.5Å; R149-V152 PolarHBondContact O-N 3.21Å; V152-Y154 PolarHBondContact O-N 3.21Å; V152-E155 PolarHBondContact O-N 2.91Å; V152-E156 WeakPolarHBondContact O-CG 3.46Å; V152-E156 PolarHBondContact O-N 2.94Å
153E71.4Confident64.7Low126 Ų126112.2 Ų112.259%0.58952%0.522SS*.Hα-helixtrans-61.3-33.2174.8-71.6172.4-168.700111.7R149 F157R149-E153 WeakPolarHBondContact O-CB 3.43Å; R149-E153 WeakPolarHBondContact O-CG 3.13Å; R149-E153 PolarHBondContact O-N 3.35Å; E153-F157 VanDerWaalsContact O-CB 3.24Å; E153-F157 WeakPolarHBondContact O-CB 3.24Å; E153-F157 PolarHBondContact O-N 3.35Å
154Y71.9Confident65.3Low109 Ų109111.1 Ų111.143%0.42752%0.523SS..Hα-helixtrans-71.3-42.8174.4-172.7-83.6000112.4F150 L151 V152 F157 E158F150-Y154 WeakPolarHBondContact O-CB 3.48Å; F150-Y154 PolarHBondContact O-N 3.03Å; L151-Y154 PolarHBondContact O-N 3.49Å; V152-Y154 PolarHBondContact O-N 3.21Å; Y154-F157 PolarHBondContact O-N 2.96Å; Y154-E158 HydrophobicContact CD1-CG 4.3Å; Y154-E158 HydrophobicContact CE1-CG 3.71Å; Y154-E158 VanDerWaalsContact CE1-OE1 3.24Å; Y154-E158 WeakPolarHBondContact CE1-OE1 3.45Å; Y154-E158 VanDerWaalsContact CZ-OE1 3.24Å; Y154-E158 PolarHBondContact O-N 2.89Å; Y154-E158 PolarHBondContact OH-OE1 3.04Å
155E73.6Confident66.1Low126 Ų126114.3 Ų114.359%0.58953%0.532SS*.Hα-helixtrans-63.9-42.8174.9-76.5-177.916400111.7L151 V152 F157 E158 L159L151-E155 WeakPolarHBondContact O-CG 3.24Å; L151-E155 PolarHBondContact O-N 3.22Å; V152-E155 PolarHBondContact O-N 2.91Å; E155-F157 PolarHBondContact O-N 3.18Å; E155-E158 PolarHBondContact O-N 3.37Å; E155-L159 WeakPolarHBondContact O-CG 3.33Å; E155-L159 PolarHBondContact O-N 2.6Å
156E74Confident66.9Low121 Ų121118.5 Ų118.557%0.56555%0.549SS*.Hα-helixtrans-61.1-43.1173.6-72.2-179.217100111.4V152 E158 L159 E160V152-E156 WeakPolarHBondContact O-CG 3.46Å; V152-E156 PolarHBondContact O-N 2.94Å; E156-E158 PolarHBondContact O-N 3.33Å; E156-L159 PolarHBondContact O-N 2.95Å; E156-E160 PolarHBondContact O-N 3.1Å
157F73.8Confident67.6Low114 Ų114123.1 Ų123.150%0.556%0.558SS.*Hα-helixtrans-71.9-24.9178.5-176.6-110.2000114.8E153 Y154 E155E153-F157 VanDerWaalsContact O-CB 3.24Å; E153-F157 WeakPolarHBondContact O-CB 3.24Å; E153-F157 PolarHBondContact O-N 3.35Å; Y154-F157 PolarHBondContact O-N 2.96Å; E155-F157 PolarHBondContact O-N 3.18Å
158E72Confident68.5Low106 Ų106119.8 Ų119.850%0.49555%0.551SS.*Hα-helixtrans-77.7-29168.2-78.3-15916700112.6Y154 E155 E156Y154-E158 HydrophobicContact CD1-CG 4.3Å; Y154-E158 HydrophobicContact CE1-CG 3.71Å; Y154-E158 VanDerWaalsContact CE1-OE1 3.24Å; Y154-E158 WeakPolarHBondContact CE1-OE1 3.45Å; Y154-E158 VanDerWaalsContact CZ-OE1 3.24Å; Y154-E158 PolarHBondContact O-N 2.89Å; Y154-E158 PolarHBondContact OH-OE1 3.04Å; E155-E158 PolarHBondContact O-N 3.37Å; E156-E158 PolarHBondContact O-N 3.33Å
159L72.6Confident69.4Low147 Ų147123.2 Ų123.277%0.7757%0.566SS**Hα-helixtrans-74.3-22.1176-75.8166.4000114.1E155 E156 K161E155-L159 WeakPolarHBondContact O-CG 3.33Å; E155-L159 PolarHBondContact O-N 2.6Å; E156-L159 PolarHBondContact O-N 2.95Å; L159-K161 VanDerWaalsContact C-N 3.34Å
160E72.4Confident70.3Confident173 Ų173122.2 Ų122.281%0.80857%0.571SS**THydrogen-bonded Turntrans-83.41.4175.7-72-165.6152.400114.8E156E156-E160 PolarHBondContact O-N 3.1Å
161K65Low71Confident191 Ų191123.5 Ų123.583%0.8358%0.58SS**  trans-103.30-177.7-76.8178.1-177.3159.20115L159L159-K161 VanDerWaalsContact C-N 3.34Å

Retrieved 161 of 161 residues in 46.3 ms (Link to these results)