A0A077ZEN3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZEN3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 300 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.7Very low36Very low238 Ų238141.6 Ų141.6100%1.17279%0.793SS**  0108.30-74.9159.5162.800107.2
2N32.8Very low36.7Very low171 Ų171138.3 Ų138.391%0.91478%0.779SS**  trans16774156.3-92.17.7000107.1
3S34.2Very low37.7Very low112 Ų112136.5 Ų136.578%0.78377%0.765SS**  trans-119.9149.5151.4-84.90000105.1
4T37.1Very low38.7Very low127 Ų127131.3 Ų131.378%0.77974%0.742SS**  trans81.387.8-179.977.90000115.7
5D39.8Very low39.6Very low161 Ų161132.6 Ų132.686%0.86175%0.746SS**  -144.882128.6-84.4-36.5000107.4P7D5-P7 WeakPolarHBondContact O-CD 3.29Å
6I35.1Very low40.8Very low161 Ų161128.8 Ų128.883%0.82672%0.722SS**  trans-89.2103.7154.5-62.5174.2000103.6N8I6-N8 PolarHBondContact O-N 3.02Å
7P37.2Very low41.9Very low113 Ų113125.7 Ų125.773%0.73471%0.709SS**  trans-69.4121.7-178.6-13.629.1000108.9D5 G9D5-P7 WeakPolarHBondContact O-CD 3.29Å; P7-G9 PolarHBondContact O-N 3.45Å
8N33.8Very low43Very low121 Ų121119.7 Ų119.765%0.64768%0.676SS**  trans-40.7106.4168.2-80-41.3000112I6 N10 K11I6-N8 PolarHBondContact O-N 3.02Å; N8-N10 PolarHBondContact O-N 3.11Å; N8-K11 PolarHBondContact O-N 3.18Å
9G35.9Very low43.9Very low54 Ų54114.9 Ų114.956%0.55765%0.652SS**THydrogen-bonded Turntrans-61.2-2172.800000115.2P7P7-G9 PolarHBondContact O-N 3.45Å
10N40.4Very low44.6Very low145 Ų145113.4 Ų113.478%0.77564%0.641SS**THydrogen-bonded Turntrans-90.8-12.8-179.5-73.711.3000114.5N8N8-N10 PolarHBondContact O-N 3.11Å
11K36.8Very low45.5Very low155 Ų155109.1 Ų109.167%0.67462%0.617SS**SBendtrans-92.8-17179.9-74-176.1179.2174.40114.4N8 S14N8-K11 PolarHBondContact O-N 3.18Å; K11-S14 PolarHBondContact O-OG 3.09Å
12T44.1Very low47.4Very low101 Ų101101.1 Ų101.162%0.6258%0.581SS**SBendtrans-84.9-23.4178.4450000112.8
13L50.7Low49.2Very low115 Ų11593.1 Ų93.160%0.60254%0.539SS*.G310 helixtrans-71.8-30.8-179.8-160.973.5000112.6L15L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 3.11Å
14S51.2Low51Low64 Ų6488.7 Ų88.745%0.44851%0.507SS..G310 helixtrans-79.9-7-177.461.10000114.8K11 Q217K11-S14 PolarHBondContact O-OG 3.09Å; S14-Q217 VanDerWaalsContact C-NE2 3.28Å; S14-Q217 PolarHBondContact O-NE2 3.49Å
15L52.9Low53Low151 Ų15186.1 Ų86.179%0.79149%0.492SS*.G310 helixtrans-109.6-1.1179.5-74.4172.9000113.5L13L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 3.11Å
16L57.7Low54.9Low71 Ų7182.1 Ų82.137%0.37247%0.47SS..SBendtrans-70.8131.3174-120.190000109.3C18 D20L16-C18 PolarHBondContact O-N 3.17Å; L16-D20 HydrophobicContact CD2-CB 3.59Å; L16-D20 HydrophobicContact CG-CB 4.27Å
17P59.3Low57Low77 Ų7778.5 Ų78.550%0.546%0.459SS..  trans-60.2137.9167.626.5-32.1000108.7S19 D20P17-S19 PolarHBondContact O-N 3.29Å; P17-D20 HydrophobicContact CG-CB 4.41Å; P17-D20 VanDerWaalsContact CG-OD2 3.29Å; P17-D20 WeakPolarHBondContact CG-OD2 3.44Å; P17-D20 PolarHBondContact O-N 3.01Å
18C61.8Low58.9Low17 Ų1778.7 Ų78.712%0.11545%0.45CS..G310 helixtrans-55.9-19-173.4-71.30000114.8L16 L21 C214 P220L16-C18 PolarHBondContact O-N 3.17Å; C18-L21 WeakPolarHBondContact O-CB 3.38Å; C18-L21 PolarHBondContact O-N 3.41Å; C18-C214 HydrophobicContact CB-CB 3.83Å; C18-C214 WeakPolarHBondContact CB-SG 3.06Å; C18-C214 WeakPolarHBondContact SG-CB 3.32Å; C18-C214 CovalentContact SG-SG 2.02Å; C18-C214 PolarHBondContact SG-SG 3.06Å; C18-P220 WeakPolarHBondContact O-CA 3.3Å; C18-P220 WeakPolarHBondContact O-CB 3.38Å
19S59.8Low61.2Low30 Ų3073.1 Ų73.121%0.2142%0.42CS..G310 helixtrans-81-15.6178.6-1610000115.5P17 L21 P145P17-S19 PolarHBondContact O-N 3.29Å; S19-L21 VanDerWaalsContact C-N 3.26Å; S19-P145 VanDerWaalsContact CB-CG 3.44Å; S19-P145 WeakPolarHBondContact OG-CB 3.47Å; S19-P145 WeakPolarHBondContact OG-CD 3.43Å; S19-P145 WeakPolarHBondContact OG-CG 3.26Å
20D59.3Low63.5Low84 Ų8475.2 Ų75.245%0.44941%0.412SS..G310 helixtrans-89.51.7173.3-65.7-15.6000111.2L16 P17 V22L16-D20 HydrophobicContact CD2-CB 3.59Å; L16-D20 HydrophobicContact CG-CB 4.27Å; P17-D20 HydrophobicContact CG-CB 4.41Å; P17-D20 VanDerWaalsContact CG-OD2 3.29Å; P17-D20 WeakPolarHBondContact CG-OD2 3.44Å; P17-D20 PolarHBondContact O-N 3.01Å; D20-V22 PolarHBondContact O-N 3.04Å
21L63.7Low65.5Low24 Ų2475.1 Ų75.113%0.12641%0.41CS..PPolyproline II helixtrans-77.4120.4-178.9-139.880.1000110.7C18 S19 Q217 P220C18-L21 WeakPolarHBondContact O-CB 3.38Å; C18-L21 PolarHBondContact O-N 3.41Å; S19-L21 VanDerWaalsContact C-N 3.26Å; L21-Q217 WeakPolarHBondContact CD2-O 3.35Å; L21-P220 HydrophobicContact CB-CB 4.14Å; L21-P220 WeakPolarHBondContact O-CB 3.38Å; L21-P220 WeakPolarHBondContact O-CG 3.45Å
22V70.9Confident67.6Low70 Ų7073.7 Ų73.742%0.42441%0.406SS..PPolyproline II helixtrans-75.1130.3176.6-176.70000109.7D20 D142D20-V22 PolarHBondContact O-N 3.04Å; V22-D142 VanDerWaalsContact CG2-OD1 3.27Å; V22-D142 WeakPolarHBondContact CG2-OD1 3.26Å
23T71.6Confident69.4Low3 Ų369.9 Ų69.92%0.01838%0.382CS..PPolyproline II helixtrans-51.4123.4172.827.10000112.2P220 Y222 A223T23-P220 HydrophobicContact CG2-CG 3.96Å; T23-Y222 WeakPolarHBondContact CB-OH 3.31Å; T23-Y222 HydrophobicContact CG2-CE2 3.77Å; T23-Y222 WeakPolarHBondContact CG2-OH 3.28Å; T23-Y222 PolarHBondContact OG1-OH 3.35Å; T23-A223 HydrophobicContact CG2-CB 3.71Å
24P72.7Confident71Confident19 Ų1966.9 Ų66.912%0.12337%0.367CS..PPolyproline II helixtrans-68.8152.2-176.926.5-33.9000112H28 Y29 L219P24-H28 HydrophobicContact CB-CB 4.24Å; P24-Y29 HydrophobicContact CG-CD2 4.42Å; P24-L219 HydrophobicContact CG-CD1 3.96Å
25P77.7Confident72.7Confident72 Ų7269.2 Ų69.247%0.46838%0.381SS..PPolyproline II helixtrans-68.7159.8168.430.7-33.9000111S27 H28 Y29P25-S27 VanDerWaalsContact C-N 3.27Å; P25-S27 PolarHBondContact O-N 3.3Å; P25-S27 VanDerWaalsContact O-N 3.12Å; P25-H28 HydrophobicContact CG-CB 4.26Å; P25-H28 PolarHBondContact O-N 3.44Å; P25-Y29 PolarHBondContact O-N 3.21Å
26L79.4Confident74.4Confident77 Ų7765.2 Ų65.240%0.40337%0.369SS..Hα-helixtrans-47-44.7-176.617964.8000114H28 Y29 W30 V94 V95L26-H28 PolarHBondContact O-N 3.4Å; L26-Y29 PolarHBondContact O-N 3.43Å; L26-W30 VanDerWaalsContact O-CD1 3.25Å; L26-W30 PolarHBondContact O-N 3.4Å; L26-V94 HydrophobicContact CD1-CG1 3.88Å; L26-V94 WeakPolarHBondContact CD1-O 3.39Å; L26-V95 HydrophobicContact CD1-CG2 4.09Å; L26-V95 HydrophobicContact CD2-CG2 4.47Å
27S80.6Confident75.8Confident85 Ų8563.2 Ų63.259%0.59436%0.36SS*.Hα-helixtrans-65.8-37.7-177.151.30000113.3P25 L31P25-S27 VanDerWaalsContact C-N 3.27Å; P25-S27 PolarHBondContact O-N 3.3Å; P25-S27 VanDerWaalsContact O-N 3.12Å; S27-L31 WeakPolarHBondContact O-CD1 3.43Å; S27-L31 WeakPolarHBondContact O-CG 3.45Å
28H77.8Confident77.3Confident117 Ų11761.2 Ų61.254%0.54235%0.346SS..Hα-helixtrans-78.2-34.1178.1-117.8-76.2000111.6P24 P25 L26 L31 E32P24-H28 HydrophobicContact CB-CB 4.24Å; P25-H28 HydrophobicContact CG-CB 4.26Å; P25-H28 PolarHBondContact O-N 3.44Å; L26-H28 PolarHBondContact O-N 3.4Å; H28-L31 PolarHBondContact O-N 2.95Å; H28-E32 PolarHBondContact O-N 3.33Å
29Y81.9Confident78.7Confident4 Ų462.6 Ų62.62%0.01636%0.359CS..Hα-helixtrans-58.4-50.6178.4177.4-114.3000111.9P24 P25 L26 L31 E32 V33 I41 P96 L219P24-Y29 HydrophobicContact CG-CD2 4.42Å; P25-Y29 PolarHBondContact O-N 3.21Å; L26-Y29 PolarHBondContact O-N 3.43Å; Y29-L31 PolarHBondContact O-N 3.09Å; Y29-E32 PolarHBondContact O-N 3.08Å; Y29-V33 HydrophobicContact CE2-CB 4.46Å; Y29-V33 HydrophobicContact CE2-CG2 4.28Å; Y29-V33 VanDerWaalsContact O-CB 3.28Å; Y29-V33 WeakPolarHBondContact O-CB 3.43Å; Y29-V33 PolarHBondContact O-N 3.42Å; Y29-I41 HydrophobicContact CE1-CD1 4.44Å; Y29-P96 HydrophobicContact CD1-CG 3.94Å; Y29-P96 HydrophobicContact CD2-CG 3.71Å; Y29-P96 HydrophobicContact CE1-CG 3.9Å; Y29-P96 HydrophobicContact CE2-CG 3.68Å; Y29-P96 HydrophobicContact CG-CG 3.83Å; Y29-L219 HydrophobicContact CD2-CD1 3.94Å; Y29-L219 HydrophobicContact CE2-CD1 3.9Å; Y29-L219 HydrophobicContact CE2-CD2 4.49Å
30W83.4Confident80.2Confident99 Ų9964.2 Ų64.238%0.37537%0.365SS..Hα-helixtrans-69.5-15.6-178.5-74.4107.1000115L26 V33 T38 I41 V94L26-W30 VanDerWaalsContact O-CD1 3.25Å; L26-W30 PolarHBondContact O-N 3.4Å; W30-V33 HydrophobicContact CE3-CG1 3.96Å; W30-T38 HydrophobicContact CZ3-CG2 4.08Å; W30-I41 HydrophobicContact CH2-CD1 4.23Å; W30-I41 HydrophobicContact CH2-CG2 4.17Å; W30-V94 HydrophobicContact CZ2-CB 4.41Å; W30-V94 HydrophobicContact CZ2-CG1 4.08Å; W30-V94 HydrophobicContact CZ2-CG2 4.25Å
31L81.9Confident81.7Confident142 Ų14260.3 Ų60.374%0.74334%0.344SS*.Hα-helixtrans-82.6-29.4178.6-73.5171.6000112.9S27 H28 Y29S27-L31 WeakPolarHBondContact O-CD1 3.43Å; S27-L31 WeakPolarHBondContact O-CG 3.45Å; H28-L31 PolarHBondContact O-N 2.95Å; Y29-L31 PolarHBondContact O-N 3.09Å
32E81.1Confident83.2Confident126 Ų12663.2 Ų63.259%0.58936%0.359SS*.Hα-helixtrans-114.4-9.4-171.8-164.267.4-125.400112H28 Y29 L218H28-E32 PolarHBondContact O-N 3.33Å; Y29-E32 PolarHBondContact O-N 3.08Å; E32-L218 HydrophobicContact CB-CD1 3.61Å; E32-L218 HydrophobicContact CB-CD2 3.64Å; E32-L218 HydrophobicContact CB-CG 4.23Å; E32-L218 HydrophobicContact CG-CD1 3.27Å; E32-L218 HydrophobicContact CG-CD2 3.68Å; E32-L218 HydrophobicContact CG-CG 3.98Å; E32-L218 WeakPolarHBondContact O-CD2 3.47Å
33V82.3Confident84.3Confident20 Ų2064 Ų6412%0.12136%0.36CS..  trans-60.8136.4-179.763.80000112.3Y29 W30 T37 T38Y29-V33 HydrophobicContact CE2-CB 4.46Å; Y29-V33 HydrophobicContact CE2-CG2 4.28Å; Y29-V33 VanDerWaalsContact O-CB 3.28Å; Y29-V33 WeakPolarHBondContact O-CB 3.43Å; Y29-V33 PolarHBondContact O-N 3.42Å; W30-V33 HydrophobicContact CE3-CG1 3.96Å; V33-T37 HydrophobicContact CG2-CG2 3.68Å; V33-T38 VanDerWaalsContact CG1-OG1 3.31Å; V33-T38 WeakPolarHBondContact CG1-OG1 3.2Å
34D84.4Confident85.3Confident53 Ų5364.1 Ų64.128%0.28336%0.361SS..  trans-59.9145.5177.4-57.3-62.9000112.1A36 T37 T38D34-A36 PolarHBondContact O-N 2.82Å; D34-T37 PolarHBondContact O-N 3.35Å; D34-T38 PolarHBondContact O-N 3.22Å; D34-T38 PolarHBondContact O-OG1 3.09Å; D34-T38 VanDerWaalsContact O-OG1 3.09Å
35P87.1Confident86.3Confident113 Ų11367.1 Ų67.173%0.73437%0.372SS*.Hα-helixtrans-61.3-31.6176.624.2-33.6000112.2A39P35-A39 WeakPolarHBondContact O-CB 3.45Å; P35-A39 PolarHBondContact O-N 3.07Å
36A88.7Confident87.2Confident67 Ų6769.9 Ų69.955%0.55438%0.377SS*.Hα-helixtrans-66.9-46.8176.400000111.9D34 T38 A39 L40D34-A36 PolarHBondContact O-N 2.82Å; A36-T38 VanDerWaalsContact C-N 3.32Å; A36-T38 PolarHBondContact O-N 2.94Å; A36-A39 PolarHBondContact O-N 3.36Å; A36-L40 WeakPolarHBondContact O-CG 3.46Å; A36-L40 PolarHBondContact O-N 2.95Å
37T86.9Confident87.9Confident28 Ų2868 Ų6817%0.17237%0.366CS..Hα-helixtrans-62.1-42.2176.1-62.20000111.1V33 D34 A39 L40 I41 L227V33-T37 HydrophobicContact CG2-CG2 3.68Å; D34-T37 PolarHBondContact O-N 3.35Å; T37-A39 PolarHBondContact O-N 3.22Å; T37-L40 PolarHBondContact O-N 2.97Å; T37-I41 HydrophobicContact CG2-CD1 4.15Å; T37-I41 WeakPolarHBondContact O-CG1 3.46Å; T37-I41 PolarHBondContact O-N 3.13Å; T37-L227 HydrophobicContact CG2-CD2 3.63Å
38T89.2Confident88.5Confident35 Ų3564.4 Ų64.422%0.21534%0.342CS..Hα-helixtrans-58.5-45.4173.8-61.90000112W30 V33 D34 A36 L40 I41 I42W30-T38 HydrophobicContact CZ3-CG2 4.08Å; V33-T38 VanDerWaalsContact CG1-OG1 3.31Å; V33-T38 WeakPolarHBondContact CG1-OG1 3.2Å; D34-T38 PolarHBondContact O-N 3.22Å; D34-T38 PolarHBondContact O-OG1 3.09Å; D34-T38 VanDerWaalsContact O-OG1 3.09Å; A36-T38 VanDerWaalsContact C-N 3.32Å; A36-T38 PolarHBondContact O-N 2.94Å; T38-L40 PolarHBondContact O-N 2.89Å; T38-I41 PolarHBondContact O-N 3.47Å; T38-I42 HydrophobicContact CG2-CD1 3.95Å; T38-I42 WeakPolarHBondContact O-CG1 3.18Å; T38-I42 PolarHBondContact O-N 3.5Å
39A92.6Very high89.3Confident46 Ų4663.6 Ų63.638%0.3834%0.34SS..Hα-helixtrans-62.3-41.5177.500000112.3P35 A36 T37 I42 I43P35-A39 WeakPolarHBondContact O-CB 3.45Å; P35-A39 PolarHBondContact O-N 3.07Å; A36-A39 PolarHBondContact O-N 3.36Å; T37-A39 PolarHBondContact O-N 3.22Å; A39-I42 PolarHBondContact O-N 3.08Å; A39-I43 VanDerWaalsContact O-CG1 3.28Å; A39-I43 WeakPolarHBondContact O-CG1 3.46Å; A39-I43 PolarHBondContact O-N 3.3Å
40L91.5Very high90Very high65 Ų6567.2 Ų67.234%0.3436%0.359SS..Hα-helixtrans-62.5-43.4176.2-70.3173000112.2A36 T37 T38 I42 I43 S44 W228 L231A36-L40 WeakPolarHBondContact O-CG 3.46Å; A36-L40 PolarHBondContact O-N 2.95Å; T37-L40 PolarHBondContact O-N 2.97Å; T38-L40 PolarHBondContact O-N 2.89Å; L40-I42 VanDerWaalsContact C-N 3.34Å; L40-I42 PolarHBondContact O-N 3.47Å; L40-I43 PolarHBondContact O-N 3.47Å; L40-S44 PolarHBondContact O-N 3.01Å; L40-S44 PolarHBondContact O-OG 3.25Å; L40-W228 HydrophobicContact CD1-CH2 4.43Å; L40-L231 HydrophobicContact CB-CD1 4.16Å; L40-L231 HydrophobicContact CB-CD2 4.07Å; L40-L231 HydrophobicContact CD1-CD1 4.13Å
41I91.1Very high90.5Very high2 Ų262.5 Ų62.51%0.0134%0.341CS..Hα-helixtrans-60-47175.7-66.2168.8000110Y29 W30 T37 T38 I43 S44 F45 M93 L227Y29-I41 HydrophobicContact CE1-CD1 4.44Å; W30-I41 HydrophobicContact CH2-CD1 4.23Å; W30-I41 HydrophobicContact CH2-CG2 4.17Å; T37-I41 HydrophobicContact CG2-CD1 4.15Å; T37-I41 WeakPolarHBondContact O-CG1 3.46Å; T37-I41 PolarHBondContact O-N 3.13Å; T38-I41 PolarHBondContact O-N 3.47Å; I41-I43 VanDerWaalsContact C-N 3.32Å; I41-I43 PolarHBondContact O-N 3.4Å; I41-S44 PolarHBondContact O-N 2.8Å; I41-S44 VanDerWaalsContact O-N 3.16Å; I41-F45 HydrophobicContact CG2-CD2 3.96Å; I41-F45 HydrophobicContact CG2-CE2 3.83Å; I41-F45 WeakPolarHBondContact O-CD2 3.38Å; I41-F45 PolarHBondContact O-N 3.32Å; I41-M93 HydrophobicContact CG1-CB 4.31Å; I41-M93 HydrophobicContact CG2-CB 4.45Å; I41-L227 HydrophobicContact CD1-CD1 4.34Å
42I93.6Very high91.1Very high85 Ų8560.3 Ų60.344%0.43633%0.33SS..Hα-helixtrans-59-44.1177.7-69.1167.2000111.1T38 A39 L40 S44 F45 F46T38-I42 HydrophobicContact CG2-CD1 3.95Å; T38-I42 WeakPolarHBondContact O-CG1 3.18Å; T38-I42 PolarHBondContact O-N 3.5Å; A39-I42 PolarHBondContact O-N 3.08Å; L40-I42 VanDerWaalsContact C-N 3.34Å; L40-I42 PolarHBondContact O-N 3.47Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 3.35Å; I42-F45 WeakPolarHBondContact O-CB 3.04Å; I42-F45 PolarHBondContact O-N 3.02Å; I42-F46 HydrophobicContact CG2-CD2 3.78Å; I42-F46 HydrophobicContact CG2-CE2 3.47Å; I42-F46 VanDerWaalsContact CG2-CE2 3.47Å; I42-F46 WeakPolarHBondContact O-CD2 3.42Å; I42-F46 PolarHBondContact O-N 2.68Å; I42-F46 VanDerWaalsContact O-N 3.07Å
43I94.2Very high91.7Very high86 Ų8660.6 Ų60.644%0.44133%0.333SS..Hα-helixtrans-59.3-44.5176.1-69.8164.1000110.8A39 L40 I41 F45 F46 E47A39-I43 VanDerWaalsContact O-CG1 3.28Å; A39-I43 WeakPolarHBondContact O-CG1 3.46Å; A39-I43 PolarHBondContact O-N 3.3Å; L40-I43 PolarHBondContact O-N 3.47Å; I41-I43 VanDerWaalsContact C-N 3.32Å; I41-I43 PolarHBondContact O-N 3.4Å; I43-F45 VanDerWaalsContact C-N 3.29Å; I43-F45 PolarHBondContact O-N 3.36Å; I43-F46 WeakPolarHBondContact O-CB 3.5Å; I43-F46 PolarHBondContact O-N 2.65Å; I43-E47 PolarHBondContact O-N 3.04Å
44S93.2Very high92.2Very high5 Ų561.5 Ų61.54%0.03534%0.337CS..Hα-helixtrans-62.2-33.7176.8-64.20000113.3L40 I41 I42 E47 A48 L231L40-S44 PolarHBondContact O-N 3.01Å; L40-S44 PolarHBondContact O-OG 3.25Å; I41-S44 PolarHBondContact O-N 2.8Å; I41-S44 VanDerWaalsContact O-N 3.16Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 3.35Å; S44-E47 PolarHBondContact O-N 3.17Å; S44-A48 WeakPolarHBondContact O-CB 3.45Å; S44-A48 PolarHBondContact O-N 2.87Å; S44-L231 WeakPolarHBondContact OG-CD2 3.25Å
45F94.4Very high92.5Very high82 Ų8261.1 Ų61.136%0.3633%0.333SS..Hα-helixtrans-66-41.2171.2-87.9-84.7000112.3I41 I42 I43 E47 A48 I49 C90 V94I41-F45 HydrophobicContact CG2-CD2 3.96Å; I41-F45 HydrophobicContact CG2-CE2 3.83Å; I41-F45 WeakPolarHBondContact O-CD2 3.38Å; I41-F45 PolarHBondContact O-N 3.32Å; I42-F45 WeakPolarHBondContact O-CB 3.04Å; I42-F45 PolarHBondContact O-N 3.02Å; I43-F45 VanDerWaalsContact C-N 3.29Å; I43-F45 PolarHBondContact O-N 3.36Å; F45-E47 VanDerWaalsContact C-N 3.35Å; F45-A48 WeakPolarHBondContact O-CB 3.16Å; F45-A48 PolarHBondContact O-N 3.5Å; F45-I49 WeakPolarHBondContact O-CG1 3.3Å; F45-I49 PolarHBondContact O-N 2.97Å; F45-C90 HydrophobicContact CD1-CB 4.28Å; F45-C90 HydrophobicContact CD2-CB 4.5Å; F45-C90 HydrophobicContact CE1-CB 3.84Å; F45-C90 HydrophobicContact CE2-CB 4.07Å; F45-C90 HydrophobicContact CZ-CB 3.72Å; F45-V94 HydrophobicContact CE2-CG2 3.5Å; F45-V94 VanDerWaalsContact CE2-CG2 3.5Å; F45-V94 HydrophobicContact CZ-CG2 3.49Å; F45-V94 VanDerWaalsContact CZ-CG2 3.49Å
46F95.1Very high92.8Very high131 Ų13157.6 Ų57.658%0.57532%0.317SS*.Hα-helixtrans-62-43.7174-78.8-69.8000111.5I42 I43 A48 I49 I50I42-F46 HydrophobicContact CG2-CD2 3.78Å; I42-F46 HydrophobicContact CG2-CE2 3.47Å; I42-F46 VanDerWaalsContact CG2-CE2 3.47Å; I42-F46 WeakPolarHBondContact O-CD2 3.42Å; I42-F46 PolarHBondContact O-N 2.68Å; I42-F46 VanDerWaalsContact O-N 3.07Å; I43-F46 WeakPolarHBondContact O-CB 3.5Å; I43-F46 PolarHBondContact O-N 2.65Å; F46-A48 VanDerWaalsContact C-N 3.34Å; F46-A48 PolarHBondContact O-N 3.21Å; F46-I49 PolarHBondContact O-N 3.5Å; F46-I50 WeakPolarHBondContact O-CG1 3.42Å; F46-I50 PolarHBondContact O-N 3.24Å
47E94Very high92.9Very high36 Ų3657.5 Ų57.517%0.16831%0.309CS..Hα-helixtrans-61.1-42173.9-71.2-176.4167.400111.9I43 S44 F45 I49 I50 I51 V234I43-E47 PolarHBondContact O-N 3.04Å; S44-E47 PolarHBondContact O-N 3.17Å; F45-E47 VanDerWaalsContact C-N 3.35Å; E47-I49 VanDerWaalsContact C-N 3.32Å; E47-I49 PolarHBondContact O-N 2.69Å; E47-I50 CarbonylContact O-C 3.58Å; E47-I50 PolarHBondContact O-N 3.33Å; E47-I50 VanDerWaalsContact O-N 3.12Å; E47-I51 VanDerWaalsContact O-CG1 3.25Å; E47-I51 WeakPolarHBondContact O-CG1 3.36Å; E47-I51 PolarHBondContact O-N 3.2Å; E47-V234 HydrophobicContact CB-CG1 3.92Å
48A94.4Very high92.9Very high11 Ų1156.8 Ų56.89%0.09131%0.305CS..Hα-helixtrans-60.3-40.6176.800000112.7S44 F45 F46 I51 L52 S86S44-A48 WeakPolarHBondContact O-CB 3.45Å; S44-A48 PolarHBondContact O-N 2.87Å; F45-A48 WeakPolarHBondContact O-CB 3.16Å; F45-A48 PolarHBondContact O-N 3.5Å; F46-A48 VanDerWaalsContact C-N 3.34Å; F46-A48 PolarHBondContact O-N 3.21Å; A48-I51 PolarHBondContact O-N 3.36Å; A48-L52 WeakPolarHBondContact O-CB 3.26Å; A48-L52 PolarHBondContact O-N 2.91Å; A48-S86 VanDerWaalsContact CA-OG 3.23Å; A48-S86 WeakPolarHBondContact CA-OG 3.47Å; A48-S86 WeakPolarHBondContact CB-OG 3.33Å
49I95.1Very high93Very high100 Ų10057 Ų5751%0.51331%0.307SS..Hα-helixtrans-63.6-44.7174.3-67.5166000110.1F45 F46 E47 I51 L52 M53F45-I49 WeakPolarHBondContact O-CG1 3.3Å; F45-I49 PolarHBondContact O-N 2.97Å; F46-I49 PolarHBondContact O-N 3.5Å; E47-I49 VanDerWaalsContact C-N 3.32Å; E47-I49 PolarHBondContact O-N 2.69Å; I49-I51 PolarHBondContact O-N 3.47Å; I49-L52 WeakPolarHBondContact O-CB 3.41Å; I49-L52 PolarHBondContact O-N 3.35Å; I49-M53 VanDerWaalsContact O-CG 3.31Å; I49-M53 WeakPolarHBondContact O-CG 3.35Å; I49-M53 PolarHBondContact O-N 3.41Å
50I94.9Very high92.7Very high79 Ų7960 Ų6041%0.40531%0.313SS..Hα-helixtrans-61.6-45.5177.3-64.1165000110.4F46 E47 L52 M53 L54 F238F46-I50 WeakPolarHBondContact O-CG1 3.42Å; F46-I50 PolarHBondContact O-N 3.24Å; E47-I50 CarbonylContact O-C 3.58Å; E47-I50 PolarHBondContact O-N 3.33Å; E47-I50 VanDerWaalsContact O-N 3.12Å; I50-L52 VanDerWaalsContact C-N 3.29Å; I50-L52 PolarHBondContact O-N 3.14Å; I50-M53 PolarHBondContact O-N 3.06Å; I50-M53 VanDerWaalsContact O-N 3.16Å; I50-L54 HydrophobicContact CG2-CD1 3.95Å; I50-L54 HydrophobicContact CG2-CG 4.17Å; I50-L54 WeakPolarHBondContact O-CB 3.08Å; I50-L54 VanDerWaalsContact O-CG 3.27Å; I50-L54 WeakPolarHBondContact O-CG 3.26Å; I50-L54 PolarHBondContact O-N 2.98Å; I50-F238 HydrophobicContact CG2-CD2 4.17Å; I50-F238 HydrophobicContact CG2-CE2 3.62Å
51I94.4Very high92.5Very high0 Ų060.9 Ų60.90%031%0.314CS..Hα-helixtrans-57.9-42.4176.2-68.3165000110.7E47 A48 I49 L54 F55 F82 P83 V234 C237 F238 L241E47-I51 VanDerWaalsContact O-CG1 3.25Å; E47-I51 WeakPolarHBondContact O-CG1 3.36Å; E47-I51 PolarHBondContact O-N 3.2Å; A48-I51 PolarHBondContact O-N 3.36Å; I49-I51 PolarHBondContact O-N 3.47Å; I51-L54 PolarHBondContact O-N 3.12Å; I51-F55 WeakPolarHBondContact O-CB 3.15Å; I51-F55 PolarHBondContact O-N 2.9Å; I51-F82 HydrophobicContact CG2-CB 4.19Å; I51-P83 HydrophobicContact CG2-CB 4.13Å; I51-V234 HydrophobicContact CD1-CG1 4.4Å; I51-C237 HydrophobicContact CD1-CB 3.94Å; I51-F238 HydrophobicContact CD1-CB 3.98Å; I51-F238 HydrophobicContact CG1-CB 4.04Å; I51-F238 HydrophobicContact CG1-CD2 4.18Å; I51-L241 HydrophobicContact CB-CD2 4.41Å; I51-L241 HydrophobicContact CG2-CD2 3.81Å; I51-L241 WeakPolarHBondContact O-CD2 3.46Å
52L94.1Very high92.3Very high97 Ų9761.2 Ų61.251%0.50832%0.315SS..Hα-helixtrans-64.2-41.6177.4-174.365.6000112A48 I49 I50 F55 G56 P83A48-L52 WeakPolarHBondContact O-CB 3.26Å; A48-L52 PolarHBondContact O-N 2.91Å; I49-L52 WeakPolarHBondContact O-CB 3.41Å; I49-L52 PolarHBondContact O-N 3.35Å; I50-L52 VanDerWaalsContact C-N 3.29Å; I50-L52 PolarHBondContact O-N 3.14Å; L52-F55 PolarHBondContact O-N 3.42Å; L52-G56 PolarHBondContact O-N 3.37Å; L52-P83 HydrophobicContact CD1-CB 4.24Å
53M94.1Very high91.9Very high132 Ų13261 Ų6165%0.6532%0.318SS*.Hα-helixtrans-64.4-46.1175.8-68-64.1-72.400111.5I49 I50 F55 G56 V57I49-M53 VanDerWaalsContact O-CG 3.31Å; I49-M53 WeakPolarHBondContact O-CG 3.35Å; I49-M53 PolarHBondContact O-N 3.41Å; I50-M53 PolarHBondContact O-N 3.06Å; I50-M53 VanDerWaalsContact O-N 3.16Å; M53-F55 VanDerWaalsContact C-N 3.29Å; M53-F55 PolarHBondContact O-N 2.98Å; M53-G56 PolarHBondContact O-N 3.04Å; M53-G56 VanDerWaalsContact O-N 3.14Å; M53-V57 WeakPolarHBondContact O-CG2 3.17Å; M53-V57 PolarHBondContact O-N 2.81Å
54L92.2Very high91.5Very high39 Ų3960.3 Ų60.320%0.20432%0.315CS..Hα-helixtrans-61.6-38175.7-69.2178.6000111.6I50 I51 V57 C58 F238 L241 M245I50-L54 HydrophobicContact CG2-CD1 3.95Å; I50-L54 HydrophobicContact CG2-CG 4.17Å; I50-L54 WeakPolarHBondContact O-CB 3.08Å; I50-L54 VanDerWaalsContact O-CG 3.27Å; I50-L54 WeakPolarHBondContact O-CG 3.26Å; I50-L54 PolarHBondContact O-N 2.98Å; I51-L54 PolarHBondContact O-N 3.12Å; L54-V57 WeakPolarHBondContact O-CB 3.42Å; L54-V57 PolarHBondContact O-N 3.22Å; L54-C58 PolarHBondContact O-N 2.94Å; L54-C58 PolarHBondContact O-SG 3.23Å; L54-F238 HydrophobicContact CD1-CD2 4.35Å; L54-F238 HydrophobicContact CD1-CE2 4.05Å; L54-L241 HydrophobicContact CB-CD2 3.54Å; L54-L241 HydrophobicContact CB-CG 4.12Å; L54-L241 HydrophobicContact CD1-CD2 4.34Å; L54-M245 HydrophobicContact CB-CE 4.06Å; L54-M245 HydrophobicContact CB-SD 4.1Å; L54-M245 HydrophobicContact CD1-CE 3.58Å; L54-M245 HydrophobicContact CD2-CE 3.56Å; L54-M245 HydrophobicContact CD2-SD 3.89Å; L54-M245 HydrophobicContact CG-CE 3.9Å; L54-M245 HydrophobicContact CG-SD 4.41Å
55F91.9Very high90.9Very high44 Ų4462.9 Ų62.919%0.19333%0.325CS..Hα-helixtrans-62.2-44.5172.8174-108.8000111.7I51 L52 M53 V57 C58 V59 L76 C79 P83I51-F55 WeakPolarHBondContact O-CB 3.15Å; I51-F55 PolarHBondContact O-N 2.9Å; L52-F55 PolarHBondContact O-N 3.42Å; M53-F55 VanDerWaalsContact C-N 3.29Å; M53-F55 PolarHBondContact O-N 2.98Å; F55-V57 VanDerWaalsContact C-N 3.28Å; F55-V57 PolarHBondContact O-N 2.97Å; F55-C58 CarbonylContact O-C 3.6Å; F55-C58 WeakPolarHBondContact O-CA 3.31Å; F55-C58 WeakPolarHBondContact O-CB 3.17Å; F55-C58 PolarHBondContact O-N 2.87Å; F55-C58 VanDerWaalsContact O-N 3.09Å; F55-V59 HydrophobicContact CD1-CG2 4.08Å; F55-V59 HydrophobicContact CD2-CG2 4.26Å; F55-V59 HydrophobicContact CE1-CG2 3.68Å; F55-V59 HydrophobicContact CE2-CG2 3.85Å; F55-V59 HydrophobicContact CG-CG2 4.37Å; F55-V59 HydrophobicContact CZ-CG2 3.55Å; F55-V59 WeakPolarHBondContact O-CG2 3.27Å; F55-V59 PolarHBondContact O-N 2.85Å; F55-L76 HydrophobicContact CE2-CD1 3.92Å; F55-L76 HydrophobicContact CZ-CD1 3.92Å; F55-C79 HydrophobicContact CD2-CB 4.1Å; F55-C79 WeakPolarHBondContact CD2-O 3.46Å; F55-C79 HydrophobicContact CE2-CB 4.11Å; F55-P83 HydrophobicContact CB-CB 4.31Å; F55-P83 HydrophobicContact CB-CG 3.97Å; F55-P83 HydrophobicContact CD1-CG 4.03Å; F55-P83 HydrophobicContact CD2-CG 4.01Å; F55-P83 HydrophobicContact CG-CB 4.47Å; F55-P83 HydrophobicContact CG-CG 3.72Å
56G92.4Very high90.3Very high39 Ų3959.5 Ų59.540%0.40231%0.311SS..Hα-helixtrans-57.5-41.6174.600000112.6L52 M53 V59 H60L52-G56 PolarHBondContact O-N 3.37Å; M53-G56 PolarHBondContact O-N 3.04Å; M53-G56 VanDerWaalsContact O-N 3.14Å; G56-V59 PolarHBondContact O-N 3.36Å; G56-H60 PolarHBondContact O-N 3.3Å
57V91Very high89.5Confident65 Ų6556.9 Ų56.939%0.39431%0.308SS..Hα-helixtrans-62.3-46.3172.8173.70000111M53 L54 F55 V59 H60 F61M53-V57 WeakPolarHBondContact O-CG2 3.17Å; M53-V57 PolarHBondContact O-N 2.81Å; L54-V57 WeakPolarHBondContact O-CB 3.42Å; L54-V57 PolarHBondContact O-N 3.22Å; F55-V57 VanDerWaalsContact C-N 3.28Å; F55-V57 PolarHBondContact O-N 2.97Å; V57-V59 VanDerWaalsContact C-N 3.35Å; V57-V59 PolarHBondContact O-N 3.45Å; V57-H60 WeakPolarHBondContact O-CB 3.47Å; V57-H60 PolarHBondContact O-N 3.32Å; V57-F61 HydrophobicContact CG1-CD2 3.46Å; V57-F61 VanDerWaalsContact CG1-CD2 3.46Å; V57-F61 HydrophobicContact CG1-CE2 3.4Å; V57-F61 VanDerWaalsContact O-CD2 3.25Å; V57-F61 WeakPolarHBondContact O-CD2 3.32Å; V57-F61 PolarHBondContact O-N 2.91Å
58C88.4Confident89Confident13 Ų1356.3 Ų56.39%0.08831%0.308CS..Hα-helixtrans-56.9-45.4174.2-72.70000112.2L54 F55 H60 F61 I62 M245L54-C58 PolarHBondContact O-N 2.94Å; L54-C58 PolarHBondContact O-SG 3.23Å; F55-C58 CarbonylContact O-C 3.6Å; F55-C58 WeakPolarHBondContact O-CA 3.31Å; F55-C58 WeakPolarHBondContact O-CB 3.17Å; F55-C58 PolarHBondContact O-N 2.87Å; F55-C58 VanDerWaalsContact O-N 3.09Å; C58-H60 VanDerWaalsContact C-N 3.31Å; C58-H60 PolarHBondContact O-N 3.34Å; C58-F61 PolarHBondContact O-N 2.85Å; C58-I62 HydrophobicContact CB-CD1 4.42Å; C58-I62 VanDerWaalsContact O-CB 3.32Å; C58-I62 WeakPolarHBondContact O-CB 3.07Å; C58-I62 WeakPolarHBondContact O-CD1 3.4Å; C58-I62 WeakPolarHBondContact O-CG1 3.22Å; C58-I62 PolarHBondContact O-N 3.13Å; C58-M245 WeakPolarHBondContact SG-CG 3.36Å
59V89.8Confident88.4Confident41 Ų4166.6 Ų66.625%0.24835%0.345CS..Hα-helixtrans-58.1-47.1176.7-177.40000110.2F55 G56 V57 I62 T63 L76F55-V59 HydrophobicContact CD1-CG2 4.08Å; F55-V59 HydrophobicContact CD2-CG2 4.26Å; F55-V59 HydrophobicContact CE1-CG2 3.68Å; F55-V59 HydrophobicContact CE2-CG2 3.85Å; F55-V59 HydrophobicContact CG-CG2 4.37Å; F55-V59 HydrophobicContact CZ-CG2 3.55Å; F55-V59 WeakPolarHBondContact O-CG2 3.27Å; F55-V59 PolarHBondContact O-N 2.85Å; G56-V59 PolarHBondContact O-N 3.36Å; V57-V59 VanDerWaalsContact C-N 3.35Å; V57-V59 PolarHBondContact O-N 3.45Å; V59-I62 PolarHBondContact O-N 2.81Å; V59-T63 HydrophobicContact CG1-CG2 4.19Å; V59-T63 WeakPolarHBondContact O-CB 3.14Å; V59-T63 WeakPolarHBondContact O-CG2 3.33Å; V59-T63 PolarHBondContact O-N 3.43Å; V59-T63 PolarHBondContact O-OG1 3.36Å; V59-L76 HydrophobicContact CB-CD1 4.01Å; V59-L76 HydrophobicContact CG1-CD1 4.01Å; V59-L76 HydrophobicContact CG2-CD1 3.39Å
60H87.8Confident87.7Confident109 Ų10964.3 Ų64.351%0.50533%0.334SS..Hα-helixtrans-60.7-48.3179-176.970.1000112G56 V57 C58 T63 L64G56-H60 PolarHBondContact O-N 3.3Å; V57-H60 WeakPolarHBondContact O-CB 3.47Å; V57-H60 PolarHBondContact O-N 3.32Å; C58-H60 VanDerWaalsContact C-N 3.31Å; C58-H60 PolarHBondContact O-N 3.34Å; H60-T63 PolarHBondContact O-OG1 2.95Å; H60-L64 VanDerWaalsContact CE1-CD1 3.41Å; H60-L64 WeakPolarHBondContact CE1-CD1 3.25Å; H60-L64 VanDerWaalsContact NE2-CD1 3.26Å; H60-L64 WeakPolarHBondContact NE2-CD1 3.32Å; H60-L64 WeakPolarHBondContact O-CB 3.44Å; H60-L64 WeakPolarHBondContact O-CG 3.42Å; H60-L64 PolarHBondContact O-N 2.97Å; H60-L64 VanDerWaalsContact O-N 3.07Å
61F86.7Confident87Confident83 Ų8363.1 Ų63.136%0.36432%0.324SS..Hα-helixtrans-63-46.6177.5-84.2-73.6000112.5V57 C58 T63 L64 Y65 P250V57-F61 HydrophobicContact CG1-CD2 3.46Å; V57-F61 VanDerWaalsContact CG1-CD2 3.46Å; V57-F61 HydrophobicContact CG1-CE2 3.4Å; V57-F61 VanDerWaalsContact O-CD2 3.25Å; V57-F61 WeakPolarHBondContact O-CD2 3.32Å; V57-F61 PolarHBondContact O-N 2.91Å; C58-F61 PolarHBondContact O-N 2.85Å; F61-T63 PolarHBondContact O-N 3.34Å; F61-L64 PolarHBondContact O-N 3.39Å; F61-Y65 HydrophobicContact CB-CD2 4.48Å; F61-Y65 AromaticContact CD1-CD2 3.69Å; F61-Y65 HydrophobicContact CD1-CD2 3.69Å; F61-Y65 AromaticContact CD1-CE2 3.44Å; F61-Y65 HydrophobicContact CD1-CE2 3.44Å; F61-Y65 VanDerWaalsContact CD1-CE2 3.44Å; F61-Y65 HydrophobicContact CE1-CD2 4.48Å; F61-Y65 AromaticContact CE1-CE2 3.81Å; F61-Y65 HydrophobicContact CE1-CE2 3.81Å; F61-Y65 WeakPolarHBondContact O-CB 3.39Å; F61-Y65 VanDerWaalsContact O-CD2 3.3Å; F61-Y65 WeakPolarHBondContact O-CD2 3.47Å; F61-Y65 PolarHBondContact O-N 3.46Å; F61-P250 HydrophobicContact CD1-CG 4.1Å
62I85.7Confident86.5Confident8 Ų863.9 Ų63.94%0.04133%0.33CS..Hα-helixtrans-62.7-44.9-178.8-67.8165.9000110.5C58 V59 L64 V66 A72 L75C58-I62 HydrophobicContact CB-CD1 4.42Å; C58-I62 VanDerWaalsContact O-CB 3.32Å; C58-I62 WeakPolarHBondContact O-CB 3.07Å; C58-I62 WeakPolarHBondContact O-CD1 3.4Å; C58-I62 WeakPolarHBondContact O-CG1 3.22Å; C58-I62 PolarHBondContact O-N 3.13Å; V59-I62 PolarHBondContact O-N 2.81Å; I62-L64 VanDerWaalsContact C-N 3.34Å; I62-L64 PolarHBondContact O-N 3.45Å; I62-V66 HydrophobicContact CG2-CB 4.5Å; I62-V66 HydrophobicContact CG2-CG2 4.12Å; I62-V66 VanDerWaalsContact O-CB 3.25Å; I62-V66 WeakPolarHBondContact O-CB 3.33Å; I62-V66 WeakPolarHBondContact O-CG2 3.47Å; I62-V66 PolarHBondContact O-N 3.31Å; I62-A72 HydrophobicContact CG2-CB 3.88Å; I62-L75 HydrophobicContact CD1-CB 4.35Å; I62-L75 HydrophobicContact CD1-CD2 3.83Å; I62-L75 HydrophobicContact CD1-CG 3.68Å; I62-L75 HydrophobicContact CG1-CD2 3.75Å; I62-L75 HydrophobicContact CG1-CG 4.19Å; I62-L75 HydrophobicContact CG2-CD2 4.45Å
63T86.2Confident86Confident82 Ų8261.6 Ų61.650%0.50332%0.323SS..Hα-helixtrans-68.7-30.8-179.153.80000113.3V59 H60 F61V59-T63 HydrophobicContact CG1-CG2 4.19Å; V59-T63 WeakPolarHBondContact O-CB 3.14Å; V59-T63 WeakPolarHBondContact O-CG2 3.33Å; V59-T63 PolarHBondContact O-N 3.43Å; V59-T63 PolarHBondContact O-OG1 3.36Å; H60-T63 PolarHBondContact O-OG1 2.95Å; F61-T63 PolarHBondContact O-N 3.34Å
64L84.6Confident85.4Confident71 Ų7161 Ų6137%0.37231%0.313SS..Hα-helixtrans-78.6-43.5177.2-75.9-177.2000113.2H60 F61 I62 R258H60-L64 VanDerWaalsContact CE1-CD1 3.41Å; H60-L64 WeakPolarHBondContact CE1-CD1 3.25Å; H60-L64 VanDerWaalsContact NE2-CD1 3.26Å; H60-L64 WeakPolarHBondContact NE2-CD1 3.32Å; H60-L64 WeakPolarHBondContact O-CB 3.44Å; H60-L64 WeakPolarHBondContact O-CG 3.42Å; H60-L64 PolarHBondContact O-N 2.97Å; H60-L64 VanDerWaalsContact O-N 3.07Å; F61-L64 PolarHBondContact O-N 3.39Å; I62-L64 VanDerWaalsContact C-N 3.34Å; I62-L64 PolarHBondContact O-N 3.45Å; L64-R258 WeakPolarHBondContact O-CD 3.08Å
65Y81.6Confident84.9Confident59 Ų5960 Ų6023%0.23131%0.308CS..Hα-helixtrans-103.5-15.8-164.9-67.1-69.4000114.9F61 P250 F256 R258 Y259F61-Y65 HydrophobicContact CB-CD2 4.48Å; F61-Y65 AromaticContact CD1-CD2 3.69Å; F61-Y65 HydrophobicContact CD1-CD2 3.69Å; F61-Y65 AromaticContact CD1-CE2 3.44Å; F61-Y65 HydrophobicContact CD1-CE2 3.44Å; F61-Y65 VanDerWaalsContact CD1-CE2 3.44Å; F61-Y65 HydrophobicContact CE1-CD2 4.48Å; F61-Y65 AromaticContact CE1-CE2 3.81Å; F61-Y65 HydrophobicContact CE1-CE2 3.81Å; F61-Y65 WeakPolarHBondContact O-CB 3.39Å; F61-Y65 VanDerWaalsContact O-CD2 3.3Å; F61-Y65 WeakPolarHBondContact O-CD2 3.47Å; F61-Y65 PolarHBondContact O-N 3.46Å; Y65-P250 HydrophobicContact CD2-CG 4.32Å; Y65-F256 VanDerWaalsContact CB-CD1 3.42Å; Y65-F256 CarbonylContact O-C 3.59Å; Y65-F256 WeakPolarHBondContact O-CA 3.35Å; Y65-R258 WeakPolarHBondContact O-CB 3.49Å; Y65-R258 PolarHBondContact O-N 3.46Å; Y65-Y259 AromaticContact CD1-CD2 3.73Å; Y65-Y259 HydrophobicContact CD1-CD2 3.73Å; Y65-Y259 HydrophobicContact CD1-CG 4.27Å; Y65-Y259 AromaticContact CE1-CD2 3.44Å; Y65-Y259 HydrophobicContact CE1-CD2 3.44Å; Y65-Y259 VanDerWaalsContact CE1-CD2 3.44Å; Y65-Y259 HydrophobicContact CE1-CE2 4.22Å; Y65-Y259 HydrophobicContact CE1-CG 4.33Å; Y65-Y259 HydrophobicContact CG-CD2 4.44Å; Y65-Y259 AromaticContact CZ-CD2 3.93Å
66V82.3Confident84.6Confident11 Ų1160.5 Ų60.57%0.06731%0.312CS..  trans-95.3115.5176.9-175.70000110.1I62 R71 A72 F256I62-V66 HydrophobicContact CG2-CB 4.5Å; I62-V66 HydrophobicContact CG2-CG2 4.12Å; I62-V66 VanDerWaalsContact O-CB 3.25Å; I62-V66 WeakPolarHBondContact O-CB 3.33Å; I62-V66 WeakPolarHBondContact O-CG2 3.47Å; I62-V66 PolarHBondContact O-N 3.31Å; V66-R71 HydrophobicContact CG1-CB 3.94Å; V66-A72 HydrophobicContact CB-CB 4.02Å; V66-A72 HydrophobicContact CG1-CB 3.85Å; V66-F256 HydrophobicContact CG2-CD1 3.7Å; V66-F256 HydrophobicContact CG2-CE1 3.72Å
67S78.7Confident84.2Confident75 Ų7567.1 Ų67.152%0.52433%0.325SS..  trans-74.8-33.3-178.4-171.90000113.4
68S81.9Confident83.6Confident25 Ų2566.1 Ų66.118%0.17532%0.318CS..  trans-85119.9-178165.90000110.5L70 R71 A72S68-L70 VanDerWaalsContact C-N 3.26Å; S68-L70 PolarHBondContact O-N 3.3Å; S68-R71 VanDerWaalsContact CB-NE 3.27Å; S68-R71 PolarHBondContact O-N 2.85Å; S68-R71 PolarHBondContact OG-N 2.9Å; S68-A72 WeakPolarHBondContact O-CB 3.46Å; S68-A72 PolarHBondContact O-N 3.34Å
69R82.7Confident83.5Confident226 Ų22666 Ų6685%0.85332%0.316SS*.Hα-helixtrans-60-35.7177.5-65.6-175-179.3-146.40.9112.2S73R69-S73 VanDerWaalsContact O-CB 3.22Å; R69-S73 WeakPolarHBondContact O-CB 3.35Å; R69-S73 PolarHBondContact O-N 3.03Å
70L80.2Confident83.3Confident53 Ų5364.7 Ų64.728%0.27731%0.312SS..Hα-helixtrans-72.7-41.4179.3-16460.6000112.1S68 S73 R74 D288S68-L70 VanDerWaalsContact C-N 3.26Å; S68-L70 PolarHBondContact O-N 3.3Å; L70-S73 PolarHBondContact O-N 3.42Å; L70-R74 VanDerWaalsContact CG-CZ 3.49Å; L70-R74 WeakPolarHBondContact O-CB 3.27Å; L70-R74 WeakPolarHBondContact O-CG 3.35Å; L70-R74 PolarHBondContact O-N 2.86Å; L70-R74 PolarHBondContact O-NE 3.07Å; L70-D288 WeakPolarHBondContact CB-OD1 2.89Å; L70-D288 WeakPolarHBondContact CD2-OD1 3.21Å; L70-D288 WeakPolarHBondContact CD2-OD2 2.96Å
71R79.5Confident83.1Confident53 Ų5360.6 Ų60.620%0.229%0.293CS..Hα-helixtrans-62.3-46.3172.6-71.9-172.9-80.9156.31.8111.5V66 S68 S73 R74 L75 D257V66-R71 HydrophobicContact CG1-CB 3.94Å; S68-R71 VanDerWaalsContact CB-NE 3.27Å; S68-R71 PolarHBondContact O-N 2.85Å; S68-R71 PolarHBondContact OG-N 2.9Å; R71-S73 PolarHBondContact O-N 3.18Å; R71-R74 PolarHBondContact O-N 3.09Å; R71-L75 WeakPolarHBondContact O-CB 3.45Å; R71-L75 PolarHBondContact O-N 3.03Å; R71-D257 IonicContact CZ-OD2 3.97Å; R71-D257 IonicContact NH1-OD1 3.42Å; R71-D257 PolarHBondContact NH1-OD1 3.49Å; R71-D257 IonicContact NH1-OD2 3.2Å; R71-D257 PolarHBondContact NH1-OD2 3.28Å; R71-D257 IonicContact NH2-OD1 3.02Å; R71-D257 IonicContact NH2-OD2 3.96Å; R71-D257 PolarHBondContact NH2-OD2 2.92Å
72A84.6Confident83.2Confident16 Ų1657.4 Ų57.413%0.13228%0.279CS..Hα-helixtrans-60.3-46.1178.200000111.6I62 V66 S68 L75 L76I62-A72 HydrophobicContact CG2-CB 3.88Å; V66-A72 HydrophobicContact CB-CB 4.02Å; V66-A72 HydrophobicContact CG1-CB 3.85Å; S68-A72 WeakPolarHBondContact O-CB 3.46Å; S68-A72 PolarHBondContact O-N 3.34Å; A72-L75 PolarHBondContact O-N 2.75Å; A72-L76 WeakPolarHBondContact O-CB 3.3Å; A72-L76 PolarHBondContact O-N 3.12Å
73S84.1Confident83.5Confident50 Ų5057.4 Ų57.435%0.3528%0.28SS..Hα-helixtrans-60.1-49.7177-178.20000111.5R69 L70 R71 L75 L76 W77R69-S73 VanDerWaalsContact O-CB 3.22Å; R69-S73 WeakPolarHBondContact O-CB 3.35Å; R69-S73 PolarHBondContact O-N 3.03Å; L70-S73 PolarHBondContact O-N 3.42Å; R71-S73 PolarHBondContact O-N 3.18Å; S73-L75 VanDerWaalsContact C-N 3.34Å; S73-L75 PolarHBondContact O-N 2.94Å; S73-L76 PolarHBondContact O-N 3.15Å; S73-W77 WeakPolarHBondContact O-CB 3.12Å; S73-W77 PolarHBondContact O-N 3.3Å
74R81.8Confident83.7Confident118 Ų11856.2 Ų56.245%0.44527%0.272SS..Hα-helixtrans-59.1-43.1178.3-73.4-177.6-74.1-137.6-4.5112.4L70 R71 L78 D288L70-R74 VanDerWaalsContact CG-CZ 3.49Å; L70-R74 WeakPolarHBondContact O-CB 3.27Å; L70-R74 WeakPolarHBondContact O-CG 3.35Å; L70-R74 PolarHBondContact O-N 2.86Å; L70-R74 PolarHBondContact O-NE 3.07Å; R71-R74 PolarHBondContact O-N 3.09Å; R74-L78 PolarHBondContact O-N 3.42Å; R74-L78 VanDerWaalsContact O-N 3.12Å; R74-D288 IonicContact CZ-OD2 2.69Å; R74-D288 IonicContact NH2-OD2 3.34Å; R74-D288 PolarHBondContact NH2-OD2 3.31Å
75L80.5Confident83.9Confident18 Ų1853.4 Ų53.49%0.09426%0.257CS..Hα-helixtrans-70-40.3178.4-173.660.6000112I62 R71 A72 S73 W77 L78 C79 M184 M255I62-L75 HydrophobicContact CD1-CB 4.35Å; I62-L75 HydrophobicContact CD1-CD2 3.83Å; I62-L75 HydrophobicContact CD1-CG 3.68Å; I62-L75 HydrophobicContact CG1-CD2 3.75Å; I62-L75 HydrophobicContact CG1-CG 4.19Å; I62-L75 HydrophobicContact CG2-CD2 4.45Å; R71-L75 WeakPolarHBondContact O-CB 3.45Å; R71-L75 PolarHBondContact O-N 3.03Å; A72-L75 PolarHBondContact O-N 2.75Å; S73-L75 VanDerWaalsContact C-N 3.34Å; S73-L75 PolarHBondContact O-N 2.94Å; L75-W77 VanDerWaalsContact C-N 3.34Å; L75-W77 PolarHBondContact O-N 3.46Å; L75-L78 HydrophobicContact CD1-CD2 4.4Å; L75-L78 WeakPolarHBondContact O-CB 3.26Å; L75-L78 PolarHBondContact O-N 3.01Å; L75-C79 PolarHBondContact O-N 3.33Å; L75-C79 PolarHBondContact O-SG 3.14Å; L75-M184 HydrophobicContact CD2-CE 4.31Å; L75-M255 HydrophobicContact CD2-SD 3.89Å
76L86.1Confident84.3Confident55 Ų5550.6 Ų50.629%0.28825%0.246SC..Hα-helixtrans-63-41.3175.9-177.764.6000111.5F55 V59 A72 S73 L78 C79 G80F55-L76 HydrophobicContact CE2-CD1 3.92Å; F55-L76 HydrophobicContact CZ-CD1 3.92Å; V59-L76 HydrophobicContact CB-CD1 4.01Å; V59-L76 HydrophobicContact CG1-CD1 4.01Å; V59-L76 HydrophobicContact CG2-CD1 3.39Å; A72-L76 WeakPolarHBondContact O-CB 3.3Å; A72-L76 PolarHBondContact O-N 3.12Å; S73-L76 PolarHBondContact O-N 3.15Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 3.47Å; L76-C79 PolarHBondContact O-N 2.72Å; L76-G80 PolarHBondContact O-N 3.4Å
77W83.7Confident84.8Confident178 Ų17853 Ų5367%0.67426%0.26SS*.Hα-helixtrans-60.4-41.8172.9-87.9108.1000112.2S73 L75 G80S73-W77 WeakPolarHBondContact O-CB 3.12Å; S73-W77 PolarHBondContact O-N 3.3Å; L75-W77 VanDerWaalsContact C-N 3.34Å; L75-W77 PolarHBondContact O-N 3.46Å; W77-G80 PolarHBondContact O-N 3Å
78L79.6Confident85.4Confident45 Ų4550.4 Ų50.424%0.23624%0.241CC..Hα-helixtrans-64.2-48175.6-16884.2000111.4R74 L75 L76 G80 I81 F82 M191R74-L78 PolarHBondContact O-N 3.42Å; R74-L78 VanDerWaalsContact O-N 3.12Å; L75-L78 HydrophobicContact CD1-CD2 4.4Å; L75-L78 WeakPolarHBondContact O-CB 3.26Å; L75-L78 PolarHBondContact O-N 3.01Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 3.47Å; L78-G80 VanDerWaalsContact C-N 3.29Å; L78-G80 PolarHBondContact O-N 2.8Å; L78-I81 WeakPolarHBondContact O-CB 3.22Å; L78-I81 WeakPolarHBondContact O-CG2 3.22Å; L78-I81 PolarHBondContact O-N 3.24Å; L78-F82 WeakPolarHBondContact O-CE2 3.05Å; L78-M191 HydrophobicContact CD2-CG 4.3Å
79C84.6Confident85.8Confident9 Ų949.3 Ų49.36%0.06123%0.233CC..Hα-helixtrans-66.1-30.6177.7-69.10000112.8F55 L75 L76 I81 F82 P83F55-C79 HydrophobicContact CD2-CB 4.1Å; F55-C79 WeakPolarHBondContact CD2-O 3.46Å; F55-C79 HydrophobicContact CE2-CB 4.11Å; L75-C79 PolarHBondContact O-N 3.33Å; L75-C79 PolarHBondContact O-SG 3.14Å; L76-C79 PolarHBondContact O-N 2.72Å; C79-I81 PolarHBondContact O-N 3.13Å; C79-F82 WeakPolarHBondContact O-CD2 3.46Å; C79-P83 WeakPolarHBondContact O-CD 3.46Å
80G86.7Confident86.3Confident15 Ų1538.7 Ų38.716%0.15519%0.194CC..THydrogen-bonded Turntrans-70.5-9.7177.500000113.7L76 W77 L78 R109L76-G80 PolarHBondContact O-N 3.4Å; W77-G80 PolarHBondContact O-N 3Å; L78-G80 VanDerWaalsContact C-N 3.29Å; L78-G80 PolarHBondContact O-N 2.8Å; G80-R109 PolarHBondContact O-NH1 3.43Å
81I84.3Confident86.8Confident22 Ų2241 Ų4111%0.11321%0.206CC..Hα-helixtrans-67.5-45.6177.2-149.5-178.5000111.5L78 C79 Y85 R109 N110 I113L78-I81 WeakPolarHBondContact O-CB 3.22Å; L78-I81 WeakPolarHBondContact O-CG2 3.22Å; L78-I81 PolarHBondContact O-N 3.24Å; C79-I81 PolarHBondContact O-N 3.13Å; I81-Y85 WeakPolarHBondContact O-CB 3.35Å; I81-Y85 PolarHBondContact O-N 3.03Å; I81-R109 PolarHBondContact O-NH1 3.47Å; I81-R109 PolarHBondContact O-NH2 3.14Å; I81-N110 WeakPolarHBondContact CD1-OD1 3.42Å; I81-I113 HydrophobicContact CB-CD1 4.45Å; I81-I113 HydrophobicContact CD1-CD1 3.25Å; I81-I113 HydrophobicContact CG1-CD1 3.84Å
82F88.4Confident87.2Confident17 Ų1738.5 Ų38.58%0.07520%0.196CC..Hα-helixtrans-59.6-54-174.8-51.8-69.5000113.6I51 L78 C79 V84 Y85 S86 M191 C237 M240 L241I51-F82 HydrophobicContact CG2-CB 4.19Å; L78-F82 WeakPolarHBondContact O-CE2 3.05Å; C79-F82 WeakPolarHBondContact O-CD2 3.46Å; F82-V84 PolarHBondContact O-N 3.48Å; F82-Y85 WeakPolarHBondContact O-CB 3.14Å; F82-Y85 PolarHBondContact O-N 2.95Å; F82-Y85 VanDerWaalsContact O-N 3.16Å; F82-S86 WeakPolarHBondContact O-CB 3.43Å; F82-S86 PolarHBondContact O-N 3.33Å; F82-M191 HydrophobicContact CE1-CE 4.12Å; F82-M191 HydrophobicContact CE1-SD 3.91Å; F82-M191 HydrophobicContact CE2-CE 3.59Å; F82-M191 HydrophobicContact CE2-SD 4.28Å; F82-M191 HydrophobicContact CZ-CE 3.2Å; F82-M191 HydrophobicContact CZ-SD 3.32Å; F82-M191 WeakPolarHBondContact CZ-SD 3.32Å; F82-C237 HydrophobicContact CB-CB 4.47Å; F82-C237 HydrophobicContact CD1-CB 4.48Å; F82-M240 HydrophobicContact CD1-CB 4.16Å; F82-M240 HydrophobicContact CE1-CB 3.78Å; F82-L241 HydrophobicContact CD2-CB 4.48Å; F82-L241 HydrophobicContact CD2-CD1 4Å; F82-L241 HydrophobicContact CG-CB 4.38Å
83P91.6Very high87.4Confident8 Ų837.7 Ų37.75%0.05219%0.19CC..Hα-helixtrans-63.2-42.2-176.724.9-35.9000112.2I51 L52 F55 C79 Y85 S86 T87I51-P83 HydrophobicContact CG2-CB 4.13Å; L52-P83 HydrophobicContact CD1-CB 4.24Å; F55-P83 HydrophobicContact CB-CB 4.31Å; F55-P83 HydrophobicContact CB-CG 3.97Å; F55-P83 HydrophobicContact CD1-CG 4.03Å; F55-P83 HydrophobicContact CD2-CG 4.01Å; F55-P83 HydrophobicContact CG-CB 4.47Å; F55-P83 HydrophobicContact CG-CG 3.72Å; C79-P83 WeakPolarHBondContact O-CD 3.46Å; P83-Y85 VanDerWaalsContact C-N 3.28Å; P83-Y85 PolarHBondContact O-N 3.01Å; P83-S86 PolarHBondContact O-N 2.88Å; P83-T87 WeakPolarHBondContact O-CG2 3.21Å; P83-T87 PolarHBondContact O-N 2.81Å; P83-T87 PolarHBondContact O-OG1 2.84Å
84V89.5Confident87.6Confident56 Ų5637 Ų3734%0.33918%0.183SC..Hα-helixtrans-70.6-29.5179.31750000111.3F82 T87 V88 R109F82-V84 PolarHBondContact O-N 3.48Å; V84-T87 WeakPolarHBondContact CA-OG1 3.2Å; V84-T87 PolarHBondContact O-OG1 3.43Å; V84-T87 VanDerWaalsContact O-OG1 3.1Å; V84-V88 HydrophobicContact CG1-CG2 4.3Å; V84-V88 WeakPolarHBondContact O-CB 3.26Å; V84-V88 WeakPolarHBondContact O-CG2 3.42Å; V84-V88 PolarHBondContact O-N 3.16Å; V84-V88 VanDerWaalsContact O-N 3.07Å; V84-R109 VanDerWaalsContact CG1-NE 3.27Å; V84-R109 VanDerWaalsContact CG1-NH1 3.32Å
85Y88.8Confident87.8Confident13 Ų1333.4 Ų33.45%0.05117%0.174CC..Hα-helixtrans-65.7-48.7174.7-159.8-58.8000109.1I81 F82 P83 T87 V88 S89 V106 Y198 V233I81-Y85 WeakPolarHBondContact O-CB 3.35Å; I81-Y85 PolarHBondContact O-N 3.03Å; F82-Y85 WeakPolarHBondContact O-CB 3.14Å; F82-Y85 PolarHBondContact O-N 2.95Å; F82-Y85 VanDerWaalsContact O-N 3.16Å; P83-Y85 VanDerWaalsContact C-N 3.28Å; P83-Y85 PolarHBondContact O-N 3.01Å; Y85-T87 PolarHBondContact O-N 2.67Å; Y85-V88 PolarHBondContact O-N 3.49Å; Y85-S89 VanDerWaalsContact CD1-OG 3.3Å; Y85-S89 WeakPolarHBondContact CD1-OG 3.23Å; Y85-S89 WeakPolarHBondContact CE1-OG 3.32Å; Y85-S89 VanDerWaalsContact O-CB 3.32Å; Y85-S89 WeakPolarHBondContact O-CB 3.41Å; Y85-S89 PolarHBondContact O-N 3.49Å; Y85-S89 PolarHBondContact O-OG 3.01Å; Y85-V106 HydrophobicContact CD1-CG2 4.34Å; Y85-V106 HydrophobicContact CD2-CB 4.48Å; Y85-V106 HydrophobicContact CD2-CG1 3.63Å; Y85-V106 HydrophobicContact CD2-CG2 4.05Å; Y85-V106 HydrophobicContact CE1-CG1 4.46Å; Y85-V106 HydrophobicContact CE1-CG2 3.94Å; Y85-V106 HydrophobicContact CE2-CB 4Å; Y85-V106 HydrophobicContact CE2-CG1 2.97Å; Y85-V106 HydrophobicContact CE2-CG2 3.82Å; Y85-V106 HydrophobicContact CG-CG2 4.28Å; Y85-V106 VanDerWaalsContact CZ-CG1 3.4Å; Y85-V106 WeakPolarHBondContact OH-CG1 3.43Å; Y85-Y198 HydrophobicContact CE1-CE2 4.42Å; Y85-Y198 HydrophobicContact CE2-CE1 4.33Å; Y85-Y198 HydrophobicContact CE2-CE2 4.28Å; Y85-Y198 AromaticContact CZ-CE2 3.65Å; Y85-Y198 AromaticContact CZ-CZ 3.71Å; Y85-Y198 WeakPolarHBondContact OH-CE2 3.4Å; Y85-Y198 PolarHBondContact OH-OH 3.44Å; Y85-V233 HydrophobicContact CD1-CG1 3.44Å; Y85-V233 VanDerWaalsContact CD1-CG1 3.44Å; Y85-V233 HydrophobicContact CE1-CB 4.25Å; Y85-V233 HydrophobicContact CE1-CG1 3.02Å; Y85-V233 HydrophobicContact CE2-CG1 4.44Å; Y85-V233 HydrophobicContact CG-CG1 4.45Å
86S91.4Very high87.7Confident0 Ų032.8 Ų32.80%017%0.171CC..Hα-helixtrans-60-44.3178.4179.70000112.2A48 F82 P83 S89 C90A48-S86 VanDerWaalsContact CA-OG 3.23Å; A48-S86 WeakPolarHBondContact CA-OG 3.47Å; A48-S86 WeakPolarHBondContact CB-OG 3.33Å; F82-S86 WeakPolarHBondContact O-CB 3.43Å; F82-S86 PolarHBondContact O-N 3.33Å; P83-S86 PolarHBondContact O-N 2.88Å; S86-S89 PolarHBondContact O-N 3.34Å; S86-C90 PolarHBondContact O-N 3.36Å; S86-C90 PolarHBondContact O-SG 3.02Å
87T91.5Very high87.4Confident61 Ų6133.6 Ų33.637%0.37417%0.17SC..Hα-helixtrans-66.6-45.1178.656.50000112.7P83 V84 Y85 S89 C90 I91P83-T87 WeakPolarHBondContact O-CG2 3.21Å; P83-T87 PolarHBondContact O-N 2.81Å; P83-T87 PolarHBondContact O-OG1 2.84Å; V84-T87 WeakPolarHBondContact CA-OG1 3.2Å; V84-T87 PolarHBondContact O-OG1 3.43Å; V84-T87 VanDerWaalsContact O-OG1 3.1Å; Y85-T87 PolarHBondContact O-N 2.67Å; T87-S89 PolarHBondContact O-N 2.97Å; T87-C90 PolarHBondContact O-N 3.49Å; T87-I91 VanDerWaalsContact O-CG1 3.29Å; T87-I91 WeakPolarHBondContact O-CG1 3.36Å; T87-I91 PolarHBondContact O-N 3.5Å
88V91.9Very high87.4Confident21 Ų2126.1 Ų26.113%0.12715%0.145CC..Hα-helixtrans-61.4-37.1176170.90000110.5V84 Y85 I91 G92 S102 V105 V106V84-V88 HydrophobicContact CG1-CG2 4.3Å; V84-V88 WeakPolarHBondContact O-CB 3.26Å; V84-V88 WeakPolarHBondContact O-CG2 3.42Å; V84-V88 PolarHBondContact O-N 3.16Å; V84-V88 VanDerWaalsContact O-N 3.07Å; Y85-V88 PolarHBondContact O-N 3.49Å; V88-I91 PolarHBondContact O-N 2.86Å; V88-G92 PolarHBondContact O-N 3.12Å; V88-G92 VanDerWaalsContact O-N 3.07Å; V88-S102 VanDerWaalsContact CG1-CB 3.47Å; V88-S102 WeakPolarHBondContact CG1-O 3.32Å; V88-S102 WeakPolarHBondContact O-CB 3.15Å; V88-V105 HydrophobicContact CG1-CB 4.4Å; V88-V105 HydrophobicContact CG1-CG1 4.46Å; V88-V105 HydrophobicContact CG2-CG1 4.16Å; V88-V106 HydrophobicContact CB-CG2 4.41Å; V88-V106 HydrophobicContact CG1-CG2 3.94Å
89S91Very high87.5Confident1 Ų124.1 Ų24.11%0.00714%0.135CC..Hα-helixtrans-69.6-42.5177.6-590000113.1Y85 S86 T87 I91 G92 M93Y85-S89 VanDerWaalsContact CD1-OG 3.3Å; Y85-S89 WeakPolarHBondContact CD1-OG 3.23Å; Y85-S89 WeakPolarHBondContact CE1-OG 3.32Å; Y85-S89 VanDerWaalsContact O-CB 3.32Å; Y85-S89 WeakPolarHBondContact O-CB 3.41Å; Y85-S89 PolarHBondContact O-N 3.49Å; Y85-S89 PolarHBondContact O-OG 3.01Å; S86-S89 PolarHBondContact O-N 3.34Å; T87-S89 PolarHBondContact O-N 2.97Å; S89-I91 VanDerWaalsContact C-N 3.3Å; S89-I91 PolarHBondContact O-N 3.39Å; S89-G92 PolarHBondContact O-N 3.4Å; S89-G92 VanDerWaalsContact O-N 3.15Å; S89-M93 WeakPolarHBondContact O-CG 3.29Å; S89-M93 PolarHBondContact O-N 3.38Å
90C92.3Very high87.2Confident3 Ų325.4 Ų25.42%0.0214%0.143CC..Hα-helixtrans-61.6-39.5175.4-67.90000111.5F45 S86 T87 G92 M93 V94F45-C90 HydrophobicContact CD1-CB 4.28Å; F45-C90 HydrophobicContact CD2-CB 4.5Å; F45-C90 HydrophobicContact CE1-CB 3.84Å; F45-C90 HydrophobicContact CE2-CB 4.07Å; F45-C90 HydrophobicContact CZ-CB 3.72Å; S86-C90 PolarHBondContact O-N 3.36Å; S86-C90 PolarHBondContact O-SG 3.02Å; T87-C90 PolarHBondContact O-N 3.49Å; C90-G92 VanDerWaalsContact C-N 3.33Å; C90-M93 PolarHBondContact O-N 3.38Å; C90-V94 WeakPolarHBondContact O-CG2 3.46Å; C90-V94 PolarHBondContact O-N 2.98Å
91I91.1Very high87.1Confident102 Ų10227.4 Ų27.452%0.52315%0.15SC..Hα-helixtrans-63.2-41.4174.8-66164.6000110.8T87 V88 S89 M93 V94 V95T87-I91 VanDerWaalsContact O-CG1 3.29Å; T87-I91 WeakPolarHBondContact O-CG1 3.36Å; T87-I91 PolarHBondContact O-N 3.5Å; V88-I91 PolarHBondContact O-N 2.86Å; S89-I91 VanDerWaalsContact C-N 3.3Å; S89-I91 PolarHBondContact O-N 3.39Å; I91-M93 PolarHBondContact O-N 3.27Å; I91-V94 PolarHBondContact O-N 3.33Å; I91-V95 PolarHBondContact O-N 2.81Å
92G87.4Confident87.1Confident0 Ų026.7 Ų26.70%015%0.147CC..Hα-helixtrans-61.7-38.3174.700000113.3V88 S89 C90 V95 M99V88-G92 PolarHBondContact O-N 3.12Å; V88-G92 VanDerWaalsContact O-N 3.07Å; S89-G92 PolarHBondContact O-N 3.4Å; S89-G92 VanDerWaalsContact O-N 3.15Å; C90-G92 VanDerWaalsContact C-N 3.33Å; G92-V95 CarbonylContact O-C 3.23Å; G92-V95 VanDerWaalsContact O-C 3.23Å; G92-V95 PolarHBondContact O-N 3.48Å; G92-M99 WeakPolarHBondContact O-CE 3.46Å; G92-M99 WeakPolarHBondContact O-CG 3.22Å
93M88.8Confident86.8Confident0 Ų027.3 Ų27.30%015%0.151CC..Hα-helixtrans-67.6-37.5176.9-67.1171.1-170.500113.6I41 S89 C90 I91 V95 L227 H230 L231 V234I41-M93 HydrophobicContact CG1-CB 4.31Å; I41-M93 HydrophobicContact CG2-CB 4.45Å; S89-M93 WeakPolarHBondContact O-CG 3.29Å; S89-M93 PolarHBondContact O-N 3.38Å; C90-M93 PolarHBondContact O-N 3.38Å; I91-M93 PolarHBondContact O-N 3.27Å; M93-V95 VanDerWaalsContact C-N 3.33Å; M93-L227 HydrophobicContact CB-CD1 4.44Å; M93-L227 HydrophobicContact CG-CD1 4.49Å; M93-H230 HydrophobicContact CE-CB 3.58Å; M93-H230 WeakPolarHBondContact CE-O 3.08Å; M93-H230 HydrophobicContact CG-CB 3.89Å; M93-L231 VanDerWaalsContact CE-CA 3.43Å; M93-L231 HydrophobicContact CE-CB 4.29Å; M93-L231 HydrophobicContact CE-CD2 3.75Å; M93-L231 HydrophobicContact CE-CG 4Å; M93-L231 VanDerWaalsContact CE-N 3.25Å; M93-L231 HydrophobicContact SD-CD2 3.86Å; M93-L231 HydrophobicContact SD-CG 4.46Å; M93-V234 HydrophobicContact CE-CG2 3.74Å
94V88.4Confident86.3Confident35 Ų3527.1 Ų27.121%0.21215%0.15CC..Hα-helixtrans-69.5-35.6179.4172.40000111.1L26 W30 F45 C90 I91L26-V94 HydrophobicContact CD1-CG1 3.88Å; L26-V94 WeakPolarHBondContact CD1-O 3.39Å; W30-V94 HydrophobicContact CZ2-CB 4.41Å; W30-V94 HydrophobicContact CZ2-CG1 4.08Å; W30-V94 HydrophobicContact CZ2-CG2 4.25Å; F45-V94 HydrophobicContact CE2-CG2 3.5Å; F45-V94 VanDerWaalsContact CE2-CG2 3.5Å; F45-V94 HydrophobicContact CZ-CG2 3.49Å; F45-V94 VanDerWaalsContact CZ-CG2 3.49Å; C90-V94 WeakPolarHBondContact O-CG2 3.46Å; C90-V94 PolarHBondContact O-N 2.98Å; I91-V94 PolarHBondContact O-N 3.33Å
95V85.5Confident86Confident43 Ų4327.4 Ų27.426%0.26115%0.152SC..  trans-120.891.8-178.8-173.60000108.7L26 I91 G92 M93 R97 S98L26-V95 HydrophobicContact CD1-CG2 4.09Å; L26-V95 HydrophobicContact CD2-CG2 4.47Å; I91-V95 PolarHBondContact O-N 2.81Å; G92-V95 CarbonylContact O-C 3.23Å; G92-V95 VanDerWaalsContact O-C 3.23Å; G92-V95 PolarHBondContact O-N 3.48Å; M93-V95 VanDerWaalsContact C-N 3.33Å; V95-R97 HydrophobicContact CG1-CB 4.38Å; V95-R97 PolarHBondContact O-N 3.24Å; V95-S98 PolarHBondContact O-N 2.89Å; V95-S98 PolarHBondContact O-OG 2.98Å
96P79.4Confident85.6Confident4 Ų426.8 Ų26.83%0.02615%0.15CC..G310 helixtrans-53.2-33.3-179-27.133000113.7Y29 S98 M99Y29-P96 HydrophobicContact CD1-CG 3.94Å; Y29-P96 HydrophobicContact CD2-CG 3.71Å; Y29-P96 HydrophobicContact CE1-CG 3.9Å; Y29-P96 HydrophobicContact CE2-CG 3.68Å; Y29-P96 HydrophobicContact CG-CG 3.83Å; P96-S98 VanDerWaalsContact C-N 3.27Å; P96-S98 PolarHBondContact O-N 3.34Å; P96-M99 HydrophobicContact CB-CE 4.46Å; P96-M99 WeakPolarHBondContact O-CB 3.2Å; P96-M99 WeakPolarHBondContact O-CG 3.41Å; P96-M99 PolarHBondContact O-N 3.44Å
97R79.4Confident84.9Confident72 Ų7228 Ų2827%0.27216%0.155SC..G310 helixtrans-64.8-24.9175-99.3-155.1177.8172.6-1.3114.5V95 W136 W140V95-R97 HydrophobicContact CG1-CB 4.38Å; V95-R97 PolarHBondContact O-N 3.24Å; R97-W136 HydrophobicContact CB-CZ2 4.41Å; R97-W136 WeakPolarHBondContact O-CZ2 3.2Å; R97-W140 PolarHBondContact NH2-O 3.45Å
98S83.2Confident84.1Confident21 Ų2129.8 Ų29.815%0.14716%0.162CC..G310 helixtrans-88.7-4.8179.377.20000113.1V95 P96 I101 S102V95-S98 PolarHBondContact O-N 2.89Å; V95-S98 PolarHBondContact O-OG 2.98Å; P96-S98 VanDerWaalsContact C-N 3.27Å; P96-S98 PolarHBondContact O-N 3.34Å; S98-I101 CarbonylContact O-C 3.57Å; S98-I101 WeakPolarHBondContact O-CA 3.25Å; S98-I101 VanDerWaalsContact O-CB 3.24Å; S98-I101 WeakPolarHBondContact O-CB 3.32Å; S98-I101 PolarHBondContact O-N 3.5Å; S98-S102 PolarHBondContact O-N 3.39Å; S98-S102 PolarHBondContact O-OG 3.36Å
99M82.6Confident83.1Confident3 Ų331.4 Ų31.42%0.01517%0.166CC..Hα-helixtrans-53.9-42.8-178.7-69.9177.3171.100114.3G92 P96 I101 S102 D103 S226 L227G92-M99 WeakPolarHBondContact O-CE 3.46Å; G92-M99 WeakPolarHBondContact O-CG 3.22Å; P96-M99 HydrophobicContact CB-CE 4.46Å; P96-M99 WeakPolarHBondContact O-CB 3.2Å; P96-M99 WeakPolarHBondContact O-CG 3.41Å; P96-M99 PolarHBondContact O-N 3.44Å; M99-I101 PolarHBondContact O-N 2.89Å; M99-S102 VanDerWaalsContact CA-OG 3.27Å; M99-S102 WeakPolarHBondContact CA-OG 3.5Å; M99-S102 PolarHBondContact O-N 3.27Å; M99-S102 PolarHBondContact O-OG 2.84Å; M99-D103 PolarHBondContact O-N 2.84Å; M99-D103 VanDerWaalsContact O-N 3.1Å; M99-S226 VanDerWaalsContact SD-CB 3.57Å; M99-S226 PolarHBondContact SD-OG 3.46Å; M99-S226 VanDerWaalsContact SD-OG 3.36Å; M99-L227 HydrophobicContact CE-CB 3.91Å; M99-L227 HydrophobicContact CE-CD1 3.78Å; M99-L227 HydrophobicContact CE-CG 4.45Å
100P78.5Confident81.8Confident36 Ų3632.3 Ų32.323%0.23417%0.171CC..Hα-helixtrans-65-31175.5-21.234.4000112.7G104 W136 F143P100-G104 PolarHBondContact O-N 3.21Å; P100-G104 VanDerWaalsContact O-N 3.15Å; P100-W136 HydrophobicContact CB-CG 4.31Å; P100-W136 HydrophobicContact CG-CG 4.32Å; P100-F143 HydrophobicContact CG-CZ 4.43Å
101I84.1Confident80.4Confident58 Ų5837.2 Ų37.230%0.29719%0.192SC..Hα-helixtrans-70.3-45.2176.6-61.1171.2000110.1S98 M99 D103 G104 V105 M133 W136S98-I101 CarbonylContact O-C 3.57Å; S98-I101 WeakPolarHBondContact O-CA 3.25Å; S98-I101 VanDerWaalsContact O-CB 3.24Å; S98-I101 WeakPolarHBondContact O-CB 3.32Å; S98-I101 PolarHBondContact O-N 3.5Å; M99-I101 PolarHBondContact O-N 2.89Å; I101-D103 PolarHBondContact O-N 2.84Å; I101-G104 PolarHBondContact O-N 3.39Å; I101-V105 HydrophobicContact CG2-CG2 4.45Å; I101-V105 WeakPolarHBondContact O-CG2 3.38Å; I101-V105 PolarHBondContact O-N 2.8Å; I101-M133 HydrophobicContact CB-CE 3.79Å; I101-M133 HydrophobicContact CB-SD 4.22Å; I101-M133 HydrophobicContact CG1-CE 3.73Å; I101-M133 HydrophobicContact CG1-SD 3.61Å; I101-M133 HydrophobicContact CG2-CE 3.59Å; I101-W136 HydrophobicContact CD1-CE3 4.37Å; I101-W136 HydrophobicContact CD1-CH2 3.82Å; I101-W136 HydrophobicContact CD1-CZ3 3.65Å; I101-W136 HydrophobicContact CG1-CE3 4.31Å; I101-W136 HydrophobicContact CG1-CH2 4.47Å; I101-W136 HydrophobicContact CG1-CZ3 4.08Å
102S84.9Confident78.9Confident7 Ų741 Ų415%0.04921%0.205CC..Hα-helixtrans-61-44.4179.352.20000111.5V88 S98 M99 G104 V105 V106 H230V88-S102 VanDerWaalsContact CG1-CB 3.47Å; V88-S102 WeakPolarHBondContact CG1-O 3.32Å; V88-S102 WeakPolarHBondContact O-CB 3.15Å; S98-S102 PolarHBondContact O-N 3.39Å; S98-S102 PolarHBondContact O-OG 3.36Å; M99-S102 VanDerWaalsContact CA-OG 3.27Å; M99-S102 WeakPolarHBondContact CA-OG 3.5Å; M99-S102 PolarHBondContact O-N 3.27Å; M99-S102 PolarHBondContact O-OG 2.84Å; S102-G104 VanDerWaalsContact C-N 3.33Å; S102-G104 PolarHBondContact O-N 3.03Å; S102-V105 PolarHBondContact O-N 3.41Å; S102-V106 WeakPolarHBondContact O-CG2 3.39Å; S102-V106 PolarHBondContact O-N 3.12Å; S102-H230 PolarHBondContact OG-NE2 3.39Å; S102-H230 VanDerWaalsContact OG-NE2 3.08Å
103D80.9Confident77.6Confident29 Ų2943.8 Ų43.816%0.15522%0.219CC..Hα-helixtrans-59.1-44174.2-72.1-22.3000111.7M99 I101 V105 V106 I107 H230M99-D103 PolarHBondContact O-N 2.84Å; M99-D103 VanDerWaalsContact O-N 3.1Å; I101-D103 PolarHBondContact O-N 2.84Å; D103-V105 PolarHBondContact O-N 3.35Å; D103-V106 PolarHBondContact O-N 3.36Å; D103-I107 WeakPolarHBondContact O-CD1 3.13Å; D103-I107 VanDerWaalsContact O-CG1 3.22Å; D103-I107 WeakPolarHBondContact O-CG1 3.46Å; D103-I107 PolarHBondContact O-N 2.95Å; D103-H230 IonicContact OD1-CE1 3.33Å; D103-H230 PolarHBondContact OD1-CE1 3.46Å; D103-H230 IonicContact OD1-NE2 2.84Å; D103-H230 PolarHBondContact OD1-NE2 3.37Å
104G80.9Confident75.8Confident4 Ų446.5 Ų46.54%0.04123%0.231CC..Hα-helixtrans-60-46176.500000113P100 I101 S102 V106 I107 L108P100-G104 PolarHBondContact O-N 3.21Å; P100-G104 VanDerWaalsContact O-N 3.15Å; I101-G104 PolarHBondContact O-N 3.39Å; S102-G104 VanDerWaalsContact C-N 3.33Å; S102-G104 PolarHBondContact O-N 3.03Å; G104-V106 PolarHBondContact O-N 3.23Å; G104-I107 PolarHBondContact O-N 3.49Å; G104-L108 VanDerWaalsContact O-CG 3.27Å; G104-L108 WeakPolarHBondContact O-CG 3.18Å; G104-L108 PolarHBondContact O-N 3.41Å
105V83.6Confident74Confident62 Ų6252.1 Ų52.138%0.37625%0.248SC..Hα-helixtrans-62-43.2179.11700000111.5V88 I101 S102 D103 L108 R109V88-V105 HydrophobicContact CG1-CB 4.4Å; V88-V105 HydrophobicContact CG1-CG1 4.46Å; V88-V105 HydrophobicContact CG2-CG1 4.16Å; I101-V105 HydrophobicContact CG2-CG2 4.45Å; I101-V105 WeakPolarHBondContact O-CG2 3.38Å; I101-V105 PolarHBondContact O-N 2.8Å; S102-V105 PolarHBondContact O-N 3.41Å; D103-V105 PolarHBondContact O-N 3.35Å; V105-L108 PolarHBondContact O-N 2.86Å; V105-R109 WeakPolarHBondContact O-CB 3.38Å; V105-R109 PolarHBondContact O-N 3.03Å
106V81.9Confident72.2Confident1 Ų156.9 Ų56.91%0.00627%0.27CS..Hα-helixtrans-57.1-51.1174.2162.90000110.7Y85 V88 S102 D103 G104 L108 R109 N110Y85-V106 HydrophobicContact CD1-CG2 4.34Å; Y85-V106 HydrophobicContact CD2-CB 4.48Å; Y85-V106 HydrophobicContact CD2-CG1 3.63Å; Y85-V106 HydrophobicContact CD2-CG2 4.05Å; Y85-V106 HydrophobicContact CE1-CG1 4.46Å; Y85-V106 HydrophobicContact CE1-CG2 3.94Å; Y85-V106 HydrophobicContact CE2-CB 4Å; Y85-V106 HydrophobicContact CE2-CG1 2.97Å; Y85-V106 HydrophobicContact CE2-CG2 3.82Å; Y85-V106 HydrophobicContact CG-CG2 4.28Å; Y85-V106 VanDerWaalsContact CZ-CG1 3.4Å; Y85-V106 WeakPolarHBondContact OH-CG1 3.43Å; V88-V106 HydrophobicContact CB-CG2 4.41Å; V88-V106 HydrophobicContact CG1-CG2 3.94Å; S102-V106 WeakPolarHBondContact O-CG2 3.39Å; S102-V106 PolarHBondContact O-N 3.12Å; D103-V106 PolarHBondContact O-N 3.36Å; G104-V106 PolarHBondContact O-N 3.23Å; V106-L108 VanDerWaalsContact C-N 3.32Å; V106-L108 PolarHBondContact O-N 3.16Å; V106-R109 WeakPolarHBondContact O-CB 3.31Å; V106-R109 PolarHBondContact O-N 2.96Å; V106-R109 VanDerWaalsContact O-N 3.07Å; V106-N110 PolarHBondContact O-N 3.45Å; V106-N110 PolarHBondContact O-OD1 3.31Å
107I76.6Confident70.8Confident24 Ų2461.2 Ų61.212%0.12329%0.292CS..Hα-helixtrans-61.4-44.3-175.5-71.5164.8000110.5D103 G104 R109 N110 F111 R125 P126 A129D103-I107 WeakPolarHBondContact O-CD1 3.13Å; D103-I107 VanDerWaalsContact O-CG1 3.22Å; D103-I107 WeakPolarHBondContact O-CG1 3.46Å; D103-I107 PolarHBondContact O-N 2.95Å; G104-I107 PolarHBondContact O-N 3.49Å; I107-R109 PolarHBondContact O-N 3.14Å; I107-N110 PolarHBondContact O-N 3.5Å; I107-F111 PolarHBondContact O-N 2.93Å; I107-R125 HydrophobicContact CG2-CB 3.66Å; I107-P126 HydrophobicContact CG2-CG 4.25Å; I107-A129 HydrophobicContact CB-CB 4.26Å; I107-A129 HydrophobicContact CD1-CB 3.86Å; I107-A129 HydrophobicContact CG2-CB 4.03Å
108L73.2Confident69.7Low99 Ų9958.4 Ų58.452%0.51828%0.283SS..Hα-helixtrans-61.1-34.2176-70.3173.3000112.4G104 V105 V106 F111 P126G104-L108 VanDerWaalsContact O-CG 3.27Å; G104-L108 WeakPolarHBondContact O-CG 3.18Å; G104-L108 PolarHBondContact O-N 3.41Å; V105-L108 PolarHBondContact O-N 2.86Å; V106-L108 VanDerWaalsContact C-N 3.32Å; V106-L108 PolarHBondContact O-N 3.16Å; L108-F111 VanDerWaalsContact O-CB 3.25Å; L108-F111 WeakPolarHBondContact O-CB 3.43Å; L108-F111 PolarHBondContact O-N 3.4Å; L108-P126 HydrophobicContact CD2-CB 4.05Å
109R70.8Confident68.4Low55 Ų5564.3 Ų64.321%0.20830%0.303CS..Hα-helixtrans-73.6-38.5178.3-164.6165.264.1101.6-0.8112.2G80 I81 V84 V105 V106 I107 F111 K112G80-R109 PolarHBondContact O-NH1 3.43Å; I81-R109 PolarHBondContact O-NH1 3.47Å; I81-R109 PolarHBondContact O-NH2 3.14Å; V84-R109 VanDerWaalsContact CG1-NE 3.27Å; V84-R109 VanDerWaalsContact CG1-NH1 3.32Å; V105-R109 WeakPolarHBondContact O-CB 3.38Å; V105-R109 PolarHBondContact O-N 3.03Å; V106-R109 WeakPolarHBondContact O-CB 3.31Å; V106-R109 PolarHBondContact O-N 2.96Å; V106-R109 VanDerWaalsContact O-N 3.07Å; I107-R109 PolarHBondContact O-N 3.14Å; R109-F111 PolarHBondContact O-N 3.31Å; R109-K112 PolarHBondContact O-N 3.01Å
110N65.1Low67.2Low21 Ų2169.9 Ų69.911%0.11233%0.329CS..Hα-helixtrans-60.2-30.1174.1-67.2-6.3000111.9I81 V106 I107 K112 I113I81-N110 WeakPolarHBondContact CD1-OD1 3.42Å; V106-N110 PolarHBondContact O-N 3.45Å; V106-N110 PolarHBondContact O-OD1 3.31Å; I107-N110 PolarHBondContact O-N 3.5Å; N110-K112 VanDerWaalsContact C-N 3.26Å; N110-K112 PolarHBondContact O-N 3.1Å; N110-I113 WeakPolarHBondContact O-CB 3.26Å; N110-I113 PolarHBondContact O-N 3.23Å; N110-I113 VanDerWaalsContact O-N 3.1Å
111F62.9Low66.5Low105 Ų10569.3 Ų69.346%0.46132%0.324SS..Hα-helixtrans-54.9-38.1178-172.4-110.4000113.6I107 L108 R109 I113 A122 P126I107-F111 PolarHBondContact O-N 2.93Å; L108-F111 VanDerWaalsContact O-CB 3.25Å; L108-F111 WeakPolarHBondContact O-CB 3.43Å; L108-F111 PolarHBondContact O-N 3.4Å; R109-F111 PolarHBondContact O-N 3.31Å; F111-I113 PolarHBondContact O-N 2.86Å; F111-A122 HydrophobicContact CD2-CB 3.9Å; F111-A122 WeakPolarHBondContact CD2-O 3.43Å; F111-A122 HydrophobicContact CE2-CB 3.92Å; F111-A122 WeakPolarHBondContact CE2-O 3.33Å; F111-P126 HydrophobicContact CB-CG 4.23Å; F111-P126 HydrophobicContact CD2-CG 3.79Å; F111-P126 HydrophobicContact CE2-CG 4.44Å; F111-P126 HydrophobicContact CG-CG 4.21Å
112K59Low65.6Low182 Ų18267.1 Ų67.179%0.79131%0.314SS*.THydrogen-bonded Turntrans-71.2-14.4-178-73.7-173.2175178.70113.7R109 N110R109-K112 PolarHBondContact O-N 3.01Å; N110-K112 VanDerWaalsContact C-N 3.26Å; N110-K112 PolarHBondContact O-N 3.1Å
113I59.3Low65.1Low59 Ų5973.2 Ų73.230%0.30334%0.34SS..THydrogen-bonded Turntrans-88.6-27.3-166.8-63.2176000112.8I81 N110 F111I81-I113 HydrophobicContact CB-CD1 4.45Å; I81-I113 HydrophobicContact CD1-CD1 3.25Å; I81-I113 HydrophobicContact CG1-CD1 3.84Å; N110-I113 WeakPolarHBondContact O-CB 3.26Å; N110-I113 PolarHBondContact O-N 3.23Å; N110-I113 VanDerWaalsContact O-N 3.1Å; F111-I113 PolarHBondContact O-N 2.86Å
114F51.4Low64.7Low56 Ų5673.8 Ų73.825%0.24634%0.344CS..  trans-113.382.9-169.8-78-82.6000113.4V118 Q192 L195F114-V118 HydrophobicContact CD1-CG2 4.11Å; F114-Q192 HydrophobicContact CE1-CG 4.18Å; F114-Q192 HydrophobicContact CZ-CG 4.13Å; F114-L195 HydrophobicContact CE2-CD2 3.66Å; F114-L195 HydrophobicContact CZ-CD2 4.2Å
115R51.1Low64.4Low153 Ų15374.6 Ų74.658%0.57735%0.346SS*.SBendtrans-80.6120.6164.6-145.7171.569.4-176.33.6108.8F295R115-F295 VanDerWaalsContact NH1-CD2 3.34Å
116M46.8Very low64.2Low143 Ų14372.6 Ų72.670%0.70434%0.335SS*.SBendtrans96.3-27.9167.3-68.3-67-142.400121.6Y119M116-Y119 HydrophobicContact SD-CE2 4.15Å
117L50.7Low64.3Low95 Ų9576.4 Ų76.450%0.49735%0.354SS..SBendtrans-120.7-6.1-165.1-90.8172.9000116.6I171L117-I171 HydrophobicContact CB-CD1 3.33Å; L117-I171 HydrophobicContact CB-CG1 4.06Å; L117-I171 HydrophobicContact CD1-CB 4.13Å; L117-I171 HydrophobicContact CD1-CD1 3.72Å; L117-I171 HydrophobicContact CD1-CG1 3.52Å; L117-I171 HydrophobicContact CD1-CG2 3.5Å; L117-I171 VanDerWaalsContact CD1-CG2 3.5Å; L117-I171 HydrophobicContact CD2-CD1 3.48Å; L117-I171 VanDerWaalsContact CD2-CD1 3.48Å; L117-I171 HydrophobicContact CD2-CG1 3.28Å; L117-I171 HydrophobicContact CG-CD1 3.59Å; L117-I171 HydrophobicContact CG-CG1 3.7Å
118V57.5Low64.5Low14 Ų1475.9 Ų75.99%0.08535%0.353CS..  trans-138.246.7171.5-148.70000111.2F114 Q120 I121 A122 A164 V168F114-V118 HydrophobicContact CD1-CG2 4.11Å; V118-Q120 PolarHBondContact O-N 3.24Å; V118-Q120 VanDerWaalsContact O-N 3.17Å; V118-I121 HydrophobicContact CB-CG2 3.77Å; V118-I121 HydrophobicContact CG1-CB 3.65Å; V118-I121 HydrophobicContact CG1-CG2 3.15Å; V118-I121 PolarHBondContact O-N 3.44Å; V118-A122 VanDerWaalsContact O-CB 3.29Å; V118-A122 WeakPolarHBondContact O-CB 3.45Å; V118-A122 PolarHBondContact O-N 3.11Å; V118-A164 HydrophobicContact CG1-CB 3.79Å; V118-V168 HydrophobicContact CG2-CG2 4.42Å
119Y55.2Low64.8Low145 Ų14571.6 Ų71.657%0.56933%0.331SS*.Hα-helixtrans-58.6-29.5-176-106-74.8000113.8M116 F123M116-Y119 HydrophobicContact SD-CE2 4.15Å; Y119-F123 PolarHBondContact O-N 3.4Å
120Q57.8Low65.5Low119 Ų11976.4 Ų76.456%0.55635%0.351SS*.Hα-helixtrans-77.6-42.7-179.5-70178.2-15.800112.9V118 A122 F123 V124V118-Q120 PolarHBondContact O-N 3.24Å; V118-Q120 VanDerWaalsContact O-N 3.17Å; Q120-A122 PolarHBondContact O-N 3.06Å; Q120-F123 PolarHBondContact O-N 2.97Å; Q120-V124 WeakPolarHBondContact O-CB 3.24Å; Q120-V124 VanDerWaalsContact O-CG2 3.24Å; Q120-V124 WeakPolarHBondContact O-CG2 3.34Å; Q120-V124 PolarHBondContact O-N 3.39Å
121I62.7Low66.3Low25 Ų2578.4 Ų78.413%0.12836%0.36CS..Hα-helixtrans-67.5-32.8173.4-146.6169.3000110.7V118 F123 R125 A164V118-I121 HydrophobicContact CB-CG2 3.77Å; V118-I121 HydrophobicContact CG1-CB 3.65Å; V118-I121 HydrophobicContact CG1-CG2 3.15Å; V118-I121 PolarHBondContact O-N 3.44Å; I121-F123 VanDerWaalsContact C-N 3.31Å; I121-F123 PolarHBondContact O-N 3.14Å; I121-R125 HydrophobicContact CG1-CG 3.92Å; I121-R125 WeakPolarHBondContact O-CB 3.37Å; I121-R125 WeakPolarHBondContact O-CG 3.45Å; I121-R125 PolarHBondContact O-N 2.89Å; I121-A164 HydrophobicContact CB-CB 4.31Å; I121-A164 HydrophobicContact CD1-CB 3.69Å; I121-A164 HydrophobicContact CG1-CB 4.48Å
122A66Low67.1Low11 Ų1176.3 Ų76.39%0.09135%0.354CS..Hα-helixtrans-62.5-39.117900000110.6F111 V118 Q120 P126F111-A122 HydrophobicContact CD2-CB 3.9Å; F111-A122 WeakPolarHBondContact CD2-O 3.43Å; F111-A122 HydrophobicContact CE2-CB 3.92Å; F111-A122 WeakPolarHBondContact CE2-O 3.33Å; V118-A122 VanDerWaalsContact O-CB 3.29Å; V118-A122 WeakPolarHBondContact O-CB 3.45Å; V118-A122 PolarHBondContact O-N 3.11Å; Q120-A122 PolarHBondContact O-N 3.06Å; A122-P126 WeakPolarHBondContact O-CD 3.15Å; A122-P126 WeakPolarHBondContact O-CG 3.43Å
123F73.4Confident68Low135 Ų13570.1 Ų70.159%0.59233%0.329SS*.Hα-helixtrans-85.1-44.6178.7-170.5-100.9000113.5Y119 Q120 I121 R125 P126 L127Y119-F123 PolarHBondContact O-N 3.4Å; Q120-F123 PolarHBondContact O-N 2.97Å; I121-F123 VanDerWaalsContact C-N 3.31Å; I121-F123 PolarHBondContact O-N 3.14Å; F123-R125 VanDerWaalsContact C-N 3.31Å; F123-R125 PolarHBondContact O-N 2.94Å; F123-P126 WeakPolarHBondContact O-CD 3.45Å; F123-L127 HydrophobicContact CE1-CD2 4.01Å; F123-L127 WeakPolarHBondContact O-CB 3.42Å; F123-L127 PolarHBondContact O-N 2.99Å
124V73.6Confident69.1Low41 Ų4170.6 Ų70.625%0.24833%0.334CS..Hα-helixtrans-63-38.4-173.8173.80000111.3Q120 L127 V128 I156Q120-V124 WeakPolarHBondContact O-CB 3.24Å; Q120-V124 VanDerWaalsContact O-CG2 3.24Å; Q120-V124 WeakPolarHBondContact O-CG2 3.34Å; Q120-V124 PolarHBondContact O-N 3.39Å; V124-L127 PolarHBondContact O-N 2.7Å; V124-V128 HydrophobicContact CG1-CG2 4.14Å; V124-V128 WeakPolarHBondContact O-CB 3.44Å; V124-V128 VanDerWaalsContact O-CG2 3.26Å; V124-V128 WeakPolarHBondContact O-CG2 3.1Å; V124-V128 PolarHBondContact O-N 3.2Å; V124-I156 HydrophobicContact CG1-CG2 3.85Å
125R74.4Confident70.4Confident21 Ų2170 Ų708%0.07933%0.333CS..Hα-helixtrans-70.6-51.9-176.2-72.9-171.7170.2-92.9-8114.4I107 I121 F123 L127 V128 A129 T161 N199I107-R125 HydrophobicContact CG2-CB 3.66Å; I121-R125 HydrophobicContact CG1-CG 3.92Å; I121-R125 WeakPolarHBondContact O-CB 3.37Å; I121-R125 WeakPolarHBondContact O-CG 3.45Å; I121-R125 PolarHBondContact O-N 2.89Å; F123-R125 VanDerWaalsContact C-N 3.31Å; F123-R125 PolarHBondContact O-N 2.94Å; R125-L127 PolarHBondContact O-N 3.43Å; R125-V128 PolarHBondContact O-N 3.45Å; R125-A129 VanDerWaalsContact O-CB 3.29Å; R125-A129 WeakPolarHBondContact O-CB 3.39Å; R125-A129 PolarHBondContact O-N 2.95Å; R125-T161 PolarHBondContact NH2-OG1 3.14Å; R125-N199 PolarHBondContact NE-OD1 2.8Å; R125-N199 VanDerWaalsContact NE-OD1 3.15Å; R125-N199 PolarHBondContact NH1-OD1 3.11Å; R125-N199 PolarHBondContact NH2-O 3.43Å; R125-N199 PolarHBondContact NH2-OD1 3.32Å
126P78.9Confident71.5Confident21 Ų2164.9 Ų64.914%0.13631%0.314CS..Hα-helixtrans-53.6-38.2171.2-29.738.2000112.6I107 L108 F111 A122 F123 A129 Y130I107-P126 HydrophobicContact CG2-CG 4.25Å; L108-P126 HydrophobicContact CD2-CB 4.05Å; F111-P126 HydrophobicContact CB-CG 4.23Å; F111-P126 HydrophobicContact CD2-CG 3.79Å; F111-P126 HydrophobicContact CE2-CG 4.44Å; F111-P126 HydrophobicContact CG-CG 4.21Å; A122-P126 WeakPolarHBondContact O-CD 3.15Å; A122-P126 WeakPolarHBondContact O-CG 3.43Å; F123-P126 WeakPolarHBondContact O-CD 3.45Å; P126-A129 PolarHBondContact O-N 2.77Å; P126-Y130 WeakPolarHBondContact O-CB 3.48Å; P126-Y130 PolarHBondContact O-N 3.26Å
127L83.4Confident73Confident80 Ų8062.3 Ų62.342%0.41931%0.306SS..Hα-helixtrans-65.7-48.3177.2-175.264.9000111.7F123 V124 R125 A129 Y130 I131F123-L127 HydrophobicContact CE1-CD2 4.01Å; F123-L127 WeakPolarHBondContact O-CB 3.42Å; F123-L127 PolarHBondContact O-N 2.99Å; V124-L127 PolarHBondContact O-N 2.7Å; R125-L127 PolarHBondContact O-N 3.43Å; L127-A129 VanDerWaalsContact C-N 3.34Å; L127-A129 PolarHBondContact O-N 2.86Å; L127-Y130 PolarHBondContact O-N 3.25Å; L127-I131 HydrophobicContact CD1-CD1 4.33Å; L127-I131 HydrophobicContact CG-CD1 4.04Å; L127-I131 VanDerWaalsContact O-CG1 3.25Å; L127-I131 WeakPolarHBondContact O-CG1 3.19Å; L127-I131 PolarHBondContact O-N 2.83Å
128V81.3Confident74.2Confident14 Ų1463.6 Ų63.69%0.08531%0.313CS..Hα-helixtrans-63.1-40.8176.2171.30000111.2V124 R125 I131 N132 L153 V157V124-V128 HydrophobicContact CG1-CG2 4.14Å; V124-V128 WeakPolarHBondContact O-CB 3.44Å; V124-V128 VanDerWaalsContact O-CG2 3.26Å; V124-V128 WeakPolarHBondContact O-CG2 3.1Å; V124-V128 PolarHBondContact O-N 3.2Å; R125-V128 PolarHBondContact O-N 3.45Å; V128-I131 PolarHBondContact O-N 2.91Å; V128-N132 WeakPolarHBondContact O-CB 3.46Å; V128-N132 PolarHBondContact O-N 3.24Å; V128-N132 PolarHBondContact O-ND2 3.43Å; V128-L153 HydrophobicContact CG1-CB 4.45Å; V128-L153 HydrophobicContact CG1-CD2 4.45Å; V128-L153 HydrophobicContact CG2-CD2 4.44Å; V128-V157 HydrophobicContact CB-CG2 4.45Å; V128-V157 HydrophobicContact CG1-CG2 3.91Å; V128-V157 HydrophobicContact CG2-CG2 4.3Å
129A80.6Confident74.7Confident8 Ų866.8 Ų66.87%0.06632%0.324CS..Hα-helixtrans-64.3-41.9176.200000112I107 R125 P126 L127 N132 M133I107-A129 HydrophobicContact CB-CB 4.26Å; I107-A129 HydrophobicContact CD1-CB 3.86Å; I107-A129 HydrophobicContact CG2-CB 4.03Å; R125-A129 VanDerWaalsContact O-CB 3.29Å; R125-A129 WeakPolarHBondContact O-CB 3.39Å; R125-A129 PolarHBondContact O-N 2.95Å; P126-A129 PolarHBondContact O-N 2.77Å; L127-A129 VanDerWaalsContact C-N 3.34Å; L127-A129 PolarHBondContact O-N 2.86Å; A129-N132 PolarHBondContact O-N 3.24Å; A129-M133 VanDerWaalsContact O-CB 3.3Å; A129-M133 WeakPolarHBondContact O-CB 3.23Å; A129-M133 WeakPolarHBondContact O-CG 3.49Å; A129-M133 PolarHBondContact O-N 3.44Å
130Y83.7Confident75.2Confident157 Ų15769 Ų6962%0.61633%0.331SS*.Hα-helixtrans-63.5-45.4174.6177.2-102000111.3P126 L127 M133 V134P126-Y130 WeakPolarHBondContact O-CB 3.48Å; P126-Y130 PolarHBondContact O-N 3.26Å; L127-Y130 PolarHBondContact O-N 3.25Å; Y130-M133 WeakPolarHBondContact O-CB 3.46Å; Y130-M133 PolarHBondContact O-N 2.83Å; Y130-V134 HydrophobicContact CD1-CG2 4.25Å; Y130-V134 HydrophobicContact CD2-CG2 4.39Å; Y130-V134 HydrophobicContact CE1-CG2 3.83Å; Y130-V134 HydrophobicContact CE2-CG2 3.98Å; Y130-V134 VanDerWaalsContact O-CG2 3.3Å; Y130-V134 WeakPolarHBondContact O-CG2 3.16Å; Y130-V134 PolarHBondContact O-N 3.18Å
131I83.6Confident75.2Confident62 Ų6263.3 Ų63.332%0.31831%0.305SS..Hα-helixtrans-61.5-46.1175.7-68165.1000110.6L127 V128 M133 V134 L135 L153L127-I131 HydrophobicContact CD1-CD1 4.33Å; L127-I131 HydrophobicContact CG-CD1 4.04Å; L127-I131 VanDerWaalsContact O-CG1 3.25Å; L127-I131 WeakPolarHBondContact O-CG1 3.19Å; L127-I131 PolarHBondContact O-N 2.83Å; V128-I131 PolarHBondContact O-N 2.91Å; I131-M133 VanDerWaalsContact C-N 3.31Å; I131-M133 PolarHBondContact O-N 3.5Å; I131-V134 PolarHBondContact O-N 3.25Å; I131-L135 HydrophobicContact CG2-CD1 3.83Å; I131-L135 HydrophobicContact CG2-CG 4.29Å; I131-L135 WeakPolarHBondContact O-CB 3.49Å; I131-L135 VanDerWaalsContact O-CG 3.28Å; I131-L135 WeakPolarHBondContact O-CG 3.28Å; I131-L135 PolarHBondContact O-N 3.28Å; I131-L153 HydrophobicContact CG2-CD1 4.37Å
132N79.2Confident75Confident61 Ų6166.5 Ų66.533%0.32632%0.322SS..Hα-helixtrans-59.5-42.2175.5-80-36.9000111.8V128 A129 W136 L153V128-N132 WeakPolarHBondContact O-CB 3.46Å; V128-N132 PolarHBondContact O-N 3.24Å; V128-N132 PolarHBondContact O-ND2 3.43Å; A129-N132 PolarHBondContact O-N 3.24Å; N132-W136 WeakPolarHBondContact O-CB 3.43Å; N132-W136 PolarHBondContact O-N 3.41Å; N132-L153 VanDerWaalsContact OD1-CD1 3.31Å; N132-L153 WeakPolarHBondContact OD1-CD1 3.42Å
133M77.5Confident74.5Confident53 Ų5367.8 Ų67.826%0.26133%0.326SS..Hα-helixtrans-61.8-47.5174.9-92.9-81.3-131.600112.3I101 A129 Y130 I131 W136 V137I101-M133 HydrophobicContact CB-CE 3.79Å; I101-M133 HydrophobicContact CB-SD 4.22Å; I101-M133 HydrophobicContact CG1-CE 3.73Å; I101-M133 HydrophobicContact CG1-SD 3.61Å; I101-M133 HydrophobicContact CG2-CE 3.59Å; A129-M133 VanDerWaalsContact O-CB 3.3Å; A129-M133 WeakPolarHBondContact O-CB 3.23Å; A129-M133 WeakPolarHBondContact O-CG 3.49Å; A129-M133 PolarHBondContact O-N 3.44Å; Y130-M133 WeakPolarHBondContact O-CB 3.46Å; Y130-M133 PolarHBondContact O-N 2.83Å; I131-M133 VanDerWaalsContact C-N 3.31Å; I131-M133 PolarHBondContact O-N 3.5Å; M133-W136 WeakPolarHBondContact O-CB 3.45Å; M133-W136 PolarHBondContact O-N 3.09Å; M133-V137 WeakPolarHBondContact O-CG2 3.36Å; M133-V137 PolarHBondContact O-N 3.39Å
134V82.4Confident73.8Confident69 Ų6965.2 Ų65.242%0.41832%0.319SS..Hα-helixtrans-62.4-46.3178.71700000110.7Y130 I131 W136 V137 D138Y130-V134 HydrophobicContact CD1-CG2 4.25Å; Y130-V134 HydrophobicContact CD2-CG2 4.39Å; Y130-V134 HydrophobicContact CE1-CG2 3.83Å; Y130-V134 HydrophobicContact CE2-CG2 3.98Å; Y130-V134 VanDerWaalsContact O-CG2 3.3Å; Y130-V134 WeakPolarHBondContact O-CG2 3.16Å; Y130-V134 PolarHBondContact O-N 3.18Å; I131-V134 PolarHBondContact O-N 3.25Å; V134-W136 VanDerWaalsContact C-N 3.3Å; V134-W136 PolarHBondContact O-N 2.96Å; V134-V137 PolarHBondContact O-N 3.27Å; V134-D138 WeakPolarHBondContact O-CB 3.47Å; V134-D138 PolarHBondContact O-N 2.88Å
135L77.8Confident72.9Confident44 Ų4466.1 Ų66.123%0.2333%0.325CS..Hα-helixtrans-64-35.8176.8-70174.7000112.3I131 R139 W149I131-L135 HydrophobicContact CG2-CD1 3.83Å; I131-L135 HydrophobicContact CG2-CG 4.29Å; I131-L135 WeakPolarHBondContact O-CB 3.49Å; I131-L135 VanDerWaalsContact O-CG 3.28Å; I131-L135 WeakPolarHBondContact O-CG 3.28Å; I131-L135 PolarHBondContact O-N 3.28Å; L135-R139 PolarHBondContact O-N 3.36Å; L135-R139 VanDerWaalsContact O-N 3.14Å; L135-W149 HydrophobicContact CD1-CD2 3.96Å; L135-W149 HydrophobicContact CD1-CE3 3.7Å; L135-W149 HydrophobicContact CD1-CH2 4.35Å; L135-W149 HydrophobicContact CD1-CZ3 3.89Å
136W74.2Confident72.1Confident44 Ų4470 Ų7017%0.16736%0.356CS..Hα-helixtrans-66.2-43.8175.8-179.873.5000112.1R97 P100 I101 N132 M133 V134 W140 F143R97-W136 HydrophobicContact CB-CZ2 4.41Å; R97-W136 WeakPolarHBondContact O-CZ2 3.2Å; P100-W136 HydrophobicContact CB-CG 4.31Å; P100-W136 HydrophobicContact CG-CG 4.32Å; I101-W136 HydrophobicContact CD1-CE3 4.37Å; I101-W136 HydrophobicContact CD1-CH2 3.82Å; I101-W136 HydrophobicContact CD1-CZ3 3.65Å; I101-W136 HydrophobicContact CG1-CE3 4.31Å; I101-W136 HydrophobicContact CG1-CH2 4.47Å; I101-W136 HydrophobicContact CG1-CZ3 4.08Å; N132-W136 WeakPolarHBondContact O-CB 3.43Å; N132-W136 PolarHBondContact O-N 3.41Å; M133-W136 WeakPolarHBondContact O-CB 3.45Å; M133-W136 PolarHBondContact O-N 3.09Å; V134-W136 VanDerWaalsContact C-N 3.3Å; V134-W136 PolarHBondContact O-N 2.96Å; W136-W140 PolarHBondContact O-N 3.16Å; W136-F143 AromaticContact CD1-CE2 3.82Å; W136-F143 AromaticContact CD1-CZ 3.4Å; W136-F143 VanDerWaalsContact CD1-CZ 3.4Å; W136-F143 HydrophobicContact CG-CZ 4.48Å
137V78.9Confident71.5Confident89 Ų8970 Ų7054%0.53936%0.356SS..Hα-helixtrans-64.8-42.7176.4171.30000111.2M133 V134 R139M133-V137 WeakPolarHBondContact O-CG2 3.36Å; M133-V137 PolarHBondContact O-N 3.39Å; V134-V137 PolarHBondContact O-N 3.27Å; V137-R139 PolarHBondContact O-N 2.96Å
138D76.9Confident70.7Confident122 Ų12271.1 Ų71.165%0.65237%0.368SS*.Hα-helixtrans-62.4-41.8-179.4-173.561.7000112.1V134V134-D138 WeakPolarHBondContact O-CB 3.47Å; V134-D138 PolarHBondContact O-N 2.88Å
139R68.3Low70.2Confident82 Ų8272.8 Ų72.831%0.30937%0.373SS..THydrogen-bonded Turntrans-96.75.3-174.3-63.3-171.6178.4-155.2-2.6115.3L135 V137 G141 D142 D144L135-R139 PolarHBondContact O-N 3.36Å; L135-R139 VanDerWaalsContact O-N 3.14Å; V137-R139 PolarHBondContact O-N 2.96Å; R139-G141 PolarHBondContact O-N 3.16Å; R139-D142 PolarHBondContact O-N 3.07Å; R139-D144 IonicContact NH1-OD2 3.84Å
140W64.7Low69.6Low190 Ų19075.6 Ų75.672%0.7238%0.382SS*.THydrogen-bonded Turntrans49.124.8178-87.183000116R97 W136R97-W140 PolarHBondContact NH2-O 3.45Å; W136-W140 PolarHBondContact O-N 3.16Å
141G58.8Low69Low1 Ų171.2 Ų71.21%0.0137%0.373CS..THydrogen-bonded Turntrans85.96.8-177.500000115.9R139 F143R139-G141 PolarHBondContact O-N 3.16Å; G141-F143 VanDerWaalsContact O-CD2 3.24Å; G141-F143 WeakPolarHBondContact O-CD2 3.46Å; G141-F143 PolarHBondContact O-N 2.89Å; G141-F143 VanDerWaalsContact O-N 3.12Å
142D58.5Low68.8Low91 Ų9174.6 Ų74.649%0.48739%0.385SS..  trans-77.492.6165.9-71.1-13000108.2V22 R139 D144V22-D142 VanDerWaalsContact CG2-OD1 3.27Å; V22-D142 WeakPolarHBondContact CG2-OD1 3.26Å; R139-D142 PolarHBondContact O-N 3.07Å; D142-D144 PolarHBondContact O-N 3.34Å
143F55.5Low68.8Low38 Ų3872.7 Ų72.717%0.16738%0.375CS..  trans-92.891.1179.2-70.8-85000110.2P100 W136 G141 P145 W149 Y222P100-F143 HydrophobicContact CG-CZ 4.43Å; W136-F143 AromaticContact CD1-CE2 3.82Å; W136-F143 AromaticContact CD1-CZ 3.4Å; W136-F143 VanDerWaalsContact CD1-CZ 3.4Å; W136-F143 HydrophobicContact CG-CZ 4.48Å; G141-F143 VanDerWaalsContact O-CD2 3.24Å; G141-F143 WeakPolarHBondContact O-CD2 3.46Å; G141-F143 PolarHBondContact O-N 2.89Å; G141-F143 VanDerWaalsContact O-N 3.12Å; F143-P145 VanDerWaalsContact O-CD 3.24Å; F143-P145 WeakPolarHBondContact O-CD 3.42Å; F143-P145 VanDerWaalsContact O-N 3.11Å; F143-W149 HydrophobicContact CD1-CH2 4.41Å; F143-Y222 HydrophobicContact CB-CD1 4.46Å; F143-Y222 HydrophobicContact CB-CE1 4.08Å; F143-Y222 HydrophobicContact CD2-CD2 4.47Å; F143-Y222 AromaticContact CD2-CE1 3.8Å; F143-Y222 HydrophobicContact CD2-CE1 3.8Å; F143-Y222 AromaticContact CD2-CE2 3.74Å; F143-Y222 HydrophobicContact CD2-CE2 3.74Å; F143-Y222 AromaticContact CD2-CZ 3.35Å; F143-Y222 WeakPolarHBondContact CD2-OH 3.36Å; F143-Y222 HydrophobicContact CE2-CD2 4.43Å; F143-Y222 AromaticContact CE2-CE2 3.66Å; F143-Y222 HydrophobicContact CE2-CE2 3.66Å; F143-Y222 AromaticContact CE2-CZ 3.74Å; F143-Y222 HydrophobicContact CG-CE1 4.25Å; F143-Y222 HydrophobicContact CZ-CE2 4.47Å
144D57.7Low68.8Low82 Ų8270.9 Ų70.944%0.43937%0.367SS..  trans-60.2115.9167.4-70.6-40.3000109.7R139 D142 S146 S147R139-D144 IonicContact NH1-OD2 3.84Å; D142-D144 PolarHBondContact O-N 3.34Å; D144-S146 PolarHBondContact O-N 3.47Å; D144-S147 PolarHBondContact O-N 3.25Å
145P54.8Low68.7Low60 Ų6071.5 Ų71.539%0.3937%0.372SS..THydrogen-bonded Turntrans-59.9-29.5175.722.7-34.1000113S19 F143 S147S19-P145 VanDerWaalsContact CB-CG 3.44Å; S19-P145 WeakPolarHBondContact OG-CB 3.47Å; S19-P145 WeakPolarHBondContact OG-CD 3.43Å; S19-P145 WeakPolarHBondContact OG-CG 3.26Å; F143-P145 VanDerWaalsContact O-CD 3.24Å; F143-P145 WeakPolarHBondContact O-CD 3.42Å; F143-P145 VanDerWaalsContact O-N 3.11Å; P145-S147 PolarHBondContact O-N 2.86Å
146S58.1Low68.9Low103 Ų10372.3 Ų72.372%0.7238%0.376SS*.THydrogen-bonded Turntrans-72.7-8.5-173.161.30000112.6D144 P148D144-S146 PolarHBondContact O-N 3.47Å; S146-P148 WeakPolarHBondContact O-CD 3.34Å
147S65.3Low69.1Low20 Ų2071 Ų7114%0.1437%0.372CS..  trans-77.2121.3-173.4-1450000111.9D144 P145 W149D144-S147 PolarHBondContact O-N 3.25Å; P145-S147 PolarHBondContact O-N 2.86Å; S147-W149 VanDerWaalsContact CB-CD1 3.43Å; S147-W149 PolarHBondContact O-N 3.29Å; S147-W149 VanDerWaalsContact O-N 3.07Å; S147-W149 PolarHBondContact OG-NE1 3.47Å
148P66.7Low69.1Low103 Ų10369.4 Ų69.467%0.66936%0.36SS*.THydrogen-bonded Turntrans-69.2-11.5-169.326.7-35.5000114.4S146 R150 P151S146-P148 WeakPolarHBondContact O-CD 3.34Å; P148-R150 VanDerWaalsContact C-N 3.31Å; P148-R150 PolarHBondContact O-N 3.43Å; P148-P151 WeakPolarHBondContact O-CD 3.5Å; P148-P151 WeakPolarHBondContact O-CG 3.45Å
149W71.2Confident69.4Low49 Ų4966.3 Ų66.319%0.18635%0.351CS..Hα-helixtrans-67.2-28.7-178.559.1-96000113L135 F143 S147 F152 L153L135-W149 HydrophobicContact CD1-CD2 3.96Å; L135-W149 HydrophobicContact CD1-CE3 3.7Å; L135-W149 HydrophobicContact CD1-CH2 4.35Å; L135-W149 HydrophobicContact CD1-CZ3 3.89Å; F143-W149 HydrophobicContact CD1-CH2 4.41Å; S147-W149 VanDerWaalsContact CB-CD1 3.43Å; S147-W149 PolarHBondContact O-N 3.29Å; S147-W149 VanDerWaalsContact O-N 3.07Å; S147-W149 PolarHBondContact OG-NE1 3.47Å; W149-F152 PolarHBondContact O-N 3.18Å; W149-L153 HydrophobicContact CE3-CD1 3.84Å; W149-L153 HydrophobicContact CZ3-CD1 4.28Å; W149-L153 WeakPolarHBondContact O-CG 3.45Å; W149-L153 PolarHBondContact O-N 3.31Å
150R67.6Low70.1Confident67 Ų6763.1 Ų63.125%0.25334%0.342SS..Hα-helixtrans-64.5-58.4-179-66.3-175.676.4-132.10.2113.9P148 F152 L153 S154P148-R150 VanDerWaalsContact C-N 3.31Å; P148-R150 PolarHBondContact O-N 3.43Å; R150-F152 PolarHBondContact O-N 3.03Å; R150-L153 PolarHBondContact O-N 2.94Å; R150-S154 PolarHBondContact O-N 3.07Å
151P71.9Confident70.7Confident66 Ų6654.2 Ų54.243%0.42931%0.308SS..Hα-helixtrans-62.9-30.4177.925.6-35.2000111.6P148 S154 T155P148-P151 WeakPolarHBondContact O-CD 3.5Å; P148-P151 WeakPolarHBondContact O-CG 3.45Å; P151-S154 PolarHBondContact O-N 3.06Å; P151-T155 WeakPolarHBondContact O-CB 3.48Å; P151-T155 PolarHBondContact O-N 2.89Å; P151-T155 PolarHBondContact O-OG1 3.47Å
152F80.1Confident71.8Confident133 Ų13359.4 Ų59.458%0.58334%0.335SS*.Hα-helixtrans-63.6-50.5174.9-175.8-103.5000112.2W149 R150 S154 T155 I156W149-F152 PolarHBondContact O-N 3.18Å; R150-F152 PolarHBondContact O-N 3.03Å; F152-S154 VanDerWaalsContact C-N 3.34Å; F152-S154 PolarHBondContact O-N 3.3Å; F152-T155 PolarHBondContact O-N 3.12Å; F152-I156 HydrophobicContact CD1-CD1 3.83Å; F152-I156 HydrophobicContact CE1-CD1 3.41Å; F152-I156 VanDerWaalsContact CE1-CD1 3.41Å; F152-I156 HydrophobicContact CE1-CG1 4.5Å; F152-I156 HydrophobicContact CZ-CD1 3.83Å; F152-I156 WeakPolarHBondContact O-CG1 3.39Å; F152-I156 PolarHBondContact O-N 3.39Å
153L78.5Confident72.8Confident21 Ų2158.9 Ų58.911%0.1133%0.332CS..Hα-helixtrans-61.5-42.2175.1-70.2-178.4000111.5V128 I131 N132 W149 R150 T155 I156 V157V128-L153 HydrophobicContact CG1-CB 4.45Å; V128-L153 HydrophobicContact CG1-CD2 4.45Å; V128-L153 HydrophobicContact CG2-CD2 4.44Å; I131-L153 HydrophobicContact CG2-CD1 4.37Å; N132-L153 VanDerWaalsContact OD1-CD1 3.31Å; N132-L153 WeakPolarHBondContact OD1-CD1 3.42Å; W149-L153 HydrophobicContact CE3-CD1 3.84Å; W149-L153 HydrophobicContact CZ3-CD1 4.28Å; W149-L153 WeakPolarHBondContact O-CG 3.45Å; W149-L153 PolarHBondContact O-N 3.31Å; R150-L153 PolarHBondContact O-N 2.94Å; L153-T155 VanDerWaalsContact C-N 3.34Å; L153-T155 PolarHBondContact O-N 3.46Å; L153-I156 PolarHBondContact O-N 2.9Å; L153-V157 VanDerWaalsContact O-CG2 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.35Å; L153-V157 PolarHBondContact O-N 3.4Å
154S76.2Confident73.8Confident14 Ų1457.3 Ų57.310%0.09833%0.326CS..Hα-helixtrans-61.2-42.5176.6-172.10000111.9R150 P151 F152 I156 V157 I158 S203 L207R150-S154 PolarHBondContact O-N 3.07Å; P151-S154 PolarHBondContact O-N 3.06Å; F152-S154 VanDerWaalsContact C-N 3.34Å; F152-S154 PolarHBondContact O-N 3.3Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 2.82Å; S154-V157 PolarHBondContact O-N 3.27Å; S154-V157 VanDerWaalsContact O-N 3.14Å; S154-I158 VanDerWaalsContact O-CG1 3.28Å; S154-I158 WeakPolarHBondContact O-CG1 3.36Å; S154-I158 PolarHBondContact O-N 2.97Å; S154-S203 PolarHBondContact OG-O 3.48Å; S154-L207 WeakPolarHBondContact OG-CG 3.44Å
155T81.4Confident74.7Confident83 Ų8356 Ų5651%0.50932%0.318SS..Hα-helixtrans-61.8-42177.1-55.90000111.8P151 F152 L153 V157 I158 A159P151-T155 WeakPolarHBondContact O-CB 3.48Å; P151-T155 PolarHBondContact O-N 2.89Å; P151-T155 PolarHBondContact O-OG1 3.47Å; F152-T155 PolarHBondContact O-N 3.12Å; L153-T155 VanDerWaalsContact C-N 3.34Å; L153-T155 PolarHBondContact O-N 3.46Å; T155-V157 VanDerWaalsContact C-N 3.33Å; T155-V157 PolarHBondContact O-N 3.42Å; T155-I158 PolarHBondContact O-N 3.14Å; T155-A159 WeakPolarHBondContact O-CB 3.38Å; T155-A159 PolarHBondContact O-N 3Å
156I81.5Confident75.8Confident61 Ų6160.6 Ų60.631%0.31333%0.329SS..Hα-helixtrans-60.1-44.6174.6-70.4168.9000110.7V124 F152 L153 S154 A159 S160V124-I156 HydrophobicContact CG1-CG2 3.85Å; F152-I156 HydrophobicContact CD1-CD1 3.83Å; F152-I156 HydrophobicContact CE1-CD1 3.41Å; F152-I156 VanDerWaalsContact CE1-CD1 3.41Å; F152-I156 HydrophobicContact CE1-CG1 4.5Å; F152-I156 HydrophobicContact CZ-CD1 3.83Å; F152-I156 WeakPolarHBondContact O-CG1 3.39Å; F152-I156 PolarHBondContact O-N 3.39Å; L153-I156 PolarHBondContact O-N 2.9Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 2.82Å; I156-A159 PolarHBondContact O-N 3.36Å; I156-S160 VanDerWaalsContact O-CB 3.31Å; I156-S160 WeakPolarHBondContact O-CB 3.35Å; I156-S160 PolarHBondContact O-N 3.19Å
157V77.9Confident76.6Confident15 Ų1557.3 Ų57.39%0.09131%0.306CS..Hα-helixtrans-65-40.2179.2176.60000111.1V128 L153 S154 T155 S160 T161 S203V128-V157 HydrophobicContact CB-CG2 4.45Å; V128-V157 HydrophobicContact CG1-CG2 3.91Å; V128-V157 HydrophobicContact CG2-CG2 4.3Å; L153-V157 VanDerWaalsContact O-CG2 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.35Å; L153-V157 PolarHBondContact O-N 3.4Å; S154-V157 PolarHBondContact O-N 3.27Å; S154-V157 VanDerWaalsContact O-N 3.14Å; T155-V157 VanDerWaalsContact C-N 3.33Å; T155-V157 PolarHBondContact O-N 3.42Å; V157-S160 PolarHBondContact O-N 3.36Å; V157-T161 WeakPolarHBondContact O-CB 3.49Å; V157-T161 PolarHBondContact O-N 3.25Å; V157-T161 PolarHBondContact O-OG1 3.44Å; V157-S203 WeakPolarHBondContact CG1-OG 3.44Å
158I80.5Confident77Confident57 Ų5757.1 Ų57.129%0.29230%0.304SS..Hα-helixtrans-64.8-48.5176.7-67.1168.6000110.7S154 T155 S160 T161 L162 L207S154-I158 VanDerWaalsContact O-CG1 3.28Å; S154-I158 WeakPolarHBondContact O-CG1 3.36Å; S154-I158 PolarHBondContact O-N 2.97Å; T155-I158 PolarHBondContact O-N 3.14Å; I158-S160 VanDerWaalsContact C-N 3.32Å; I158-S160 PolarHBondContact O-N 2.9Å; I158-T161 WeakPolarHBondContact O-CB 3.32Å; I158-T161 PolarHBondContact O-N 2.7Å; I158-T161 VanDerWaalsContact O-N 3.07Å; I158-L162 HydrophobicContact CG2-CD1 4.45Å; I158-L162 WeakPolarHBondContact O-CG 3.42Å; I158-L162 PolarHBondContact O-N 2.88Å; I158-L207 HydrophobicContact CD1-CD1 3.47Å; I158-L207 VanDerWaalsContact CD1-CD1 3.47Å
159A82.5Confident77.4Confident56 Ų5656.7 Ų56.746%0.46330%0.296SS..Hα-helixtrans-59.4-43.2177.200000111.8T155 I156 T161 L162 L163T155-A159 WeakPolarHBondContact O-CB 3.38Å; T155-A159 PolarHBondContact O-N 3Å; I156-A159 PolarHBondContact O-N 3.36Å; A159-T161 VanDerWaalsContact C-N 3.3Å; A159-T161 PolarHBondContact O-N 2.85Å; A159-L162 PolarHBondContact O-N 3.11Å; A159-L163 PolarHBondContact O-N 3.02Å; A159-L163 VanDerWaalsContact O-N 3.12Å
160S82.1Confident77.9Confident15 Ų1558.1 Ų58.111%0.10531%0.31CS..Hα-helixtrans-63.3-36.7174.9-1770000112.2I156 V157 I158 L163 A164I156-S160 VanDerWaalsContact O-CB 3.31Å; I156-S160 WeakPolarHBondContact O-CB 3.35Å; I156-S160 PolarHBondContact O-N 3.19Å; V157-S160 PolarHBondContact O-N 3.36Å; I158-S160 VanDerWaalsContact C-N 3.32Å; I158-S160 PolarHBondContact O-N 2.9Å; S160-L163 PolarHBondContact O-N 3.31Å; S160-A164 WeakPolarHBondContact O-CB 3.08Å; S160-A164 PolarHBondContact O-N 2.89Å
161T78.3Confident78.2Confident4 Ų456 Ų563%0.02530%0.303CS..Hα-helixtrans-69.8-41.8178.1-56.10000111.3R125 V157 I158 A159 L163 A164 I165 L196 N199 V200R125-T161 PolarHBondContact NH2-OG1 3.14Å; V157-T161 WeakPolarHBondContact O-CB 3.49Å; V157-T161 PolarHBondContact O-N 3.25Å; V157-T161 PolarHBondContact O-OG1 3.44Å; I158-T161 WeakPolarHBondContact O-CB 3.32Å; I158-T161 PolarHBondContact O-N 2.7Å; I158-T161 VanDerWaalsContact O-N 3.07Å; A159-T161 VanDerWaalsContact C-N 3.3Å; A159-T161 PolarHBondContact O-N 2.85Å; T161-L163 VanDerWaalsContact C-N 3.32Å; T161-L163 PolarHBondContact O-N 3.27Å; T161-A164 WeakPolarHBondContact O-CB 3.2Å; T161-A164 PolarHBondContact O-N 3.15Å; T161-A164 VanDerWaalsContact O-N 3.14Å; T161-I165 WeakPolarHBondContact O-CG1 3.29Å; T161-I165 PolarHBondContact O-N 3.19Å; T161-L196 HydrophobicContact CG2-CG 4.32Å; T161-N199 HydrophobicContact CG2-CB 4.35Å; T161-V200 HydrophobicContact CG2-CG2 3.7Å
162L80.9Confident78.2Confident109 Ų10955.7 Ų55.757%0.57130%0.296SS*.Hα-helixtrans-59.1-43173.8-69.4174.6000112I158 A159 A164 I165 Y166I158-L162 HydrophobicContact CG2-CD1 4.45Å; I158-L162 WeakPolarHBondContact O-CG 3.42Å; I158-L162 PolarHBondContact O-N 2.88Å; A159-L162 PolarHBondContact O-N 3.11Å; L162-A164 VanDerWaalsContact C-N 3.3Å; L162-A164 PolarHBondContact O-N 3.41Å; L162-I165 HydrophobicContact CD2-CD1 4.25Å; L162-I165 WeakPolarHBondContact O-CB 2.96Å; L162-I165 PolarHBondContact O-N 3.08Å; L162-Y166 PolarHBondContact O-N 2.72Å; L162-Y166 VanDerWaalsContact O-N 3.14Å
163L80.7Confident78.1Confident80 Ų8055.1 Ų55.142%0.41930%0.295SS..Hα-helixtrans-66.3-34.4176.6-17252.6000112.3A159 S160 T161 Y166 S167A159-L163 PolarHBondContact O-N 3.02Å; A159-L163 VanDerWaalsContact O-N 3.12Å; S160-L163 PolarHBondContact O-N 3.31Å; T161-L163 VanDerWaalsContact C-N 3.32Å; T161-L163 PolarHBondContact O-N 3.27Å; L163-Y166 PolarHBondContact O-N 2.9Å; L163-S167 PolarHBondContact O-N 3.11Å; L163-S167 PolarHBondContact O-OG 3.25Å
164A75.1Confident78.2Confident5 Ų556.9 Ų56.94%0.04131%0.313CS..Hα-helixtrans-67.9-39.7172.700000112.5V118 I121 S160 T161 L162 Y166 S167 V168V118-A164 HydrophobicContact CG1-CB 3.79Å; I121-A164 HydrophobicContact CB-CB 4.31Å; I121-A164 HydrophobicContact CD1-CB 3.69Å; I121-A164 HydrophobicContact CG1-CB 4.48Å; S160-A164 WeakPolarHBondContact O-CB 3.08Å; S160-A164 PolarHBondContact O-N 2.89Å; T161-A164 WeakPolarHBondContact O-CB 3.2Å; T161-A164 PolarHBondContact O-N 3.15Å; T161-A164 VanDerWaalsContact O-N 3.14Å; L162-A164 VanDerWaalsContact C-N 3.3Å; L162-A164 PolarHBondContact O-N 3.41Å; A164-Y166 VanDerWaalsContact C-N 3.32Å; A164-Y166 PolarHBondContact O-N 3.23Å; A164-S167 PolarHBondContact O-N 3.16Å; A164-V168 WeakPolarHBondContact O-CB 3.37Å; A164-V168 VanDerWaalsContact O-CG2 3.26Å; A164-V168 WeakPolarHBondContact O-CG2 3.5Å; A164-V168 PolarHBondContact O-N 3.1Å
165I76.7Confident77.9Confident54 Ų5457.5 Ų57.528%0.27732%0.319SS..Hα-helixtrans-55.6-50.9173.2-64.1172.1000109.9T161 L162 S167 V168 N169 L196T161-I165 WeakPolarHBondContact O-CG1 3.29Å; T161-I165 PolarHBondContact O-N 3.19Å; L162-I165 HydrophobicContact CD2-CD1 4.25Å; L162-I165 WeakPolarHBondContact O-CB 2.96Å; L162-I165 PolarHBondContact O-N 3.08Å; I165-S167 VanDerWaalsContact C-N 3.31Å; I165-S167 PolarHBondContact O-N 3.39Å; I165-V168 PolarHBondContact O-N 2.93Å; I165-N169 VanDerWaalsContact O-CG 3.28Å; I165-N169 PolarHBondContact O-N 3.04Å; I165-N169 PolarHBondContact O-ND2 3.24Å; I165-L196 HydrophobicContact CB-CD1 4.09Å; I165-L196 HydrophobicContact CD1-CD1 4.4Å; I165-L196 HydrophobicContact CD1-CD2 3.72Å; I165-L196 HydrophobicContact CD1-CG 4.48Å; I165-L196 HydrophobicContact CG1-CD1 3.25Å; I165-L196 HydrophobicContact CG1-CD2 3.43Å; I165-L196 VanDerWaalsContact CG1-CD2 3.43Å; I165-L196 HydrophobicContact CG1-CG 3.79Å
166Y78.7Confident77.5Confident157 Ų15758.5 Ų58.562%0.61632%0.316SS*.Hα-helixtrans-57.1-47.4179.4174.9-100.6000111.4L162 L163 A164 N169 V170L162-Y166 PolarHBondContact O-N 2.72Å; L162-Y166 VanDerWaalsContact O-N 3.14Å; L163-Y166 PolarHBondContact O-N 2.9Å; A164-Y166 VanDerWaalsContact C-N 3.32Å; A164-Y166 PolarHBondContact O-N 3.23Å; Y166-N169 PolarHBondContact O-N 3.32Å; Y166-V170 HydrophobicContact CE1-CG2 4.13Å; Y166-V170 HydrophobicContact CE2-CG2 4.21Å; Y166-V170 WeakPolarHBondContact O-CG2 3.37Å; Y166-V170 PolarHBondContact O-N 3.3Å; Y166-V170 VanDerWaalsContact O-N 3.1Å
167S75.2Confident77Confident34 Ų3462.5 Ų62.524%0.23834%0.338CS..Hα-helixtrans-60.4-48.9179.3-54.90000111.2L163 A164 I165 N169 V170 I171L163-S167 PolarHBondContact O-N 3.11Å; L163-S167 PolarHBondContact O-OG 3.25Å; A164-S167 PolarHBondContact O-N 3.16Å; I165-S167 VanDerWaalsContact C-N 3.31Å; I165-S167 PolarHBondContact O-N 3.39Å; S167-N169 VanDerWaalsContact C-N 3.33Å; S167-N169 PolarHBondContact O-N 3.02Å; S167-V170 PolarHBondContact O-N 3.24Å; S167-I171 WeakPolarHBondContact O-CD1 2.99Å; S167-I171 WeakPolarHBondContact O-CG1 3.46Å; S167-I171 PolarHBondContact O-N 3.33Å
168V72.7Confident76.4Confident17 Ų1768.8 Ų68.810%0.10337%0.366CS..Hα-helixtrans-58.8-42177.9171.20000111.7V118 A164 I165 I171 H172 Q192V118-V168 HydrophobicContact CG2-CG2 4.42Å; A164-V168 WeakPolarHBondContact O-CB 3.37Å; A164-V168 VanDerWaalsContact O-CG2 3.26Å; A164-V168 WeakPolarHBondContact O-CG2 3.5Å; A164-V168 PolarHBondContact O-N 3.1Å; I165-V168 PolarHBondContact O-N 2.93Å; V168-I171 PolarHBondContact O-N 3.31Å; V168-H172 VanDerWaalsContact O-CB 3.3Å; V168-H172 WeakPolarHBondContact O-CB 3.41Å; V168-H172 PolarHBondContact O-N 3.38Å; V168-Q192 HydrophobicContact CG1-CB 4.22Å
169N76.5Confident75.5Confident93 Ų9369 Ų6950%0.49737%0.367SS..Hα-helixtrans-64.1-42.8177.9-71.5-17.5000112I165 Y166 S167 I171 H172 E173I165-N169 VanDerWaalsContact O-CG 3.28Å; I165-N169 PolarHBondContact O-N 3.04Å; I165-N169 PolarHBondContact O-ND2 3.24Å; Y166-N169 PolarHBondContact O-N 3.32Å; S167-N169 VanDerWaalsContact C-N 3.33Å; S167-N169 PolarHBondContact O-N 3.02Å; N169-I171 VanDerWaalsContact C-N 3.33Å; N169-I171 PolarHBondContact O-N 3.37Å; N169-H172 PolarHBondContact O-N 3.3Å; N169-E173 PolarHBondContact O-N 2.96Å; N169-E173 VanDerWaalsContact O-N 3.15Å
170V80.6Confident74.6Confident79 Ų7974.9 Ų74.948%0.47938%0.379SS..Hα-helixtrans-61.9-43.1176.3172.10000111Y166 S167 A174Y166-V170 HydrophobicContact CE1-CG2 4.13Å; Y166-V170 HydrophobicContact CE2-CG2 4.21Å; Y166-V170 WeakPolarHBondContact O-CG2 3.37Å; Y166-V170 PolarHBondContact O-N 3.3Å; Y166-V170 VanDerWaalsContact O-N 3.1Å; S167-V170 PolarHBondContact O-N 3.24Å; V170-A174 PolarHBondContact O-N 2.79Å; V170-A174 VanDerWaalsContact O-N 3.12Å
171I74.1Confident73.6Confident22 Ų2280 Ų8011%0.11340%0.399CS..Hα-helixtrans-64.6-44176.6-65.4153.2000111.2L117 S167 V168 N169 E173 A174 A175L117-I171 HydrophobicContact CB-CD1 3.33Å; L117-I171 HydrophobicContact CB-CG1 4.06Å; L117-I171 HydrophobicContact CD1-CB 4.13Å; L117-I171 HydrophobicContact CD1-CD1 3.72Å; L117-I171 HydrophobicContact CD1-CG1 3.52Å; L117-I171 HydrophobicContact CD1-CG2 3.5Å; L117-I171 VanDerWaalsContact CD1-CG2 3.5Å; L117-I171 HydrophobicContact CD2-CD1 3.48Å; L117-I171 VanDerWaalsContact CD2-CD1 3.48Å; L117-I171 HydrophobicContact CD2-CG1 3.28Å; L117-I171 HydrophobicContact CG-CD1 3.59Å; L117-I171 HydrophobicContact CG-CG1 3.7Å; S167-I171 WeakPolarHBondContact O-CD1 2.99Å; S167-I171 WeakPolarHBondContact O-CG1 3.46Å; S167-I171 PolarHBondContact O-N 3.33Å; V168-I171 PolarHBondContact O-N 3.31Å; N169-I171 VanDerWaalsContact C-N 3.33Å; N169-I171 PolarHBondContact O-N 3.37Å; I171-E173 VanDerWaalsContact C-N 3.28Å; I171-E173 PolarHBondContact O-N 2.98Å; I171-A174 CarbonylContact O-C 3.49Å; I171-A174 PolarHBondContact O-N 2.99Å; I171-A174 VanDerWaalsContact O-N 3.14Å; I171-A175 WeakPolarHBondContact O-CB 3.2Å; I171-A175 PolarHBondContact O-N 2.77Å
172H72.4Confident72.8Confident61 Ų6182.3 Ų82.328%0.28241%0.409SS..Hα-helixtrans-58.3-45.6-177.3-179.873.9000110.4V168 N169 A175 K176 A189V168-H172 VanDerWaalsContact O-CB 3.3Å; V168-H172 WeakPolarHBondContact O-CB 3.41Å; V168-H172 PolarHBondContact O-N 3.38Å; N169-H172 PolarHBondContact O-N 3.3Å; H172-A175 PolarHBondContact O-N 3.39Å; H172-K176 WeakPolarHBondContact O-CB 3.45Å; H172-K176 PolarHBondContact O-N 2.9Å; H172-A189 WeakPolarHBondContact ND1-CB 3.38Å
173E78.7Confident72Confident120 Ų12084.3 Ų84.356%0.56141%0.409SS*.Hα-helixtrans-64-41.1175.4-70.2-60.2160.400112.3N169 I171N169-E173 PolarHBondContact O-N 2.96Å; N169-E173 VanDerWaalsContact O-N 3.15Å; I171-E173 VanDerWaalsContact C-N 3.28Å; I171-E173 PolarHBondContact O-N 2.98Å
174A78.7Confident71.2Confident59 Ų5981.5 Ų81.549%0.48839%0.394SS..Hα-helixtrans-67.5-36.317600000113.3V170 I171 H178V170-A174 PolarHBondContact O-N 2.79Å; V170-A174 VanDerWaalsContact O-N 3.12Å; I171-A174 CarbonylContact O-C 3.49Å; I171-A174 PolarHBondContact O-N 2.99Å; I171-A174 VanDerWaalsContact O-N 3.14Å; A174-H178 PolarHBondContact O-ND1 2.9Å; A174-H178 VanDerWaalsContact O-ND1 3.14Å
175A71.4Confident70.7Confident26 Ų2682.6 Ų82.622%0.21540%0.398CS..Hα-helixtrans-75-33.8-178.500000111.8I171 H172 L177 H178 L179I171-A175 WeakPolarHBondContact O-CB 3.2Å; I171-A175 PolarHBondContact O-N 2.77Å; H172-A175 PolarHBondContact O-N 3.39Å; A175-L177 PolarHBondContact O-N 3.3Å; A175-H178 PolarHBondContact O-N 3.16Å; A175-H178 VanDerWaalsContact O-N 3.12Å; A175-L179 HydrophobicContact CB-CD1 4.22Å; A175-L179 WeakPolarHBondContact O-CB 3.3Å; A175-L179 PolarHBondContact O-N 3.48Å
176K71.8Confident70.2Confident104 Ų10483.9 Ų83.945%0.45240%0.404SS..Hα-helixtrans-55.3-35.9177.1-174.3176.9176.2-176.40112.1H172H172-K176 WeakPolarHBondContact O-CB 3.45Å; H172-K176 PolarHBondContact O-N 2.9Å
177L71.2Confident69.7Low146 Ų14676.9 Ų76.976%0.76438%0.378SS*.Hα-helixtrans-67.4-38.9178.9-16871.2000112.9A175A175-L177 PolarHBondContact O-N 3.3Å
178H66.3Low69.3Low147 Ų14780.1 Ų80.168%0.68139%0.391SS*.Hα-helixtrans-93.6-28-172.4-64.989.4000113.4A174 A175A174-H178 PolarHBondContact O-ND1 2.9Å; A174-H178 VanDerWaalsContact O-ND1 3.14Å; A175-H178 PolarHBondContact O-N 3.16Å; A175-H178 VanDerWaalsContact O-N 3.12Å
179L61.8Low69.1Low61 Ų6179.7 Ų79.732%0.31939%0.389SS..Hα-helixtrans-110.510.2-170-67.6165.3000113.9A175 K181 F182 H185A175-L179 HydrophobicContact CB-CD1 4.22Å; A175-L179 WeakPolarHBondContact O-CB 3.3Å; A175-L179 PolarHBondContact O-N 3.48Å; L179-K181 PolarHBondContact O-N 3.44Å; L179-F182 PolarHBondContact O-N 2.91Å; L179-H185 HydrophobicContact CB-CB 3.86Å; L179-H185 PolarHBondContact O-ND1 3.47Å
180Y62Low68.9Low180 Ų18078.6 Ų78.671%0.70638%0.38SS*.G310 helixtrans-53.2-39.8174.3-174.8-99.2000111.4F182 R183Y180-F182 PolarHBondContact O-N 3.43Å; Y180-R183 PolarHBondContact O-N 3.32Å
181K61.4Low68.3Low121 Ų12175.8 Ų75.853%0.52636%0.362SS..G310 helixtrans-60.8-37.2-178.4-166.7172.3-178.1179.20113.8L179L179-K181 PolarHBondContact O-N 3.44Å
182F63Low68.2Low54 Ų5476.1 Ų76.124%0.23736%0.363CS..G310 helixtrans-92.1-1.4-172.6-75.3-74.4000115L179 Y180 M184 N253 L284L179-F182 PolarHBondContact O-N 2.91Å; Y180-F182 PolarHBondContact O-N 3.43Å; F182-M184 HydrophobicContact CB-CB 4.42Å; F182-M184 HydrophobicContact CB-CG 4.49Å; F182-M184 WeakPolarHBondContact O-CG 3.34Å; F182-M184 PolarHBondContact O-N 3.21Å; F182-N253 PolarHBondContact O-OD1 3.07Å; F182-L284 HydrophobicContact CZ-CD1 4.41Å
183R63.9Low68.2Low150 Ų15077.6 Ų77.657%0.56637%0.372SS*.SBendtrans50-6.7-172.1-79.9-175.3141.1-173.5-6.1116.8Y180 H185 I186Y180-R183 PolarHBondContact O-N 3.32Å; R183-H185 VanDerWaalsContact C-N 3.27Å; R183-H185 PolarHBondContact O-N 3.1Å; R183-I186 PolarHBondContact O-N 3.32Å
184M63.4Low67.8Low22 Ų2273.2 Ų73.211%0.10835%0.353CS..Hα-helixtrans-70.8-21.1-179.4-78-61.5-161.800113.2L75 F182 I186 V187 M188 N253 M255L75-M184 HydrophobicContact CD2-CE 4.31Å; F182-M184 HydrophobicContact CB-CB 4.42Å; F182-M184 HydrophobicContact CB-CG 4.49Å; F182-M184 WeakPolarHBondContact O-CG 3.34Å; F182-M184 PolarHBondContact O-N 3.21Å; M184-I186 PolarHBondContact O-N 3.02Å; M184-V187 PolarHBondContact O-N 3.27Å; M184-V187 VanDerWaalsContact O-N 3.13Å; M184-M188 WeakPolarHBondContact O-CB 3.38Å; M184-M188 PolarHBondContact O-N 3.48Å; M184-N253 WeakPolarHBondContact CE-ND2 3.46Å; M184-N253 PolarHBondContact SD-ND2 3.01Å; M184-M255 HydrophobicContact CE-CB 3.93Å; M184-M255 HydrophobicContact CE-CE 3.25Å; M184-M255 HydrophobicContact CE-CG 4.13Å; M184-M255 HydrophobicContact CE-SD 3.17Å; M184-M255 WeakPolarHBondContact CE-SD 3.08Å; M184-M255 HydrophobicContact CG-CE 3.53Å; M184-M255 HydrophobicContact SD-CE 4.02Å
185H64.1Low67.5Low27 Ų2772.3 Ų72.313%0.12534%0.34CS..Hα-helixtrans-56.4-35.1175.764-88000111.4L179 R183 A189L179-H185 HydrophobicContact CB-CB 3.86Å; L179-H185 PolarHBondContact O-ND1 3.47Å; R183-H185 VanDerWaalsContact C-N 3.27Å; R183-H185 PolarHBondContact O-N 3.1Å; H185-A189 WeakPolarHBondContact O-CB 3.42Å; H185-A189 PolarHBondContact O-N 3.22Å
186I66.6Low67.5Low81 Ų8172.5 Ų72.542%0.41534%0.337SS..Hα-helixtrans-66.8-47.5177.5-55.5-179.4000110.3R183 M184 A189 F190R183-I186 PolarHBondContact O-N 3.32Å; M184-I186 PolarHBondContact O-N 3.02Å; I186-A189 PolarHBondContact O-N 3.02Å; I186-F190 WeakPolarHBondContact O-CB 3.36Å; I186-F190 PolarHBondContact O-N 3.34Å
187V67.6Low67.6Low10 Ų1070.4 Ų70.46%0.06133%0.333CS..Hα-helixtrans-66.3-44.3-179.4-178.60000110.8M184 F190 M191 F247M184-V187 PolarHBondContact O-N 3.27Å; M184-V187 VanDerWaalsContact O-N 3.13Å; V187-F190 PolarHBondContact O-N 3.46Å; V187-M191 HydrophobicContact CG1-CG 4.42Å; V187-M191 WeakPolarHBondContact O-CB 3.32Å; V187-M191 WeakPolarHBondContact O-CG 3.2Å; V187-M191 PolarHBondContact O-N 3.34Å; V187-F247 HydrophobicContact CG2-CB 3.46Å; V187-F247 VanDerWaalsContact CG2-CB 3.46Å; V187-F247 HydrophobicContact CG2-CG 4.29Å
188M67.8Low67.7Low102 Ų10263.9 Ų63.950%0.50230%0.298SS..Hα-helixtrans-64.6-42.4178.3-164.2177-140.200111.8M184 M191 Q192M184-M188 WeakPolarHBondContact O-CB 3.38Å; M184-M188 PolarHBondContact O-N 3.48Å; M188-M191 PolarHBondContact O-N 3.24Å; M188-Q192 WeakPolarHBondContact O-CG 3.34Å; M188-Q192 PolarHBondContact O-N 3.03Å
189A68.9Low67.9Low9 Ų957.4 Ų57.47%0.07427%0.269CS..Hα-helixtrans-64.7-43.117500000111.6H172 H185 I186 M191 Q192 I193H172-A189 WeakPolarHBondContact ND1-CB 3.38Å; H185-A189 WeakPolarHBondContact O-CB 3.42Å; H185-A189 PolarHBondContact O-N 3.22Å; I186-A189 PolarHBondContact O-N 3.02Å; A189-M191 PolarHBondContact O-N 2.97Å; A189-Q192 WeakPolarHBondContact O-CB 3.36Å; A189-Q192 PolarHBondContact O-N 2.95Å; A189-Q192 VanDerWaalsContact O-N 3.16Å; A189-I193 VanDerWaalsContact O-CG1 3.26Å; A189-I193 WeakPolarHBondContact O-CG1 3.44Å; A189-I193 PolarHBondContact O-N 3.46Å
190F71.6Confident68.4Low70 Ų7057 Ų5731%0.30727%0.269SS..Hα-helixtrans-63.3-42.9178.5-169.2-106.7000111.6I186 V187 Q192 I193 V194 M240 L243I186-F190 WeakPolarHBondContact O-CB 3.36Å; I186-F190 PolarHBondContact O-N 3.34Å; V187-F190 PolarHBondContact O-N 3.46Å; F190-Q192 VanDerWaalsContact C-N 3.32Å; F190-Q192 PolarHBondContact O-N 2.92Å; F190-I193 PolarHBondContact O-N 3.4Å; F190-V194 HydrophobicContact CE1-CG2 4.29Å; F190-V194 HydrophobicContact CZ-CG2 4.25Å; F190-V194 WeakPolarHBondContact O-CG2 3.35Å; F190-V194 PolarHBondContact O-N 3.44Å; F190-M240 HydrophobicContact CD1-CE 3.36Å; F190-M240 HydrophobicContact CD1-SD 3.92Å; F190-M240 HydrophobicContact CE1-CE 3.44Å; F190-M240 VanDerWaalsContact CE1-CE 3.44Å; F190-M240 HydrophobicContact CE1-SD 3.31Å; F190-M240 WeakPolarHBondContact CE1-SD 3.32Å; F190-M240 HydrophobicContact CG-CE 4.38Å; F190-M240 HydrophobicContact CZ-SD 4.07Å; F190-L243 HydrophobicContact CE1-CB 4.18Å; F190-L243 HydrophobicContact CE1-CD1 3.39Å; F190-L243 HydrophobicContact CE1-CG 4.41Å; F190-L243 HydrophobicContact CZ-CD1 3.51Å
191M68.5Low69.1Low20 Ų2050 Ų5010%0.09924%0.243CC..Hα-helixtrans-60.2-40.7172.2-70-57-170.400112.5L78 F82 V187 M188 A189 L195 M240 A244L78-M191 HydrophobicContact CD2-CG 4.3Å; F82-M191 HydrophobicContact CE1-CE 4.12Å; F82-M191 HydrophobicContact CE1-SD 3.91Å; F82-M191 HydrophobicContact CE2-CE 3.59Å; F82-M191 HydrophobicContact CE2-SD 4.28Å; F82-M191 HydrophobicContact CZ-CE 3.2Å; F82-M191 HydrophobicContact CZ-SD 3.32Å; F82-M191 WeakPolarHBondContact CZ-SD 3.32Å; V187-M191 HydrophobicContact CG1-CG 4.42Å; V187-M191 WeakPolarHBondContact O-CB 3.32Å; V187-M191 WeakPolarHBondContact O-CG 3.2Å; V187-M191 PolarHBondContact O-N 3.34Å; M188-M191 PolarHBondContact O-N 3.24Å; A189-M191 PolarHBondContact O-N 2.97Å; M191-L195 WeakPolarHBondContact O-CB 3.31Å; M191-L195 PolarHBondContact O-N 2.92Å; M191-M240 HydrophobicContact CE-CE 4.3Å; M191-M240 HydrophobicContact CG-CE 4.38Å; M191-M240 HydrophobicContact SD-CE 3.23Å; M191-M240 WeakPolarHBondContact SD-CE 3.2Å; M191-A244 HydrophobicContact CE-CB 3.44Å; M191-A244 VanDerWaalsContact CE-CB 3.44Å
192Q72.4Confident69.6Low29 Ų2946 Ų4614%0.13623%0.23CC..Hα-helixtrans-66.6-43.3176.9-73.4168.610.300112F114 V168 M188 A189 F190 L195 L196F114-Q192 HydrophobicContact CE1-CG 4.18Å; F114-Q192 HydrophobicContact CZ-CG 4.13Å; V168-Q192 HydrophobicContact CG1-CB 4.22Å; M188-Q192 WeakPolarHBondContact O-CG 3.34Å; M188-Q192 PolarHBondContact O-N 3.03Å; A189-Q192 WeakPolarHBondContact O-CB 3.36Å; A189-Q192 PolarHBondContact O-N 2.95Å; A189-Q192 VanDerWaalsContact O-N 3.16Å; F190-Q192 VanDerWaalsContact C-N 3.32Å; F190-Q192 PolarHBondContact O-N 2.92Å; Q192-L195 PolarHBondContact O-N 3.45Å; Q192-L196 WeakPolarHBondContact O-CB 3.29Å; Q192-L196 PolarHBondContact O-N 3.31Å
193I72.2Confident69.9Low91 Ų9143.8 Ų43.847%0.46722%0.221SC..Hα-helixtrans-61.8-44.2176.9-70.3166.2000110.4A189 F190 L196 V197A189-I193 VanDerWaalsContact O-CG1 3.26Å; A189-I193 WeakPolarHBondContact O-CG1 3.44Å; A189-I193 PolarHBondContact O-N 3.46Å; F190-I193 PolarHBondContact O-N 3.4Å; I193-L196 CarbonylContact O-C 3.59Å; I193-L196 WeakPolarHBondContact O-CA 3.42Å; I193-L196 VanDerWaalsContact O-CB 3.24Å; I193-L196 WeakPolarHBondContact O-CB 3.28Å; I193-L196 PolarHBondContact O-N 2.87Å; I193-L196 VanDerWaalsContact O-N 3.14Å; I193-V197 WeakPolarHBondContact O-CG2 3.49Å; I193-V197 PolarHBondContact O-N 2.98Å
194V70.1Confident70.4Confident28 Ų2840.7 Ų40.717%0.1722%0.215CC..Hα-helixtrans-72-39-180174.30000112.1F190 L196 V197 Y198 M240F190-V194 HydrophobicContact CE1-CG2 4.29Å; F190-V194 HydrophobicContact CZ-CG2 4.25Å; F190-V194 WeakPolarHBondContact O-CG2 3.35Å; F190-V194 PolarHBondContact O-N 3.44Å; V194-L196 PolarHBondContact O-N 2.68Å; V194-V197 PolarHBondContact O-N 2.88Å; V194-V197 VanDerWaalsContact O-N 3.11Å; V194-Y198 WeakPolarHBondContact O-CB 3.28Å; V194-Y198 PolarHBondContact O-N 3.05Å; V194-M240 HydrophobicContact CB-CE 3.6Å; V194-M240 HydrophobicContact CB-CG 4.26Å; V194-M240 HydrophobicContact CB-SD 3.69Å; V194-M240 HydrophobicContact CG1-CE 4.08Å; V194-M240 HydrophobicContact CG1-CG 3.67Å; V194-M240 HydrophobicContact CG1-SD 3.68Å; V194-M240 HydrophobicContact CG2-CE 3.58Å; V194-M240 HydrophobicContact CG2-CG 4.47Å; V194-M240 HydrophobicContact CG2-SD 3.35Å; V194-M240 WeakPolarHBondContact CG2-SD 3.24Å
195L71.2Confident70.7Confident40 Ų4042.1 Ų42.121%0.20922%0.221CC..Hα-helixtrans-57.7-34.1170.1-174.560.1000111F114 M191 Q192 Y198 N199F114-L195 HydrophobicContact CE2-CD2 3.66Å; F114-L195 HydrophobicContact CZ-CD2 4.2Å; M191-L195 WeakPolarHBondContact O-CB 3.31Å; M191-L195 PolarHBondContact O-N 2.92Å; Q192-L195 PolarHBondContact O-N 3.45Å; L195-Y198 HydrophobicContact CD1-CD1 4.2Å; L195-Y198 WeakPolarHBondContact O-CB 3.24Å; L195-N199 WeakPolarHBondContact O-CB 3.22Å; L195-N199 PolarHBondContact O-N 3.17Å; L195-N199 VanDerWaalsContact O-N 3.08Å; L195-N199 PolarHBondContact O-ND2 3.07Å
196L71.7Confident70.8Confident31 Ų3142.3 Ų42.316%0.16223%0.23CC..Hα-helixtrans-69.7-43.7175.3-167.3125.4000112.8T161 I165 Q192 I193 V194 Y198 N199 V200T161-L196 HydrophobicContact CG2-CG 4.32Å; I165-L196 HydrophobicContact CB-CD1 4.09Å; I165-L196 HydrophobicContact CD1-CD1 4.4Å; I165-L196 HydrophobicContact CD1-CD2 3.72Å; I165-L196 HydrophobicContact CD1-CG 4.48Å; I165-L196 HydrophobicContact CG1-CD1 3.25Å; I165-L196 HydrophobicContact CG1-CD2 3.43Å; I165-L196 VanDerWaalsContact CG1-CD2 3.43Å; I165-L196 HydrophobicContact CG1-CG 3.79Å; Q192-L196 WeakPolarHBondContact O-CB 3.29Å; Q192-L196 PolarHBondContact O-N 3.31Å; I193-L196 CarbonylContact O-C 3.59Å; I193-L196 WeakPolarHBondContact O-CA 3.42Å; I193-L196 VanDerWaalsContact O-CB 3.24Å; I193-L196 WeakPolarHBondContact O-CB 3.28Å; I193-L196 PolarHBondContact O-N 2.87Å; I193-L196 VanDerWaalsContact O-N 3.14Å; V194-L196 PolarHBondContact O-N 2.68Å; L196-Y198 VanDerWaalsContact C-N 3.35Å; L196-N199 WeakPolarHBondContact O-CB 3.25Å; L196-N199 PolarHBondContact O-N 3.24Å; L196-V200 HydrophobicContact CD2-CG2 4.5Å; L196-V200 WeakPolarHBondContact O-CG2 3.47Å; L196-V200 PolarHBondContact O-N 3.13Å
197V73.1Confident70.8Confident59 Ų5941.8 Ų41.836%0.35823%0.228SC..Hα-helixtrans-58.7-47.5173.7171.30000110.5I193 V194 N199 V200 Q201I193-V197 WeakPolarHBondContact O-CG2 3.49Å; I193-V197 PolarHBondContact O-N 2.98Å; V194-V197 PolarHBondContact O-N 2.88Å; V194-V197 VanDerWaalsContact O-N 3.11Å; V197-N199 VanDerWaalsContact C-N 3.28Å; V197-N199 PolarHBondContact O-N 3.36Å; V197-V200 PolarHBondContact O-N 3.22Å; V197-V200 VanDerWaalsContact O-N 3.11Å; V197-Q201 HydrophobicContact CG1-CG 4.38Å; V197-Q201 WeakPolarHBondContact O-CG 3.21Å; V197-Q201 PolarHBondContact O-N 3.41Å
198Y73.7Confident70.7Confident9 Ų944 Ų444%0.03524%0.243CC..Hα-helixtrans-51.7-47.4173.6167.9-95.6000112.1Y85 V194 L195 L196 V200 Q201 S202 H229 V233Y85-Y198 HydrophobicContact CE1-CE2 4.42Å; Y85-Y198 HydrophobicContact CE2-CE1 4.33Å; Y85-Y198 HydrophobicContact CE2-CE2 4.28Å; Y85-Y198 AromaticContact CZ-CE2 3.65Å; Y85-Y198 AromaticContact CZ-CZ 3.71Å; Y85-Y198 WeakPolarHBondContact OH-CE2 3.4Å; Y85-Y198 PolarHBondContact OH-OH 3.44Å; V194-Y198 WeakPolarHBondContact O-CB 3.28Å; V194-Y198 PolarHBondContact O-N 3.05Å; L195-Y198 HydrophobicContact CD1-CD1 4.2Å; L195-Y198 WeakPolarHBondContact O-CB 3.24Å; L196-Y198 VanDerWaalsContact C-N 3.35Å; Y198-V200 VanDerWaalsContact C-N 3.32Å; Y198-V200 PolarHBondContact O-N 3.41Å; Y198-Q201 WeakPolarHBondContact O-CB 3.39Å; Y198-Q201 PolarHBondContact O-N 3.2Å; Y198-S202 PolarHBondContact O-N 3.39Å; Y198-S202 VanDerWaalsContact O-N 3.16Å; Y198-H229 AromaticContact CD2-CE1 4Å; Y198-H229 AromaticContact CE2-CE1 3.37Å; Y198-H229 WeakPolarHBondContact CE2-CE1 2.83Å; Y198-H229 AromaticContact CE2-NE2 3.29Å; Y198-H229 VanDerWaalsContact CE2-NE2 3.29Å; Y198-H229 WeakPolarHBondContact CE2-NE2 2.93Å; Y198-H229 AromaticContact CZ-CE1 4Å; Y198-H229 AromaticContact CZ-NE2 3.6Å; Y198-H229 PolarHBondContact OH-NE2 3.01Å; Y198-V233 HydrophobicContact CD2-CG1 4.01Å; Y198-V233 HydrophobicContact CD2-CG2 3.63Å; Y198-V233 HydrophobicContact CE2-CB 4.39Å; Y198-V233 HydrophobicContact CE2-CG1 3.93Å; Y198-V233 HydrophobicContact CE2-CG2 3.51Å
199N71.2Confident70.4Confident12 Ų1239.7 Ų39.76%0.06422%0.223CC..Hα-helixtrans-65.4-33.6-179.4-83.6-45.7000113.3R125 T161 L195 L196 V197 S203R125-N199 PolarHBondContact NE-OD1 2.8Å; R125-N199 VanDerWaalsContact NE-OD1 3.15Å; R125-N199 PolarHBondContact NH1-OD1 3.11Å; R125-N199 PolarHBondContact NH2-O 3.43Å; R125-N199 PolarHBondContact NH2-OD1 3.32Å; T161-N199 HydrophobicContact CG2-CB 4.35Å; L195-N199 WeakPolarHBondContact O-CB 3.22Å; L195-N199 PolarHBondContact O-N 3.17Å; L195-N199 VanDerWaalsContact O-N 3.08Å; L195-N199 PolarHBondContact O-ND2 3.07Å; L196-N199 WeakPolarHBondContact O-CB 3.25Å; L196-N199 PolarHBondContact O-N 3.24Å; V197-N199 VanDerWaalsContact C-N 3.28Å; V197-N199 PolarHBondContact O-N 3.36Å; N199-S203 PolarHBondContact O-OG 3Å
200V73Confident69.9Low53 Ų5342.4 Ų42.432%0.32125%0.252SS..Hα-helixtrans-71.8-44.4173.5172.60000110.3T161 L196 V197 Y198 S202 S203 L204T161-V200 HydrophobicContact CG2-CG2 3.7Å; L196-V200 HydrophobicContact CD2-CG2 4.5Å; L196-V200 WeakPolarHBondContact O-CG2 3.47Å; L196-V200 PolarHBondContact O-N 3.13Å; V197-V200 PolarHBondContact O-N 3.22Å; V197-V200 VanDerWaalsContact O-N 3.11Å; Y198-V200 VanDerWaalsContact C-N 3.32Å; Y198-V200 PolarHBondContact O-N 3.41Å; V200-S202 PolarHBondContact O-N 3.31Å; V200-S203 WeakPolarHBondContact O-CB 3.41Å; V200-S203 PolarHBondContact O-N 2.97Å; V200-S203 VanDerWaalsContact O-N 3.14Å; V200-L204 HydrophobicContact CG1-CD1 3.65Å; V200-L204 HydrophobicContact CG1-CG 3.95Å; V200-L204 WeakPolarHBondContact O-CG 3.33Å; V200-L204 PolarHBondContact O-N 3.27Å
201Q75.2Confident69.2Low33 Ų3347.6 Ų47.615%0.15428%0.275CS..Hα-helixtrans-57.2-49.1-179.7-73.7173.6-3.600112.7V197 Y198 S203 L204 F205 E236V197-Q201 HydrophobicContact CG1-CG 4.38Å; V197-Q201 WeakPolarHBondContact O-CG 3.21Å; V197-Q201 PolarHBondContact O-N 3.41Å; Y198-Q201 WeakPolarHBondContact O-CB 3.39Å; Y198-Q201 PolarHBondContact O-N 3.2Å; Q201-S203 PolarHBondContact O-N 3.26Å; Q201-L204 PolarHBondContact O-N 3.21Å; Q201-L204 VanDerWaalsContact O-N 3.13Å; Q201-F205 HydrophobicContact CB-CD2 4.31Å; Q201-F205 HydrophobicContact CB-CE2 4.15Å; Q201-F205 WeakPolarHBondContact O-CD2 3.41Å; Q201-F205 PolarHBondContact O-N 2.7Å; Q201-E236 PolarHBondContact NE2-OE1 3.14Å; Q201-E236 PolarHBondContact OE1-OE1 3.01Å
202S72.2Confident68.7Low36 Ų3650.3 Ų50.325%0.25229%0.289SS..Hα-helixtrans-55.9-40.8177.4176.30000111.8Y198 V200 G206Y198-S202 PolarHBondContact O-N 3.39Å; Y198-S202 VanDerWaalsContact O-N 3.16Å; V200-S202 PolarHBondContact O-N 3.31Å; S202-G206 PolarHBondContact O-N 3.23Å
203S70.2Confident67.6Low7 Ų754.3 Ų54.35%0.04932%0.32CS..Hα-helixtrans-70.4-39.4178.4-47.30000112.3S154 V157 N199 V200 Q201 G206 L207S154-S203 PolarHBondContact OG-O 3.48Å; V157-S203 WeakPolarHBondContact CG1-OG 3.44Å; N199-S203 PolarHBondContact O-OG 3Å; V200-S203 WeakPolarHBondContact O-CB 3.41Å; V200-S203 PolarHBondContact O-N 2.97Å; V200-S203 VanDerWaalsContact O-N 3.14Å; Q201-S203 PolarHBondContact O-N 3.26Å; S203-G206 PolarHBondContact O-N 3.12Å; S203-L207 PolarHBondContact O-N 3.1Å
204L73.1Confident66.8Low85 Ų8552.3 Ų52.345%0.44531%0.313SS..Hα-helixtrans-65.7-46.2177-72.5176.4000111.6V200 Q201 G206 L207 C208V200-L204 HydrophobicContact CG1-CD1 3.65Å; V200-L204 HydrophobicContact CG1-CG 3.95Å; V200-L204 WeakPolarHBondContact O-CG 3.33Å; V200-L204 PolarHBondContact O-N 3.27Å; Q201-L204 PolarHBondContact O-N 3.21Å; Q201-L204 VanDerWaalsContact O-N 3.13Å; L204-G206 PolarHBondContact O-N 3.16Å; L204-L207 PolarHBondContact O-N 2.87Å; L204-L207 VanDerWaalsContact O-N 3.11Å; L204-C208 VanDerWaalsContact O-CB 3.28Å; L204-C208 WeakPolarHBondContact O-CB 3.44Å; L204-C208 PolarHBondContact O-N 3.28Å; L204-C208 PolarHBondContact O-SG 3.27Å
205F70.4Confident66Low52 Ų5259.4 Ų59.423%0.22835%0.345CS..Hα-helixtrans-62.1-33.8177.1-74.9-63.4000112.1Q201 S209 A225 H229 I232Q201-F205 HydrophobicContact CB-CD2 4.31Å; Q201-F205 HydrophobicContact CB-CE2 4.15Å; Q201-F205 WeakPolarHBondContact O-CD2 3.41Å; Q201-F205 PolarHBondContact O-N 2.7Å; F205-S209 PolarHBondContact O-N 3.22Å; F205-S209 VanDerWaalsContact O-N 3.16Å; F205-A225 HydrophobicContact CB-CB 4.38Å; F205-A225 HydrophobicContact CD1-CB 4.38Å; F205-H229 HydrophobicContact CD2-CB 3.84Å; F205-H229 AromaticContact CD2-ND1 3.66Å; F205-H229 HydrophobicContact CE2-CB 4.17Å; F205-H229 AromaticContact CE2-ND1 3.89Å; F205-H229 HydrophobicContact CG-CB 4.4Å; F205-I232 HydrophobicContact CE2-CD1 4.3Å; F205-I232 HydrophobicContact CZ-CD1 3.8Å
206G65.7Low65.3Low31 Ų3161.6 Ų61.632%0.3235%0.354SS..Hα-helixtrans-65.9-33.7173.600000114.5S202 S203 L204S202-G206 PolarHBondContact O-N 3.23Å; S203-G206 PolarHBondContact O-N 3.12Å; L204-G206 PolarHBondContact O-N 3.16Å
207L66.4Low64.7Low71 Ų7164.6 Ų64.637%0.37237%0.367SS..Hα-helixtrans-84.4-41.4176.6-70.3176.1000112.4S154 I158 S203 L204 S209S154-L207 WeakPolarHBondContact OG-CG 3.44Å; I158-L207 HydrophobicContact CD1-CD1 3.47Å; I158-L207 VanDerWaalsContact CD1-CD1 3.47Å; S203-L207 PolarHBondContact O-N 3.1Å; L204-L207 PolarHBondContact O-N 2.87Å; L204-L207 VanDerWaalsContact O-N 3.11Å; L207-S209 VanDerWaalsContact C-N 3.27Å; L207-S209 PolarHBondContact O-N 3.02Å
208C65.5Low64.1Low56 Ų5664 Ų6438%0.37836%0.361SS..Hα-helixtrans-76.3-10-176.3-69.40000113.6L204 G210 F211 I212L204-C208 VanDerWaalsContact O-CB 3.28Å; L204-C208 WeakPolarHBondContact O-CB 3.44Å; L204-C208 PolarHBondContact O-N 3.28Å; L204-C208 PolarHBondContact O-SG 3.27Å; C208-G210 PolarHBondContact O-N 3.45Å; C208-G210 VanDerWaalsContact O-N 3.1Å; C208-F211 PolarHBondContact O-N 3.23Å; C208-I212 PolarHBondContact O-N 3.3Å
209S61.2Low63.7Low11 Ų1164.4 Ų64.48%0.07736%0.364CS..THydrogen-bonded Turntrans-57.6-25.9176.972.40000112.7F205 L207 F211 D221F205-S209 PolarHBondContact O-N 3.22Å; F205-S209 VanDerWaalsContact O-N 3.16Å; L207-S209 VanDerWaalsContact C-N 3.27Å; L207-S209 PolarHBondContact O-N 3.02Å; S209-F211 VanDerWaalsContact C-N 3.34Å; S209-D221 WeakPolarHBondContact O-CB 3.46Å
210G59.1Low63.6Low67 Ų6763.8 Ų63.869%0.69136%0.361SS*.THydrogen-bonded Turntrans-76.9-13.7176.800000115.3C208C208-G210 PolarHBondContact O-N 3.45Å; C208-G210 VanDerWaalsContact O-N 3.1Å
211F57.2Low63.5Low179 Ų17962.7 Ų62.779%0.78535%0.353SS*.THydrogen-bonded Turntrans-105-17.5-176.3-69.4-74.3000113.9C208 S209 S213C208-F211 PolarHBondContact O-N 3.23Å; S209-F211 VanDerWaalsContact C-N 3.34Å; F211-S213 PolarHBondContact O-N 2.97Å; F211-S213 VanDerWaalsContact O-N 3.12Å
212I58.9Low63.2Low77 Ų7762.8 Ų62.840%0.39535%0.352SS..SBendtrans-70.7110.6178.6-84.8155.8000108.2C208 C214C208-I212 PolarHBondContact O-N 3.3Å; I212-C214 PolarHBondContact O-N 3.07Å
213S49.1Very low63.3Low112 Ų11261.1 Ų61.178%0.78334%0.341SS*.  trans-63.3128.3177.2-64.60000109.6F211 E215F211-S213 PolarHBondContact O-N 2.97Å; F211-S213 VanDerWaalsContact O-N 3.12Å; S213-E215 PolarHBondContact O-N 3.34Å
214C55Low63.7Low49 Ų4963.5 Ų63.533%0.33135%0.35SS..  trans-8893-170-160.60000109.9C18 I212 D221C18-C214 HydrophobicContact CB-CB 3.83Å; C18-C214 WeakPolarHBondContact CB-SG 3.06Å; C18-C214 WeakPolarHBondContact SG-CB 3.32Å; C18-C214 CovalentContact SG-SG 2.02Å; C18-C214 PolarHBondContact SG-SG 3.06Å; I212-C214 PolarHBondContact O-N 3.07Å; C214-D221 PolarHBondContact SG-OD1 3.29Å
215E53.3Low63.9Low178 Ų17859.7 Ų59.783%0.83233%0.331SS*.  trans-80.9-28.8177.4-162.4100.9-155.200111.8S213S213-E215 PolarHBondContact O-N 3.34Å
216E56.3Low64.4Low86 Ų8658.2 Ų58.240%0.40233%0.328SS..  trans-124.1112.8-171-69.1157.7173.800111L218 K224E216-L218 PolarHBondContact O-N 3.42Å; E216-K224 IonicContact OE2-NZ 3.48Å; E216-K224 PolarHBondContact OE2-NZ 3.43Å
217Q57.8Low65.2Low94 Ų9457.1 Ų57.144%0.43931%0.314SS..THydrogen-bonded Turntrans-75.118.3-172.6-81.5167-42.400115.4S14 L21S14-Q217 VanDerWaalsContact C-NE2 3.28Å; S14-Q217 PolarHBondContact O-NE2 3.49Å; L21-Q217 WeakPolarHBondContact CD2-O 3.35Å
218L62.1Low66.1Low45 Ų4559.6 Ų59.624%0.23632%0.319CS..THydrogen-bonded Turntrans-87.7-38.4-176.7-174.756.2000113.6E32 E216E32-L218 HydrophobicContact CB-CD1 3.61Å; E32-L218 HydrophobicContact CB-CD2 3.64Å; E32-L218 HydrophobicContact CB-CG 4.23Å; E32-L218 HydrophobicContact CG-CD1 3.27Å; E32-L218 HydrophobicContact CG-CD2 3.68Å; E32-L218 HydrophobicContact CG-CG 3.98Å; E32-L218 WeakPolarHBondContact O-CD2 3.47Å; E216-L218 PolarHBondContact O-N 3.42Å
219L65.5Low67Low18 Ų1857.2 Ų57.29%0.09430%0.302CS..SBendtrans-125133.4-171.6-135.870.5000108.9P24 Y29 A223P24-L219 HydrophobicContact CG-CD1 3.96Å; Y29-L219 HydrophobicContact CD2-CD1 3.94Å; Y29-L219 HydrophobicContact CE2-CD1 3.9Å; Y29-L219 HydrophobicContact CE2-CD2 4.49Å; L219-A223 HydrophobicContact CD2-CB 3.71Å; L219-A223 HydrophobicContact CG-CB 3.66Å
220P67.8Low68.3Low0 Ų056.7 Ų56.70%030%0.298CS..  trans-61.3152.2174.525-33.9000110.9C18 L21 T23 Y222 A223 K224C18-P220 WeakPolarHBondContact O-CA 3.3Å; C18-P220 WeakPolarHBondContact O-CB 3.38Å; L21-P220 HydrophobicContact CB-CB 4.14Å; L21-P220 WeakPolarHBondContact O-CB 3.38Å; L21-P220 WeakPolarHBondContact O-CG 3.45Å; T23-P220 HydrophobicContact CG2-CG 3.96Å; P220-Y222 HydrophobicContact CB-CD1 3.54Å; P220-Y222 HydrophobicContact CB-CE1 3.28Å; P220-Y222 HydrophobicContact CG-CD1 3.77Å; P220-Y222 HydrophobicContact CG-CE1 3.14Å; P220-Y222 HydrophobicContact CG-CE2 4.17Å; P220-Y222 HydrophobicContact CG-CG 4.49Å; P220-Y222 PolarHBondContact O-N 2.92Å; P220-A223 HydrophobicContact CG-CB 3.83Å; P220-A223 PolarHBondContact O-N 3.37Å; P220-K224 PolarHBondContact O-N 2.97Å; P220-K224 VanDerWaalsContact O-N 3.1Å
221D70.4Confident69.8Low29 Ų2954.3 Ų54.316%0.15527%0.27CS..Hα-helixtrans-52.2-36.1-173.1-58.5-37.2000112.6S209 C214 A225S209-D221 WeakPolarHBondContact O-CB 3.46Å; C214-D221 PolarHBondContact SG-OD1 3.29Å; D221-A225 WeakPolarHBondContact O-CB 3.37Å; D221-A225 PolarHBondContact O-N 3.04Å
222Y70.5Confident71.3Confident35 Ų3548.5 Ų48.514%0.13725%0.246CC..Hα-helixtrans-67.6-39.3177.973.8-97.2000113T23 F143 P220 S226T23-Y222 WeakPolarHBondContact CB-OH 3.31Å; T23-Y222 HydrophobicContact CG2-CE2 3.77Å; T23-Y222 WeakPolarHBondContact CG2-OH 3.28Å; T23-Y222 PolarHBondContact OG1-OH 3.35Å; F143-Y222 HydrophobicContact CB-CD1 4.46Å; F143-Y222 HydrophobicContact CB-CE1 4.08Å; F143-Y222 HydrophobicContact CD2-CD2 4.47Å; F143-Y222 AromaticContact CD2-CE1 3.8Å; F143-Y222 HydrophobicContact CD2-CE1 3.8Å; F143-Y222 AromaticContact CD2-CE2 3.74Å; F143-Y222 HydrophobicContact CD2-CE2 3.74Å; F143-Y222 AromaticContact CD2-CZ 3.35Å; F143-Y222 WeakPolarHBondContact CD2-OH 3.36Å; F143-Y222 HydrophobicContact CE2-CD2 4.43Å; F143-Y222 AromaticContact CE2-CE2 3.66Å; F143-Y222 HydrophobicContact CE2-CE2 3.66Å; F143-Y222 AromaticContact CE2-CZ 3.74Å; F143-Y222 HydrophobicContact CG-CE1 4.25Å; F143-Y222 HydrophobicContact CZ-CE2 4.47Å; P220-Y222 HydrophobicContact CB-CD1 3.54Å; P220-Y222 HydrophobicContact CB-CE1 3.28Å; P220-Y222 HydrophobicContact CG-CD1 3.77Å; P220-Y222 HydrophobicContact CG-CE1 3.14Å; P220-Y222 HydrophobicContact CG-CE2 4.17Å; P220-Y222 HydrophobicContact CG-CG 4.49Å; P220-Y222 PolarHBondContact O-N 2.92Å; Y222-S226 WeakPolarHBondContact O-CB 3.29Å; Y222-S226 PolarHBondContact O-N 3.42Å
223A73.5Confident72.6Confident1 Ų145 Ų451%0.00823%0.228CC..Hα-helixtrans-75.4-35.6-177.200000110.3T23 L219 P220 S226 L227T23-A223 HydrophobicContact CG2-CB 3.71Å; L219-A223 HydrophobicContact CD2-CB 3.71Å; L219-A223 HydrophobicContact CG-CB 3.66Å; P220-A223 HydrophobicContact CG-CB 3.83Å; P220-A223 PolarHBondContact O-N 3.37Å; A223-S226 PolarHBondContact O-N 3.34Å; A223-L227 WeakPolarHBondContact O-CB 3.45Å; A223-L227 PolarHBondContact O-N 3.28Å
224K77.9Confident74.6Confident57 Ų5739.6 Ų39.625%0.24819%0.191CC..Hα-helixtrans-63-47.9171.3-171.8164.6-177.2161.60110.6E216 P220 S226 L227 W228E216-K224 IonicContact OE2-NZ 3.48Å; E216-K224 PolarHBondContact OE2-NZ 3.43Å; P220-K224 PolarHBondContact O-N 2.97Å; P220-K224 VanDerWaalsContact O-N 3.1Å; K224-S226 VanDerWaalsContact C-N 3.3Å; K224-S226 PolarHBondContact O-N 3.39Å; K224-L227 WeakPolarHBondContact O-CB 3.26Å; K224-L227 PolarHBondContact O-N 3.43Å; K224-W228 PolarHBondContact O-N 2.84Å; K224-W228 VanDerWaalsContact O-N 3.08Å
225A78.8Confident76.3Confident5 Ų541.5 Ų41.54%0.04120%0.197CC..Hα-helixtrans-59.5-40175.500000112.5F205 D221 W228 H229F205-A225 HydrophobicContact CB-CB 4.38Å; F205-A225 HydrophobicContact CD1-CB 4.38Å; D221-A225 WeakPolarHBondContact O-CB 3.37Å; D221-A225 PolarHBondContact O-N 3.04Å; A225-W228 PolarHBondContact O-N 2.82Å; A225-H229 WeakPolarHBondContact O-CB 3.31Å; A225-H229 PolarHBondContact O-N 2.88Å
226S79.5Confident78Confident22 Ų2234.7 Ų34.715%0.15417%0.165CC..Hα-helixtrans-68.7-37.4177.4-1710000113M99 Y222 A223 K224 H229 H230M99-S226 VanDerWaalsContact SD-CB 3.57Å; M99-S226 PolarHBondContact SD-OG 3.46Å; M99-S226 VanDerWaalsContact SD-OG 3.36Å; Y222-S226 WeakPolarHBondContact O-CB 3.29Å; Y222-S226 PolarHBondContact O-N 3.42Å; A223-S226 PolarHBondContact O-N 3.34Å; K224-S226 VanDerWaalsContact C-N 3.3Å; K224-S226 PolarHBondContact O-N 3.39Å; S226-H229 WeakPolarHBondContact O-CB 3.48Å; S226-H229 PolarHBondContact O-N 3.08Å; S226-H230 PolarHBondContact O-N 3.37Å; S226-H230 PolarHBondContact O-ND1 3.07Å; S226-H230 PolarHBondContact OG-ND1 3.48Å
227L83.8Confident79.5Confident8 Ų831 Ų314%0.04215%0.149CC..Hα-helixtrans-58.4-51.3171.7-176.190000110.9T37 I41 M93 M99 A223 K224 H229 H230 L231T37-L227 HydrophobicContact CG2-CD2 3.63Å; I41-L227 HydrophobicContact CD1-CD1 4.34Å; M93-L227 HydrophobicContact CB-CD1 4.44Å; M93-L227 HydrophobicContact CG-CD1 4.49Å; M99-L227 HydrophobicContact CE-CB 3.91Å; M99-L227 HydrophobicContact CE-CD1 3.78Å; M99-L227 HydrophobicContact CE-CG 4.45Å; A223-L227 WeakPolarHBondContact O-CB 3.45Å; A223-L227 PolarHBondContact O-N 3.28Å; K224-L227 WeakPolarHBondContact O-CB 3.26Å; K224-L227 PolarHBondContact O-N 3.43Å; L227-H229 VanDerWaalsContact C-N 3.29Å; L227-H229 PolarHBondContact O-N 2.96Å; L227-H230 PolarHBondContact O-N 3.07Å; L227-L231 HydrophobicContact CD2-CD1 4.42Å; L227-L231 HydrophobicContact CG-CD1 4.32Å; L227-L231 WeakPolarHBondContact O-CG 3.09Å; L227-L231 PolarHBondContact O-N 3.17Å
228W84.9Confident81Confident123 Ų12329.7 Ų29.747%0.46614%0.142SC..Hα-helixtrans-59.5-39.8176.9-80.4105.2000112.4L40 K224 A225 L231 I232L40-W228 HydrophobicContact CD1-CH2 4.43Å; K224-W228 PolarHBondContact O-N 2.84Å; K224-W228 VanDerWaalsContact O-N 3.08Å; A225-W228 PolarHBondContact O-N 2.82Å; W228-L231 HydrophobicContact CE3-CD1 4.45Å; W228-L231 PolarHBondContact O-N 3.08Å; W228-I232 WeakPolarHBondContact O-CG1 3.41Å; W228-I232 PolarHBondContact O-N 3.26Å
229H85.2Confident82.3Confident5 Ų530.7 Ų30.72%0.02315%0.15CC..Hα-helixtrans-58.3-54.5174.6-178.155.8000110.8Y198 F205 A225 S226 L227 L231 I232 V233Y198-H229 AromaticContact CD2-CE1 4Å; Y198-H229 AromaticContact CE2-CE1 3.37Å; Y198-H229 WeakPolarHBondContact CE2-CE1 2.83Å; Y198-H229 AromaticContact CE2-NE2 3.29Å; Y198-H229 VanDerWaalsContact CE2-NE2 3.29Å; Y198-H229 WeakPolarHBondContact CE2-NE2 2.93Å; Y198-H229 AromaticContact CZ-CE1 4Å; Y198-H229 AromaticContact CZ-NE2 3.6Å; Y198-H229 PolarHBondContact OH-NE2 3.01Å; F205-H229 HydrophobicContact CD2-CB 3.84Å; F205-H229 AromaticContact CD2-ND1 3.66Å; F205-H229 HydrophobicContact CE2-CB 4.17Å; F205-H229 AromaticContact CE2-ND1 3.89Å; F205-H229 HydrophobicContact CG-CB 4.4Å; A225-H229 WeakPolarHBondContact O-CB 3.31Å; A225-H229 PolarHBondContact O-N 2.88Å; S226-H229 WeakPolarHBondContact O-CB 3.48Å; S226-H229 PolarHBondContact O-N 3.08Å; L227-H229 VanDerWaalsContact C-N 3.29Å; L227-H229 PolarHBondContact O-N 2.96Å; H229-L231 PolarHBondContact O-N 3.15Å; H229-I232 PolarHBondContact O-N 3.42Å; H229-V233 WeakPolarHBondContact O-CB 3.29Å; H229-V233 WeakPolarHBondContact O-CG2 3.46Å; H229-V233 PolarHBondContact O-N 3.06Å
230H88.1Confident83.1Confident1 Ų130.2 Ų30.21%0.00515%0.147CC..Hα-helixtrans-58.8-36.7179.4-74.189.4000112.2M93 S102 D103 S226 L227 V233 V234M93-H230 HydrophobicContact CE-CB 3.58Å; M93-H230 WeakPolarHBondContact CE-O 3.08Å; M93-H230 HydrophobicContact CG-CB 3.89Å; S102-H230 PolarHBondContact OG-NE2 3.39Å; S102-H230 VanDerWaalsContact OG-NE2 3.08Å; D103-H230 IonicContact OD1-CE1 3.33Å; D103-H230 PolarHBondContact OD1-CE1 3.46Å; D103-H230 IonicContact OD1-NE2 2.84Å; D103-H230 PolarHBondContact OD1-NE2 3.37Å; S226-H230 PolarHBondContact O-N 3.37Å; S226-H230 PolarHBondContact O-ND1 3.07Å; S226-H230 PolarHBondContact OG-ND1 3.48Å; L227-H230 PolarHBondContact O-N 3.07Å; H230-V233 PolarHBondContact O-N 3.09Å; H230-V234 WeakPolarHBondContact O-CG2 3.43Å; H230-V234 PolarHBondContact O-N 3.28Å; H230-V234 VanDerWaalsContact O-N 3.09Å
231L90.1Very high84Confident17 Ų1730.2 Ų30.29%0.08915%0.147CC..Hα-helixtrans-64.4-50.7179.5-74.8171.5000111.4L40 S44 M93 L227 W228 H229 V233 V234 L235L40-L231 HydrophobicContact CB-CD1 4.16Å; L40-L231 HydrophobicContact CB-CD2 4.07Å; L40-L231 HydrophobicContact CD1-CD1 4.13Å; S44-L231 WeakPolarHBondContact OG-CD2 3.25Å; M93-L231 VanDerWaalsContact CE-CA 3.43Å; M93-L231 HydrophobicContact CE-CB 4.29Å; M93-L231 HydrophobicContact CE-CD2 3.75Å; M93-L231 HydrophobicContact CE-CG 4Å; M93-L231 VanDerWaalsContact CE-N 3.25Å; M93-L231 HydrophobicContact SD-CD2 3.86Å; M93-L231 HydrophobicContact SD-CG 4.46Å; L227-L231 HydrophobicContact CD2-CD1 4.42Å; L227-L231 HydrophobicContact CG-CD1 4.32Å; L227-L231 WeakPolarHBondContact O-CG 3.09Å; L227-L231 PolarHBondContact O-N 3.17Å; W228-L231 HydrophobicContact CE3-CD1 4.45Å; W228-L231 PolarHBondContact O-N 3.08Å; H229-L231 PolarHBondContact O-N 3.15Å; L231-V233 PolarHBondContact O-N 2.7Å; L231-V234 PolarHBondContact O-N 3.5Å; L231-L235 PolarHBondContact O-N 3.06Å
232I88.8Confident84.8Confident56 Ų5630.6 Ų30.629%0.28716%0.155SC..Hα-helixtrans-58.9-38.9177.4-69.8166.1000110.2F205 W228 H229 L235 E236F205-I232 HydrophobicContact CE2-CD1 4.3Å; F205-I232 HydrophobicContact CZ-CD1 3.8Å; W228-I232 WeakPolarHBondContact O-CG1 3.41Å; W228-I232 PolarHBondContact O-N 3.26Å; H229-I232 PolarHBondContact O-N 3.42Å; I232-L235 WeakPolarHBondContact O-CB 3.42Å; I232-L235 PolarHBondContact O-N 3.3Å; I232-E236 HydrophobicContact CG2-CG 4.25Å; I232-E236 WeakPolarHBondContact O-CG 3.36Å; I232-E236 PolarHBondContact O-N 3.23Å
233V87.3Confident85.5Confident3 Ų331.5 Ų31.52%0.01816%0.161CC..Hα-helixtrans-71.8-35.8-174.8176.40000112.8Y85 Y198 H229 H230 L231 L235 E236 C237Y85-V233 HydrophobicContact CD1-CG1 3.44Å; Y85-V233 VanDerWaalsContact CD1-CG1 3.44Å; Y85-V233 HydrophobicContact CE1-CB 4.25Å; Y85-V233 HydrophobicContact CE1-CG1 3.02Å; Y85-V233 HydrophobicContact CE2-CG1 4.44Å; Y85-V233 HydrophobicContact CG-CG1 4.45Å; Y198-V233 HydrophobicContact CD2-CG1 4.01Å; Y198-V233 HydrophobicContact CD2-CG2 3.63Å; Y198-V233 HydrophobicContact CE2-CB 4.39Å; Y198-V233 HydrophobicContact CE2-CG1 3.93Å; Y198-V233 HydrophobicContact CE2-CG2 3.51Å; H229-V233 WeakPolarHBondContact O-CB 3.29Å; H229-V233 WeakPolarHBondContact O-CG2 3.46Å; H229-V233 PolarHBondContact O-N 3.06Å; H230-V233 PolarHBondContact O-N 3.09Å; L231-V233 PolarHBondContact O-N 2.7Å; V233-L235 VanDerWaalsContact C-N 3.32Å; V233-E236 PolarHBondContact O-N 3.27Å; V233-C237 WeakPolarHBondContact O-CB 3.41Å; V233-C237 PolarHBondContact O-N 3.45Å; V233-C237 PolarHBondContact O-SG 3.41Å
234V90.4Very high85.9Confident0 Ų031.9 Ų31.90%016%0.164CC..Hα-helixtrans-62.5-43.4171.6174.40000110.3E47 I51 M93 H230 L231 C237 F238E47-V234 HydrophobicContact CB-CG1 3.92Å; I51-V234 HydrophobicContact CD1-CG1 4.4Å; M93-V234 HydrophobicContact CE-CG2 3.74Å; H230-V234 WeakPolarHBondContact O-CG2 3.43Å; H230-V234 PolarHBondContact O-N 3.28Å; H230-V234 VanDerWaalsContact O-N 3.09Å; L231-V234 PolarHBondContact O-N 3.5Å; V234-C237 WeakPolarHBondContact O-CB 3.35Å; V234-C237 PolarHBondContact O-N 3.38Å; V234-F238 PolarHBondContact O-N 2.96Å
235L90.5Very high86.1Confident88 Ų8831.8 Ų31.846%0.46117%0.165SC..Hα-helixtrans-63.3-43.3176.7-176.7150.9000111.8L231 I232 V233 C237 F238 V239L231-L235 PolarHBondContact O-N 3.06Å; I232-L235 WeakPolarHBondContact O-CB 3.42Å; I232-L235 PolarHBondContact O-N 3.3Å; V233-L235 VanDerWaalsContact C-N 3.32Å; L235-C237 PolarHBondContact O-N 3.47Å; L235-F238 WeakPolarHBondContact O-CB 3.27Å; L235-F238 PolarHBondContact O-N 3.44Å; L235-V239 HydrophobicContact CD2-CG2 4.19Å; L235-V239 WeakPolarHBondContact O-CG2 3.43Å; L235-V239 PolarHBondContact O-N 3.28Å
236E88.1Confident86.3Confident35 Ų3541.1 Ų41.116%0.16420%0.2CC..Hα-helixtrans-60.5-44.1173.9-75.2-176.8167.600111.4Q201 I232 V233 F238 V239 M240Q201-E236 PolarHBondContact NE2-OE1 3.14Å; Q201-E236 PolarHBondContact OE1-OE1 3.01Å; I232-E236 HydrophobicContact CG2-CG 4.25Å; I232-E236 WeakPolarHBondContact O-CG 3.36Å; I232-E236 PolarHBondContact O-N 3.23Å; V233-E236 PolarHBondContact O-N 3.27Å; E236-F238 VanDerWaalsContact C-N 3.27Å; E236-F238 PolarHBondContact O-N 2.87Å; E236-V239 PolarHBondContact O-N 3.43Å; E236-M240 VanDerWaalsContact O-CB 3.29Å; E236-M240 WeakPolarHBondContact O-CB 2.95Å; E236-M240 WeakPolarHBondContact O-CG 3.27Å; E236-M240 PolarHBondContact O-N 2.8Å
237C88.8Confident86.1Confident10 Ų1044.7 Ų44.77%0.06821%0.213CC..Hα-helixtrans-58.6-40.7176.5-72.40000112I51 F82 V233 V234 L235 L241I51-C237 HydrophobicContact CD1-CB 3.94Å; F82-C237 HydrophobicContact CB-CB 4.47Å; F82-C237 HydrophobicContact CD1-CB 4.48Å; V233-C237 WeakPolarHBondContact O-CB 3.41Å; V233-C237 PolarHBondContact O-N 3.45Å; V233-C237 PolarHBondContact O-SG 3.41Å; V234-C237 WeakPolarHBondContact O-CB 3.35Å; V234-C237 PolarHBondContact O-N 3.38Å; L235-C237 PolarHBondContact O-N 3.47Å; C237-L241 WeakPolarHBondContact O-CB 3.36Å; C237-L241 PolarHBondContact O-N 2.89Å
238F90.1Very high85.6Confident65 Ų6545.1 Ų45.129%0.28522%0.216SC..Hα-helixtrans-63.1-52175.9175.1-107000111.7I50 I51 L54 V234 L235 E236 M240 L241 A242I50-F238 HydrophobicContact CG2-CD2 4.17Å; I50-F238 HydrophobicContact CG2-CE2 3.62Å; I51-F238 HydrophobicContact CD1-CB 3.98Å; I51-F238 HydrophobicContact CG1-CB 4.04Å; I51-F238 HydrophobicContact CG1-CD2 4.18Å; L54-F238 HydrophobicContact CD1-CD2 4.35Å; L54-F238 HydrophobicContact CD1-CE2 4.05Å; V234-F238 PolarHBondContact O-N 2.96Å; L235-F238 WeakPolarHBondContact O-CB 3.27Å; L235-F238 PolarHBondContact O-N 3.44Å; E236-F238 VanDerWaalsContact C-N 3.27Å; E236-F238 PolarHBondContact O-N 2.87Å; F238-M240 VanDerWaalsContact C-N 3.3Å; F238-M240 PolarHBondContact O-N 3.33Å; F238-L241 PolarHBondContact O-N 3.25Å; F238-A242 WeakPolarHBondContact O-CB 3.46Å; F238-A242 PolarHBondContact O-N 2.86Å
239V88.2Confident85.4Confident66 Ų6646.3 Ų46.340%0.422%0.221SC..Hα-helixtrans-60.3-41.5178.8173.80000111L235 E236 A242 L243L235-V239 HydrophobicContact CD2-CG2 4.19Å; L235-V239 WeakPolarHBondContact O-CG2 3.43Å; L235-V239 PolarHBondContact O-N 3.28Å; E236-V239 PolarHBondContact O-N 3.43Å; V239-A242 PolarHBondContact O-N 3.26Å; V239-L243 HydrophobicContact CG1-CD1 3.79Å; V239-L243 HydrophobicContact CG1-CG 4.27Å; V239-L243 WeakPolarHBondContact O-CB 3.19Å; V239-L243 VanDerWaalsContact O-CG 3.27Å; V239-L243 WeakPolarHBondContact O-CG 3.32Å; V239-L243 PolarHBondContact O-N 3.2Å
240M83.6Confident84.5Confident9 Ų947 Ų474%0.04423%0.225CC..Hα-helixtrans-66.7-43179.8-71.8-52.9-70.300112.8F82 F190 M191 V194 E236 F238 A242 L243 A244F82-M240 HydrophobicContact CD1-CB 4.16Å; F82-M240 HydrophobicContact CE1-CB 3.78Å; F190-M240 HydrophobicContact CD1-CE 3.36Å; F190-M240 HydrophobicContact CD1-SD 3.92Å; F190-M240 HydrophobicContact CE1-CE 3.44Å; F190-M240 VanDerWaalsContact CE1-CE 3.44Å; F190-M240 HydrophobicContact CE1-SD 3.31Å; F190-M240 WeakPolarHBondContact CE1-SD 3.32Å; F190-M240 HydrophobicContact CG-CE 4.38Å; F190-M240 HydrophobicContact CZ-SD 4.07Å; M191-M240 HydrophobicContact CE-CE 4.3Å; M191-M240 HydrophobicContact CG-CE 4.38Å; M191-M240 HydrophobicContact SD-CE 3.23Å; M191-M240 WeakPolarHBondContact SD-CE 3.2Å; V194-M240 HydrophobicContact CB-CE 3.6Å; V194-M240 HydrophobicContact CB-CG 4.26Å; V194-M240 HydrophobicContact CB-SD 3.69Å; V194-M240 HydrophobicContact CG1-CE 4.08Å; V194-M240 HydrophobicContact CG1-CG 3.67Å; V194-M240 HydrophobicContact CG1-SD 3.68Å; V194-M240 HydrophobicContact CG2-CE 3.58Å; V194-M240 HydrophobicContact CG2-CG 4.47Å; V194-M240 HydrophobicContact CG2-SD 3.35Å; V194-M240 WeakPolarHBondContact CG2-SD 3.24Å; E236-M240 VanDerWaalsContact O-CB 3.29Å; E236-M240 WeakPolarHBondContact O-CB 2.95Å; E236-M240 WeakPolarHBondContact O-CG 3.27Å; E236-M240 PolarHBondContact O-N 2.8Å; F238-M240 VanDerWaalsContact C-N 3.3Å; F238-M240 PolarHBondContact O-N 3.33Å; M240-A242 VanDerWaalsContact C-N 3.32Å; M240-L243 PolarHBondContact O-N 3.36Å; M240-A244 WeakPolarHBondContact O-CB 3.31Å; M240-A244 PolarHBondContact O-N 3.1Å
241L86.9Confident83.6Confident0 Ų049.4 Ų49.40%024%0.24CC..Hα-helixtrans-65.7-39.5176.1-173.957.9000110.8I51 L54 F82 C237 F238 A244 M245I51-L241 HydrophobicContact CB-CD2 4.41Å; I51-L241 HydrophobicContact CG2-CD2 3.81Å; I51-L241 WeakPolarHBondContact O-CD2 3.46Å; L54-L241 HydrophobicContact CB-CD2 3.54Å; L54-L241 HydrophobicContact CB-CG 4.12Å; L54-L241 HydrophobicContact CD1-CD2 4.34Å; F82-L241 HydrophobicContact CD2-CB 4.48Å; F82-L241 HydrophobicContact CD2-CD1 4Å; F82-L241 HydrophobicContact CG-CB 4.38Å; C237-L241 WeakPolarHBondContact O-CB 3.36Å; C237-L241 PolarHBondContact O-N 2.89Å; F238-L241 PolarHBondContact O-N 3.25Å; L241-A244 PolarHBondContact O-N 3.49Å; L241-M245 HydrophobicContact CG-CE 4.47Å; L241-M245 VanDerWaalsContact O-CG 3.32Å; L241-M245 WeakPolarHBondContact O-CG 3.03Å; L241-M245 PolarHBondContact O-N 3.39Å
242A86.9Confident82.6Confident37 Ų3752.2 Ų52.231%0.30626%0.258SS..Hα-helixtrans-61.3-47.8174.600000112.4F238 V239 M240 M245 W246F238-A242 WeakPolarHBondContact O-CB 3.46Å; F238-A242 PolarHBondContact O-N 2.86Å; V239-A242 PolarHBondContact O-N 3.26Å; M240-A242 VanDerWaalsContact C-N 3.32Å; A242-M245 PolarHBondContact O-N 3.02Å; A242-W246 PolarHBondContact O-N 3.33Å
243L84.3Confident81.7Confident54 Ų5449.9 Ų49.928%0.28325%0.246SC..Hα-helixtrans-65-40.5176.5-70.4174.4000111.6F190 V239 M240 M245 W246 F247F190-L243 HydrophobicContact CE1-CB 4.18Å; F190-L243 HydrophobicContact CE1-CD1 3.39Å; F190-L243 HydrophobicContact CE1-CG 4.41Å; F190-L243 HydrophobicContact CZ-CD1 3.51Å; V239-L243 HydrophobicContact CG1-CD1 3.79Å; V239-L243 HydrophobicContact CG1-CG 4.27Å; V239-L243 WeakPolarHBondContact O-CB 3.19Å; V239-L243 VanDerWaalsContact O-CG 3.27Å; V239-L243 WeakPolarHBondContact O-CG 3.32Å; V239-L243 PolarHBondContact O-N 3.2Å; M240-L243 PolarHBondContact O-N 3.36Å; L243-M245 VanDerWaalsContact C-N 3.35Å; L243-M245 PolarHBondContact O-N 3.45Å; L243-W246 PolarHBondContact O-N 2.9Å; L243-F247 HydrophobicContact CB-CD2 4.37Å; L243-F247 HydrophobicContact CB-CE2 4.46Å; L243-F247 HydrophobicContact CD2-CE2 4.33Å; L243-F247 WeakPolarHBondContact O-CD2 3.25Å; L243-F247 PolarHBondContact O-N 2.77Å
244A81.2Confident80.8Confident8 Ų855.4 Ų55.47%0.06627%0.272CS..Hα-helixtrans-58.7-46.5175.400000111.4M191 M240 L241 W246 F247 C248M191-A244 HydrophobicContact CE-CB 3.44Å; M191-A244 VanDerWaalsContact CE-CB 3.44Å; M240-A244 WeakPolarHBondContact O-CB 3.31Å; M240-A244 PolarHBondContact O-N 3.1Å; L241-A244 PolarHBondContact O-N 3.49Å; A244-W246 VanDerWaalsContact C-N 3.34Å; A244-W246 PolarHBondContact O-N 3.15Å; A244-F247 PolarHBondContact O-N 3.3Å; A244-C248 WeakPolarHBondContact O-CA 3.17Å; A244-C248 WeakPolarHBondContact O-CB 3.18Å; A244-C248 PolarHBondContact O-N 3.2Å; A244-C248 PolarHBondContact O-SG 3.03Å; A244-C248 VanDerWaalsContact O-SG 3.36Å
245M83Confident79.7Confident55 Ų5556.6 Ų56.627%0.27128%0.278SS..Hα-helixtrans-64.2-39.5176.5-71.3-175.8-60.900112.2L54 C58 L241 A242 L243 C248 R249L54-M245 HydrophobicContact CB-CE 4.06Å; L54-M245 HydrophobicContact CB-SD 4.1Å; L54-M245 HydrophobicContact CD1-CE 3.58Å; L54-M245 HydrophobicContact CD2-CE 3.56Å; L54-M245 HydrophobicContact CD2-SD 3.89Å; L54-M245 HydrophobicContact CG-CE 3.9Å; L54-M245 HydrophobicContact CG-SD 4.41Å; C58-M245 WeakPolarHBondContact SG-CG 3.36Å; L241-M245 HydrophobicContact CG-CE 4.47Å; L241-M245 VanDerWaalsContact O-CG 3.32Å; L241-M245 WeakPolarHBondContact O-CG 3.03Å; L241-M245 PolarHBondContact O-N 3.39Å; A242-M245 PolarHBondContact O-N 3.02Å; L243-M245 VanDerWaalsContact C-N 3.35Å; L243-M245 PolarHBondContact O-N 3.45Å; M245-C248 CarbonylContact O-C 3.57Å; M245-R249 PolarHBondContact O-N 2.02Å
246W82.3Confident78.7Confident202 Ų20252.8 Ų52.877%0.76526%0.257SS*.Hα-helixtrans-62.3-51.4177.1-172.5-56.9000111.2A242 L243 A244 R249A242-W246 PolarHBondContact O-N 3.33Å; L243-W246 PolarHBondContact O-N 2.9Å; A244-W246 VanDerWaalsContact C-N 3.34Å; A244-W246 PolarHBondContact O-N 3.15Å; W246-R249 WeakPolarHBondContact O-CB 3.3Å; W246-R249 PolarHBondContact O-N 3.1Å
247F76.6Confident77.8Confident96 Ų9653 Ų5342%0.42126%0.26SS..Hα-helixtrans-72.9-33.1-178.2-75.6-67.1000112.8V187 L243 A244 R249V187-F247 HydrophobicContact CG2-CB 3.46Å; V187-F247 VanDerWaalsContact CG2-CB 3.46Å; V187-F247 HydrophobicContact CG2-CG 4.29Å; L243-F247 HydrophobicContact CB-CD2 4.37Å; L243-F247 HydrophobicContact CB-CE2 4.46Å; L243-F247 HydrophobicContact CD2-CE2 4.33Å; L243-F247 WeakPolarHBondContact O-CD2 3.25Å; L243-F247 PolarHBondContact O-N 2.77Å; A244-F247 PolarHBondContact O-N 3.3Å; F247-R249 PolarHBondContact O-N 2.97Å
248C73.6Confident76.9Confident18 Ų1859.2 Ų59.212%0.12228%0.282CS..THydrogen-bonded Turntrans-87.123.9174.9-63.60000112.9A244 M245 P250 F256A244-C248 WeakPolarHBondContact O-CA 3.17Å; A244-C248 WeakPolarHBondContact O-CB 3.18Å; A244-C248 PolarHBondContact O-N 3.2Å; A244-C248 PolarHBondContact O-SG 3.03Å; A244-C248 VanDerWaalsContact O-SG 3.36Å; M245-C248 CarbonylContact O-C 3.57Å; C248-P250 WeakPolarHBondContact O-CD 3.48Å; C248-F256 HydrophobicContact CB-CE2 4.35Å; C248-F256 HydrophobicContact CB-CZ 4.42Å; C248-F256 WeakPolarHBondContact O-CE2 3.24Å; C248-F256 WeakPolarHBondContact O-CZ 3.33Å
249R78.7Confident75.6Confident148 Ų14859 Ų5956%0.55828%0.28SS*.  trans-59.6128.4175.4-171.4178.6168.8179.7-3.4110.2M245 W246 F247 T251 V252 N253M245-R249 PolarHBondContact O-N 2.02Å; W246-R249 WeakPolarHBondContact O-CB 3.3Å; W246-R249 PolarHBondContact O-N 3.1Å; F247-R249 PolarHBondContact O-N 2.97Å; R249-T251 VanDerWaalsContact CD-OG1 3.3Å; R249-T251 WeakPolarHBondContact CD-OG1 3.46Å; R249-T251 WeakPolarHBondContact CG-OG1 2.96Å; R249-T251 PolarHBondContact NE-OG1 3.29Å; R249-T251 VanDerWaalsContact NE-OG1 3.09Å; R249-T251 PolarHBondContact O-N 3.34Å; R249-T251 VanDerWaalsContact O-N 3.07Å; R249-V252 PolarHBondContact O-N 3.48Å; R249-V252 VanDerWaalsContact O-N 3.08Å; R249-N253 PolarHBondContact O-N 3.02Å
250P67.7Low74.3Confident18 Ų1862.8 Ų62.812%0.11729%0.292CS..THydrogen-bonded Turntrans-56.5-28.9-176.4-28.334.6000115.3F61 Y65 C248 V252 F256 Y259F61-P250 HydrophobicContact CD1-CG 4.1Å; Y65-P250 HydrophobicContact CD2-CG 4.32Å; C248-P250 WeakPolarHBondContact O-CD 3.48Å; P250-V252 VanDerWaalsContact C-N 3.26Å; P250-V252 PolarHBondContact O-N 2.9Å; P250-F256 HydrophobicContact CB-CB 4.22Å; P250-F256 HydrophobicContact CB-CD2 4.19Å; P250-F256 HydrophobicContact CB-CG 4.08Å; P250-F256 HydrophobicContact CG-CD2 4.45Å; P250-F256 HydrophobicContact CG-CG 4.42Å; P250-Y259 HydrophobicContact CB-CD1 4.27Å; P250-Y259 HydrophobicContact CB-CD2 3.4Å; P250-Y259 VanDerWaalsContact CB-CD2 3.4Å; P250-Y259 HydrophobicContact CB-CE2 3.89Å; P250-Y259 HydrophobicContact CB-CG 3.65Å; P250-Y259 HydrophobicContact CG-CD2 4.48Å; P250-Y259 WeakPolarHBondContact O-CD1 3.39Å
251T68.6Low73Confident53 Ų5370.9 Ų70.933%0.32532%0.322SS..THydrogen-bonded Turntrans-66.7-24.9-179.953.40000114R249 Y259R249-T251 VanDerWaalsContact CD-OG1 3.3Å; R249-T251 WeakPolarHBondContact CD-OG1 3.46Å; R249-T251 WeakPolarHBondContact CG-OG1 2.96Å; R249-T251 PolarHBondContact NE-OG1 3.29Å; R249-T251 VanDerWaalsContact NE-OG1 3.09Å; R249-T251 PolarHBondContact O-N 3.34Å; R249-T251 VanDerWaalsContact O-N 3.07Å; T251-Y259 HydrophobicContact CG2-CE1 3.6Å; T251-Y259 VanDerWaalsContact CG2-CZ 3.49Å; T251-Y259 WeakPolarHBondContact CG2-OH 3.3Å
252V69.4Low71.6Confident76 Ų7675.8 Ų75.846%0.46135%0.352SS..THydrogen-bonded Turntrans-110.3-20.6-169.6-1750000112R249 P250R249-V252 PolarHBondContact O-N 3.48Å; R249-V252 VanDerWaalsContact O-N 3.08Å; P250-V252 VanDerWaalsContact C-N 3.26Å; P250-V252 PolarHBondContact O-N 2.9Å
253N69.7Low69.9Low7 Ų777.4 Ų77.44%0.03736%0.358CS..  trans-110.8117.2-167.7-165.7-18.5000111F182 M184 R249 M255 F256F182-N253 PolarHBondContact O-OD1 3.07Å; M184-N253 WeakPolarHBondContact CE-ND2 3.46Å; M184-N253 PolarHBondContact SD-ND2 3.01Å; R249-N253 PolarHBondContact O-N 3.02Å; N253-M255 PolarHBondContact O-N 2.93Å; N253-M255 VanDerWaalsContact O-N 3.09Å; N253-M255 PolarHBondContact OD1-N 3.48Å; N253-F256 HydrophobicContact CB-CD2 3.98Å; N253-F256 HydrophobicContact CB-CE2 4.16Å; N253-F256 PolarHBondContact O-N 3.49Å
254E69Low68.3Low118 Ų11880 Ų8055%0.55138%0.379SS*.THydrogen-bonded Turntrans-61.6-15.5-179.8-69.2-174.5-177.200113.4F256E254-F256 PolarHBondContact O-N 3.36Å; E254-F256 VanDerWaalsContact O-N 3.17Å
255M67.3Low66.7Low26 Ų2686.7 Ų86.713%0.12841%0.413CS..THydrogen-bonded Turntrans-57.6-29.7174.4-177.6-176.9-74.600112.8L75 M184 N253 D257L75-M255 HydrophobicContact CD2-SD 3.89Å; M184-M255 HydrophobicContact CE-CB 3.93Å; M184-M255 HydrophobicContact CE-CE 3.25Å; M184-M255 HydrophobicContact CE-CG 4.13Å; M184-M255 HydrophobicContact CE-SD 3.17Å; M184-M255 WeakPolarHBondContact CE-SD 3.08Å; M184-M255 HydrophobicContact CG-CE 3.53Å; M184-M255 HydrophobicContact SD-CE 4.02Å; N253-M255 PolarHBondContact O-N 2.93Å; N253-M255 VanDerWaalsContact O-N 3.09Å; N253-M255 PolarHBondContact OD1-N 3.48Å; M255-D257 PolarHBondContact O-N 3.23Å
256F69.5Low64.9Low7 Ų789.4 Ų89.43%0.03143%0.429CS..  trans-84.761.7-178.7-63.2-75.9000110.5Y65 V66 C248 P250 N253 E254 R258 Y259Y65-F256 VanDerWaalsContact CB-CD1 3.42Å; Y65-F256 CarbonylContact O-C 3.59Å; Y65-F256 WeakPolarHBondContact O-CA 3.35Å; V66-F256 HydrophobicContact CG2-CD1 3.7Å; V66-F256 HydrophobicContact CG2-CE1 3.72Å; C248-F256 HydrophobicContact CB-CE2 4.35Å; C248-F256 HydrophobicContact CB-CZ 4.42Å; C248-F256 WeakPolarHBondContact O-CE2 3.24Å; C248-F256 WeakPolarHBondContact O-CZ 3.33Å; P250-F256 HydrophobicContact CB-CB 4.22Å; P250-F256 HydrophobicContact CB-CD2 4.19Å; P250-F256 HydrophobicContact CB-CG 4.08Å; P250-F256 HydrophobicContact CG-CD2 4.45Å; P250-F256 HydrophobicContact CG-CG 4.42Å; N253-F256 HydrophobicContact CB-CD2 3.98Å; N253-F256 HydrophobicContact CB-CE2 4.16Å; N253-F256 PolarHBondContact O-N 3.49Å; E254-F256 PolarHBondContact O-N 3.36Å; E254-F256 VanDerWaalsContact O-N 3.17Å; F256-R258 PolarHBondContact O-N 3.3Å; F256-Y259 VanDerWaalsContact O-CB 3.26Å; F256-Y259 WeakPolarHBondContact O-CB 3.03Å; F256-Y259 PolarHBondContact O-N 3.29Å
257D68.9Low63.3Low40 Ų4087.9 Ų87.921%0.21444%0.436CS..THydrogen-bonded Turntrans-51.9-26-175.6-47.4-13.1000113.4R71 M255 R261R71-D257 IonicContact CZ-OD2 3.97Å; R71-D257 IonicContact NH1-OD1 3.42Å; R71-D257 PolarHBondContact NH1-OD1 3.49Å; R71-D257 IonicContact NH1-OD2 3.2Å; R71-D257 PolarHBondContact NH1-OD2 3.28Å; R71-D257 IonicContact NH2-OD1 3.02Å; R71-D257 IonicContact NH2-OD2 3.96Å; R71-D257 PolarHBondContact NH2-OD2 2.92Å; M255-D257 PolarHBondContact O-N 3.23Å; D257-R261 PolarHBondContact O-NE 3.41Å
258R70.1Confident61.8Low141 Ų14188.3 Ų88.353%0.53245%0.45SS..THydrogen-bonded Turntrans-82.4-23.2178.7-154.1-177.8-162.6176.52.4112.9L64 Y65 F256 R261 V262L64-R258 WeakPolarHBondContact O-CD 3.08Å; Y65-R258 WeakPolarHBondContact O-CB 3.49Å; Y65-R258 PolarHBondContact O-N 3.46Å; F256-R258 PolarHBondContact O-N 3.3Å; R258-R261 PolarHBondContact O-N 3.48Å; R258-V262 WeakPolarHBondContact O-CG2 3.38Å
259Y61.4Low60.4Low61 Ų6192.9 Ų92.924%0.23947%0.474CS..THydrogen-bonded Turntrans-64.9-47.7180-172.8-94.2000111.3Y65 P250 T251 F256 R261 V262Y65-Y259 AromaticContact CD1-CD2 3.73Å; Y65-Y259 HydrophobicContact CD1-CD2 3.73Å; Y65-Y259 HydrophobicContact CD1-CG 4.27Å; Y65-Y259 AromaticContact CE1-CD2 3.44Å; Y65-Y259 HydrophobicContact CE1-CD2 3.44Å; Y65-Y259 VanDerWaalsContact CE1-CD2 3.44Å; Y65-Y259 HydrophobicContact CE1-CE2 4.22Å; Y65-Y259 HydrophobicContact CE1-CG 4.33Å; Y65-Y259 HydrophobicContact CG-CD2 4.44Å; Y65-Y259 AromaticContact CZ-CD2 3.93Å; P250-Y259 HydrophobicContact CB-CD1 4.27Å; P250-Y259 HydrophobicContact CB-CD2 3.4Å; P250-Y259 VanDerWaalsContact CB-CD2 3.4Å; P250-Y259 HydrophobicContact CB-CE2 3.89Å; P250-Y259 HydrophobicContact CB-CG 3.65Å; P250-Y259 HydrophobicContact CG-CD2 4.48Å; P250-Y259 WeakPolarHBondContact O-CD1 3.39Å; T251-Y259 HydrophobicContact CG2-CE1 3.6Å; T251-Y259 VanDerWaalsContact CG2-CZ 3.49Å; T251-Y259 WeakPolarHBondContact CG2-OH 3.3Å; F256-Y259 VanDerWaalsContact O-CB 3.26Å; F256-Y259 WeakPolarHBondContact O-CB 3.03Å; F256-Y259 PolarHBondContact O-N 3.29Å; Y259-R261 PolarHBondContact O-N 3.46Å; Y259-V262 PolarHBondContact O-N 3.2Å; Y259-V262 VanDerWaalsContact O-N 3.17Å
260H60.9Low58.8Low144 Ų14491.1 Ų91.167%0.66748%0.484SS*.THydrogen-bonded Turntrans-67.5-22179.1-121.281000113.7V262 T263H260-V262 VanDerWaalsContact C-N 3.35Å; H260-T263 PolarHBondContact O-OG1 2.84Å
261R57.9Low57.7Low179 Ų179101.8 Ų101.868%0.67552%0.522SS*.THydrogen-bonded Turntrans-77.9-16.3175.1-78.8-171-104.4-176.4-10.4114.1D257 R258 Y259D257-R261 PolarHBondContact O-NE 3.41Å; R258-R261 PolarHBondContact O-N 3.48Å; Y259-R261 PolarHBondContact O-N 3.46Å
262V57.2Low56.3Low103 Ų103105.7 Ų105.762%0.62454%0.541SS*.THydrogen-bonded Turntrans-95.7-21.1-177.9176.50000112.1R258 Y259 H260 P264R258-V262 WeakPolarHBondContact O-CG2 3.38Å; Y259-V262 PolarHBondContact O-N 3.2Å; Y259-V262 VanDerWaalsContact O-N 3.17Å; H260-V262 VanDerWaalsContact C-N 3.35Å; V262-P264 VanDerWaalsContact O-CD 3.29Å; V262-P264 WeakPolarHBondContact O-CD 3.45Å
263T51.1Low54.8Low71 Ų71108.9 Ų108.944%0.43656%0.556SS.*  trans-69.8114.417435.20000110.8H260 N265H260-T263 PolarHBondContact O-OG1 2.84Å; T263-N265 VanDerWaalsContact C-N 3.32Å; T263-N265 PolarHBondContact O-N 3.38Å
264P51.1Low53.3Low109 Ų109113.8 Ų113.871%0.70859%0.588SS**  trans-91.539.3-167.437.9-35.3000113.8V262V262-P264 VanDerWaalsContact O-CD 3.29Å; V262-P264 WeakPolarHBondContact O-CD 3.45Å
265N47Very low52.2Low148 Ų148112.1 Ų112.179%0.79159%0.587SS**SBendtrans-115.574.3170.3-79.40.1000109T263T263-N265 VanDerWaalsContact C-N 3.32Å; T263-N265 PolarHBondContact O-N 3.38Å
266D45.4Very low51.1Low113 Ų113118.8 Ų118.860%0.60462%0.618SS**  trans17259.9138.4-84.7-23.3000110.9S268D266-S268 PolarHBondContact O-N 2.88Å; D266-S268 VanDerWaalsContact O-N 3.11Å
267D47.5Very low50Low169 Ų169125.6 Ų125.690%0.90465%0.65SS**THydrogen-bonded Turntrans-67.75.4161.5-88.3-31.7000112.6
268S46.4Very low48.8Very low105 Ų105126.7 Ų126.773%0.73466%0.664SS**THydrogen-bonded Turntrans-104.8-15.1-177.171.90000116.4D266D266-S268 PolarHBondContact O-N 2.88Å; D266-S268 VanDerWaalsContact O-N 3.11Å
269D44Very low47.7Very low115 Ų115124.5 Ų124.562%0.61567%0.666SS**THydrogen-bonded Turntrans-118.2-8.5-176.4-144.112.8000115.9R271 N272D269-R271 PolarHBondContact O-N 3.32Å; D269-N272 PolarHBondContact O-N 3.48Å
270S45.6Very low46.9Very low111 Ų111125.5 Ų125.578%0.77668%0.675SS**THydrogen-bonded Turntrans-74.49.3-178.1-70.90000115.8
271R43.2Very low46.2Very low242 Ų242121.7 Ų121.791%0.91366%0.664SS**THydrogen-bonded Turntrans-87.8-17.8171.2-91.6-172.5-166.6171.66.9114.6D269D269-R271 PolarHBondContact O-N 3.32Å
272N40.6Very low45.8Very low134 Ų134116.5 Ų116.572%0.71766%0.655SS**SBendtrans-109.72.4-165.5-75.8-14.9000116.6D269D269-N272 PolarHBondContact O-N 3.48Å
273N36.2Very low45.3Very low144 Ų144115.4 Ų115.477%0.7765%0.648SS**SBendtrans-141.2119.3166.6-101-34.5000111.1
274P38.6Very low45.2Very low110 Ų110116 Ų11671%0.71465%0.649SS**  trans-63.1138.1173.327.5-31.4000109Q276P274-Q276 PolarHBondContact O-N 3.49Å; P274-Q276 VanDerWaalsContact O-N 3.09Å
275P47.2Very low45.2Very low83 Ų83117 Ų11754%0.53964%0.644SS.*  trans-71.6110.7-165.226.3-33000111.1E277 A278P275-E277 HydrophobicContact CB-CB 4.29Å; P275-E277 PolarHBondContact O-N 2.86Å; P275-A278 PolarHBondContact O-N 2.81Å; P275-A278 VanDerWaalsContact O-N 3.11Å
276Q43.8Very low45.4Very low166 Ų166118.8 Ų118.878%0.77664%0.64SS**Hα-helixtrans-54.8-18.4164.4-72.4-177.2-17.100112.1P274 A278 V279 I280P274-Q276 PolarHBondContact O-N 3.49Å; P274-Q276 VanDerWaalsContact O-N 3.09Å; Q276-A278 VanDerWaalsContact C-N 3.33Å; Q276-A278 PolarHBondContact O-N 3.42Å; Q276-V279 PolarHBondContact O-N 3.25Å; Q276-I280 PolarHBondContact O-N 2.85Å
277E45.8Very low45.6Very low150 Ų150120.5 Ų120.570%0.70164%0.642SS**Hα-helixtrans-63.2-30.5174.7-60.6-174.4143.300114.1P275 V279 I280 C281P275-E277 HydrophobicContact CB-CB 4.29Å; P275-E277 PolarHBondContact O-N 2.86Å; E277-V279 VanDerWaalsContact C-N 3.29Å; E277-V279 PolarHBondContact O-N 2.85Å; E277-I280 PolarHBondContact O-N 2.82Å; E277-C281 WeakPolarHBondContact O-CB 3.39Å; E277-C281 PolarHBondContact O-N 3.43Å
278A43.7Very low45.8Very low62 Ų62114 Ų11451%0.51261%0.607SS.*Hα-helixtrans-67.1-33.7177.500000111.6P275 Q276 S282P275-A278 PolarHBondContact O-N 2.81Å; P275-A278 VanDerWaalsContact O-N 3.11Å; Q276-A278 VanDerWaalsContact C-N 3.33Å; Q276-A278 PolarHBondContact O-N 3.42Å; A278-S282 WeakPolarHBondContact O-CB 3.47Å; A278-S282 PolarHBondContact O-N 3.02Å
279V46.6Very low46Very low95 Ų95113.1 Ų113.158%0.57659%0.594SS**Hα-helixtrans-71-46.3177.8-176.60000110.4Q276 E277 C281 S282 T283Q276-V279 PolarHBondContact O-N 3.25Å; E277-V279 VanDerWaalsContact C-N 3.29Å; E277-V279 PolarHBondContact O-N 2.85Å; V279-C281 PolarHBondContact O-N 3.47Å; V279-S282 PolarHBondContact O-N 2.87Å; V279-S282 VanDerWaalsContact O-N 3.13Å; V279-S282 PolarHBondContact O-OG 3.46Å; V279-T283 PolarHBondContact O-N 3.3Å; V279-T283 PolarHBondContact O-OG1 3.4Å; V279-T283 VanDerWaalsContact O-OG1 3.08Å
280I45.7Very low46.5Very low83 Ų83112.1 Ų112.143%0.42659%0.589SS.*Hα-helixtrans-64.3-40.9177.8-60.3173.8000111.2Q276 E277 S282 T283 L284Q276-I280 PolarHBondContact O-N 2.85Å; E277-I280 PolarHBondContact O-N 2.82Å; I280-S282 VanDerWaalsContact C-N 3.32Å; I280-S282 PolarHBondContact O-N 3.04Å; I280-T283 PolarHBondContact O-N 3.06Å; I280-L284 HydrophobicContact CG2-CD1 3.98Å; I280-L284 HydrophobicContact CG2-CG 4.46Å; I280-L284 WeakPolarHBondContact O-CB 2.98Å; I280-L284 PolarHBondContact O-N 2.81Å
281C46.6Very low46.5Very low64 Ų64110.3 Ų110.343%0.43257%0.571SS.*Hα-helixtrans-60.4-41.4172.6-870000111.8E277 V279 Q285E277-C281 WeakPolarHBondContact O-CB 3.39Å; E277-C281 PolarHBondContact O-N 3.43Å; V279-C281 PolarHBondContact O-N 3.47Å; C281-Q285 WeakPolarHBondContact O-CB 3.39Å; C281-Q285 PolarHBondContact O-N 3.31Å
282S48Very low46.6Very low70 Ų70101.4 Ų101.449%0.4954%0.543SS..Hα-helixtrans-66-37.3177.476.70000112.6A278 V279 I280 R286A278-S282 WeakPolarHBondContact O-CB 3.47Å; A278-S282 PolarHBondContact O-N 3.02Å; V279-S282 PolarHBondContact O-N 2.87Å; V279-S282 VanDerWaalsContact O-N 3.13Å; V279-S282 PolarHBondContact O-OG 3.46Å; I280-S282 VanDerWaalsContact C-N 3.32Å; I280-S282 PolarHBondContact O-N 3.04Å; S282-R286 VanDerWaalsContact O-CB 3.26Å; S282-R286 WeakPolarHBondContact O-CB 3.11Å; S282-R286 PolarHBondContact O-N 3.23Å
283T47.4Very low46.4Very low79 Ų79101.7 Ų101.749%0.48554%0.54SS..Hα-helixtrans-71.5-42177-49.30000111.9V279 I280 R286 F287V279-T283 PolarHBondContact O-N 3.3Å; V279-T283 PolarHBondContact O-OG1 3.4Å; V279-T283 VanDerWaalsContact O-OG1 3.08Å; I280-T283 PolarHBondContact O-N 3.06Å; T283-R286 PolarHBondContact O-N 3.21Å; T283-F287 PolarHBondContact O-N 3.12Å
284L48Very low46.6Very low84 Ų8498.8 Ų98.844%0.4453%0.527SS..Hα-helixtrans-67.5-39.1175.8-81.1170.9000112.1F182 I280 R286 F287 D288F182-L284 HydrophobicContact CZ-CD1 4.41Å; I280-L284 HydrophobicContact CG2-CD1 3.98Å; I280-L284 HydrophobicContact CG2-CG 4.46Å; I280-L284 WeakPolarHBondContact O-CB 2.98Å; I280-L284 PolarHBondContact O-N 2.81Å; L284-R286 VanDerWaalsContact C-N 3.34Å; L284-F287 PolarHBondContact O-N 2.92Å; L284-D288 WeakPolarHBondContact O-CB 3.4Å; L284-D288 PolarHBondContact O-N 3.07Å
285Q52.8Low46.2Very low130 Ų13099.6 Ų99.661%0.60752%0.52SS*.Hα-helixtrans-69.2-34.7176.4-167.8148.6-44.400111.7C281 D288 D289C281-Q285 WeakPolarHBondContact O-CB 3.39Å; C281-Q285 PolarHBondContact O-N 3.31Å; Q285-D288 PolarHBondContact O-N 3.45Å; Q285-D289 WeakPolarHBondContact O-CB 3.49Å; Q285-D289 PolarHBondContact O-N 2.92Å
286R50.4Low45.4Very low186 Ų18699.5 Ų99.570%0.70252%0.52SS*.Hα-helixtrans-65.2-39.3172.4-172.6170.1-96.9173.2-9.1112.3S282 T283 L284 D289 D290S282-R286 VanDerWaalsContact O-CB 3.26Å; S282-R286 WeakPolarHBondContact O-CB 3.11Å; S282-R286 PolarHBondContact O-N 3.23Å; T283-R286 PolarHBondContact O-N 3.21Å; L284-R286 VanDerWaalsContact C-N 3.34Å; R286-D289 PolarHBondContact O-N 2.88Å; R286-D290 PolarHBondContact O-N 3.27Å
287F49Very low44.8Very low148 Ų14895 Ų9565%0.64951%0.511SS*.Hα-helixtrans-63.7-38.8170.9-111.5-86.1000112.5T283 L284 D291T283-F287 PolarHBondContact O-N 3.12Å; L284-F287 PolarHBondContact O-N 2.92Å; F287-D291 PolarHBondContact O-N 2.93Å; F287-D291 VanDerWaalsContact O-N 3.13Å
288D51.7Low44.1Very low34 Ų3493.1 Ų93.118%0.18251%0.51CS..Hα-helixtrans-70.7-36.8178.4-152.9-103.8000111.7L70 R74 L284 Q285 T292L70-D288 WeakPolarHBondContact CB-OD1 2.89Å; L70-D288 WeakPolarHBondContact CD2-OD1 3.21Å; L70-D288 WeakPolarHBondContact CD2-OD2 2.96Å; R74-D288 IonicContact CZ-OD2 2.69Å; R74-D288 IonicContact NH2-OD2 3.34Å; R74-D288 PolarHBondContact NH2-OD2 3.31Å; L284-D288 WeakPolarHBondContact O-CB 3.4Å; L284-D288 PolarHBondContact O-N 3.07Å; Q285-D288 PolarHBondContact O-N 3.45Å; D288-T292 VanDerWaalsContact O-CB 3.26Å; D288-T292 WeakPolarHBondContact O-CB 3.24Å; D288-T292 PolarHBondContact O-N 3.12Å; D288-T292 PolarHBondContact O-OG1 2.87Å
289D51.6Low43.6Very low86 Ų8694.1 Ų94.146%0.4652%0.519SS..Hα-helixtrans-67.6-40.9173.8-82.8-40.2000111.7Q285 R286 T292 Q293Q285-D289 WeakPolarHBondContact O-CB 3.49Å; Q285-D289 PolarHBondContact O-N 2.92Å; R286-D289 PolarHBondContact O-N 2.88Å; D289-T292 PolarHBondContact O-N 2.94Å; D289-Q293 WeakPolarHBondContact O-CB 3.4Å; D289-Q293 WeakPolarHBondContact O-CG 3.5Å; D289-Q293 PolarHBondContact O-N 3.41Å
290D53.2Low42.9Very low93 Ų9399.6 Ų99.650%0.49754%0.544SS..Hα-helixtrans-62.8-44.8174.6-76.5-25.9000110.8R286 T292 Q293 V294R286-D290 PolarHBondContact O-N 3.27Å; D290-T292 VanDerWaalsContact C-N 3.33Å; D290-T292 PolarHBondContact O-N 3.18Å; D290-Q293 PolarHBondContact O-N 3.43Å; D290-V294 VanDerWaalsContact O-CG2 3.26Å; D290-V294 WeakPolarHBondContact O-CG2 3.28Å; D290-V294 PolarHBondContact O-N 3.27Å
291D45.9Very low42.8Very low74 Ų74100.5 Ų100.540%0.39655%0.55SS..Hα-helixtrans-64.8-35.2174.4-85.2-25.9000112.6F287 F295F287-D291 PolarHBondContact O-N 2.93Å; F287-D291 VanDerWaalsContact O-N 3.13Å; D291-F295 PolarHBondContact O-N 3.14Å
292T45.2Very low42.6Very low55 Ų55102.4 Ų102.434%0.33756%0.556SS.*Hα-helixtrans-72.6-38.1177.4-58.60000111.5D288 D289 D290 F295 C296D288-T292 VanDerWaalsContact O-CB 3.26Å; D288-T292 WeakPolarHBondContact O-CB 3.24Å; D288-T292 PolarHBondContact O-N 3.12Å; D288-T292 PolarHBondContact O-OG1 2.87Å; D289-T292 PolarHBondContact O-N 2.94Å; D290-T292 VanDerWaalsContact C-N 3.33Å; D290-T292 PolarHBondContact O-N 3.18Å; T292-F295 CarbonylContact O-C 3.58Å; T292-F295 WeakPolarHBondContact O-CA 3.34Å; T292-F295 WeakPolarHBondContact O-CB 3.27Å; T292-F295 PolarHBondContact O-N 2.96Å; T292-F295 VanDerWaalsContact O-N 3.11Å; T292-C296 PolarHBondContact O-N 3.22Å
293Q37.6Very low42.3Very low140 Ų140104.2 Ų104.265%0.65456%0.559SS**Hα-helixtrans-64.5-41.9172.3-79.2-16517.500111.4D289 D290 F295 C296 A297D289-Q293 WeakPolarHBondContact O-CB 3.4Å; D289-Q293 WeakPolarHBondContact O-CG 3.5Å; D289-Q293 PolarHBondContact O-N 3.41Å; D290-Q293 PolarHBondContact O-N 3.43Å; Q293-F295 PolarHBondContact O-N 3.43Å; Q293-C296 PolarHBondContact O-N 2.98Å; Q293-A297 WeakPolarHBondContact O-CB 3.29Å; Q293-A297 PolarHBondContact O-N 3.38Å
294V39.1Very low42Very low82 Ų82105.6 Ų105.650%0.49756%0.564SS.*Hα-helixtrans-59.5-37.4171.21730000110.5D290 A297 T298D290-V294 VanDerWaalsContact O-CG2 3.26Å; D290-V294 WeakPolarHBondContact O-CG2 3.28Å; D290-V294 PolarHBondContact O-N 3.27Å; V294-A297 PolarHBondContact O-N 3.38Å; V294-T298 WeakPolarHBondContact O-CB 3.4Å; V294-T298 PolarHBondContact O-N 2.89Å; V294-T298 PolarHBondContact O-OG1 3.48Å
295F31.5Very low41.6Very low127 Ų127107 Ų10756%0.55757%0.571SS**Hα-helixtrans-64.3-42.3174.9-140.2-80.4000112.8R115 D291 T292 Q293 A299R115-F295 VanDerWaalsContact NH1-CD2 3.34Å; D291-F295 PolarHBondContact O-N 3.14Å; T292-F295 CarbonylContact O-C 3.58Å; T292-F295 WeakPolarHBondContact O-CA 3.34Å; T292-F295 WeakPolarHBondContact O-CB 3.27Å; T292-F295 PolarHBondContact O-N 2.96Å; T292-F295 VanDerWaalsContact O-N 3.11Å; Q293-F295 PolarHBondContact O-N 3.43Å; F295-A299 WeakPolarHBondContact O-CB 3.38Å; F295-A299 PolarHBondContact O-N 3.03Å
296C29.5Very low40.9Very low82 Ų82105.5 Ų105.555%0.55457%0.569SS**Hα-helixtrans-68.5-35.6174.2-78.50000112.5T292 Q293 T298T292-C296 PolarHBondContact O-N 3.22Å; Q293-C296 PolarHBondContact O-N 2.98Å; C296-T298 VanDerWaalsContact C-N 3.35Å
297A31.1Very low40.2Very low70 Ų7099.7 Ų99.758%0.57956%0.56SS**Hα-helixtrans-73-25.3178.500000113.4Q293 V294Q293-A297 WeakPolarHBondContact O-CB 3.29Å; Q293-A297 PolarHBondContact O-N 3.38Å; V294-A297 PolarHBondContact O-N 3.38Å
298T32.6Very low39.5Very low112 Ų11296 Ų9669%0.68755%0.553SS**Hα-helixtrans-93.2-13.3179.1-41.50000112.7V294 C296V294-T298 WeakPolarHBondContact O-CB 3.4Å; V294-T298 PolarHBondContact O-N 2.89Å; V294-T298 PolarHBondContact O-OG1 3.48Å; C296-T298 VanDerWaalsContact C-N 3.35Å
299A32.6Very low38.5Very low83 Ų83101.2 Ų101.269%0.68658%0.584SS**  trans-94.8-6.2178.600000113.9F295F295-A299 WeakPolarHBondContact O-CB 3.38Å; F295-A299 PolarHBondContact O-N 3.03Å
300L32.1Very low37.3Very low210 Ų210102.5 Ų102.5100%1.09960%0.595SS**  trans-97.10167.4-82.7160.3000109.7

Retrieved 300 of 300 residues in 82.5 ms (Link to these results)