A0A060YEZ1_ONCMY Loading...

Sphingosine-1-phosphate receptor 1

AlphaFold DB , UniProt , Accession A0A060YEZ1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110524100, Length 372 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
1M42.1Very low64.9Low225 Ų22580.8 Ų80.8100%1.10845%0.448SS*.  0-25.10-92.9172.1-179.600113.9
2G49Very low67.1Low40 Ų4084.8 Ų84.841%0.41245%0.451SS..Hα-helixtrans-68.9-45176.200000114.7S4 M5 Y6G2-S4 PolarHBondContact O-N 3.02Å; G2-M5 PolarHBondContact O-N 3.13Å; G2-Y6 WeakPolarHBondContact O-CD2 3.3Å; G2-Y6 PolarHBondContact O-N 3.3Å
3D48.1Very low69Low122 Ų12278.5 Ų78.565%0.65242%0.417SS*.Hα-helixtrans-63.8-34.5-173.3-72.8-22.8000114.4M5 Y6 S7D3-M5 VanDerWaalsContact C-N 3.33Å; D3-M5 PolarHBondContact O-N 3.43Å; D3-Y6 PolarHBondContact O-N 3.21Å; D3-S7 PolarHBondContact O-N 3.22Å; D3-S7 VanDerWaalsContact O-N 3.13Å; D3-S7 PolarHBondContact O-OG 2.91Å
4S54.7Low70.6Confident90 Ų9074.6 Ų74.663%0.62940%0.395SS*.Hα-helixtrans-71.1-28.2-179.673.60000113.1G2 D8G2-S4 PolarHBondContact O-N 3.02Å; S4-D8 PolarHBondContact O-N 2.82Å
5M55.1Low72Confident125 Ų12575.3 Ų75.362%0.61640%0.399SS*.Hα-helixtrans-75.8-32.5177.3-164-1787900111.6G2 D3 L9G2-M5 PolarHBondContact O-N 3.13Å; D3-M5 VanDerWaalsContact C-N 3.33Å; D3-M5 PolarHBondContact O-N 3.43Å; M5-L9 PolarHBondContact O-N 3.03Å
6Y54.8Low73.2Confident112 Ų11275.1 Ų75.144%0.43939%0.393SS..Hα-helixtrans-78.4-38.4179.7-73.3-61.6000113.2G2 D3 D8 L9 P98G2-Y6 WeakPolarHBondContact O-CD2 3.3Å; G2-Y6 PolarHBondContact O-N 3.3Å; D3-Y6 PolarHBondContact O-N 3.21Å; Y6-D8 PolarHBondContact O-N 3.34Å; Y6-L9 WeakPolarHBondContact O-CB 3.35Å; Y6-L9 PolarHBondContact O-N 3.16Å; Y6-P98 HydrophobicContact CD1-CG 3.95Å
7S61.7Low74.2Confident41 Ų4170.8 Ų70.829%0.28737%0.371SS..Hα-helixtrans-61.5-34170.4-65.70000112D3 L9 A11 Y94D3-S7 PolarHBondContact O-N 3.22Å; D3-S7 VanDerWaalsContact O-N 3.13Å; D3-S7 PolarHBondContact O-OG 2.91Å; S7-L9 VanDerWaalsContact C-N 3.35Å; S7-L9 PolarHBondContact O-N 3.49Å; S7-A11 PolarHBondContact O-N 2.94Å; S7-Y94 WeakPolarHBondContact CB-O 3.42Å; S7-Y94 PolarHBondContact OG-O 3.14Å
8D80.1Confident74.8Confident75 Ų7568.8 Ų68.840%0.40137%0.37SS..Hα-helixtrans-65.6-35.1175.3-170.452.4000112.5S4 Y6 A11 R12S4-D8 PolarHBondContact O-N 2.82Å; Y6-D8 PolarHBondContact O-N 3.34Å; D8-A11 PolarHBondContact O-N 3.35Å; D8-R12 VanDerWaalsContact O-CB 3.29Å; D8-R12 WeakPolarHBondContact O-CB 3.43Å; D8-R12 PolarHBondContact O-N 2.66Å; D8-R12 IonicContact OD2-CZ 3.72Å; D8-R12 IonicContact OD2-NE 3.93Å; D8-R12 IonicContact OD2-NH2 2.76Å; D8-R12 PolarHBondContact OD2-NH2 2.7Å
9L89.4Confident75.4Confident34 Ų3467.3 Ų67.318%0.17836%0.36CS..Hα-helixtrans-62.6-48.3179.3-172.275.6000112.2M5 Y6 S7 R12 H13 P98 I169M5-L9 PolarHBondContact O-N 3.03Å; Y6-L9 WeakPolarHBondContact O-CB 3.35Å; Y6-L9 PolarHBondContact O-N 3.16Å; S7-L9 VanDerWaalsContact C-N 3.35Å; S7-L9 PolarHBondContact O-N 3.49Å; L9-R12 PolarHBondContact O-N 2.99Å; L9-H13 PolarHBondContact O-N 3.48Å; L9-H13 VanDerWaalsContact O-N 3.14Å; L9-H13 PolarHBondContact O-ND1 3.1Å; L9-P98 HydrophobicContact CD2-CB 4.35Å; L9-P98 HydrophobicContact CD2-CG 3.74Å; L9-I169 HydrophobicContact CD1-CG2 4.22Å; L9-I169 HydrophobicContact CD2-CG2 3.98Å
10I89.8Confident75.8Confident0 Ų068 Ų680%036%0.363CS..Hα-helixtrans-64.3-46.5179.4-61.2-175.4000109.3R12 H13 Y14 T93 Y94 L96 W101 L181I10-R12 VanDerWaalsContact C-N 3.27Å; I10-R12 PolarHBondContact O-N 2.96Å; I10-H13 PolarHBondContact O-N 3.46Å; I10-Y14 HydrophobicContact CG2-CD2 3.66Å; I10-Y14 HydrophobicContact CG2-CE2 3.69Å; I10-Y14 VanDerWaalsContact O-CD2 3.27Å; I10-Y14 WeakPolarHBondContact O-CD2 3.4Å; I10-Y14 PolarHBondContact O-N 3.43Å; I10-T93 HydrophobicContact CG2-CG2 4.35Å; I10-Y94 HydrophobicContact CG2-CD1 4.47Å; I10-L96 HydrophobicContact CD1-CB 4.25Å; I10-L96 WeakPolarHBondContact CD1-O 3.22Å; I10-W101 HydrophobicContact CD1-CB 3.99Å; I10-W101 HydrophobicContact CD1-CG 4.29Å; I10-L181 HydrophobicContact CG1-CD2 4.41Å
11A88.9Confident75.6Confident25 Ų2569.9 Ų69.921%0.20737%0.365CS..Hα-helixtrans-57.3-40.5177.200000112S7 D8 Y14 N15 L20 Y94S7-A11 PolarHBondContact O-N 2.94Å; D8-A11 PolarHBondContact O-N 3.35Å; A11-Y14 PolarHBondContact O-N 2.79Å; A11-N15 VanDerWaalsContact O-CB 3.27Å; A11-N15 WeakPolarHBondContact O-CB 3.48Å; A11-N15 PolarHBondContact O-N 2.84Å; A11-L20 HydrophobicContact CB-CD1 4.31Å; A11-Y94 HydrophobicContact CB-CD1 4.45Å
12R91.3Very high76.4Confident128 Ų12867.8 Ų67.848%0.48335%0.35SS..Hα-helixtrans-62.5-45.7177.3-168.3-178.2-57.5174.72.5112.8D8 L9 I10 N15 F16 M172D8-R12 VanDerWaalsContact O-CB 3.29Å; D8-R12 WeakPolarHBondContact O-CB 3.43Å; D8-R12 PolarHBondContact O-N 2.66Å; D8-R12 IonicContact OD2-CZ 3.72Å; D8-R12 IonicContact OD2-NE 3.93Å; D8-R12 IonicContact OD2-NH2 2.76Å; D8-R12 PolarHBondContact OD2-NH2 2.7Å; L9-R12 PolarHBondContact O-N 2.99Å; I10-R12 VanDerWaalsContact C-N 3.27Å; I10-R12 PolarHBondContact O-N 2.96Å; R12-N15 PolarHBondContact O-N 3.11Å; R12-F16 WeakPolarHBondContact O-CB 3.21Å; R12-F16 PolarHBondContact O-N 3.36Å; R12-M172 HydrophobicContact CG-SD 4.11Å
13H92.1Very high76.7Confident3 Ų370.7 Ų70.71%0.01436%0.359CS..Hα-helixtrans-67.4-41178.1-74.376000112L9 I10 N15 F16 T17 P180 L181L9-H13 PolarHBondContact O-N 3.48Å; L9-H13 VanDerWaalsContact O-N 3.14Å; L9-H13 PolarHBondContact O-ND1 3.1Å; I10-H13 PolarHBondContact O-N 3.46Å; H13-N15 VanDerWaalsContact C-N 3.33Å; H13-F16 PolarHBondContact O-N 3.23Å; H13-T17 WeakPolarHBondContact O-CG2 2.99Å; H13-T17 PolarHBondContact O-N 2.86Å; H13-T17 PolarHBondContact O-OG1 3.25Å; H13-P180 HydrophobicContact CB-CB 4.09Å; H13-P180 PolarHBondContact CD2-O 3.42Å; H13-P180 VanDerWaalsContact CD2-O 3.28Å; H13-L181 HydrophobicContact CB-CD1 3.83Å
14Y91.3Very high76.7Confident25 Ų2573.8 Ų73.810%0.09837%0.37CS..Hα-helixtrans-66.1-36174.3-86.1-106.9000111.9I10 A11 T17 G18 K19 L20 T93 Y94 W101 P180 L181I10-Y14 HydrophobicContact CG2-CD2 3.66Å; I10-Y14 HydrophobicContact CG2-CE2 3.69Å; I10-Y14 VanDerWaalsContact O-CD2 3.27Å; I10-Y14 WeakPolarHBondContact O-CD2 3.4Å; I10-Y14 PolarHBondContact O-N 3.43Å; A11-Y14 PolarHBondContact O-N 2.79Å; Y14-T17 WeakPolarHBondContact CA-OG1 3.31Å; Y14-T17 PolarHBondContact O-OG1 2.72Å; Y14-G18 PolarHBondContact O-N 3.39Å; Y14-K19 HydrophobicContact CD1-CB 3.74Å; Y14-K19 HydrophobicContact CE1-CB 4.4Å; Y14-K19 HydrophobicContact CG-CB 4.49Å; Y14-K19 CarbonylContact O-C 3.5Å; Y14-K19 WeakPolarHBondContact O-CA 3.29Å; Y14-K19 PolarHBondContact O-N 2.92Å; Y14-L20 PolarHBondContact O-N 3.08Å; Y14-T93 HydrophobicContact CE1-CG2 4.28Å; Y14-T93 HydrophobicContact CE2-CG2 4.14Å; Y14-Y94 HydrophobicContact CD1-CE1 4.33Å; Y14-Y94 HydrophobicContact CG-CE1 4.18Å; Y14-W101 HydrophobicContact CE2-CZ2 4.43Å; Y14-W101 AromaticContact CE2-NE1 3.67Å; Y14-W101 AromaticContact CZ-NE1 3.77Å; Y14-W101 PolarHBondContact OH-NE1 2.85Å; Y14-P180 HydrophobicContact CD1-CG 4.24Å; Y14-P180 HydrophobicContact CD2-CB 3.88Å; Y14-P180 HydrophobicContact CD2-CG 3.93Å; Y14-P180 HydrophobicContact CE1-CG 4.13Å; Y14-P180 HydrophobicContact CE2-CB 3.98Å; Y14-P180 HydrophobicContact CE2-CG 3.84Å; Y14-P180 HydrophobicContact CG-CB 4.41Å; Y14-P180 HydrophobicContact CG-CG 4.15Å; Y14-L181 HydrophobicContact CE2-CD1 4.31Å
15N91.7Very high76.5Confident85 Ų8578 Ų7846%0.45538%0.379SS..Hα-helixtrans-65.6-49.3174.1-169.612000110.8A11 R12 H13 T17 G18 L20 R275A11-N15 VanDerWaalsContact O-CB 3.27Å; A11-N15 WeakPolarHBondContact O-CB 3.48Å; A11-N15 PolarHBondContact O-N 2.84Å; R12-N15 PolarHBondContact O-N 3.11Å; H13-N15 VanDerWaalsContact C-N 3.33Å; N15-T17 VanDerWaalsContact C-N 3.31Å; N15-T17 PolarHBondContact O-N 2.85Å; N15-G18 PolarHBondContact O-N 3.41Å; N15-L20 HydrophobicContact CB-CB 4.13Å; N15-L20 HydrophobicContact CB-CD2 3.99Å; N15-R275 PolarHBondContact O-NH2 2.83Å
16F90.9Very high76.2Confident72 Ų7273.8 Ų73.832%0.31636%0.36SS..Hα-helixtrans-55.8-46.9179.4-173.5-107000111.8R12 H13 G18 M172 I274 R275R12-F16 WeakPolarHBondContact O-CB 3.21Å; R12-F16 PolarHBondContact O-N 3.36Å; H13-F16 PolarHBondContact O-N 3.23Å; F16-G18 PolarHBondContact O-N 3.32Å; F16-M172 HydrophobicContact CB-SD 4.3Å; F16-M172 HydrophobicContact CD1-CB 3.94Å; F16-M172 HydrophobicContact CD2-SD 4.46Å; F16-M172 VanDerWaalsContact CE1-C 3.49Å; F16-M172 HydrophobicContact CE1-CB 3.87Å; F16-M172 WeakPolarHBondContact CE1-O 3.43Å; F16-M172 HydrophobicContact CE2-CB 4.5Å; F16-M172 HydrophobicContact CG-CB 4.27Å; F16-M172 HydrophobicContact CG-SD 4.29Å; F16-M172 HydrophobicContact CZ-CB 4.18Å; F16-I274 HydrophobicContact CD1-CD1 3.86Å; F16-I274 HydrophobicContact CE1-CD1 3.25Å; F16-I274 HydrophobicContact CZ-CD1 4.14Å; F16-I274 WeakPolarHBondContact O-CG2 3.48Å; F16-R275 PolarHBondContact O-NE 3.37Å; F16-R275 PolarHBondContact O-NH2 3.14Å
17T90Very high76.1Confident1 Ų174.2 Ų74.21%0.00638%0.379CS..THydrogen-bonded Turntrans-72.4-4.1177.154.20000114.7H13 Y14 N15 K19 S176 P180 Y281H13-T17 WeakPolarHBondContact O-CG2 2.99Å; H13-T17 PolarHBondContact O-N 2.86Å; H13-T17 PolarHBondContact O-OG1 3.25Å; Y14-T17 WeakPolarHBondContact CA-OG1 3.31Å; Y14-T17 PolarHBondContact O-OG1 2.72Å; N15-T17 VanDerWaalsContact C-N 3.31Å; N15-T17 PolarHBondContact O-N 2.85Å; T17-K19 VanDerWaalsContact C-N 3.29Å; T17-K19 PolarHBondContact O-N 2.95Å; T17-S176 WeakPolarHBondContact CG2-O 3.03Å; T17-P180 HydrophobicContact CG2-CB 3.97Å; T17-P180 HydrophobicContact CG2-CG 4.24Å; T17-Y281 WeakPolarHBondContact O-CE1 3.41Å; T17-Y281 PolarHBondContact O-OH 3.21Å
18G86.1Confident76.1Confident35 Ų3582.8 Ų82.836%0.36141%0.405SS..THydrogen-bonded Turntrans75.713.9-179.100000114.2Y14 N15 F16 Y281Y14-G18 PolarHBondContact O-N 3.39Å; N15-G18 PolarHBondContact O-N 3.41Å; F16-G18 PolarHBondContact O-N 3.32Å; G18-Y281 WeakPolarHBondContact O-CE1 3.44Å
19K85.4Confident75.5Confident41 Ų4184.6 Ų84.618%0.17841%0.414CS..  trans-96.1-3.7-179.8-77.9-168.6167.4-178.50114.7Y14 T17 R21 T177 V178 P180 Y281Y14-K19 HydrophobicContact CD1-CB 3.74Å; Y14-K19 HydrophobicContact CE1-CB 4.4Å; Y14-K19 HydrophobicContact CG-CB 4.49Å; Y14-K19 CarbonylContact O-C 3.5Å; Y14-K19 WeakPolarHBondContact O-CA 3.29Å; Y14-K19 PolarHBondContact O-N 2.92Å; T17-K19 VanDerWaalsContact C-N 3.29Å; T17-K19 PolarHBondContact O-N 2.95Å; K19-R21 PolarHBondContact O-N 3.27Å; K19-R21 VanDerWaalsContact O-N 3.12Å; K19-T177 VanDerWaalsContact CD-O 3.27Å; K19-T177 WeakPolarHBondContact CD-O 3.48Å; K19-T177 WeakPolarHBondContact CE-O 3.36Å; K19-T177 PolarHBondContact NZ-O 3.09Å; K19-V178 VanDerWaalsContact NZ-CA 3.34Å; K19-V178 PolarHBondContact NZ-O 2.9Å; K19-P180 HydrophobicContact CD-CG 4.19Å; K19-Y281 HydrophobicContact CG-CD1 3.71Å; K19-Y281 HydrophobicContact CG-CE1 3.71Å
20L83.6Confident74.9Confident80 Ų8086 Ų8642%0.41942%0.419SS..  trans-63.6115.6178.6-172.173000110.1A11 Y14 N15 Y94A11-L20 HydrophobicContact CB-CD1 4.31Å; Y14-L20 PolarHBondContact O-N 3.08Å; N15-L20 HydrophobicContact CB-CB 4.13Å; N15-L20 HydrophobicContact CB-CD2 3.99Å; L20-Y94 HydrophobicContact CD1-CD1 4.33Å; L20-Y94 HydrophobicContact CD1-CE1 3.6Å
21R71.7Confident74.6Confident109 Ų10989.9 Ų89.941%0.41145%0.451SS..  trans-97.4134.6176-71.9174.4130.9-132.2-12.4109.9K19 V23 D26 K30 Y94K19-R21 PolarHBondContact O-N 3.27Å; K19-R21 VanDerWaalsContact O-N 3.12Å; R21-V23 PolarHBondContact O-N 3.36Å; R21-D26 IonicContact CZ-OD1 3.82Å; R21-D26 IonicContact CZ-OD2 3.9Å; R21-D26 VanDerWaalsContact NH1-CG 3.26Å; R21-D26 IonicContact NH1-OD1 2.8Å; R21-D26 PolarHBondContact NH1-OD1 3.41Å; R21-D26 IonicContact NH1-OD2 2.88Å; R21-D26 PolarHBondContact NH1-OD2 2.82Å; R21-K30 VanDerWaalsContact CZ-CE 3.46Å; R21-K30 VanDerWaalsContact NH2-NZ 3.15Å; R21-Y94 PolarHBondContact N-OH 3.21Å
22K59.2Low74.3Confident180 Ų18090.2 Ų90.278%0.78345%0.449SS*.  trans-67.8129.2172.6-70.5-174.6178.7-177.50109.5E24 Q25K22-E24 PolarHBondContact O-N 3.14Å; K22-Q25 PolarHBondContact O-N 2.8Å
23V54.8Low74.1Confident101 Ų10185 Ų8561%0.61243%0.432SS*.G310 helixtrans-61.5-25.9-171178.30000113.2R21 Q25R21-V23 PolarHBondContact O-N 3.36Å; V23-Q25 VanDerWaalsContact C-N 3.26Å; V23-Q25 PolarHBondContact O-N 3.05Å
24E47.7Very low73.9Confident188 Ų18887.9 Ų87.988%0.87945%0.45SS*.G310 helixtrans-67.5-14.7-177.9-85.5175.8141.900115.5K22K22-E24 PolarHBondContact O-N 3.14Å
25Q49.8Very low73.9Confident177 Ų17790.7 Ų90.783%0.82747%0.469SS*.G310 helixtrans-98.6-2.1-173.4-151.3164.5700114.6K22 V23K22-Q25 PolarHBondContact O-N 2.8Å; V23-Q25 VanDerWaalsContact C-N 3.26Å; V23-Q25 PolarHBondContact O-N 3.05Å
26D50.4Low73.9Confident38 Ų3887.4 Ų87.420%0.20345%0.451CS..  trans-122.122-162-96.9-6.4000114.8R21 R28R21-D26 IonicContact CZ-OD1 3.82Å; R21-D26 IonicContact CZ-OD2 3.9Å; R21-D26 VanDerWaalsContact NH1-CG 3.26Å; R21-D26 IonicContact NH1-OD1 2.8Å; R21-D26 PolarHBondContact NH1-OD1 3.41Å; R21-D26 IonicContact NH1-OD2 2.88Å; R21-D26 PolarHBondContact NH1-OD2 2.82Å; D26-R28 PolarHBondContact O-N 3.27Å
27S53.1Low74Confident121 Ų12185.6 Ų85.685%0.84645%0.445SS*.SBendtrans-74.2-1.4176.141.60000114.6
28R60.2Low74.1Confident221 Ų22190.7 Ų90.783%0.83447%0.47SS*.SBendtrans-119.3131.4172.4-74.6-174.6167.8-150.2-2.6111D26 K30D26-R28 PolarHBondContact O-N 3.27Å; R28-K30 PolarHBondContact O-N 3.24Å
29L66.9Low74.4Confident113 Ų11391 Ų9159%0.59247%0.465SS*.  trans-53.1122.7164.4-83.4157.4000108.3V34L29-V34 HydrophobicContact CB-CG2 4.25Å
30K78.1Confident74.8Confident64 Ų6489 Ų8928%0.27846%0.457SS..  trans-63.6148.9175.4-63.3176.1-175.4167.70110.1R21 R28 D32 S33 V34R21-K30 VanDerWaalsContact CZ-CE 3.46Å; R21-K30 VanDerWaalsContact NH2-NZ 3.15Å; R28-K30 PolarHBondContact O-N 3.24Å; K30-D32 VanDerWaalsContact C-N 3.25Å; K30-D32 WeakPolarHBondContact CB-OD1 3.43Å; K30-D32 WeakPolarHBondContact CD-OD1 3.28Å; K30-D32 PolarHBondContact O-N 3.42Å; K30-S33 WeakPolarHBondContact O-CB 3.33Å; K30-S33 PolarHBondContact O-N 3.31Å; K30-S33 VanDerWaalsContact O-N 3.11Å; K30-V34 PolarHBondContact O-N 3.26Å
31A83.4Confident75.4Confident80 Ų8088 Ų8866%0.66146%0.456SS*.Hα-helixtrans-59.2-35.4-179.300000113V34 V35A31-V34 PolarHBondContact O-N 3.41Å; A31-V35 WeakPolarHBondContact O-CG2 3.32Å; A31-V35 PolarHBondContact O-N 3.48Å; A31-V35 VanDerWaalsContact O-N 3.16Å
32D82.9Confident76.4Confident32 Ų3288 Ų8817%0.17146%0.459CS..Hα-helixtrans-61.7-42.717555.71.2000112.4K30 V34 V35 F36 W285K30-D32 VanDerWaalsContact C-N 3.25Å; K30-D32 WeakPolarHBondContact CB-OD1 3.43Å; K30-D32 WeakPolarHBondContact CD-OD1 3.28Å; K30-D32 PolarHBondContact O-N 3.42Å; D32-V34 VanDerWaalsContact C-N 3.32Å; D32-V34 PolarHBondContact O-N 3.3Å; D32-V35 WeakPolarHBondContact O-CB 3.2Å; D32-V35 PolarHBondContact O-N 3.43Å; D32-F36 HydrophobicContact CB-CE2 4.19Å; D32-F36 HydrophobicContact CB-CZ 4.42Å; D32-F36 VanDerWaalsContact O-CD2 3.31Å; D32-F36 WeakPolarHBondContact O-CD2 3.48Å; D32-F36 VanDerWaalsContact O-CG 3.27Å; D32-F36 WeakPolarHBondContact O-CG 3.47Å; D32-F36 PolarHBondContact O-N 3.34Å; D32-W285 HydrophobicContact CB-CH2 4Å; D32-W285 HydrophobicContact CB-CZ2 3.77Å
33S85.6Confident78Confident19 Ų1979.4 Ų79.413%0.13342%0.421CS..Hα-helixtrans-63.5-38.5178.6-56.20000111.5K30 F36 I37K30-S33 WeakPolarHBondContact O-CB 3.33Å; K30-S33 PolarHBondContact O-N 3.31Å; K30-S33 VanDerWaalsContact O-N 3.11Å; S33-F36 PolarHBondContact O-N 2.99Å; S33-I37 VanDerWaalsContact O-CG1 3.26Å; S33-I37 WeakPolarHBondContact O-CG1 3.39Å; S33-I37 PolarHBondContact O-N 3Å
34V89.2Confident80Confident64 Ų6476.5 Ų76.539%0.38840%0.402SS..Hα-helixtrans-63.8-44.6174.6178.60000110.9L29 K30 A31 D32 F36 I37 I38L29-V34 HydrophobicContact CB-CG2 4.25Å; K30-V34 PolarHBondContact O-N 3.26Å; A31-V34 PolarHBondContact O-N 3.41Å; D32-V34 VanDerWaalsContact C-N 3.32Å; D32-V34 PolarHBondContact O-N 3.3Å; V34-F36 VanDerWaalsContact C-N 3.34Å; V34-F36 PolarHBondContact O-N 2.86Å; V34-I37 PolarHBondContact O-N 3.21Å; V34-I38 HydrophobicContact CG1-CD1 4.16Å; V34-I38 WeakPolarHBondContact O-CG1 3.43Å; V34-I38 PolarHBondContact O-N 3.41Å
35V91.1Very high82.2Confident83 Ų8373.2 Ų73.250%0.50339%0.39SS..Hα-helixtrans-60.6-44.8176.6173.60000110.8A31 D32 I37 I38 V39A31-V35 WeakPolarHBondContact O-CG2 3.32Å; A31-V35 PolarHBondContact O-N 3.48Å; A31-V35 VanDerWaalsContact O-N 3.16Å; D32-V35 WeakPolarHBondContact O-CB 3.2Å; D32-V35 PolarHBondContact O-N 3.43Å; V35-I37 PolarHBondContact O-N 2.89Å; V35-I38 PolarHBondContact O-N 3.47Å; V35-V39 WeakPolarHBondContact O-CG2 3.4Å; V35-V39 PolarHBondContact O-N 3.29Å
36F91.6Very high84.2Confident16 Ų1665.9 Ų65.97%0.0736%0.355CS..Hα-helixtrans-63.8-38.3177.8-60.4-30.5000112.7D32 S33 V34 V39 C40 Y82 I86 E284 W285 A288D32-F36 HydrophobicContact CB-CE2 4.19Å; D32-F36 HydrophobicContact CB-CZ 4.42Å; D32-F36 VanDerWaalsContact O-CD2 3.31Å; D32-F36 WeakPolarHBondContact O-CD2 3.48Å; D32-F36 VanDerWaalsContact O-CG 3.27Å; D32-F36 WeakPolarHBondContact O-CG 3.47Å; D32-F36 PolarHBondContact O-N 3.34Å; S33-F36 PolarHBondContact O-N 2.99Å; V34-F36 VanDerWaalsContact C-N 3.34Å; V34-F36 PolarHBondContact O-N 2.86Å; F36-V39 WeakPolarHBondContact O-CB 3.46Å; F36-V39 PolarHBondContact O-N 3.38Å; F36-C40 PolarHBondContact O-N 2.99Å; F36-C40 PolarHBondContact O-SG 3.03Å; F36-Y82 HydrophobicContact CB-CE1 4.49Å; F36-I86 HydrophobicContact CB-CD1 3.64Å; F36-E284 HydrophobicContact CE2-CB 4.45Å; F36-W285 AromaticContact CE1-CE3 3.95Å; F36-W285 HydrophobicContact CE1-CE3 3.95Å; F36-W285 HydrophobicContact CE1-CH2 4.5Å; F36-W285 AromaticContact CE1-CZ3 3.86Å; F36-W285 HydrophobicContact CE1-CZ3 3.86Å; F36-W285 AromaticContact CZ-CD2 3.89Å; F36-W285 HydrophobicContact CZ-CD2 3.89Å; F36-W285 AromaticContact CZ-CE3 3.61Å; F36-W285 HydrophobicContact CZ-CE3 3.61Å; F36-W285 HydrophobicContact CZ-CH2 4.12Å; F36-W285 HydrophobicContact CZ-CZ2 4.37Å; F36-W285 AromaticContact CZ-CZ3 3.73Å; F36-W285 HydrophobicContact CZ-CZ3 3.73Å; F36-A288 HydrophobicContact CD1-CB 3.57Å; F36-A288 HydrophobicContact CD2-CB 4.5Å; F36-A288 HydrophobicContact CE1-CB 3.38Å; F36-A288 HydrophobicContact CE2-CB 4.35Å; F36-A288 HydrophobicContact CG-CB 4.15Å; F36-A288 HydrophobicContact CZ-CB 3.81Å
37I92.7Very high86.3Confident35 Ų3564 Ų6418%0.17935%0.346CS..Hα-helixtrans-62.5-43.4174.5-70.3165.1000110.9S33 V34 V35 V39 C40 C41 I86 L87S33-I37 VanDerWaalsContact O-CG1 3.26Å; S33-I37 WeakPolarHBondContact O-CG1 3.39Å; S33-I37 PolarHBondContact O-N 3Å; V34-I37 PolarHBondContact O-N 3.21Å; V35-I37 PolarHBondContact O-N 2.89Å; I37-V39 VanDerWaalsContact C-N 3.3Å; I37-V39 PolarHBondContact O-N 3.22Å; I37-C40 WeakPolarHBondContact O-CB 3.46Å; I37-C40 PolarHBondContact O-N 3.04Å; I37-C40 VanDerWaalsContact O-N 3.12Å; I37-C41 PolarHBondContact O-N 3.19Å; I37-C41 PolarHBondContact O-SG 3.14Å; I37-C41 VanDerWaalsContact O-SG 3.33Å; I37-I86 HydrophobicContact CD1-CG2 3.93Å; I37-I86 HydrophobicContact CG1-CB 4.46Å; I37-I86 HydrophobicContact CG1-CD1 4.21Å; I37-I86 HydrophobicContact CG1-CG2 3.99Å; I37-L87 HydrophobicContact CD1-CD2 4.16Å
38I92.9Very high88.3Confident107 Ų10760.9 Ų60.955%0.54932%0.321SS..Hα-helixtrans-59.2-44.2176.7-67.8165.5000110.6V34 V35 C40 C41 F42V34-I38 HydrophobicContact CG1-CD1 4.16Å; V34-I38 WeakPolarHBondContact O-CG1 3.43Å; V34-I38 PolarHBondContact O-N 3.41Å; V35-I38 PolarHBondContact O-N 3.47Å; I38-C40 VanDerWaalsContact C-N 3.34Å; I38-C40 PolarHBondContact O-N 2.88Å; I38-C41 WeakPolarHBondContact O-CB 3.32Å; I38-C41 PolarHBondContact O-N 2.75Å; I38-F42 PolarHBondContact O-N 3.18Å
39V92.1Very high89.8Confident41 Ų4151.4 Ų51.425%0.24829%0.287CS..Hα-helixtrans-60.6-42.9174.9170.10000111.3V35 F36 I37 F42 I43 L292V35-V39 WeakPolarHBondContact O-CG2 3.4Å; V35-V39 PolarHBondContact O-N 3.29Å; F36-V39 WeakPolarHBondContact O-CB 3.46Å; F36-V39 PolarHBondContact O-N 3.38Å; I37-V39 VanDerWaalsContact C-N 3.3Å; I37-V39 PolarHBondContact O-N 3.22Å; V39-F42 WeakPolarHBondContact O-CB 3.5Å; V39-F42 PolarHBondContact O-N 3.48Å; V39-I43 HydrophobicContact CG1-CD1 3.95Å; V39-I43 WeakPolarHBondContact O-CG1 3.44Å; V39-I43 PolarHBondContact O-N 2.79Å; V39-L292 HydrophobicContact CG1-CD2 3.38Å; V39-L292 HydrophobicContact CG1-CG 4.15Å; V39-L292 HydrophobicContact CG2-CD2 4.48Å
40C94.2Very high90.9Very high0 Ų046.2 Ų46.20%026%0.26CS..Hα-helixtrans-62.6-43.6176.7-64.70000112.3F36 I37 I38 F42 I43 I44 Y82 T83F36-C40 PolarHBondContact O-N 2.99Å; F36-C40 PolarHBondContact O-SG 3.03Å; I37-C40 WeakPolarHBondContact O-CB 3.46Å; I37-C40 PolarHBondContact O-N 3.04Å; I37-C40 VanDerWaalsContact O-N 3.12Å; I38-C40 VanDerWaalsContact C-N 3.34Å; I38-C40 PolarHBondContact O-N 2.88Å; C40-F42 VanDerWaalsContact C-N 3.25Å; C40-F42 PolarHBondContact O-N 3.28Å; C40-I43 PolarHBondContact O-N 2.86Å; C40-I44 VanDerWaalsContact O-CG1 3.25Å; C40-I44 WeakPolarHBondContact O-CG1 3.46Å; C40-I44 PolarHBondContact O-N 2.82Å; C40-Y82 WeakPolarHBondContact SG-CD1 3.31Å; C40-T83 WeakPolarHBondContact CB-OG1 3.4Å
41C94.7Very high91.6Very high59 Ų5945.6 Ų45.640%0.39926%0.259SS..Hα-helixtrans-57.5-42.5175.6-70.60000111.1I37 I38 I44 L45I37-C41 PolarHBondContact O-N 3.19Å; I37-C41 PolarHBondContact O-SG 3.14Å; I37-C41 VanDerWaalsContact O-SG 3.33Å; I38-C41 WeakPolarHBondContact O-CB 3.32Å; I38-C41 PolarHBondContact O-N 2.75Å; C41-I44 PolarHBondContact O-N 2.97Å; C41-L45 WeakPolarHBondContact O-CB 3.33Å; C41-L45 VanDerWaalsContact O-CG 3.23Å; C41-L45 WeakPolarHBondContact O-CG 3.35Å; C41-L45 PolarHBondContact O-N 3.34Å
42F93.4Very high92Very high108 Ų10844.4 Ų44.447%0.47424%0.241SC..Hα-helixtrans-61.6-48.7175.3-174.9-104.1000111.9I38 V39 C40 I44 L45 E46 A295I38-F42 PolarHBondContact O-N 3.18Å; V39-F42 WeakPolarHBondContact O-CB 3.5Å; V39-F42 PolarHBondContact O-N 3.48Å; C40-F42 VanDerWaalsContact C-N 3.25Å; C40-F42 PolarHBondContact O-N 3.28Å; F42-I44 VanDerWaalsContact C-N 3.31Å; F42-I44 PolarHBondContact O-N 3.36Å; F42-L45 PolarHBondContact O-N 3.26Å; F42-E46 HydrophobicContact CD1-CG 4.21Å; F42-E46 HydrophobicContact CD2-CG 4.43Å; F42-E46 HydrophobicContact CE1-CG 3.91Å; F42-E46 WeakPolarHBondContact CE1-OE1 3.26Å; F42-E46 WeakPolarHBondContact CE1-OE2 3.39Å; F42-E46 HydrophobicContact CE2-CG 4.12Å; F42-E46 HydrophobicContact CG-CG 4.48Å; F42-E46 HydrophobicContact CZ-CG 3.86Å; F42-E46 WeakPolarHBondContact CZ-OE1 3.5Å; F42-E46 WeakPolarHBondContact O-CG 3.44Å; F42-E46 PolarHBondContact O-N 3.12Å; F42-A295 HydrophobicContact CD1-CB 4.47Å
43I94.1Very high92.3Very high0 Ų043 Ų430%023%0.234CC..Hα-helixtrans-56.1-45.4176.4-69.4164.7000111.4V39 C40 N47 V291 A295V39-I43 HydrophobicContact CG1-CD1 3.95Å; V39-I43 WeakPolarHBondContact O-CG1 3.44Å; V39-I43 PolarHBondContact O-N 2.79Å; C40-I43 PolarHBondContact O-N 2.86Å; I43-N47 WeakPolarHBondContact O-CB 3.43Å; I43-N47 PolarHBondContact O-N 3.3Å; I43-N47 VanDerWaalsContact O-N 3.1Å; I43-N47 PolarHBondContact O-ND2 3.36Å; I43-V291 HydrophobicContact CD1-CG1 3.55Å; I43-V291 WeakPolarHBondContact CD1-O 3.08Å; I43-A295 HydrophobicContact CG1-CB 3.88Å
44I95.5Very high92.5Very high40 Ų4042.8 Ų42.821%0.20523%0.231CC..Hα-helixtrans-61.8-50.7179-67.4164.6000109.9C40 C41 F42 E46 N47 V48 V80C40-I44 VanDerWaalsContact O-CG1 3.25Å; C40-I44 WeakPolarHBondContact O-CG1 3.46Å; C40-I44 PolarHBondContact O-N 2.82Å; C41-I44 PolarHBondContact O-N 2.97Å; F42-I44 VanDerWaalsContact C-N 3.31Å; F42-I44 PolarHBondContact O-N 3.36Å; I44-E46 PolarHBondContact O-N 3.5Å; I44-N47 PolarHBondContact O-N 3.1Å; I44-V48 HydrophobicContact CG2-CG2 4.28Å; I44-V48 WeakPolarHBondContact O-CB 3.42Å; I44-V48 VanDerWaalsContact O-CG2 3.22Å; I44-V48 WeakPolarHBondContact O-CG2 3.3Å; I44-V48 PolarHBondContact O-N 3.38Å; I44-V80 HydrophobicContact CD1-CG2 3.86Å; I44-V80 HydrophobicContact CG1-CG2 4.08Å
45L93.7Very high92.5Very high119 Ų11948.6 Ų48.662%0.62325%0.246SC*.Hα-helixtrans-60.7-45.8-178.3-72.4170.3000112.4C41 F42 V48 L49C41-L45 WeakPolarHBondContact O-CB 3.33Å; C41-L45 VanDerWaalsContact O-CG 3.23Å; C41-L45 WeakPolarHBondContact O-CG 3.35Å; C41-L45 PolarHBondContact O-N 3.34Å; F42-L45 PolarHBondContact O-N 3.26Å; L45-V48 PolarHBondContact O-N 3.27Å; L45-L49 WeakPolarHBondContact O-CB 3.05Å; L45-L49 PolarHBondContact O-N 3.34Å
46E92.5Very high92.3Very high23 Ų2350.8 Ų50.811%0.10725%0.246CC..Hα-helixtrans-62.9-45.1179.5-71.3-168.8130.900112.1F42 I44 L49 V50 P298F42-E46 HydrophobicContact CD1-CG 4.21Å; F42-E46 HydrophobicContact CD2-CG 4.43Å; F42-E46 HydrophobicContact CE1-CG 3.91Å; F42-E46 WeakPolarHBondContact CE1-OE1 3.26Å; F42-E46 WeakPolarHBondContact CE1-OE2 3.39Å; F42-E46 HydrophobicContact CE2-CG 4.12Å; F42-E46 HydrophobicContact CG-CG 4.48Å; F42-E46 HydrophobicContact CZ-CG 3.86Å; F42-E46 WeakPolarHBondContact CZ-OE1 3.5Å; F42-E46 WeakPolarHBondContact O-CG 3.44Å; F42-E46 PolarHBondContact O-N 3.12Å; I44-E46 PolarHBondContact O-N 3.5Å; E46-L49 WeakPolarHBondContact O-CB 3.35Å; E46-L49 PolarHBondContact O-N 3.23Å; E46-V50 WeakPolarHBondContact O-CG2 3.46Å; E46-V50 PolarHBondContact O-N 3.33Å; E46-P298 HydrophobicContact CB-CB 4.48Å; E46-P298 HydrophobicContact CB-CG 4.11Å
47N93.8Very high92.1Very high0 Ų051.7 Ų51.70%025%0.253CS..Hα-helixtrans-72.5-34-179.1-76.3-70.7000112.5I43 I44 L49 V50 L51 A72 L76 S294I43-N47 WeakPolarHBondContact O-CB 3.43Å; I43-N47 PolarHBondContact O-N 3.3Å; I43-N47 VanDerWaalsContact O-N 3.1Å; I43-N47 PolarHBondContact O-ND2 3.36Å; I44-N47 PolarHBondContact O-N 3.1Å; N47-L49 VanDerWaalsContact C-N 3.3Å; N47-L49 PolarHBondContact O-N 3Å; N47-V50 PolarHBondContact O-N 2.89Å; N47-L51 WeakPolarHBondContact O-CG 3.43Å; N47-L51 PolarHBondContact O-N 3.02Å; N47-A72 HydrophobicContact CB-CB 4.43Å; N47-A72 WeakPolarHBondContact CB-O 3.3Å; N47-A72 WeakPolarHBondContact OD1-CA 3.21Å; N47-L76 HydrophobicContact CB-CB 3.96Å; N47-S294 PolarHBondContact ND2-O 3.01Å
48V94.7Very high91.6Very high54 Ų5458.9 Ų58.933%0.32728%0.283SS..Hα-helixtrans-58-45167.6167.50000110.4I44 L45 V50 L51 L52 L76I44-V48 HydrophobicContact CG2-CG2 4.28Å; I44-V48 WeakPolarHBondContact O-CB 3.42Å; I44-V48 VanDerWaalsContact O-CG2 3.22Å; I44-V48 WeakPolarHBondContact O-CG2 3.3Å; I44-V48 PolarHBondContact O-N 3.38Å; L45-V48 PolarHBondContact O-N 3.27Å; V48-V50 VanDerWaalsContact C-N 3.34Å; V48-V50 PolarHBondContact O-N 2.89Å; V48-L51 PolarHBondContact O-N 2.9Å; V48-L52 HydrophobicContact CG1-CD1 3.82Å; V48-L52 HydrophobicContact CG1-CG 4.19Å; V48-L52 WeakPolarHBondContact O-CB 3.22Å; V48-L52 WeakPolarHBondContact O-CG 3.4Å; V48-L52 PolarHBondContact O-N 3.27Å; V48-L76 HydrophobicContact CB-CD1 4.48Å; V48-L76 HydrophobicContact CG2-CD1 3.43Å; V48-L76 VanDerWaalsContact CG2-CD1 3.43Å; V48-L76 HydrophobicContact CG2-CG 4.42Å
49L91.8Very high91Very high23 Ų2359.4 Ų59.412%0.1228%0.281CS..Hα-helixtrans-65.3-36.2-179.5-175.856.2000112.5L45 E46 N47 T53 F312 T315 L316L45-L49 WeakPolarHBondContact O-CB 3.05Å; L45-L49 PolarHBondContact O-N 3.34Å; E46-L49 WeakPolarHBondContact O-CB 3.35Å; E46-L49 PolarHBondContact O-N 3.23Å; N47-L49 VanDerWaalsContact C-N 3.3Å; N47-L49 PolarHBondContact O-N 3Å; L49-T53 VanDerWaalsContact O-CB 3.31Å; L49-T53 WeakPolarHBondContact O-CB 3.39Å; L49-T53 PolarHBondContact O-N 3.49Å; L49-T53 PolarHBondContact O-OG1 3.06Å; L49-F312 HydrophobicContact CB-CE2 3.99Å; L49-F312 HydrophobicContact CB-CZ 4.28Å; L49-F312 HydrophobicContact CD2-CD1 4.12Å; L49-F312 HydrophobicContact CD2-CD2 4.17Å; L49-F312 HydrophobicContact CD2-CE1 3.47Å; L49-F312 VanDerWaalsContact CD2-CE1 3.47Å; L49-F312 HydrophobicContact CD2-CE2 3.54Å; L49-F312 HydrophobicContact CD2-CG 4.45Å; L49-F312 HydrophobicContact CD2-CZ 3.16Å; L49-F312 HydrophobicContact CG-CD2 3.92Å; L49-F312 HydrophobicContact CG-CE1 4.28Å; L49-F312 HydrophobicContact CG-CE2 3.47Å; L49-F312 VanDerWaalsContact CG-CE2 3.47Å; L49-F312 HydrophobicContact CG-CZ 3.7Å; L49-T315 HydrophobicContact CD1-CG2 3.51Å; L49-L316 HydrophobicContact CD2-CD1 4.06Å
50V91.2Very high90.6Very high3 Ų357.7 Ų57.72%0.01827%0.27CS..Hα-helixtrans-61.9-49.6171.61730000110.8E46 N47 V48 L52 T53 I54 I68 A72 P298 F312E46-V50 WeakPolarHBondContact O-CG2 3.46Å; E46-V50 PolarHBondContact O-N 3.33Å; N47-V50 PolarHBondContact O-N 2.89Å; V48-V50 VanDerWaalsContact C-N 3.34Å; V48-V50 PolarHBondContact O-N 2.89Å; V50-L52 PolarHBondContact O-N 2.73Å; V50-T53 PolarHBondContact O-N 2.95Å; V50-I54 HydrophobicContact CG1-CD1 3.98Å; V50-I54 WeakPolarHBondContact O-CG1 3.42Å; V50-I54 PolarHBondContact O-N 2.84Å; V50-I68 HydrophobicContact CG1-CG2 4.34Å; V50-A72 HydrophobicContact CB-CB 4.15Å; V50-A72 HydrophobicContact CG1-CB 3.82Å; V50-P298 HydrophobicContact CG2-CB 3.92Å; V50-P298 HydrophobicContact CG2-CG 3.99Å; V50-F312 HydrophobicContact CG2-CE2 4.14Å
51L92.9Very high90.1Very high51 Ų5161.7 Ų61.727%0.26729%0.288SS..Hα-helixtrans-59.3-46.6178.3-70.8172.5000111.9N47 V48 T53 I54 W55 G69 A72 L76N47-L51 WeakPolarHBondContact O-CG 3.43Å; N47-L51 PolarHBondContact O-N 3.02Å; V48-L51 PolarHBondContact O-N 2.9Å; L51-T53 VanDerWaalsContact C-N 3.3Å; L51-T53 PolarHBondContact O-N 3.49Å; L51-I54 PolarHBondContact O-N 3.35Å; L51-W55 WeakPolarHBondContact O-CB 3.47Å; L51-W55 PolarHBondContact O-N 3.38Å; L51-G69 WeakPolarHBondContact CD2-O 3.37Å; L51-A72 HydrophobicContact CD2-CB 4.12Å; L51-A72 HydrophobicContact CG-CB 4.08Å; L51-L76 HydrophobicContact CD1-CD1 3.87Å
52L91.6Very high89.4Confident55 Ų5563.2 Ų63.229%0.28829%0.289SS..Hα-helixtrans-60.2-39.6176.3-73.2175.1000112.2V48 V50 W55 R56 T315V48-L52 HydrophobicContact CG1-CD1 3.82Å; V48-L52 HydrophobicContact CG1-CG 4.19Å; V48-L52 WeakPolarHBondContact O-CB 3.22Å; V48-L52 WeakPolarHBondContact O-CG 3.4Å; V48-L52 PolarHBondContact O-N 3.27Å; V50-L52 PolarHBondContact O-N 2.73Å; L52-W55 HydrophobicContact CD2-CE3 4.36Å; L52-W55 PolarHBondContact O-N 3Å; L52-R56 WeakPolarHBondContact O-CB 3.3Å; L52-R56 WeakPolarHBondContact O-CG 3.44Å; L52-R56 PolarHBondContact O-N 3.27Å; L52-T315 HydrophobicContact CB-CG2 4.2Å
53T89.3Confident88.6Confident2 Ų259 Ų591%0.01227%0.272CS..Hα-helixtrans-66.5-41.1179.5-62.90000111.6L49 V50 L51 T57 F60 A311 T315L49-T53 VanDerWaalsContact O-CB 3.31Å; L49-T53 WeakPolarHBondContact O-CB 3.39Å; L49-T53 PolarHBondContact O-N 3.49Å; L49-T53 PolarHBondContact O-OG1 3.06Å; V50-T53 PolarHBondContact O-N 2.95Å; L51-T53 VanDerWaalsContact C-N 3.3Å; L51-T53 PolarHBondContact O-N 3.49Å; T53-T57 WeakPolarHBondContact O-CB 3.36Å; T53-T57 PolarHBondContact O-N 2.7Å; T53-T57 PolarHBondContact O-OG1 3.39Å; T53-F60 HydrophobicContact CG2-CD2 4.49Å; T53-F60 HydrophobicContact CG2-CE2 4.06Å; T53-A311 HydrophobicContact CG2-CB 3.55Å; T53-T315 WeakPolarHBondContact OG1-CB 3.47Å; T53-T315 PolarHBondContact OG1-OG1 3.4Å
54I89.7Confident87.9Confident15 Ų1560.8 Ų60.88%0.07728%0.281CS..Hα-helixtrans-64.8-47.7175.1-66167.2000109.9V50 L51 R56 T57 I68V50-I54 HydrophobicContact CG1-CD1 3.98Å; V50-I54 WeakPolarHBondContact O-CG1 3.42Å; V50-I54 PolarHBondContact O-N 2.84Å; L51-I54 PolarHBondContact O-N 3.35Å; I54-R56 PolarHBondContact O-N 3.45Å; I54-T57 PolarHBondContact O-N 3.05Å; I54-I68 HydrophobicContact CD1-CG2 4.15Å
55W89.3Confident87.3Confident186 Ų18660.1 Ų60.171%0.70528%0.276SS*.Hα-helixtrans-62.1-43-178.1-17860.2000113.3L51 L52L51-W55 WeakPolarHBondContact O-CB 3.47Å; L51-W55 PolarHBondContact O-N 3.38Å; L52-W55 HydrophobicContact CD2-CE3 4.36Å; L52-W55 PolarHBondContact O-N 3Å
56R87.6Confident87Confident129 Ų12957.4 Ų57.449%0.48726%0.258SS..Hα-helixtrans-75.8-24.3-179.4-72-174.5175.9173.50.6113.8L52 I54L52-R56 WeakPolarHBondContact O-CB 3.3Å; L52-R56 WeakPolarHBondContact O-CG 3.44Å; L52-R56 PolarHBondContact O-N 3.27Å; I54-R56 PolarHBondContact O-N 3.45Å
57T85.6Confident86.7Confident36 Ų3656.9 Ų56.922%0.22126%0.255CS..  trans-99.599-170.5-53.90000110.9T53 I54 K59 F60T53-T57 WeakPolarHBondContact O-CB 3.36Å; T53-T57 PolarHBondContact O-N 2.7Å; T53-T57 PolarHBondContact O-OG1 3.39Å; I54-T57 PolarHBondContact O-N 3.05Å; T57-K59 HydrophobicContact CG2-CB 4.12Å; T57-K59 PolarHBondContact O-N 2.92Å; T57-F60 HydrophobicContact CG2-CD1 4.24Å; T57-F60 HydrophobicContact CG2-CD2 3.78Å; T57-F60 HydrophobicContact CG2-CE1 4.4Å; T57-F60 HydrophobicContact CG2-CE2 3.95Å; T57-F60 HydrophobicContact CG2-CG 3.93Å; T57-F60 HydrophobicContact CG2-CZ 4.25Å; T57-F60 WeakPolarHBondContact O-CB 3.47Å; T57-F60 PolarHBondContact O-N 2.93Å
58K83.9Confident86.4Confident186 Ų18657.2 Ų57.281%0.80926%0.257SS*.G310 helixtrans-51.5-33.1179.9-68.5-171.1179.7-176.20114.3F60 H61K58-F60 PolarHBondContact O-N 3.07Å; K58-H61 PolarHBondContact O-N 3.01Å; K58-H61 PolarHBondContact O-ND1 3.24Å
59K80.4Confident86.2Confident118 Ų11855.1 Ų55.151%0.51325%0.246SC..G310 helixtrans-62.1-22.5177.4-174.6176.2171.5-175.80113.3T57 E307T57-K59 HydrophobicContact CG2-CB 4.12Å; T57-K59 PolarHBondContact O-N 2.92Å; K59-E307 VanDerWaalsContact CE-OE2 3.29Å; K59-E307 WeakPolarHBondContact CE-OE2 3.48Å; K59-E307 IonicContact NZ-OE1 2.72Å; K59-E307 PolarHBondContact NZ-OE1 3.43Å; K59-E307 IonicContact NZ-OE2 3.1Å; K59-E307 PolarHBondContact NZ-OE2 3.42Å; K59-E307 VanDerWaalsContact NZ-OE2 3.1Å
60F82.3Confident86.2Confident4 Ų454.5 Ų54.52%0.01824%0.243CC..G310 helixtrans-92.44-179.8-62.1-18000113.6T53 T57 K58 K62 Y65 E307 A311T53-F60 HydrophobicContact CG2-CD2 4.49Å; T53-F60 HydrophobicContact CG2-CE2 4.06Å; T57-F60 HydrophobicContact CG2-CD1 4.24Å; T57-F60 HydrophobicContact CG2-CD2 3.78Å; T57-F60 HydrophobicContact CG2-CE1 4.4Å; T57-F60 HydrophobicContact CG2-CE2 3.95Å; T57-F60 HydrophobicContact CG2-CG 3.93Å; T57-F60 HydrophobicContact CG2-CZ 4.25Å; T57-F60 WeakPolarHBondContact O-CB 3.47Å; T57-F60 PolarHBondContact O-N 2.93Å; K58-F60 PolarHBondContact O-N 3.07Å; F60-K62 PolarHBondContact O-N 3.48Å; F60-Y65 HydrophobicContact CB-CD1 3.98Å; F60-Y65 HydrophobicContact CB-CD2 4.02Å; F60-Y65 HydrophobicContact CB-CE1 4.3Å; F60-Y65 HydrophobicContact CB-CE2 4.36Å; F60-Y65 HydrophobicContact CB-CG 3.83Å; F60-Y65 HydrophobicContact CD1-CD1 4.08Å; F60-Y65 HydrophobicContact CD1-CD2 4.29Å; F60-Y65 AromaticContact CD1-CE1 3.5Å; F60-Y65 HydrophobicContact CD1-CE1 3.5Å; F60-Y65 AromaticContact CD1-CE2 3.77Å; F60-Y65 HydrophobicContact CD1-CE2 3.77Å; F60-Y65 HydrophobicContact CD1-CG 4.44Å; F60-Y65 AromaticContact CD1-CZ 3.33Å; F60-Y65 HydrophobicContact CD2-CE1 4.43Å; F60-Y65 AromaticContact CE1-CE1 3.86Å; F60-Y65 HydrophobicContact CE1-CE1 3.86Å; F60-Y65 AromaticContact CE1-CZ 3.74Å; F60-Y65 WeakPolarHBondContact CE1-OH 3.44Å; F60-Y65 AromaticContact CG-CD1 3.96Å; F60-Y65 HydrophobicContact CG-CD1 3.96Å; F60-Y65 HydrophobicContact CG-CD2 4.47Å; F60-Y65 AromaticContact CG-CE1 3.84Å; F60-Y65 HydrophobicContact CG-CE1 3.84Å; F60-Y65 HydrophobicContact CG-CE2 4.38Å; F60-Y65 HydrophobicContact CG-CG 4.28Å; F60-Y65 HydrophobicContact CZ-CE1 4.46Å; F60-Y65 WeakPolarHBondContact O-CB 3.46Å; F60-Y65 VanDerWaalsContact O-CD2 3.31Å; F60-Y65 WeakPolarHBondContact O-CD2 3.23Å; F60-E307 HydrophobicContact CE1-CB 4.48Å; F60-A311 HydrophobicContact CE2-CB 3.5Å; F60-A311 HydrophobicContact CZ-CB 3.77Å
61H83.4Confident86.3Confident84 Ų8454.3 Ų54.339%0.38924%0.242SC..  trans-78.563170.4-64.1123000111.8K58K58-H61 PolarHBondContact O-N 3.01Å; K58-H61 PolarHBondContact O-ND1 3.24Å
62K79.9Confident86.3Confident92 Ų9251.9 Ų51.940%0.423%0.229SC..SBendtrans-127.6152.6174.2-56.3-172175.7-168.30110.1F60 M64 Y65 Y66F60-K62 PolarHBondContact O-N 3.48Å; K62-M64 VanDerWaalsContact C-N 3.3Å; K62-M64 PolarHBondContact O-N 3.03Å; K62-M64 VanDerWaalsContact O-N 3.08Å; K62-Y65 HydrophobicContact CB-CD2 4Å; K62-Y65 HydrophobicContact CB-CE2 4.48Å; K62-Y65 PolarHBondContact O-N 3.43Å; K62-Y66 PolarHBondContact O-N 3.33Å
63P78.3Confident86.5Confident19 Ų1952.6 Ų52.612%0.12323%0.233CC..Hα-helixtrans-38-52.6-179.4-38.239.6000115.8Y65 Y66 F67 V144P63-Y65 VanDerWaalsContact C-N 3.3Å; P63-Y65 PolarHBondContact O-N 3.21Å; P63-Y66 WeakPolarHBondContact O-CB 3.21Å; P63-Y66 PolarHBondContact O-N 2.82Å; P63-Y66 VanDerWaalsContact O-N 3.1Å; P63-F67 WeakPolarHBondContact O-CD2 3.44Å; P63-F67 PolarHBondContact O-N 2.93Å; P63-V144 HydrophobicContact CB-CG2 3.69Å; P63-V144 HydrophobicContact CG-CG2 4.25Å
64M78.6Confident86.7Confident38 Ų3852.5 Ų52.519%0.18723%0.232CC..Hα-helixtrans-58.6-35.9-178.4-166.6-167.5108.500114K62 F67 I68 R126K62-M64 VanDerWaalsContact C-N 3.3Å; K62-M64 PolarHBondContact O-N 3.03Å; K62-M64 VanDerWaalsContact O-N 3.08Å; M64-F67 PolarHBondContact O-N 3.37Å; M64-I68 HydrophobicContact CE-CD1 3.78Å; M64-I68 WeakPolarHBondContact O-CG1 3.5Å; M64-I68 PolarHBondContact O-N 3.02Å; M64-R126 VanDerWaalsContact CE-CZ 3.45Å; M64-R126 PolarHBondContact SD-NH1 3.46Å; M64-R126 PolarHBondContact SD-NH2 3.17Å
65Y84Confident87Confident25 Ų2551.8 Ų51.810%0.09823%0.228CC..Hα-helixtrans-79.3-24.4-180-66.8-77.7000112.2F60 K62 P63 F67 I68 G69 M308F60-Y65 HydrophobicContact CB-CD1 3.98Å; F60-Y65 HydrophobicContact CB-CD2 4.02Å; F60-Y65 HydrophobicContact CB-CE1 4.3Å; F60-Y65 HydrophobicContact CB-CE2 4.36Å; F60-Y65 HydrophobicContact CB-CG 3.83Å; F60-Y65 HydrophobicContact CD1-CD1 4.08Å; F60-Y65 HydrophobicContact CD1-CD2 4.29Å; F60-Y65 AromaticContact CD1-CE1 3.5Å; F60-Y65 HydrophobicContact CD1-CE1 3.5Å; F60-Y65 AromaticContact CD1-CE2 3.77Å; F60-Y65 HydrophobicContact CD1-CE2 3.77Å; F60-Y65 HydrophobicContact CD1-CG 4.44Å; F60-Y65 AromaticContact CD1-CZ 3.33Å; F60-Y65 HydrophobicContact CD2-CE1 4.43Å; F60-Y65 AromaticContact CE1-CE1 3.86Å; F60-Y65 HydrophobicContact CE1-CE1 3.86Å; F60-Y65 AromaticContact CE1-CZ 3.74Å; F60-Y65 WeakPolarHBondContact CE1-OH 3.44Å; F60-Y65 AromaticContact CG-CD1 3.96Å; F60-Y65 HydrophobicContact CG-CD1 3.96Å; F60-Y65 HydrophobicContact CG-CD2 4.47Å; F60-Y65 AromaticContact CG-CE1 3.84Å; F60-Y65 HydrophobicContact CG-CE1 3.84Å; F60-Y65 HydrophobicContact CG-CE2 4.38Å; F60-Y65 HydrophobicContact CG-CG 4.28Å; F60-Y65 HydrophobicContact CZ-CE1 4.46Å; F60-Y65 WeakPolarHBondContact O-CB 3.46Å; F60-Y65 VanDerWaalsContact O-CD2 3.31Å; F60-Y65 WeakPolarHBondContact O-CD2 3.23Å; K62-Y65 HydrophobicContact CB-CD2 4Å; K62-Y65 HydrophobicContact CB-CE2 4.48Å; K62-Y65 PolarHBondContact O-N 3.43Å; P63-Y65 VanDerWaalsContact C-N 3.3Å; P63-Y65 PolarHBondContact O-N 3.21Å; Y65-F67 VanDerWaalsContact C-N 3.33Å; Y65-I68 HydrophobicContact CD1-CD1 4.28Å; Y65-I68 PolarHBondContact O-N 2.9Å; Y65-G69 PolarHBondContact O-N 3.2Å; Y65-M308 HydrophobicContact CD1-CE 4.32Å; Y65-M308 HydrophobicContact CE1-CE 4.18Å
66Y87Confident87.3Confident62 Ų6244.2 Ų44.224%0.24320%0.202CC..Hα-helixtrans-67-36170.5-66.9-60.7000111.5K62 P63 G69 N70 T141K62-Y66 PolarHBondContact O-N 3.33Å; P63-Y66 WeakPolarHBondContact O-CB 3.21Å; P63-Y66 PolarHBondContact O-N 2.82Å; P63-Y66 VanDerWaalsContact O-N 3.1Å; Y66-G69 PolarHBondContact O-N 2.77Å; Y66-N70 WeakPolarHBondContact O-CB 3.41Å; Y66-N70 PolarHBondContact O-N 3.33Å; Y66-T141 HydrophobicContact CE2-CG2 4.1Å
67F84.9Confident87.6Confident13 Ų1341 Ų416%0.05719%0.194CC..Hα-helixtrans-65.3-40.7171.1-73.7-68.5000112.6P63 M64 Y65 G69 N70 L71 A121 I122 E125 V144 L147 I148P63-F67 WeakPolarHBondContact O-CD2 3.44Å; P63-F67 PolarHBondContact O-N 2.93Å; M64-F67 PolarHBondContact O-N 3.37Å; Y65-F67 VanDerWaalsContact C-N 3.33Å; F67-G69 VanDerWaalsContact C-N 3.33Å; F67-N70 PolarHBondContact O-N 3.27Å; F67-L71 PolarHBondContact O-N 3.34Å; F67-A121 HydrophobicContact CD1-CB 4.25Å; F67-A121 HydrophobicContact CE1-CB 4.11Å; F67-I122 HydrophobicContact CB-CD1 4.33Å; F67-I122 HydrophobicContact CB-CG1 3.76Å; F67-E125 WeakPolarHBondContact CD2-OE2 3.24Å; F67-V144 HydrophobicContact CD2-CG1 4.16Å; F67-V144 HydrophobicContact CE1-CG1 4.34Å; F67-V144 HydrophobicContact CE2-CB 4.47Å; F67-V144 HydrophobicContact CE2-CG1 3.81Å; F67-V144 HydrophobicContact CE2-CG2 4.13Å; F67-V144 HydrophobicContact CZ-CB 4.49Å; F67-V144 HydrophobicContact CZ-CG1 3.9Å; F67-V144 HydrophobicContact CZ-CG2 4.5Å; F67-L147 HydrophobicContact CE1-CB 4.24Å; F67-L147 HydrophobicContact CZ-CB 4.3Å; F67-L147 HydrophobicContact CZ-CD1 3.89Å; F67-I148 HydrophobicContact CD1-CG1 4.46Å; F67-I148 HydrophobicContact CE1-CG1 4.42Å
68I87.3Confident88Confident6 Ų639.8 Ų39.83%0.03119%0.187CC..Hα-helixtrans-64.1-40.7174.6-65.5169.8000110.7V50 I54 M64 Y65 L71 A72 Y301 M308V50-I68 HydrophobicContact CG1-CG2 4.34Å; I54-I68 HydrophobicContact CD1-CG2 4.15Å; M64-I68 HydrophobicContact CE-CD1 3.78Å; M64-I68 WeakPolarHBondContact O-CG1 3.5Å; M64-I68 PolarHBondContact O-N 3.02Å; Y65-I68 HydrophobicContact CD1-CD1 4.28Å; Y65-I68 PolarHBondContact O-N 2.9Å; I68-L71 PolarHBondContact O-N 3.47Å; I68-A72 WeakPolarHBondContact O-CB 3.23Å; I68-A72 PolarHBondContact O-N 3.26Å; I68-Y301 HydrophobicContact CG2-CD2 3.99Å; I68-Y301 HydrophobicContact CG2-CE1 4.47Å; I68-Y301 HydrophobicContact CG2-CE2 3.59Å; I68-M308 HydrophobicContact CD1-CE 3.94Å; I68-M308 HydrophobicContact CG2-CE 4.18Å
69G91.4Very high88.5Confident10 Ų1030.9 Ų30.910%0.10315%0.149CC..Hα-helixtrans-62.5-42.2173.800000112.3L51 Y65 Y66 F67 L71 A72 L73L51-G69 WeakPolarHBondContact CD2-O 3.37Å; Y65-G69 PolarHBondContact O-N 3.2Å; Y66-G69 PolarHBondContact O-N 2.77Å; F67-G69 VanDerWaalsContact C-N 3.33Å; G69-L71 VanDerWaalsContact C-N 3.34Å; G69-L71 PolarHBondContact O-N 3.46Å; G69-A72 PolarHBondContact O-N 2.98Å; G69-L73 WeakPolarHBondContact O-CB 3.5Å; G69-L73 PolarHBondContact O-N 3.48Å
70N92.7Very high89.2Confident10 Ų1028.4 Ų28.45%0.05314%0.143CC..Hα-helixtrans-62-42.2175.5-168.661.7000112.3Y66 F67 L73 S74 S118 I148 W152Y66-N70 WeakPolarHBondContact O-CB 3.41Å; Y66-N70 PolarHBondContact O-N 3.33Å; F67-N70 PolarHBondContact O-N 3.27Å; N70-L73 WeakPolarHBondContact O-CB 3.28Å; N70-L73 PolarHBondContact O-N 2.97Å; N70-S74 PolarHBondContact O-N 3.15Å; N70-S74 PolarHBondContact O-OG 2.88Å; N70-S118 PolarHBondContact ND2-OG 3.17Å; N70-I148 HydrophobicContact CB-CD1 4.1Å; N70-I148 HydrophobicContact CB-CG1 4.15Å; N70-I148 HydrophobicContact CB-CG2 4.5Å; N70-I148 VanDerWaalsContact OD1-CG2 3.26Å; N70-I148 WeakPolarHBondContact OD1-CG2 3.29Å; N70-W152 PolarHBondContact OD1-NE1 2.89Å
71L91.6Very high89.8Confident0 Ų029.5 Ų29.50%015%0.15CC..Hα-helixtrans-62.6-47.2176.1-179.451.9000111.2F67 I68 G69 L73 S74 D75 S115 L119 I122 Y301F67-L71 PolarHBondContact O-N 3.34Å; I68-L71 PolarHBondContact O-N 3.47Å; G69-L71 VanDerWaalsContact C-N 3.34Å; G69-L71 PolarHBondContact O-N 3.46Å; L71-L73 VanDerWaalsContact C-N 3.28Å; L71-L73 PolarHBondContact O-N 3.5Å; L71-S74 WeakPolarHBondContact CA-OG 3.26Å; L71-S74 PolarHBondContact O-N 3.34Å; L71-S74 VanDerWaalsContact O-N 3.15Å; L71-S74 PolarHBondContact O-OG 2.94Å; L71-D75 PolarHBondContact O-N 3.36Å; L71-S115 VanDerWaalsContact CD1-OG 3.27Å; L71-S115 WeakPolarHBondContact CD1-OG 3.34Å; L71-L119 HydrophobicContact CD1-CD2 4.41Å; L71-L119 HydrophobicContact CD1-CG 4.06Å; L71-L119 HydrophobicContact CD2-CD2 3.46Å; L71-L119 VanDerWaalsContact CD2-CD2 3.46Å; L71-L119 HydrophobicContact CD2-CG 3.94Å; L71-I122 HydrophobicContact CB-CD1 4.19Å; L71-I122 HydrophobicContact CD2-CD1 3.55Å; L71-Y301 WeakPolarHBondContact CD2-OH 3.48Å
72A93.4Very high90.2Very high0 Ų025.9 Ų25.90%013%0.133CC..Hα-helixtrans-60-36.8174.700000112.5N47 V50 L51 I68 G69 L76N47-A72 HydrophobicContact CB-CB 4.43Å; N47-A72 WeakPolarHBondContact CB-O 3.3Å; N47-A72 WeakPolarHBondContact OD1-CA 3.21Å; V50-A72 HydrophobicContact CB-CB 4.15Å; V50-A72 HydrophobicContact CG1-CB 3.82Å; L51-A72 HydrophobicContact CD2-CB 4.12Å; L51-A72 HydrophobicContact CG-CB 4.08Å; I68-A72 WeakPolarHBondContact O-CB 3.23Å; I68-A72 PolarHBondContact O-N 3.26Å; G69-A72 PolarHBondContact O-N 2.98Å; A72-L76 VanDerWaalsContact O-CB 3.23Å; A72-L76 WeakPolarHBondContact O-CB 3.25Å; A72-L76 PolarHBondContact O-N 3.21Å
73L95.1Very high90.9Very high69 Ų6922.7 Ų22.736%0.36112%0.122SC..Hα-helixtrans-65.4-44.5174.5178.662.9000111.9G69 N70 L71 D75 L76 L77 W152G69-L73 WeakPolarHBondContact O-CB 3.5Å; G69-L73 PolarHBondContact O-N 3.48Å; N70-L73 WeakPolarHBondContact O-CB 3.28Å; N70-L73 PolarHBondContact O-N 2.97Å; L71-L73 VanDerWaalsContact C-N 3.28Å; L71-L73 PolarHBondContact O-N 3.5Å; L73-D75 VanDerWaalsContact C-N 3.35Å; L73-L76 PolarHBondContact O-N 3.23Å; L73-L77 HydrophobicContact CD1-CD1 4.24Å; L73-L77 HydrophobicContact CD1-CG 4.46Å; L73-L77 HydrophobicContact CG-CD1 4.2Å; L73-L77 WeakPolarHBondContact O-CB 3.48Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 2.94Å; L73-W152 HydrophobicContact CD2-CZ2 4.15Å; L73-W152 HydrophobicContact CG-CZ2 4.27Å
74S94.8Very high91.6Very high0 Ų023.8 Ų23.80%013%0.132CC..Hα-helixtrans-64.4-38.4176.855.40000112.7N70 L71 L77 A78 S115N70-S74 PolarHBondContact O-N 3.15Å; N70-S74 PolarHBondContact O-OG 2.88Å; L71-S74 WeakPolarHBondContact CA-OG 3.26Å; L71-S74 PolarHBondContact O-N 3.34Å; L71-S74 VanDerWaalsContact O-N 3.15Å; L71-S74 PolarHBondContact O-OG 2.94Å; S74-L77 PolarHBondContact O-N 2.86Å; S74-A78 PolarHBondContact O-N 3.38Å; S74-S115 WeakPolarHBondContact OG-CA 3.36Å
75D94.8Very high92.2Very high0 Ų022.8 Ų22.80%013%0.127CC..Hα-helixtrans-71.3-38.4177.7-73.2-29.8000112.2L71 L73 L77 A78 G79 S115 S294 N297L71-D75 PolarHBondContact O-N 3.36Å; L73-D75 VanDerWaalsContact C-N 3.35Å; D75-L77 VanDerWaalsContact C-N 3.35Å; D75-A78 WeakPolarHBondContact O-CB 3.31Å; D75-A78 PolarHBondContact O-N 2.84Å; D75-G79 PolarHBondContact O-N 2.97Å; D75-S115 PolarHBondContact OD1-OG 2.7Å; D75-S294 WeakPolarHBondContact OD1-CB 3.27Å; D75-S294 PolarHBondContact OD1-OG 3.48Å; D75-N297 PolarHBondContact OD2-ND2 3.2Å
76L95.6Very high92.5Very high28 Ų2822.4 Ų22.415%0.14713%0.127CC..Hα-helixtrans-58.5-48.7170.8179.9160.4000110.5N47 V48 L51 A72 L73 A78 G79 V80N47-L76 HydrophobicContact CB-CB 3.96Å; V48-L76 HydrophobicContact CB-CD1 4.48Å; V48-L76 HydrophobicContact CG2-CD1 3.43Å; V48-L76 VanDerWaalsContact CG2-CD1 3.43Å; V48-L76 HydrophobicContact CG2-CG 4.42Å; L51-L76 HydrophobicContact CD1-CD1 3.87Å; A72-L76 VanDerWaalsContact O-CB 3.23Å; A72-L76 WeakPolarHBondContact O-CB 3.25Å; A72-L76 PolarHBondContact O-N 3.21Å; L73-L76 PolarHBondContact O-N 3.23Å; L76-A78 VanDerWaalsContact C-N 3.32Å; L76-A78 PolarHBondContact O-N 2.67Å; L76-G79 PolarHBondContact O-N 3.36Å; L76-V80 HydrophobicContact CD2-CG2 4.07Å; L76-V80 WeakPolarHBondContact O-CG2 3.34Å; L76-V80 PolarHBondContact O-N 3.47Å
77L95Very high92.6Very high61 Ų6124 Ų2432%0.31914%0.139SC..Hα-helixtrans-63.6-38.6178-74.5168.7000111.5L73 S74 D75 G79 V80 V81 W152L73-L77 HydrophobicContact CD1-CD1 4.24Å; L73-L77 HydrophobicContact CD1-CG 4.46Å; L73-L77 HydrophobicContact CG-CD1 4.2Å; L73-L77 WeakPolarHBondContact O-CB 3.48Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 2.94Å; S74-L77 PolarHBondContact O-N 2.86Å; D75-L77 VanDerWaalsContact C-N 3.35Å; L77-G79 VanDerWaalsContact C-N 3.33Å; L77-G79 PolarHBondContact O-N 3.38Å; L77-V80 PolarHBondContact O-N 3.27Å; L77-V81 WeakPolarHBondContact O-CB 3.29Å; L77-V81 WeakPolarHBondContact O-CG2 3.34Å; L77-V81 PolarHBondContact O-N 3.5Å; L77-W152 HydrophobicContact CD1-CH2 3.51Å; L77-W152 HydrophobicContact CD1-CZ2 4.36Å; L77-W152 HydrophobicContact CD1-CZ3 4.13Å
78A93.8Very high92.7Very high10 Ų1026.7 Ų26.78%0.08315%0.154CC..Hα-helixtrans-58-44.7173.300000111.6S74 D75 L76 Y82 A111S74-A78 PolarHBondContact O-N 3.38Å; D75-A78 WeakPolarHBondContact O-CB 3.31Å; D75-A78 PolarHBondContact O-N 2.84Å; L76-A78 VanDerWaalsContact C-N 3.32Å; L76-A78 PolarHBondContact O-N 2.67Å; A78-Y82 WeakPolarHBondContact O-CB 3.29Å; A78-Y82 PolarHBondContact O-N 3.23Å; A78-A111 HydrophobicContact CB-CB 3.9Å
79G94.4Very high92.7Very high0 Ų027.9 Ų27.90%016%0.163CC..Hα-helixtrans-62.5-43.6175.600000113.3D75 L76 L77 T83D75-G79 PolarHBondContact O-N 2.97Å; L76-G79 PolarHBondContact O-N 3.36Å; L77-G79 VanDerWaalsContact C-N 3.33Å; L77-G79 PolarHBondContact O-N 3.38Å; G79-T83 WeakPolarHBondContact O-CB 3.4Å; G79-T83 PolarHBondContact O-N 3.47Å; G79-T83 PolarHBondContact O-OG1 3.45Å
80V95.1Very high92.2Very high66 Ų6628.7 Ų28.740%0.417%0.17SC..Hα-helixtrans-64.3-49.2177.61720000111.2I44 L76 L77 Y82 T83 A84I44-V80 HydrophobicContact CD1-CG2 3.86Å; I44-V80 HydrophobicContact CG1-CG2 4.08Å; L76-V80 HydrophobicContact CD2-CG2 4.07Å; L76-V80 WeakPolarHBondContact O-CG2 3.34Å; L76-V80 PolarHBondContact O-N 3.47Å; L77-V80 PolarHBondContact O-N 3.27Å; V80-Y82 PolarHBondContact O-N 2.94Å; V80-T83 WeakPolarHBondContact O-CB 3.47Å; V80-T83 PolarHBondContact O-N 3.43Å; V80-A84 PolarHBondContact O-N 2.92Å
81V94.5Very high91.6Very high26 Ų2629.7 Ų29.716%0.15818%0.18CC..Hα-helixtrans-66-39.6-179.21780000110.6L77 A84 N85 S107 M108L77-V81 WeakPolarHBondContact O-CB 3.29Å; L77-V81 WeakPolarHBondContact O-CG2 3.34Å; L77-V81 PolarHBondContact O-N 3.5Å; V81-A84 CarbonylContact O-C 3.24Å; V81-A84 PolarHBondContact O-N 3.34Å; V81-N85 WeakPolarHBondContact O-CB 3.47Å; V81-N85 PolarHBondContact O-N 3.44Å; V81-S107 WeakPolarHBondContact CG1-OG 3.38Å; V81-M108 HydrophobicContact CB-SD 3.91Å; V81-M108 HydrophobicContact CG1-CG 3.68Å; V81-M108 HydrophobicContact CG1-SD 3.47Å; V81-M108 WeakPolarHBondContact CG1-SD 3.27Å
82Y93.1Very high91.2Very high9 Ų932.9 Ų32.94%0.03520%0.197CC..Hα-helixtrans-68-37.5177.9-166.6-132.8000111.9F36 C40 A78 V80 A84 N85 I86 M108 E284 L287 A288 V291F36-Y82 HydrophobicContact CB-CE1 4.49Å; C40-Y82 WeakPolarHBondContact SG-CD1 3.31Å; A78-Y82 WeakPolarHBondContact O-CB 3.29Å; A78-Y82 PolarHBondContact O-N 3.23Å; V80-Y82 PolarHBondContact O-N 2.94Å; Y82-A84 PolarHBondContact O-N 2.92Å; Y82-N85 HydrophobicContact CD2-CB 4.42Å; Y82-N85 WeakPolarHBondContact O-CB 3.36Å; Y82-N85 PolarHBondContact O-N 2.95Å; Y82-I86 HydrophobicContact CD1-CD1 4.13Å; Y82-I86 HydrophobicContact CE1-CD1 3.96Å; Y82-I86 WeakPolarHBondContact O-CG1 3.44Å; Y82-I86 PolarHBondContact O-N 3.38Å; Y82-M108 VanDerWaalsContact CA-SD 3.57Å; Y82-M108 HydrophobicContact CD2-CE 3.43Å; Y82-M108 VanDerWaalsContact CD2-CE 3.43Å; Y82-M108 HydrophobicContact CD2-SD 4.1Å; Y82-M108 HydrophobicContact CE2-CE 4.32Å; Y82-M108 HydrophobicContact CG-CE 3.86Å; Y82-M108 HydrophobicContact CG-SD 4.4Å; Y82-M108 PolarHBondContact N-SD 2.94Å; Y82-M108 VanDerWaalsContact N-SD 3.44Å; Y82-E284 PolarHBondContact OH-O 3.33Å; Y82-L287 HydrophobicContact CE2-CB 4.36Å; Y82-A288 HydrophobicContact CE1-CB 4.44Å; Y82-A288 PolarHBondContact OH-N 3.4Å; Y82-V291 HydrophobicContact CD1-CB 4.17Å; Y82-V291 HydrophobicContact CD1-CG1 3.86Å; Y82-V291 HydrophobicContact CD1-CG2 3.87Å; Y82-V291 HydrophobicContact CD2-CG2 4.41Å; Y82-V291 HydrophobicContact CE1-CB 4.36Å; Y82-V291 HydrophobicContact CE1-CG1 4.43Å; Y82-V291 HydrophobicContact CE1-CG2 4.18Å; Y82-V291 HydrophobicContact CG-CG2 4.03Å
83T93.5Very high90.9Very high25 Ų2533.1 Ų33.115%0.15320%0.199CC..Hα-helixtrans-59.1-48.1170.8-55.20000110.7C40 G79 V80 N85 I86 L87C40-T83 WeakPolarHBondContact CB-OG1 3.4Å; G79-T83 WeakPolarHBondContact O-CB 3.4Å; G79-T83 PolarHBondContact O-N 3.47Å; G79-T83 PolarHBondContact O-OG1 3.45Å; V80-T83 WeakPolarHBondContact O-CB 3.47Å; V80-T83 PolarHBondContact O-N 3.43Å; T83-N85 VanDerWaalsContact C-N 3.3Å; T83-N85 PolarHBondContact O-N 2.92Å; T83-I86 PolarHBondContact O-N 2.9Å; T83-L87 HydrophobicContact CG2-CD1 4.12Å; T83-L87 WeakPolarHBondContact O-CG 3.45Å; T83-L87 PolarHBondContact O-N 3.2Å
84A92.9Very high90.5Very high41 Ų4131.4 Ų31.434%0.33919%0.188SC..Hα-helixtrans-61.7-38.5176.100000112V80 V81 Y82 L87 L88V80-A84 PolarHBondContact O-N 2.92Å; V81-A84 CarbonylContact O-C 3.24Å; V81-A84 PolarHBondContact O-N 3.34Å; Y82-A84 PolarHBondContact O-N 2.92Å; A84-L87 PolarHBondContact O-N 3.36Å; A84-L88 VanDerWaalsContact O-CB 3.27Å; A84-L88 WeakPolarHBondContact O-CB 3.25Å; A84-L88 VanDerWaalsContact O-CG 3.24Å; A84-L88 WeakPolarHBondContact O-CG 3.4Å; A84-L88 PolarHBondContact O-N 2.87Å
85N91.5Very high90Very high17 Ų1738.7 Ų38.79%0.09122%0.219CC..Hα-helixtrans-60.3-46.2176.3-171.6-70.2000111.2V81 Y82 T83 L88 S89 R104 E105V81-N85 WeakPolarHBondContact O-CB 3.47Å; V81-N85 PolarHBondContact O-N 3.44Å; Y82-N85 HydrophobicContact CD2-CB 4.42Å; Y82-N85 WeakPolarHBondContact O-CB 3.36Å; Y82-N85 PolarHBondContact O-N 2.95Å; T83-N85 VanDerWaalsContact C-N 3.3Å; T83-N85 PolarHBondContact O-N 2.92Å; N85-L88 PolarHBondContact O-N 3.2Å; N85-S89 VanDerWaalsContact O-CB 3.28Å; N85-S89 WeakPolarHBondContact O-CB 3.43Å; N85-S89 PolarHBondContact O-N 2.91Å; N85-S89 PolarHBondContact O-OG 3.32Å; N85-R104 HydrophobicContact CB-CG 4.45Å; N85-E105 PolarHBondContact ND2-OE1 2.9Å; N85-E105 PolarHBondContact ND2-OE2 3.44Å
86I89.3Confident89.7Confident18 Ų1839.6 Ų39.69%0.09222%0.224CC..Hα-helixtrans-63.1-45.9177.3-64.9163000111F36 I37 Y82 T83 L88 S89F36-I86 HydrophobicContact CB-CD1 3.64Å; I37-I86 HydrophobicContact CD1-CG2 3.93Å; I37-I86 HydrophobicContact CG1-CB 4.46Å; I37-I86 HydrophobicContact CG1-CD1 4.21Å; I37-I86 HydrophobicContact CG1-CG2 3.99Å; Y82-I86 HydrophobicContact CD1-CD1 4.13Å; Y82-I86 HydrophobicContact CE1-CD1 3.96Å; Y82-I86 WeakPolarHBondContact O-CG1 3.44Å; Y82-I86 PolarHBondContact O-N 3.38Å; T83-I86 PolarHBondContact O-N 2.9Å; I86-L88 VanDerWaalsContact C-N 3.33Å; I86-L88 PolarHBondContact O-N 2.91Å; I86-S89 WeakPolarHBondContact O-CB 3.23Å; I86-S89 PolarHBondContact O-N 3.46Å
87L89.1Confident89.5Confident94 Ų9439.8 Ų39.849%0.49223%0.227SC..Hα-helixtrans-67.5-32.3-178.8-66.7175.5000113.2I37 T83 A84 S89 N92I37-L87 HydrophobicContact CD1-CD2 4.16Å; T83-L87 HydrophobicContact CG2-CD1 4.12Å; T83-L87 WeakPolarHBondContact O-CG 3.45Å; T83-L87 PolarHBondContact O-N 3.2Å; A84-L87 PolarHBondContact O-N 3.36Å; L87-S89 VanDerWaalsContact C-N 3.34Å; L87-N92 PolarHBondContact O-ND2 2.96Å
88L88.7Confident89.3Confident71 Ų7137.6 Ų37.637%0.37222%0.216SC..THydrogen-bonded Turntrans-89.61.5177-64.4174.1000113.1A84 N85 I86 T93 R104A84-L88 VanDerWaalsContact O-CB 3.27Å; A84-L88 WeakPolarHBondContact O-CB 3.25Å; A84-L88 VanDerWaalsContact O-CG 3.24Å; A84-L88 WeakPolarHBondContact O-CG 3.4Å; A84-L88 PolarHBondContact O-N 2.87Å; N85-L88 PolarHBondContact O-N 3.2Å; I86-L88 VanDerWaalsContact C-N 3.33Å; I86-L88 PolarHBondContact O-N 2.91Å; L88-T93 PolarHBondContact O-N 3.41Å; L88-T93 PolarHBondContact O-OG1 3.49Å; L88-R104 HydrophobicContact CD1-CG 4.45Å; L88-R104 PolarHBondContact O-NH1 3.3Å
89S85.6Confident89.1Confident31 Ų3141.7 Ų41.722%0.21724%0.24CC..SBendtrans-84.2179.1177.2-76.60000112.3N85 I86 L87 T93N85-S89 VanDerWaalsContact O-CB 3.28Å; N85-S89 WeakPolarHBondContact O-CB 3.43Å; N85-S89 PolarHBondContact O-N 2.91Å; N85-S89 PolarHBondContact O-OG 3.32Å; I86-S89 WeakPolarHBondContact O-CB 3.23Å; I86-S89 PolarHBondContact O-N 3.46Å; L87-S89 VanDerWaalsContact C-N 3.34Å; S89-T93 WeakPolarHBondContact CA-OG1 3.47Å
90G82.7Confident89Confident26 Ų2646.5 Ų46.527%0.26826%0.262SS..G310 helixtrans67-136.7-17800000112.3N92 T93G90-N92 PolarHBondContact O-N 3.25Å; G90-T93 PolarHBondContact N-OG1 3.34Å; G90-T93 VanDerWaalsContact O-CB 3.24Å; G90-T93 WeakPolarHBondContact O-CB 3.4Å; G90-T93 PolarHBondContact O-N 3.06Å; G90-T93 PolarHBondContact O-OG1 3.37Å
91A78.6Confident88.9Confident31 Ų3143.4 Ų43.426%0.25624%0.243SC..G310 helixtrans-58.8-27.5-177.800000113.9T93A91-T93 VanDerWaalsContact C-N 3.27Å; A91-T93 PolarHBondContact O-N 3.45Å
92N84.5Confident88.9Confident67 Ų6742.5 Ų42.536%0.35824%0.238SC..G310 helixtrans-72.4-20177.6-69.6-29.9000112.9L87 G90 Y94 K95L87-N92 PolarHBondContact O-ND2 2.96Å; G90-N92 PolarHBondContact O-N 3.25Å; N92-Y94 VanDerWaalsContact C-N 3.28Å; N92-Y94 PolarHBondContact O-N 3.14Å; N92-K95 PolarHBondContact O-N 3.36Å; N92-K95 VanDerWaalsContact O-N 3.15Å
93T87.1Confident88.9Confident5 Ų549.2 Ų49.23%0.03127%0.267CS..G310 helixtrans-60.3-37.9-179.9-53.70000112.1I10 Y14 L88 S89 G90 A91 K95 L96 R104I10-T93 HydrophobicContact CG2-CG2 4.35Å; Y14-T93 HydrophobicContact CE1-CG2 4.28Å; Y14-T93 HydrophobicContact CE2-CG2 4.14Å; L88-T93 PolarHBondContact O-N 3.41Å; L88-T93 PolarHBondContact O-OG1 3.49Å; S89-T93 WeakPolarHBondContact CA-OG1 3.47Å; G90-T93 PolarHBondContact N-OG1 3.34Å; G90-T93 VanDerWaalsContact O-CB 3.24Å; G90-T93 WeakPolarHBondContact O-CB 3.4Å; G90-T93 PolarHBondContact O-N 3.06Å; G90-T93 PolarHBondContact O-OG1 3.37Å; A91-T93 VanDerWaalsContact C-N 3.27Å; A91-T93 PolarHBondContact O-N 3.45Å; T93-K95 VanDerWaalsContact C-N 3.28Å; T93-K95 PolarHBondContact O-N 3.49Å; T93-L96 WeakPolarHBondContact O-CB 3.43Å; T93-L96 PolarHBondContact O-N 2.92Å; T93-R104 PolarHBondContact OG1-NH1 2.83Å
94Y84.9Confident88.9Confident34 Ų3448.6 Ų48.613%0.13326%0.262CS..G310 helixtrans-79-12.5-177.1-47.4-65.5000113.3S7 I10 A11 Y14 L20 R21 N92 L96S7-Y94 WeakPolarHBondContact CB-O 3.42Å; S7-Y94 PolarHBondContact OG-O 3.14Å; I10-Y94 HydrophobicContact CG2-CD1 4.47Å; A11-Y94 HydrophobicContact CB-CD1 4.45Å; Y14-Y94 HydrophobicContact CD1-CE1 4.33Å; Y14-Y94 HydrophobicContact CG-CE1 4.18Å; L20-Y94 HydrophobicContact CD1-CD1 4.33Å; L20-Y94 HydrophobicContact CD1-CE1 3.6Å; R21-Y94 PolarHBondContact N-OH 3.21Å; N92-Y94 VanDerWaalsContact C-N 3.28Å; N92-Y94 PolarHBondContact O-N 3.14Å; Y94-L96 VanDerWaalsContact C-N 3.34Å
95K86.3Confident88.9Confident153 Ų15347.8 Ų47.867%0.66525%0.251SS*.G310 helixtrans-84.7-11.2173.6-61180-178171.20112.5N92 T93N92-K95 PolarHBondContact O-N 3.36Å; N92-K95 VanDerWaalsContact O-N 3.15Å; T93-K95 VanDerWaalsContact C-N 3.28Å; T93-K95 PolarHBondContact O-N 3.49Å
96L88.3Confident89Confident18 Ų1847.1 Ų47.19%0.09425%0.249CC..SBendtrans-77148.9-179.8-61.1175.9000110.8I10 T93 Y94 Q100I10-L96 HydrophobicContact CD1-CB 4.25Å; I10-L96 WeakPolarHBondContact CD1-O 3.22Å; T93-L96 WeakPolarHBondContact O-CB 3.43Å; T93-L96 PolarHBondContact O-N 2.92Å; Y94-L96 VanDerWaalsContact C-N 3.34Å; L96-Q100 HydrophobicContact CB-CB 4.28Å; L96-Q100 HydrophobicContact CD2-CB 4.25Å
97T90.3Very high89.2Confident33 Ų3347.5 Ų47.520%0.20225%0.253CS..  trans-76.8157.6163.269.10000110.1T99 Q100 W101T97-T99 PolarHBondContact O-N 3.1Å; T97-T99 PolarHBondContact OG1-OG1 2.97Å; T97-Q100 PolarHBondContact O-N 3.21Å; T97-Q100 VanDerWaalsContact O-N 3.11Å; T97-Q100 WeakPolarHBondContact OG1-CB 3.46Å; T97-Q100 VanDerWaalsContact OG1-CG 3.25Å; T97-Q100 WeakPolarHBondContact OG1-CG 3.41Å; T97-Q100 PolarHBondContact OG1-N 2.93Å; T97-Q100 PolarHBondContact OG1-OE1 3.4Å; T97-W101 PolarHBondContact O-N 3.47Å
98P90.3Very high89.4Confident14 Ų1444.5 Ų44.59%0.09124%0.237CC..Hα-helixtrans-55-37.7175.8-28.835.6000113Y6 L9 W101 F102 L181Y6-P98 HydrophobicContact CD1-CG 3.95Å; L9-P98 HydrophobicContact CD2-CB 4.35Å; L9-P98 HydrophobicContact CD2-CG 3.74Å; P98-W101 PolarHBondContact O-N 2.9Å; P98-F102 WeakPolarHBondContact O-CD2 3.37Å; P98-F102 PolarHBondContact O-N 3.1Å; P98-L181 HydrophobicContact CB-CD2 4.45Å
99T90.3Very high89.5Confident96 Ų9642.2 Ų42.259%0.58922%0.224SC*.Hα-helixtrans-66.6-42.4177.251.80000112.2T97 W101 F102 F103T97-T99 PolarHBondContact O-N 3.1Å; T97-T99 PolarHBondContact OG1-OG1 2.97Å; T99-W101 VanDerWaalsContact C-N 3.32Å; T99-W101 PolarHBondContact O-N 3.34Å; T99-F102 PolarHBondContact O-N 2.93Å; T99-F103 WeakPolarHBondContact O-CB 3.15Å; T99-F103 PolarHBondContact O-N 3.33Å
100Q92.3Very high90Very high101 Ų10142.3 Ų42.347%0.47222%0.223SC..Hα-helixtrans-63.7-38.9173.4-71.8168.4-14.700111.7L96 T97 F103 R104L96-Q100 HydrophobicContact CB-CB 4.28Å; L96-Q100 HydrophobicContact CD2-CB 4.25Å; T97-Q100 PolarHBondContact O-N 3.21Å; T97-Q100 VanDerWaalsContact O-N 3.11Å; T97-Q100 WeakPolarHBondContact OG1-CB 3.46Å; T97-Q100 VanDerWaalsContact OG1-CG 3.25Å; T97-Q100 WeakPolarHBondContact OG1-CG 3.41Å; T97-Q100 PolarHBondContact OG1-N 2.93Å; T97-Q100 PolarHBondContact OG1-OE1 3.4Å; Q100-F103 PolarHBondContact O-N 3Å; Q100-R104 WeakPolarHBondContact O-CB 3.26Å; Q100-R104 PolarHBondContact O-N 3.49Å
101W93.4Very high90.5Very high1 Ų141.2 Ų41.20%0.00421%0.212CC..Hα-helixtrans-63.4-46.5176.5-170.799.3000111.5I10 Y14 T97 P98 T99 F103 R104 E105 L179 L181 Y182I10-W101 HydrophobicContact CD1-CB 3.99Å; I10-W101 HydrophobicContact CD1-CG 4.29Å; Y14-W101 HydrophobicContact CE2-CZ2 4.43Å; Y14-W101 AromaticContact CE2-NE1 3.67Å; Y14-W101 AromaticContact CZ-NE1 3.77Å; Y14-W101 PolarHBondContact OH-NE1 2.85Å; T97-W101 PolarHBondContact O-N 3.47Å; P98-W101 PolarHBondContact O-N 2.9Å; T99-W101 VanDerWaalsContact C-N 3.32Å; T99-W101 PolarHBondContact O-N 3.34Å; W101-F103 VanDerWaalsContact C-N 3.31Å; W101-F103 PolarHBondContact O-N 3Å; W101-R104 WeakPolarHBondContact O-CB 3.18Å; W101-R104 PolarHBondContact O-N 2.89Å; W101-E105 HydrophobicContact CD2-CG 4.14Å; W101-E105 HydrophobicContact CE3-CG 4.11Å; W101-E105 HydrophobicContact CH2-CB 4.47Å; W101-E105 HydrophobicContact CH2-CG 3.71Å; W101-E105 HydrophobicContact CZ2-CG 3.74Å; W101-E105 HydrophobicContact CZ3-CB 4.35Å; W101-E105 HydrophobicContact CZ3-CG 3.9Å; W101-E105 PolarHBondContact O-N 3.43Å; W101-L179 HydrophobicContact CH2-CB 4.2Å; W101-L181 HydrophobicContact CD2-CD1 4.36Å; W101-L181 HydrophobicContact CD2-CD2 4.02Å; W101-L181 HydrophobicContact CE3-CB 3.87Å; W101-L181 HydrophobicContact CE3-CD1 4.48Å; W101-L181 HydrophobicContact CE3-CD2 3.77Å; W101-L181 HydrophobicContact CE3-CG 4.26Å; W101-L181 HydrophobicContact CG-CD2 4.39Å; W101-L181 HydrophobicContact CH2-CB 3.91Å; W101-L181 HydrophobicContact CH2-CD1 4.48Å; W101-L181 HydrophobicContact CZ2-CD1 4.34Å; W101-L181 HydrophobicContact CZ3-CB 3.5Å; W101-L181 HydrophobicContact CZ3-CD2 4.3Å; W101-L181 HydrophobicContact CZ3-CG 4.32Å; W101-Y182 HydrophobicContact CE3-CE2 4.41Å; W101-Y182 AromaticContact CH2-CD2 3.57Å; W101-Y182 HydrophobicContact CH2-CD2 3.57Å; W101-Y182 AromaticContact CH2-CE2 3.82Å; W101-Y182 HydrophobicContact CH2-CE2 3.82Å; W101-Y182 AromaticContact CZ3-CD2 3.4Å; W101-Y182 HydrophobicContact CZ3-CD2 3.4Å; W101-Y182 VanDerWaalsContact CZ3-CD2 3.4Å; W101-Y182 AromaticContact CZ3-CE2 3.36Å; W101-Y182 HydrophobicContact CZ3-CE2 3.36Å
102F94.5Very high91Very high8 Ų841.1 Ų41.14%0.03521%0.207CC..Hα-helixtrans-64.8-34.5174.6-73.6-63000112.7P98 T99 G106 P162 I163 N167 I169 L181 Y182P98-F102 WeakPolarHBondContact O-CD2 3.37Å; P98-F102 PolarHBondContact O-N 3.1Å; T99-F102 PolarHBondContact O-N 2.93Å; F102-G106 WeakPolarHBondContact O-CA 3.23Å; F102-G106 PolarHBondContact O-N 3.21Å; F102-P162 HydrophobicContact CD1-CB 4.03Å; F102-P162 HydrophobicContact CE1-CB 4.04Å; F102-I163 HydrophobicContact CB-CD1 4.05Å; F102-I163 HydrophobicContact CB-CG1 3.52Å; F102-I163 HydrophobicContact CG-CG1 4.11Å; F102-N167 HydrophobicContact CE1-CB 3.99Å; F102-N167 HydrophobicContact CZ-CB 3.66Å; F102-I169 HydrophobicContact CE2-CD1 3.96Å; F102-I169 HydrophobicContact CZ-CD1 4.13Å; F102-I169 HydrophobicContact CZ-CG1 4.43Å; F102-L181 HydrophobicContact CE1-CB 3.95Å; F102-L181 HydrophobicContact CE2-CD2 4.26Å; F102-L181 HydrophobicContact CZ-CB 3.86Å; F102-L181 HydrophobicContact CZ-CD2 4.14Å; F102-Y182 AromaticContact CD1-CE2 3.97Å; F102-Y182 HydrophobicContact CD1-CE2 3.97Å; F102-Y182 HydrophobicContact CE1-CD2 4.36Å; F102-Y182 HydrophobicContact CE1-CE2 4.26Å
103F93.8Very high91.5Very high150 Ų15038 Ų3866%0.65819%0.19SC*.Hα-helixtrans-66.3-41174.6-169-97000111.3T99 Q100 W101 S107T99-F103 WeakPolarHBondContact O-CB 3.15Å; T99-F103 PolarHBondContact O-N 3.33Å; Q100-F103 PolarHBondContact O-N 3Å; W101-F103 VanDerWaalsContact C-N 3.31Å; W101-F103 PolarHBondContact O-N 3Å; F103-S107 WeakPolarHBondContact O-CB 3.48Å; F103-S107 PolarHBondContact O-N 3.11Å; F103-S107 PolarHBondContact O-OG 3.47Å
104R93.4Very high91.8Very high12 Ų1237.7 Ų37.75%0.04519%0.188CC..Hα-helixtrans-60.9-49.4177-173.2-171.475.7-1805112.3N85 L88 T93 Q100 W101 S107N85-R104 HydrophobicContact CB-CG 4.45Å; L88-R104 HydrophobicContact CD1-CG 4.45Å; L88-R104 PolarHBondContact O-NH1 3.3Å; T93-R104 PolarHBondContact OG1-NH1 2.83Å; Q100-R104 WeakPolarHBondContact O-CB 3.26Å; Q100-R104 PolarHBondContact O-N 3.49Å; W101-R104 WeakPolarHBondContact O-CB 3.18Å; W101-R104 PolarHBondContact O-N 2.89Å; R104-S107 PolarHBondContact O-OG 3.37Å; R104-S107 VanDerWaalsContact O-OG 3.06Å
105E92.5Very high92.1Very high23 Ų2336.3 Ų36.311%0.10718%0.183CC..Hα-helixtrans-78.2-40.5179.1-59.6-51.7143.600111.9N85 W101 S107 M108 F109 L179 Y182N85-E105 PolarHBondContact ND2-OE1 2.9Å; N85-E105 PolarHBondContact ND2-OE2 3.44Å; W101-E105 HydrophobicContact CD2-CG 4.14Å; W101-E105 HydrophobicContact CE3-CG 4.11Å; W101-E105 HydrophobicContact CH2-CB 4.47Å; W101-E105 HydrophobicContact CH2-CG 3.71Å; W101-E105 HydrophobicContact CZ2-CG 3.74Å; W101-E105 HydrophobicContact CZ3-CB 4.35Å; W101-E105 HydrophobicContact CZ3-CG 3.9Å; W101-E105 PolarHBondContact O-N 3.43Å; E105-S107 VanDerWaalsContact C-N 3.34Å; E105-S107 PolarHBondContact O-N 2.94Å; E105-M108 WeakPolarHBondContact O-CB 3.49Å; E105-M108 PolarHBondContact O-N 3.23Å; E105-M108 VanDerWaalsContact O-N 3.11Å; E105-F109 WeakPolarHBondContact O-CD2 3.34Å; E105-F109 PolarHBondContact O-N 3.41Å; E105-L179 HydrophobicContact CB-CD2 4.13Å; E105-L179 HydrophobicContact CG-CD2 4.22Å; E105-Y182 HydrophobicContact CB-CE2 3.82Å; E105-Y182 HydrophobicContact CG-CE2 4.47Å
106G93.8Very high92.3Very high4 Ų429 Ų294%0.04115%0.151CC..Hα-helixtrans-62.4-38.4-179.900000112.6F102 M108 F109 V110 Y182F102-G106 WeakPolarHBondContact O-CA 3.23Å; F102-G106 PolarHBondContact O-N 3.21Å; G106-M108 VanDerWaalsContact C-N 3.26Å; G106-M108 PolarHBondContact O-N 3.49Å; G106-F109 CarbonylContact O-C 3.59Å; G106-F109 WeakPolarHBondContact O-CA 3.5Å; G106-F109 WeakPolarHBondContact O-CB 3.27Å; G106-F109 PolarHBondContact O-N 3.01Å; G106-V110 WeakPolarHBondContact O-CG2 3.49Å; G106-V110 PolarHBondContact O-N 3.23Å; G106-Y182 WeakPolarHBondContact CA-OH 3.08Å; G106-Y182 PolarHBondContact N-OH 3.02Å
107S94Very high92.5Very high25 Ų2529.8 Ų29.818%0.17515%0.154CC..Hα-helixtrans-62.9-30.8175.152.50000113V81 F103 R104 E105 V110 A111V81-S107 WeakPolarHBondContact CG1-OG 3.38Å; F103-S107 WeakPolarHBondContact O-CB 3.48Å; F103-S107 PolarHBondContact O-N 3.11Å; F103-S107 PolarHBondContact O-OG 3.47Å; R104-S107 PolarHBondContact O-OG 3.37Å; R104-S107 VanDerWaalsContact O-OG 3.06Å; E105-S107 VanDerWaalsContact C-N 3.34Å; E105-S107 PolarHBondContact O-N 2.94Å; S107-V110 PolarHBondContact O-N 3.36Å; S107-A111 WeakPolarHBondContact O-CB 3.38Å; S107-A111 PolarHBondContact O-N 3.14Å
108M91.3Very high92.5Very high31 Ų3128.2 Ų28.215%0.15315%0.145CC..Hα-helixtrans-65.4-43.1170.6-69.2-67-65.200111.2V81 Y82 E105 G106 A111 L112 V291V81-M108 HydrophobicContact CB-SD 3.91Å; V81-M108 HydrophobicContact CG1-CG 3.68Å; V81-M108 HydrophobicContact CG1-SD 3.47Å; V81-M108 WeakPolarHBondContact CG1-SD 3.27Å; Y82-M108 VanDerWaalsContact CA-SD 3.57Å; Y82-M108 HydrophobicContact CD2-CE 3.43Å; Y82-M108 VanDerWaalsContact CD2-CE 3.43Å; Y82-M108 HydrophobicContact CD2-SD 4.1Å; Y82-M108 HydrophobicContact CE2-CE 4.32Å; Y82-M108 HydrophobicContact CG-CE 3.86Å; Y82-M108 HydrophobicContact CG-SD 4.4Å; Y82-M108 PolarHBondContact N-SD 2.94Å; Y82-M108 VanDerWaalsContact N-SD 3.44Å; E105-M108 WeakPolarHBondContact O-CB 3.49Å; E105-M108 PolarHBondContact O-N 3.23Å; E105-M108 VanDerWaalsContact O-N 3.11Å; G106-M108 VanDerWaalsContact C-N 3.26Å; G106-M108 PolarHBondContact O-N 3.49Å; M108-A111 PolarHBondContact O-N 2.96Å; M108-L112 VanDerWaalsContact O-CB 3.31Å; M108-L112 WeakPolarHBondContact O-CB 3.21Å; M108-L112 PolarHBondContact O-N 2.65Å; M108-V291 HydrophobicContact CE-CG2 4.17Å
109F92.3Very high92.3Very high24 Ų2428.2 Ų28.211%0.10514%0.144CC..Hα-helixtrans-63.3-39.3174.8-85.5-94.8000112.5E105 G106 A113 L179 Y182 Y186 I187 C190 F194E105-F109 WeakPolarHBondContact O-CD2 3.34Å; E105-F109 PolarHBondContact O-N 3.41Å; G106-F109 CarbonylContact O-C 3.59Å; G106-F109 WeakPolarHBondContact O-CA 3.5Å; G106-F109 WeakPolarHBondContact O-CB 3.27Å; G106-F109 PolarHBondContact O-N 3.01Å; F109-A113 VanDerWaalsContact O-CB 3.28Å; F109-A113 WeakPolarHBondContact O-CB 2.98Å; F109-A113 PolarHBondContact O-N 3.43Å; F109-L179 HydrophobicContact CE2-CD2 3.96Å; F109-Y182 HydrophobicContact CD2-CE1 4.43Å; F109-Y182 HydrophobicContact CE2-CE1 4.11Å; F109-Y182 HydrophobicContact CZ-CE1 4.5Å; F109-Y186 HydrophobicContact CE1-CE1 4.13Å; F109-Y186 HydrophobicContact CZ-CE1 4.32Å; F109-I187 HydrophobicContact CZ-CD1 3.95Å; F109-C190 HydrophobicContact CE1-CB 4.06Å; F109-F194 HydrophobicContact CD1-CE2 4.29Å
110V95.1Very high92.2Very high32 Ų3225.3 Ų25.319%0.19413%0.125CC..Hα-helixtrans-63.2-49.1176175.80000110.6G106 S107 L112 A113 A114 W152 A155G106-V110 WeakPolarHBondContact O-CG2 3.49Å; G106-V110 PolarHBondContact O-N 3.23Å; S107-V110 PolarHBondContact O-N 3.36Å; V110-L112 VanDerWaalsContact C-N 3.33Å; V110-L112 PolarHBondContact O-N 2.92Å; V110-A113 PolarHBondContact O-N 3.22Å; V110-A114 WeakPolarHBondContact O-CB 3.43Å; V110-A114 PolarHBondContact O-N 2.94Å; V110-W152 HydrophobicContact CG1-CZ3 4.37Å; V110-A155 HydrophobicContact CG1-CB 4.13Å
111A93.3Very high91.9Very high4 Ų421.6 Ų21.63%0.03311%0.111CC..Hα-helixtrans-61.4-43.1179.900000111.6A78 S107 M108 A114 S115A78-A111 HydrophobicContact CB-CB 3.9Å; S107-A111 WeakPolarHBondContact O-CB 3.38Å; S107-A111 PolarHBondContact O-N 3.14Å; M108-A111 PolarHBondContact O-N 2.96Å; A111-A114 PolarHBondContact O-N 3.35Å; A111-S115 WeakPolarHBondContact O-CB 3.34Å; A111-S115 PolarHBondContact O-N 3.34Å
112L90.4Very high91.3Very high29 Ų2922.1 Ų22.115%0.15211%0.114CC..Hα-helixtrans-56.6-54.8172.6170.154.8000112M108 V110 A114 S115 V116 F194 W259M108-L112 VanDerWaalsContact O-CB 3.31Å; M108-L112 WeakPolarHBondContact O-CB 3.21Å; M108-L112 PolarHBondContact O-N 2.65Å; V110-L112 VanDerWaalsContact C-N 3.33Å; V110-L112 PolarHBondContact O-N 2.92Å; L112-A114 VanDerWaalsContact C-N 3.32Å; L112-A114 PolarHBondContact O-N 3.04Å; L112-S115 PolarHBondContact O-N 2.74Å; L112-V116 HydrophobicContact CD1-CG2 3.75Å; L112-V116 WeakPolarHBondContact O-CG2 3.38Å; L112-V116 PolarHBondContact O-N 3.46Å; L112-F194 HydrophobicContact CD2-CD2 4.06Å; L112-F194 HydrophobicContact CD2-CE2 3.78Å; L112-F194 HydrophobicContact CD2-CZ 4.34Å; L112-F194 HydrophobicContact CG-CE2 4.14Å; L112-F194 HydrophobicContact CG-CZ 4.21Å; L112-W259 HydrophobicContact CD1-CE3 4.23Å; L112-W259 HydrophobicContact CD1-CH2 3.05Å; L112-W259 HydrophobicContact CD1-CZ2 3.81Å; L112-W259 HydrophobicContact CD1-CZ3 3.25Å; L112-W259 HydrophobicContact CD2-CZ3 4.13Å; L112-W259 HydrophobicContact CG-CH2 4.36Å; L112-W259 HydrophobicContact CG-CZ3 4.34Å
113A93.5Very high90.8Very high0 Ų021.8 Ų21.80%011%0.112CC..Hα-helixtrans-58.4-47-178.500000111F109 V110 S115 V116 F117 A155 F194F109-A113 VanDerWaalsContact O-CB 3.28Å; F109-A113 WeakPolarHBondContact O-CB 2.98Å; F109-A113 PolarHBondContact O-N 3.43Å; V110-A113 PolarHBondContact O-N 3.22Å; A113-S115 VanDerWaalsContact C-N 3.33Å; A113-S115 PolarHBondContact O-N 2.73Å; A113-V116 PolarHBondContact O-N 3.1Å; A113-F117 HydrophobicContact CB-CD2 4.24Å; A113-F117 HydrophobicContact CB-CE2 4.17Å; A113-F117 WeakPolarHBondContact O-CB 3.31Å; A113-F117 WeakPolarHBondContact O-CD2 3.24Å; A113-F117 PolarHBondContact O-N 3.01Å; A113-A155 HydrophobicContact CB-CB 3.67Å; A113-F194 HydrophobicContact CB-CE1 3.83Å; A113-F194 HydrophobicContact CB-CZ 3.84Å
114A94.2Very high90.3Very high0 Ų018.2 Ų18.20%010%0.099CC..Hα-helixtrans-58.6-43.2178.500000112.2V110 A111 L112 S118 W152 A155V110-A114 WeakPolarHBondContact O-CB 3.43Å; V110-A114 PolarHBondContact O-N 2.94Å; A111-A114 PolarHBondContact O-N 3.35Å; L112-A114 VanDerWaalsContact C-N 3.32Å; L112-A114 PolarHBondContact O-N 3.04Å; A114-S118 WeakPolarHBondContact O-CB 3.27Å; A114-S118 PolarHBondContact O-N 3.48Å; A114-S118 PolarHBondContact O-OG 3.32Å; A114-W152 HydrophobicContact CB-CD2 4.46Å; A114-W152 HydrophobicContact CB-CE3 4.22Å; A114-W152 HydrophobicContact CB-CH2 3.98Å; A114-W152 HydrophobicContact CB-CZ2 4.26Å; A114-W152 HydrophobicContact CB-CZ3 3.98Å; A114-A155 HydrophobicContact CB-CB 4.12Å
115S91.7Very high89.6Confident4 Ų419.6 Ų19.63%0.02811%0.106CC..Hα-helixtrans-66.3-47.1178-174.70000111.6L71 S74 D75 A111 L112 A113 S118 L119L71-S115 VanDerWaalsContact CD1-OG 3.27Å; L71-S115 WeakPolarHBondContact CD1-OG 3.34Å; S74-S115 WeakPolarHBondContact OG-CA 3.36Å; D75-S115 PolarHBondContact OD1-OG 2.7Å; A111-S115 WeakPolarHBondContact O-CB 3.34Å; A111-S115 PolarHBondContact O-N 3.34Å; L112-S115 PolarHBondContact O-N 2.74Å; A113-S115 VanDerWaalsContact C-N 3.33Å; A113-S115 PolarHBondContact O-N 2.73Å; S115-S118 WeakPolarHBondContact O-CB 3.36Å; S115-S118 PolarHBondContact O-N 3.08Å; S115-L119 WeakPolarHBondContact O-CG 3.43Å; S115-L119 PolarHBondContact O-N 3.02Å
116V90.5Very high88.9Confident0 Ų022.5 Ų22.50%012%0.116CC..Hα-helixtrans-64.5-45.6-179.6169.10000112.4L112 A113 S118 L119 L120 F194 I197 L198L112-V116 HydrophobicContact CD1-CG2 3.75Å; L112-V116 WeakPolarHBondContact O-CG2 3.38Å; L112-V116 PolarHBondContact O-N 3.46Å; A113-V116 PolarHBondContact O-N 3.1Å; V116-S118 VanDerWaalsContact C-N 3.32Å; V116-S118 PolarHBondContact O-N 3.31Å; V116-L119 PolarHBondContact O-N 2.95Å; V116-L120 PolarHBondContact O-N 2.9Å; V116-F194 HydrophobicContact CG1-CD1 4.3Å; V116-I197 HydrophobicContact CG1-CB 4Å; V116-I197 HydrophobicContact CG1-CD1 4.42Å; V116-I197 HydrophobicContact CG1-CG2 3.41Å; V116-I197 VanDerWaalsContact CG1-CG2 3.41Å; V116-L198 HydrophobicContact CB-CD2 4.41Å; V116-L198 HydrophobicContact CG1-CD2 3.62Å; V116-L198 HydrophobicContact CG2-CD2 3.92Å
117F91.6Very high88.1Confident34 Ų3423.9 Ų23.915%0.14912%0.121CC..Hα-helixtrans-66-35.5175.6-74.9-60.6000112.1A113 L120 A121 V151 I154 L158 I197A113-F117 HydrophobicContact CB-CD2 4.24Å; A113-F117 HydrophobicContact CB-CE2 4.17Å; A113-F117 WeakPolarHBondContact O-CB 3.31Å; A113-F117 WeakPolarHBondContact O-CD2 3.24Å; A113-F117 PolarHBondContact O-N 3.01Å; F117-L120 PolarHBondContact O-N 3.48Å; F117-A121 WeakPolarHBondContact O-CB 3.38Å; F117-A121 PolarHBondContact O-N 3.4Å; F117-V151 HydrophobicContact CB-CB 4.4Å; F117-V151 HydrophobicContact CB-CG1 3.69Å; F117-V151 HydrophobicContact CB-CG2 3.99Å; F117-I154 HydrophobicContact CD2-CG2 4.36Å; F117-I154 HydrophobicContact CE2-CG2 3.61Å; F117-I154 HydrophobicContact CZ-CG2 3.74Å; F117-L158 HydrophobicContact CE2-CD1 3.82Å; F117-L158 HydrophobicContact CZ-CD1 4.05Å; F117-I197 HydrophobicContact CD1-CD1 4Å; F117-I197 HydrophobicContact CE1-CD1 3.34Å; F117-I197 HydrophobicContact CE1-CG1 4.43Å; F117-I197 HydrophobicContact CZ-CD1 3.7Å
118S90.3Very high87.3Confident1 Ų126.1 Ų26.11%0.00713%0.131CC..Hα-helixtrans-64.5-42.7174-63.50000111.8N70 A114 S115 V116 L120 A121 I122N70-S118 PolarHBondContact ND2-OG 3.17Å; A114-S118 WeakPolarHBondContact O-CB 3.27Å; A114-S118 PolarHBondContact O-N 3.48Å; A114-S118 PolarHBondContact O-OG 3.32Å; S115-S118 WeakPolarHBondContact O-CB 3.36Å; S115-S118 PolarHBondContact O-N 3.08Å; V116-S118 VanDerWaalsContact C-N 3.32Å; V116-S118 PolarHBondContact O-N 3.31Å; S118-L120 VanDerWaalsContact C-N 3.34Å; S118-L120 PolarHBondContact O-N 3.33Å; S118-A121 PolarHBondContact O-N 3.06Å; S118-I122 VanDerWaalsContact O-CG1 3.26Å; S118-I122 WeakPolarHBondContact O-CG1 3.28Å; S118-I122 PolarHBondContact O-N 3.5Å
119L85.8Confident86.4Confident14 Ų1427.9 Ų27.97%0.07314%0.143CC..Hα-helixtrans-61.2-41.6174.3-76170000112.1L71 S115 V116 I122 A123 I201 F255L71-L119 HydrophobicContact CD1-CD2 4.41Å; L71-L119 HydrophobicContact CD1-CG 4.06Å; L71-L119 HydrophobicContact CD2-CD2 3.46Å; L71-L119 VanDerWaalsContact CD2-CD2 3.46Å; L71-L119 HydrophobicContact CD2-CG 3.94Å; S115-L119 WeakPolarHBondContact O-CG 3.43Å; S115-L119 PolarHBondContact O-N 3.02Å; V116-L119 PolarHBondContact O-N 2.95Å; L119-I122 PolarHBondContact O-N 3.29Å; L119-A123 WeakPolarHBondContact O-CB 3.04Å; L119-A123 PolarHBondContact O-N 3.42Å; L119-I201 HydrophobicContact CB-CD1 3.88Å; L119-F255 HydrophobicContact CD1-CD2 4.5Å; L119-F255 HydrophobicContact CD1-CE2 3.56Å; L119-F255 HydrophobicContact CD1-CZ 4.15Å
120L88.8Confident85.2Confident35 Ų3530 Ų3018%0.18315%0.154CC..Hα-helixtrans-62.3-46.1174.5-179.565.8000111.5V116 F117 S118 I122 A123 I124 I197 A200 I201 L204V116-L120 PolarHBondContact O-N 2.9Å; F117-L120 PolarHBondContact O-N 3.48Å; S118-L120 VanDerWaalsContact C-N 3.34Å; S118-L120 PolarHBondContact O-N 3.33Å; L120-I122 VanDerWaalsContact C-N 3.33Å; L120-I122 PolarHBondContact O-N 3.34Å; L120-A123 PolarHBondContact O-N 3.39Å; L120-I124 HydrophobicContact CD1-CD1 4.09Å; L120-I124 HydrophobicContact CD1-CG1 4.34Å; L120-I124 HydrophobicContact CD2-CD1 4.48Å; L120-I124 HydrophobicContact CG-CD1 3.89Å; L120-I124 HydrophobicContact CG-CG1 4.5Å; L120-I124 VanDerWaalsContact O-CG1 3.31Å; L120-I124 WeakPolarHBondContact O-CG1 3.43Å; L120-I124 PolarHBondContact O-N 3.22Å; L120-I197 HydrophobicContact CB-CG2 4.02Å; L120-I197 HydrophobicContact CD2-CG2 3.95Å; L120-I197 HydrophobicContact CG-CG2 4.37Å; L120-A200 HydrophobicContact CD1-CB 4.38Å; L120-I201 HydrophobicContact CB-CD1 4.16Å; L120-I201 HydrophobicContact CB-CG1 4.09Å; L120-I201 HydrophobicContact CD1-CG1 3.93Å; L120-L204 HydrophobicContact CD1-CD1 3.96Å
121A84.9Confident84Confident22 Ų2231.9 Ų31.918%0.18216%0.163CC..Hα-helixtrans-59.7-44.3177.900000111.6F67 F117 S118 I124 E125F67-A121 HydrophobicContact CD1-CB 4.25Å; F67-A121 HydrophobicContact CE1-CB 4.11Å; F117-A121 WeakPolarHBondContact O-CB 3.38Å; F117-A121 PolarHBondContact O-N 3.4Å; S118-A121 PolarHBondContact O-N 3.06Å; A121-I124 PolarHBondContact O-N 3.01Å; A121-E125 WeakPolarHBondContact O-CB 3.34Å; A121-E125 PolarHBondContact O-N 3.33Å
122I82.6Confident82.5Confident13 Ų1337.8 Ų37.87%0.06719%0.188CC..Hα-helixtrans-61.9-45.6175-66.9164.7000110.5F67 L71 S118 L119 L120 I124 E125 R126F67-I122 HydrophobicContact CB-CD1 4.33Å; F67-I122 HydrophobicContact CB-CG1 3.76Å; L71-I122 HydrophobicContact CB-CD1 4.19Å; L71-I122 HydrophobicContact CD2-CD1 3.55Å; S118-I122 VanDerWaalsContact O-CG1 3.26Å; S118-I122 WeakPolarHBondContact O-CG1 3.28Å; S118-I122 PolarHBondContact O-N 3.5Å; L119-I122 PolarHBondContact O-N 3.29Å; L120-I122 VanDerWaalsContact C-N 3.33Å; L120-I122 PolarHBondContact O-N 3.34Å; I122-I124 VanDerWaalsContact C-N 3.34Å; I122-I124 PolarHBondContact O-N 2.92Å; I122-E125 PolarHBondContact O-N 3.24Å; I122-R126 HydrophobicContact CG2-CG 4.23Å; I122-R126 WeakPolarHBondContact O-CB 3.39Å; I122-R126 VanDerWaalsContact O-CG 3.23Å; I122-R126 WeakPolarHBondContact O-CG 3.44Å; I122-R126 PolarHBondContact O-N 2.95Å
123A82.7Confident80.7Confident0 Ų043.6 Ų43.60%022%0.217CC..Hα-helixtrans-60.6-43.217900000111.8L119 L120 R126 H127 L204 Y205L119-A123 WeakPolarHBondContact O-CB 3.04Å; L119-A123 PolarHBondContact O-N 3.42Å; L120-A123 PolarHBondContact O-N 3.39Å; A123-R126 PolarHBondContact O-N 3.43Å; A123-H127 WeakPolarHBondContact O-CB 3.5Å; A123-H127 PolarHBondContact O-N 3.07Å; A123-L204 HydrophobicContact CB-CB 4.34Å; A123-L204 HydrophobicContact CB-CD1 4.07Å; A123-Y205 HydrophobicContact CB-CD2 4.48Å; A123-Y205 HydrophobicContact CB-CE2 3.96Å
124I83.3Confident78.5Confident75 Ų7550.3 Ų50.339%0.38525%0.246SC..Hα-helixtrans-64.2-48.2176-67.8168.9000110.6L120 A121 I122 R126 H127 L128 L204L120-I124 HydrophobicContact CD1-CD1 4.09Å; L120-I124 HydrophobicContact CD1-CG1 4.34Å; L120-I124 HydrophobicContact CD2-CD1 4.48Å; L120-I124 HydrophobicContact CG-CD1 3.89Å; L120-I124 HydrophobicContact CG-CG1 4.5Å; L120-I124 VanDerWaalsContact O-CG1 3.31Å; L120-I124 WeakPolarHBondContact O-CG1 3.43Å; L120-I124 PolarHBondContact O-N 3.22Å; A121-I124 PolarHBondContact O-N 3.01Å; I122-I124 VanDerWaalsContact C-N 3.34Å; I122-I124 PolarHBondContact O-N 2.92Å; I124-R126 VanDerWaalsContact C-N 3.33Å; I124-R126 PolarHBondContact O-N 2.79Å; I124-H127 PolarHBondContact O-N 3.18Å; I124-L128 HydrophobicContact CG2-CD1 3.82Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CB 3.43Å; I124-L128 VanDerWaalsContact O-CG 3.29Å; I124-L128 WeakPolarHBondContact O-CG 3.4Å; I124-L128 PolarHBondContact O-N 2.88Å; I124-L204 HydrophobicContact CG1-CD1 3.84Å
125E79.6Confident76.2Confident42 Ų4258.4 Ų58.420%0.19629%0.288CS..Hα-helixtrans-59.3-44.7178.5-173.1-174.3-176.500111.2F67 A121 I122 H127 L128 T129F67-E125 WeakPolarHBondContact CD2-OE2 3.24Å; A121-E125 WeakPolarHBondContact O-CB 3.34Å; A121-E125 PolarHBondContact O-N 3.33Å; I122-E125 PolarHBondContact O-N 3.24Å; E125-H127 PolarHBondContact O-N 3.48Å; E125-L128 PolarHBondContact O-N 2.89Å; E125-T129 HydrophobicContact CG-CG2 4.38Å; E125-T129 WeakPolarHBondContact O-CB 3.45Å; E125-T129 VanDerWaalsContact O-CG2 3.3Å; E125-T129 WeakPolarHBondContact O-CG2 3.42Å; E125-T129 PolarHBondContact O-N 3.01Å; E125-T129 PolarHBondContact O-OG1 2.95Å
126R76.8Confident74.2Confident84 Ų8463.3 Ų63.332%0.31731%0.31SS..Hα-helixtrans-61.9-42.8175.9-72.4-58.6-163.5170.210.4112.2M64 I122 A123 I124 T129 M130 I208M64-R126 VanDerWaalsContact CE-CZ 3.45Å; M64-R126 PolarHBondContact SD-NH1 3.46Å; M64-R126 PolarHBondContact SD-NH2 3.17Å; I122-R126 HydrophobicContact CG2-CG 4.23Å; I122-R126 WeakPolarHBondContact O-CB 3.39Å; I122-R126 VanDerWaalsContact O-CG 3.23Å; I122-R126 WeakPolarHBondContact O-CG 3.44Å; I122-R126 PolarHBondContact O-N 2.95Å; A123-R126 PolarHBondContact O-N 3.43Å; I124-R126 VanDerWaalsContact C-N 3.33Å; I124-R126 PolarHBondContact O-N 2.79Å; R126-T129 WeakPolarHBondContact CA-OG1 3.45Å; R126-T129 PolarHBondContact O-OG1 3.05Å; R126-M130 WeakPolarHBondContact O-CB 3.47Å; R126-M130 VanDerWaalsContact O-CG 3.29Å; R126-M130 WeakPolarHBondContact O-CG 3.36Å; R126-M130 PolarHBondContact O-N 2.92Å; R126-I208 HydrophobicContact CB-CD1 4.09Å
127H78.5Confident72.1Confident32 Ų3269.3 Ų69.315%0.14834%0.342CS..Hα-helixtrans-62.4-46.5177.2-17259.9000111.6A123 I124 E125 M130 L131 I208A123-H127 WeakPolarHBondContact O-CB 3.5Å; A123-H127 PolarHBondContact O-N 3.07Å; I124-H127 PolarHBondContact O-N 3.18Å; E125-H127 PolarHBondContact O-N 3.48Å; H127-M130 PolarHBondContact O-N 3.33Å; H127-L131 VanDerWaalsContact NE2-CD1 3.27Å; H127-L131 WeakPolarHBondContact NE2-CD1 3.37Å; H127-L131 WeakPolarHBondContact O-CB 3.41Å; H127-L131 WeakPolarHBondContact O-CG 3.37Å; H127-L131 PolarHBondContact O-N 3.29Å; H127-I208 HydrophobicContact CB-CD1 4.02Å; H127-I208 HydrophobicContact CB-CG1 4.02Å
128L76.9Confident70.2Confident72 Ų7274.3 Ų74.338%0.37737%0.371SS..Hα-helixtrans-65.9-42.4-179.6-70.3174.7000112.7I124 E125 L131 K132I124-L128 HydrophobicContact CG2-CD1 3.82Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CB 3.43Å; I124-L128 VanDerWaalsContact O-CG 3.29Å; I124-L128 WeakPolarHBondContact O-CG 3.4Å; I124-L128 PolarHBondContact O-N 2.88Å; E125-L128 PolarHBondContact O-N 2.89Å; L128-L131 PolarHBondContact O-N 3.19Å; L128-K132 WeakPolarHBondContact O-CB 3.44Å; L128-K132 PolarHBondContact O-N 2.93Å
129T71.8Confident68.6Low68 Ų6875.6 Ų75.642%0.41738%0.384SS..Hα-helixtrans-66.1-42178.649.20000111.6E125 R126E125-T129 HydrophobicContact CG-CG2 4.38Å; E125-T129 WeakPolarHBondContact O-CB 3.45Å; E125-T129 VanDerWaalsContact O-CG2 3.3Å; E125-T129 WeakPolarHBondContact O-CG2 3.42Å; E125-T129 PolarHBondContact O-N 3.01Å; E125-T129 PolarHBondContact O-OG1 2.95Å; R126-T129 WeakPolarHBondContact CA-OG1 3.45Å; R126-T129 PolarHBondContact O-OG1 3.05Å
130M68.1Low67.7Low68 Ų6881 Ų8134%0.33541%0.413SS..Hα-helixtrans-69.7-36.1175.8-68.2-169.9-167.900112.8R126 H127 I208 V212 R215R126-M130 WeakPolarHBondContact O-CB 3.47Å; R126-M130 VanDerWaalsContact O-CG 3.29Å; R126-M130 WeakPolarHBondContact O-CG 3.36Å; R126-M130 PolarHBondContact O-N 2.92Å; H127-M130 PolarHBondContact O-N 3.33Å; M130-I208 HydrophobicContact CE-CG2 4.12Å; M130-I208 HydrophobicContact SD-CG2 3.47Å; M130-I208 WeakPolarHBondContact SD-CG2 3.25Å; M130-V212 HydrophobicContact SD-CG2 4.01Å; M130-R215 PolarHBondContact O-NH1 2.92Å; M130-R215 PolarHBondContact O-NH2 3.01Å
131L69.7Low67Low73 Ų7382.3 Ų82.338%0.38242%0.423SS..Hα-helixtrans-64.4-50.8175.3-83.3171.8000111.8H127 L128 M133 L211 R215H127-L131 VanDerWaalsContact NE2-CD1 3.27Å; H127-L131 WeakPolarHBondContact NE2-CD1 3.37Å; H127-L131 WeakPolarHBondContact O-CB 3.41Å; H127-L131 WeakPolarHBondContact O-CG 3.37Å; H127-L131 PolarHBondContact O-N 3.29Å; L128-L131 PolarHBondContact O-N 3.19Å; L131-M133 PolarHBondContact O-N 3.34Å; L131-L211 HydrophobicContact CD2-CD1 3.35Å; L131-L211 HydrophobicContact CG-CD1 3.99Å; L131-R215 PolarHBondContact O-NH2 2.86Å
132K60.1Low66.9Low128 Ų12885.2 Ų85.256%0.55744%0.44SS*.Hα-helixtrans-82.8-3.7-165.1-68.9-173.1175179.50115.5L128 K134L128-K132 WeakPolarHBondContact O-CB 3.44Å; L128-K132 PolarHBondContact O-N 2.93Å; K132-K134 HydrophobicContact CB-CB 4.25Å; K132-K134 HydrophobicContact CB-CD 4.16Å; K132-K134 HydrophobicContact CB-CG 3.94Å; K132-K134 HydrophobicContact CD-CD 4.34Å; K132-K134 PolarHBondContact O-N 3.41Å
133M52.9Low67Low151 Ų15192.4 Ų92.474%0.74447%0.467SS*.THydrogen-bonded Turntrans40.627.9-170.6-64.2-165.6-158.500113L131 L135L131-M133 PolarHBondContact O-N 3.34Å; M133-L135 PolarHBondContact O-N 3.37Å; M133-L135 VanDerWaalsContact O-N 3.14Å
134K47.6Very low67Low140 Ų14092.9 Ų92.961%0.60947%0.47SS*.  trans-77.9113.7-172.3-90.4-175.8178-163.20106.9K132 H136K132-K134 HydrophobicContact CB-CB 4.25Å; K132-K134 HydrophobicContact CB-CD 4.16Å; K132-K134 HydrophobicContact CB-CG 3.94Å; K132-K134 HydrophobicContact CD-CD 4.34Å; K132-K134 PolarHBondContact O-N 3.41Å; K134-H136 PolarHBondContact O-N 2.99Å; K134-H136 VanDerWaalsContact O-N 3.09Å
135L47.2Very low67.2Low170 Ų17094.3 Ų94.389%0.8947%0.473SS*.  trans-40.9118.1155.3-16377.5000106M133 N137M133-L135 PolarHBondContact O-N 3.37Å; M133-L135 VanDerWaalsContact O-N 3.14Å; L135-N137 VanDerWaalsContact C-N 3.32Å; L135-N137 PolarHBondContact O-N 3.2Å
136H48.3Very low67.6Low107 Ų10797.6 Ų97.650%0.49549%0.49SS..  trans-3191.3-173.7-173.178.2000111.3K134 N138K134-H136 PolarHBondContact O-N 2.99Å; K134-H136 VanDerWaalsContact O-N 3.09Å; H136-N138 PolarHBondContact O-N 2.89Å; H136-N138 VanDerWaalsContact O-N 3.14Å
137N47.6Very low68.1Low127 Ų12797.1 Ų97.168%0.67949%0.493SS*.  trans-64.2123.6176.4-169.943.1000104.2L135 G139L135-N137 VanDerWaalsContact C-N 3.32Å; L135-N137 PolarHBondContact O-N 3.2Å; N137-G139 PolarHBondContact O-N 3.3Å
138N51.7Low68.8Low138 Ų13896.7 Ų96.774%0.73849%0.492SS*.  trans-55.288-178.2-16648.5000108.2H136 N140H136-N138 PolarHBondContact O-N 2.89Å; H136-N138 VanDerWaalsContact O-N 3.14Å; N138-N140 PolarHBondContact O-N 3.21Å
139G56.4Low69.5Low28 Ų2896.9 Ų96.929%0.28950%0.499SS..  trans-73124.3-169.600000107.6N137 T141N137-G139 PolarHBondContact O-N 3.3Å; G139-T141 PolarHBondContact O-N 3.47Å
140N66.5Low70.4Confident127 Ų12797 Ų9768%0.67950%0.5SS*.  trans-50.2109.6175.4-69.4-4.1000109N138 C142 R143N138-N140 PolarHBondContact O-N 3.21Å; N140-C142 PolarHBondContact O-N 3.4Å; N140-R143 WeakPolarHBondContact O-CB 3.32Å; N140-R143 PolarHBondContact O-N 3.28Å
141T74.8Confident71.6Confident64 Ų6494.7 Ų94.739%0.39349%0.49SS..Hα-helixtrans-51.2-31.6-179.5-47.90000111.6Y66 G139 R143 V144 F145Y66-T141 HydrophobicContact CE2-CG2 4.1Å; G139-T141 PolarHBondContact O-N 3.47Å; T141-R143 VanDerWaalsContact C-N 3.32Å; T141-R143 PolarHBondContact O-N 2.88Å; T141-V144 PolarHBondContact O-N 2.94Å; T141-V144 VanDerWaalsContact O-N 3.13Å; T141-F145 HydrophobicContact CG2-CD2 3.85Å; T141-F145 HydrophobicContact CG2-CE2 3.44Å; T141-F145 VanDerWaalsContact CG2-CE2 3.44Å; T141-F145 HydrophobicContact CG2-CZ 4.44Å; T141-F145 VanDerWaalsContact O-CD2 3.3Å; T141-F145 WeakPolarHBondContact O-CD2 3.37Å; T141-F145 PolarHBondContact O-N 3.26Å; T141-F145 VanDerWaalsContact O-N 3.16Å
142C82.5Confident72.9Confident82 Ų8294.2 Ų94.255%0.55448%0.483SS*.Hα-helixtrans-53.2-42.5171.8-178.40000113.5N140 V144 F145 M146N140-C142 PolarHBondContact O-N 3.4Å; C142-V144 VanDerWaalsContact C-N 3.31Å; C142-V144 PolarHBondContact O-N 3.14Å; C142-F145 PolarHBondContact O-N 3.46Å; C142-M146 WeakPolarHBondContact O-CG 2.9Å; C142-M146 PolarHBondContact O-N 3.01Å
143R84.8Confident74.6Confident165 Ų16593.1 Ų93.162%0.62348%0.483SS*.Hα-helixtrans-61.3-39.9178178.7-178.8170.7171.90.9112N140 T141 L147N140-R143 WeakPolarHBondContact O-CB 3.32Å; N140-R143 PolarHBondContact O-N 3.28Å; T141-R143 VanDerWaalsContact C-N 3.32Å; T141-R143 PolarHBondContact O-N 2.88Å; R143-L147 HydrophobicContact CG-CD1 4.23Å; R143-L147 WeakPolarHBondContact O-CG 3.49Å; R143-L147 PolarHBondContact O-N 3.48Å
144V83.1Confident76.6Confident9 Ų989.1 Ų89.16%0.05546%0.463CS..Hα-helixtrans-67.6-45-179.5179.60000110P63 F67 T141 C142 L147 I148P63-V144 HydrophobicContact CB-CG2 3.69Å; P63-V144 HydrophobicContact CG-CG2 4.25Å; F67-V144 HydrophobicContact CD2-CG1 4.16Å; F67-V144 HydrophobicContact CE1-CG1 4.34Å; F67-V144 HydrophobicContact CE2-CB 4.47Å; F67-V144 HydrophobicContact CE2-CG1 3.81Å; F67-V144 HydrophobicContact CE2-CG2 4.13Å; F67-V144 HydrophobicContact CZ-CB 4.49Å; F67-V144 HydrophobicContact CZ-CG1 3.9Å; F67-V144 HydrophobicContact CZ-CG2 4.5Å; T141-V144 PolarHBondContact O-N 2.94Å; T141-V144 VanDerWaalsContact O-N 3.13Å; C142-V144 VanDerWaalsContact C-N 3.31Å; C142-V144 PolarHBondContact O-N 3.14Å; V144-L147 PolarHBondContact O-N 2.91Å; V144-I148 HydrophobicContact CG1-CD1 3.94Å; V144-I148 WeakPolarHBondContact O-CG1 3.49Å; V144-I148 PolarHBondContact O-N 3.43Å
145F87.1Confident78.9Confident105 Ų10582.4 Ų82.446%0.46143%0.434SS..Hα-helixtrans-63-42.6175.9-74.6-62000112.4T141 C142 L147 I148 S149T141-F145 HydrophobicContact CG2-CD2 3.85Å; T141-F145 HydrophobicContact CG2-CE2 3.44Å; T141-F145 VanDerWaalsContact CG2-CE2 3.44Å; T141-F145 HydrophobicContact CG2-CZ 4.44Å; T141-F145 VanDerWaalsContact O-CD2 3.3Å; T141-F145 WeakPolarHBondContact O-CD2 3.37Å; T141-F145 PolarHBondContact O-N 3.26Å; T141-F145 VanDerWaalsContact O-N 3.16Å; C142-F145 PolarHBondContact O-N 3.46Å; F145-L147 VanDerWaalsContact C-N 3.33Å; F145-L147 PolarHBondContact O-N 3.05Å; F145-I148 PolarHBondContact O-N 3.29Å; F145-S149 WeakPolarHBondContact O-CB 3.42Å; F145-S149 PolarHBondContact O-N 2.96Å; F145-S149 PolarHBondContact O-OG 3.06Å; F145-S149 VanDerWaalsContact O-OG 3.11Å
146M88.4Confident81.2Confident112 Ų11276.7 Ų76.755%0.55241%0.412SS*.Hα-helixtrans-58.4-44.4174-74.2-168.7-65.700112C142 S149 T150C142-M146 WeakPolarHBondContact O-CG 2.9Å; C142-M146 PolarHBondContact O-N 3.01Å; M146-S149 PolarHBondContact O-N 2.92Å; M146-T150 PolarHBondContact O-N 3.36Å; M146-T150 PolarHBondContact O-OG1 3.4Å
147L87.3Confident83.4Confident74 Ų7475.9 Ų75.939%0.38741%0.41SS..Hα-helixtrans-62.9-43.6177.2-73.7169.7000112F67 R143 V144 F145 T150 V151F67-L147 HydrophobicContact CE1-CB 4.24Å; F67-L147 HydrophobicContact CZ-CB 4.3Å; F67-L147 HydrophobicContact CZ-CD1 3.89Å; R143-L147 HydrophobicContact CG-CD1 4.23Å; R143-L147 WeakPolarHBondContact O-CG 3.49Å; R143-L147 PolarHBondContact O-N 3.48Å; V144-L147 PolarHBondContact O-N 2.91Å; F145-L147 VanDerWaalsContact C-N 3.33Å; F145-L147 PolarHBondContact O-N 3.05Å; L147-T150 PolarHBondContact O-N 3.24Å; L147-V151 WeakPolarHBondContact O-CG2 3.24Å; L147-V151 PolarHBondContact O-N 3.34Å
148I91.3Very high85.6Confident22 Ų2270.9 Ų70.911%0.11338%0.383CS..Hα-helixtrans-60.3-48.6175.5-71168.4000110.1F67 N70 V144 F145 T150 V151 W152F67-I148 HydrophobicContact CD1-CG1 4.46Å; F67-I148 HydrophobicContact CE1-CG1 4.42Å; N70-I148 HydrophobicContact CB-CD1 4.1Å; N70-I148 HydrophobicContact CB-CG1 4.15Å; N70-I148 HydrophobicContact CB-CG2 4.5Å; N70-I148 VanDerWaalsContact OD1-CG2 3.26Å; N70-I148 WeakPolarHBondContact OD1-CG2 3.29Å; V144-I148 HydrophobicContact CG1-CD1 3.94Å; V144-I148 WeakPolarHBondContact O-CG1 3.49Å; V144-I148 PolarHBondContact O-N 3.43Å; F145-I148 PolarHBondContact O-N 3.29Å; I148-T150 VanDerWaalsContact C-N 3.32Å; I148-T150 PolarHBondContact O-N 2.74Å; I148-V151 WeakPolarHBondContact O-CB 3.48Å; I148-V151 PolarHBondContact O-N 2.97Å; I148-V151 VanDerWaalsContact O-N 3.12Å; I148-W152 PolarHBondContact O-N 3.01Å
149S92.3Very high87.6Confident77 Ų7764.5 Ų64.554%0.53835%0.349SS..Hα-helixtrans-58.8-42177.1-640000112.3F145 M146 W152 L153F145-S149 WeakPolarHBondContact O-CB 3.42Å; F145-S149 PolarHBondContact O-N 2.96Å; F145-S149 PolarHBondContact O-OG 3.06Å; F145-S149 VanDerWaalsContact O-OG 3.11Å; M146-S149 PolarHBondContact O-N 2.92Å; S149-W152 PolarHBondContact O-N 3.32Å; S149-L153 WeakPolarHBondContact O-CB 3.42Å; S149-L153 PolarHBondContact O-N 3.33Å
150T91.8Very high89.4Confident71 Ų7164 Ų6444%0.43635%0.345SS..Hα-helixtrans-62.7-41.6174.7-58.70000111.9M146 L147 I148 W152 L153 I154M146-T150 PolarHBondContact O-N 3.36Å; M146-T150 PolarHBondContact O-OG1 3.4Å; L147-T150 PolarHBondContact O-N 3.24Å; I148-T150 VanDerWaalsContact C-N 3.32Å; I148-T150 PolarHBondContact O-N 2.74Å; T150-W152 PolarHBondContact O-N 2.89Å; T150-L153 PolarHBondContact O-N 3.49Å; T150-I154 HydrophobicContact CG2-CD1 3.72Å; T150-I154 HydrophobicContact CG2-CG1 4.29Å; T150-I154 WeakPolarHBondContact O-CB 3.39Å; T150-I154 VanDerWaalsContact O-CG1 3.28Å; T150-I154 WeakPolarHBondContact O-CG1 3.11Å; T150-I154 PolarHBondContact O-N 3.5Å
151V93.2Very high90.8Very high18 Ų1859.9 Ų59.911%0.10932%0.322CS..Hα-helixtrans-59.5-47.7176.3165.80000111.1F117 L147 I148 I154 A155F117-V151 HydrophobicContact CB-CB 4.4Å; F117-V151 HydrophobicContact CB-CG1 3.69Å; F117-V151 HydrophobicContact CB-CG2 3.99Å; L147-V151 WeakPolarHBondContact O-CG2 3.24Å; L147-V151 PolarHBondContact O-N 3.34Å; I148-V151 WeakPolarHBondContact O-CB 3.48Å; I148-V151 PolarHBondContact O-N 2.97Å; I148-V151 VanDerWaalsContact O-N 3.12Å; V151-I154 PolarHBondContact O-N 3.34Å; V151-A155 VanDerWaalsContact O-CB 3.27Å; V151-A155 WeakPolarHBondContact O-CB 3.11Å; V151-A155 PolarHBondContact O-N 2.73Å
152W95.9Very high91.7Very high64 Ų6456.9 Ų56.924%0.24230%0.304CS..Hα-helixtrans-65.3-39.9178.1-77.7103.3000112.6N70 L73 L77 V110 A114 I148 S149 T150 A155 A156N70-W152 PolarHBondContact OD1-NE1 2.89Å; L73-W152 HydrophobicContact CD2-CZ2 4.15Å; L73-W152 HydrophobicContact CG-CZ2 4.27Å; L77-W152 HydrophobicContact CD1-CH2 3.51Å; L77-W152 HydrophobicContact CD1-CZ2 4.36Å; L77-W152 HydrophobicContact CD1-CZ3 4.13Å; V110-W152 HydrophobicContact CG1-CZ3 4.37Å; A114-W152 HydrophobicContact CB-CD2 4.46Å; A114-W152 HydrophobicContact CB-CE3 4.22Å; A114-W152 HydrophobicContact CB-CH2 3.98Å; A114-W152 HydrophobicContact CB-CZ2 4.26Å; A114-W152 HydrophobicContact CB-CZ3 3.98Å; I148-W152 PolarHBondContact O-N 3.01Å; S149-W152 PolarHBondContact O-N 3.32Å; T150-W152 PolarHBondContact O-N 2.89Å; W152-A155 PolarHBondContact O-N 2.96Å; W152-A156 VanDerWaalsContact O-CB 3.29Å; W152-A156 WeakPolarHBondContact O-CB 3.09Å; W152-A156 PolarHBondContact O-N 3Å
153L95.8Very high92.2Very high105 Ų10557.1 Ų57.155%0.5530%0.299SS..Hα-helixtrans-61.8-48.9176.5-179.662.6000111.2S149 T150 A155 A156 I157S149-L153 WeakPolarHBondContact O-CB 3.42Å; S149-L153 PolarHBondContact O-N 3.33Å; T150-L153 PolarHBondContact O-N 3.49Å; L153-A155 VanDerWaalsContact C-N 3.33Å; L153-A155 PolarHBondContact O-N 3.24Å; L153-A156 PolarHBondContact O-N 3.19Å; L153-I157 HydrophobicContact CD1-CD1 4.02Å; L153-I157 HydrophobicContact CD1-CG1 4.4Å; L153-I157 HydrophobicContact CG-CD1 3.93Å; L153-I157 VanDerWaalsContact O-CG1 3.25Å; L153-I157 WeakPolarHBondContact O-CG1 3.49Å; L153-I157 PolarHBondContact O-N 2.99Å
154I94.6Very high92.5Very high66 Ų6657.1 Ų57.134%0.33831%0.308SS..Hα-helixtrans-62.3-43.2177.6-66.4169.3000110.5F117 T150 V151 I157 L158F117-I154 HydrophobicContact CD2-CG2 4.36Å; F117-I154 HydrophobicContact CE2-CG2 3.61Å; F117-I154 HydrophobicContact CZ-CG2 3.74Å; T150-I154 HydrophobicContact CG2-CD1 3.72Å; T150-I154 HydrophobicContact CG2-CG1 4.29Å; T150-I154 WeakPolarHBondContact O-CB 3.39Å; T150-I154 VanDerWaalsContact O-CG1 3.28Å; T150-I154 WeakPolarHBondContact O-CG1 3.11Å; T150-I154 PolarHBondContact O-N 3.5Å; V151-I154 PolarHBondContact O-N 3.34Å; I154-I157 PolarHBondContact O-N 3.49Å; I154-L158 HydrophobicContact CG2-CD1 3.87Å; I154-L158 HydrophobicContact CG2-CG 4.3Å; I154-L158 WeakPolarHBondContact O-CB 3.45Å; I154-L158 WeakPolarHBondContact O-CG 3.43Å; I154-L158 PolarHBondContact O-N 2.78Å
155A96Very high92.9Very high0 Ų059 Ų590%033%0.33CS..Hα-helixtrans-60.7-46.3177.700000112.1V110 A113 A114 V151 W152 L153 L158 G159V110-A155 HydrophobicContact CG1-CB 4.13Å; A113-A155 HydrophobicContact CB-CB 3.67Å; A114-A155 HydrophobicContact CB-CB 4.12Å; V151-A155 VanDerWaalsContact O-CB 3.27Å; V151-A155 WeakPolarHBondContact O-CB 3.11Å; V151-A155 PolarHBondContact O-N 2.73Å; W152-A155 PolarHBondContact O-N 2.96Å; L153-A155 VanDerWaalsContact C-N 3.33Å; L153-A155 PolarHBondContact O-N 3.24Å; A155-L158 PolarHBondContact O-N 2.98Å; A155-G159 PolarHBondContact O-N 3.27Å
156A95.6Very high93.3Very high50 Ų5058.4 Ų58.441%0.41332%0.324SS..Hα-helixtrans-63.3-43.1177.900000112.1W152 L153 G160W152-A156 VanDerWaalsContact O-CB 3.29Å; W152-A156 WeakPolarHBondContact O-CB 3.09Å; W152-A156 PolarHBondContact O-N 3Å; L153-A156 PolarHBondContact O-N 3.19Å; A156-G160 PolarHBondContact O-N 3.44Å
157I95.3Very high93.5Very high90 Ų9054.9 Ų54.946%0.46231%0.307SS..Hα-helixtrans-60.4-54.4175.3-68.5165.7000109.6L153 I154 G159 G160 L161L153-I157 HydrophobicContact CD1-CD1 4.02Å; L153-I157 HydrophobicContact CD1-CG1 4.4Å; L153-I157 HydrophobicContact CG-CD1 3.93Å; L153-I157 VanDerWaalsContact O-CG1 3.25Å; L153-I157 WeakPolarHBondContact O-CG1 3.49Å; L153-I157 PolarHBondContact O-N 2.99Å; I154-I157 PolarHBondContact O-N 3.49Å; I157-G159 VanDerWaalsContact C-N 3.33Å; I157-G159 PolarHBondContact O-N 2.86Å; I157-G160 PolarHBondContact O-N 3.06Å; I157-L161 WeakPolarHBondContact O-CG 3.25Å; I157-L161 PolarHBondContact O-N 3.23Å
158L94.1Very high93.9Very high22 Ų2251.4 Ų51.412%0.11529%0.289CS..Hα-helixtrans-58.9-41.6-178.1-73.4175.2000112.9F117 I154 A155 G160 L161 Y186 F189F117-L158 HydrophobicContact CE2-CD1 3.82Å; F117-L158 HydrophobicContact CZ-CD1 4.05Å; I154-L158 HydrophobicContact CG2-CD1 3.87Å; I154-L158 HydrophobicContact CG2-CG 4.3Å; I154-L158 WeakPolarHBondContact O-CB 3.45Å; I154-L158 WeakPolarHBondContact O-CG 3.43Å; I154-L158 PolarHBondContact O-N 2.78Å; A155-L158 PolarHBondContact O-N 2.98Å; L158-G160 VanDerWaalsContact C-N 3.34Å; L158-L161 HydrophobicContact CD2-CD1 4.25Å; L158-Y186 PolarHBondContact O-OH 3.21Å; L158-F189 HydrophobicContact CD2-CE1 3.74Å; L158-F189 HydrophobicContact CD2-CZ 4.19Å
159G93.7Very high93.9Very high3 Ų353 Ų533%0.03130%0.297CS..Hα-helixtrans-71.9-26.3176.300000113.8A155 I157A155-G159 PolarHBondContact O-N 3.27Å; I157-G159 VanDerWaalsContact C-N 3.33Å; I157-G159 PolarHBondContact O-N 2.86Å
160G94.3Very high93.8Very high18 Ų1858.9 Ų58.919%0.18632%0.316CS..Hα-helixtrans-89.7-16.5-178.400000115.7A156 I157 L158 P162 I163 M164A156-G160 PolarHBondContact O-N 3.44Å; I157-G160 PolarHBondContact O-N 3.06Å; L158-G160 VanDerWaalsContact C-N 3.34Å; G160-P162 VanDerWaalsContact C-N 3.32Å; G160-I163 WeakPolarHBondContact O-CA 3.07Å; G160-I163 WeakPolarHBondContact O-CB 3.47Å; G160-I163 PolarHBondContact O-N 3.36Å; G160-M164 PolarHBondContact O-N 3.08Å
161L94.5Very high93.7Very high41 Ų4157.9 Ų57.922%0.21531%0.313CS..THydrogen-bonded Turntrans-49.6-39.8179.8-74.3172.9000114.9I157 L158 I163 M164 G165 W166 Y186 F189I157-L161 WeakPolarHBondContact O-CG 3.25Å; I157-L161 PolarHBondContact O-N 3.23Å; L158-L161 HydrophobicContact CD2-CD1 4.25Å; L161-I163 VanDerWaalsContact C-N 3.31Å; L161-I163 PolarHBondContact O-N 2.94Å; L161-M164 PolarHBondContact O-N 2.97Å; L161-G165 PolarHBondContact O-N 3.21Å; L161-W166 HydrophobicContact CD1-CE3 4.18Å; L161-W166 HydrophobicContact CD1-CZ3 4.28Å; L161-W166 PolarHBondContact O-N 2.96Å; L161-Y186 HydrophobicContact CB-CD2 4.35Å; L161-Y186 HydrophobicContact CB-CE2 3.89Å; L161-Y186 HydrophobicContact CD1-CE2 4.33Å; L161-F189 HydrophobicContact CD1-CE1 4.34Å
162P93.8Very high93.4Very high0 Ų060.1 Ų60.10%032%0.323CS..THydrogen-bonded Turntrans-64-35.1176.7-21.132.8000113.3F102 G160 M164 G165 N167 Y182 Y186F102-P162 HydrophobicContact CD1-CB 4.03Å; F102-P162 HydrophobicContact CE1-CB 4.04Å; G160-P162 VanDerWaalsContact C-N 3.32Å; P162-M164 VanDerWaalsContact C-N 3.28Å; P162-G165 PolarHBondContact O-N 3.21Å; P162-N167 PolarHBondContact O-ND2 3.5Å; P162-Y182 HydrophobicContact CB-CD1 4.38Å; P162-Y182 HydrophobicContact CB-CE1 4Å; P162-Y182 HydrophobicContact CG-CD1 3.92Å; P162-Y182 HydrophobicContact CG-CE1 3.31Å; P162-Y186 HydrophobicContact CG-CD1 4.3Å; P162-Y186 HydrophobicContact CG-CD2 4.12Å; P162-Y186 HydrophobicContact CG-CE1 3.89Å; P162-Y186 HydrophobicContact CG-CE2 3.69Å; P162-Y186 HydrophobicContact CG-CG 4.38Å
163I93.1Very high93.1Very high88 Ų8861.6 Ų61.645%0.45134%0.34SS..THydrogen-bonded Turntrans-67.2-35.4176.2-58.9170.8000109.9F102 G160 L161 G165F102-I163 HydrophobicContact CB-CD1 4.05Å; F102-I163 HydrophobicContact CB-CG1 3.52Å; F102-I163 HydrophobicContact CG-CG1 4.11Å; G160-I163 WeakPolarHBondContact O-CA 3.07Å; G160-I163 WeakPolarHBondContact O-CB 3.47Å; G160-I163 PolarHBondContact O-N 3.36Å; L161-I163 VanDerWaalsContact C-N 3.31Å; L161-I163 PolarHBondContact O-N 2.94Å; I163-G165 PolarHBondContact O-N 3.42Å
164M91.3Very high93Very high164 Ų16458.3 Ų58.381%0.80833%0.326SS*.THydrogen-bonded Turntrans-77.9-0.5178.5-61-173.4118.500114.1G160 L161 P162G160-M164 PolarHBondContact O-N 3.08Å; L161-M164 PolarHBondContact O-N 2.97Å; P162-M164 VanDerWaalsContact C-N 3.28Å
165G91.6Very high93Very high50 Ų5055.1 Ų55.152%0.51531%0.31SS..THydrogen-bonded Turntrans128.4-9.3171.300000115.7L161 P162 I163 N167L161-G165 PolarHBondContact O-N 3.21Å; P162-G165 PolarHBondContact O-N 3.21Å; I163-G165 PolarHBondContact O-N 3.42Å; G165-N167 PolarHBondContact O-N 2.93Å
166W94.7Very high92.9Very high92 Ų9255.1 Ų55.135%0.34831%0.31SS..  trans-81.956.4177.6-157.9-12.2000112.1L161 T185 Y186 F189L161-W166 HydrophobicContact CD1-CE3 4.18Å; L161-W166 HydrophobicContact CD1-CZ3 4.28Å; L161-W166 PolarHBondContact O-N 2.96Å; W166-T185 PolarHBondContact NE1-OG1 3.48Å; W166-T185 VanDerWaalsContact NE1-OG1 3.08Å; W166-Y186 HydrophobicContact CD2-CD2 4.07Å; W166-Y186 HydrophobicContact CE3-CD2 4.12Å; W166-Y186 HydrophobicContact CG-CD2 4.27Å; W166-F189 HydrophobicContact CH2-CB 4.05Å; W166-F189 HydrophobicContact CH2-CD1 4.1Å; W166-F189 HydrophobicContact CH2-CD2 4.44Å; W166-F189 AromaticContact CH2-CG 3.94Å; W166-F189 HydrophobicContact CH2-CG 3.94Å; W166-F189 HydrophobicContact CZ2-CB 4.39Å; W166-F189 HydrophobicContact CZ3-CD1 4.16Å; W166-F189 HydrophobicContact CZ3-CE1 4.46Å; W166-F189 HydrophobicContact CZ3-CG 4.44Å
167N94.4Very high92.8Very high37 Ų3752.8 Ų52.820%0.19829%0.291CS..BIsolated β-bridgetrans-124.4176.3-179.962.566.7000110.9F102 P162 G165 I169F102-N167 HydrophobicContact CE1-CB 3.99Å; F102-N167 HydrophobicContact CZ-CB 3.66Å; P162-N167 PolarHBondContact O-ND2 3.5Å; G165-N167 PolarHBondContact O-N 2.93Å; N167-I169 HydrophobicContact CB-CG1 4.46Å; N167-I169 WeakPolarHBondContact OD1-CB 3.32Å; N167-I169 WeakPolarHBondContact OD1-CD1 3.5Å; N167-I169 WeakPolarHBondContact OD1-CG1 3.42Å; N167-I169 PolarHBondContact OD1-N 3.32Å
168C94.3Very high92.6Very high1 Ų149.2 Ų49.21%0.00727%0.273CS..  trans-110.719.2-176.869.60000113.8Q170 S171 C175 L181 Y182 H183C168-Q170 PolarHBondContact O-N 3.3Å; C168-Q170 VanDerWaalsContact O-N 3.11Å; C168-S171 CarbonylContact O-C 3.6Å; C168-S171 VanDerWaalsContact O-C 3.24Å; C168-S171 PolarHBondContact O-N 2.89Å; C168-C175 HydrophobicContact CB-CB 4.02Å; C168-C175 WeakPolarHBondContact CB-SG 3.46Å; C168-C175 WeakPolarHBondContact SG-CA 3.4Å; C168-C175 WeakPolarHBondContact SG-CB 3.19Å; C168-C175 CovalentContact SG-SG 2.03Å; C168-C175 PolarHBondContact SG-SG 3.02Å; C168-L181 PolarHBondContact N-O 2.98Å; C168-L181 PolarHBondContact SG-O 3.44Å; C168-L181 VanDerWaalsContact SG-O 3.42Å; C168-Y182 PolarHBondContact SG-O 2.9Å; C168-H183 HydrophobicContact CB-CB 4.27Å
169I91.4Very high92.6Very high55 Ų5548.9 Ų48.928%0.28227%0.271SS..THydrogen-bonded Turntrans-54.8-38.2-172.3-67.2169.1000112.7L9 F102 N167L9-I169 HydrophobicContact CD1-CG2 4.22Å; L9-I169 HydrophobicContact CD2-CG2 3.98Å; F102-I169 HydrophobicContact CE2-CD1 3.96Å; F102-I169 HydrophobicContact CZ-CD1 4.13Å; F102-I169 HydrophobicContact CZ-CG1 4.43Å; N167-I169 HydrophobicContact CB-CG1 4.46Å; N167-I169 WeakPolarHBondContact OD1-CB 3.32Å; N167-I169 WeakPolarHBondContact OD1-CD1 3.5Å; N167-I169 WeakPolarHBondContact OD1-CG1 3.42Å; N167-I169 PolarHBondContact OD1-N 3.32Å
170Q89.8Confident92.6Very high201 Ų20148.8 Ų48.894%0.93927%0.27SS*.THydrogen-bonded Turntrans-91.8-14-179.7-63.6-180-3.900113.3C168C168-Q170 PolarHBondContact O-N 3.3Å; C168-Q170 VanDerWaalsContact O-N 3.11Å
171S89.8Confident92.6Very high51 Ų5148 Ų4836%0.35726%0.261SS..  trans-130.281.1-175.8-175.70000110.9C168 P173 S174C168-S171 CarbonylContact O-C 3.6Å; C168-S171 VanDerWaalsContact O-C 3.24Å; C168-S171 PolarHBondContact O-N 2.89Å; S171-P173 VanDerWaalsContact C-CD 3.4Å; S171-S174 PolarHBondContact O-N 3.11Å; S171-S174 PolarHBondContact OG-OG 2.95Å; S171-S174 VanDerWaalsContact OG-OG 3.13Å
172M87.9Confident92.6Very high65 Ų6546 Ų4632%0.3225%0.251SS..G310 helixtrans-54.9-40.7-180-70.6-166.9-74.200114.5R12 F16 S174 C175R12-M172 HydrophobicContact CG-SD 4.11Å; F16-M172 HydrophobicContact CB-SD 4.3Å; F16-M172 HydrophobicContact CD1-CB 3.94Å; F16-M172 HydrophobicContact CD2-SD 4.46Å; F16-M172 VanDerWaalsContact CE1-C 3.49Å; F16-M172 HydrophobicContact CE1-CB 3.87Å; F16-M172 WeakPolarHBondContact CE1-O 3.43Å; F16-M172 HydrophobicContact CE2-CB 4.5Å; F16-M172 HydrophobicContact CG-CB 4.27Å; F16-M172 HydrophobicContact CG-SD 4.29Å; F16-M172 HydrophobicContact CZ-CB 4.18Å; M172-S174 PolarHBondContact O-N 3.36Å; M172-S174 VanDerWaalsContact O-N 3.12Å; M172-C175 VanDerWaalsContact O-CB 3.27Å; M172-C175 WeakPolarHBondContact O-CB 3.2Å; M172-C175 PolarHBondContact O-N 2.72Å; M172-C175 PolarHBondContact O-SG 3.22Å
173P90.1Very high92.7Very high94 Ų9447.9 Ų47.961%0.6126%0.259SS*.G310 helixtrans-60.6-24.7-179.7-24.234.9000114.2S171 C175S171-P173 VanDerWaalsContact C-CD 3.4Å; P173-C175 VanDerWaalsContact C-N 3.34Å
174S92.7Very high92.8Very high36 Ų3644.9 Ų44.925%0.25224%0.243SC..G310 helixtrans-90.53.3-179.4-47.60000113.4S171 M172 H183 K184S171-S174 PolarHBondContact O-N 3.11Å; S171-S174 PolarHBondContact OG-OG 2.95Å; S171-S174 VanDerWaalsContact OG-OG 3.13Å; M172-S174 PolarHBondContact O-N 3.36Å; M172-S174 VanDerWaalsContact O-N 3.12Å; S174-H183 WeakPolarHBondContact CB-NE2 3.33Å; S174-K184 WeakPolarHBondContact O-CG 3.48Å; S174-K184 PolarHBondContact O-N 3.37Å
175C94.6Very high93Very high0 Ų040.3 Ų40.30%023%0.225CC..BIsolated β-bridgetrans-74.9147.1179-66.50000112.9C168 M172 P173 P180 K184C168-C175 HydrophobicContact CB-CB 4.02Å; C168-C175 WeakPolarHBondContact CB-SG 3.46Å; C168-C175 WeakPolarHBondContact SG-CA 3.4Å; C168-C175 WeakPolarHBondContact SG-CB 3.19Å; C168-C175 CovalentContact SG-SG 2.03Å; C168-C175 PolarHBondContact SG-SG 3.02Å; M172-C175 VanDerWaalsContact O-CB 3.27Å; M172-C175 WeakPolarHBondContact O-CB 3.2Å; M172-C175 PolarHBondContact O-N 2.72Å; M172-C175 PolarHBondContact O-SG 3.22Å; P173-C175 VanDerWaalsContact C-N 3.34Å; C175-P180 PolarHBondContact SG-O 3.39Å; C175-K184 VanDerWaalsContact O-CE 3.28Å; C175-K184 WeakPolarHBondContact O-CE 3.29Å
176S94.6Very high93.2Very high0 Ų037.9 Ų37.90%020%0.2CC..  trans-71.5143.2169.9161.70000111T17 V178 L179 P180 Y182 D269T17-S176 WeakPolarHBondContact CG2-O 3.03Å; S176-V178 PolarHBondContact OG-N 2.68Å; S176-V178 VanDerWaalsContact OG-N 3.15Å; S176-L179 WeakPolarHBondContact CB-O 3.31Å; S176-L179 CarbonylContact O-C 3.55Å; S176-L179 PolarHBondContact OG-N 3.33Å; S176-P180 WeakPolarHBondContact O-CA 3.41Å; S176-Y182 PolarHBondContact N-O 3.17Å; S176-D269 WeakPolarHBondContact CB-OD2 3.41Å; S176-D269 PolarHBondContact OG-OD2 2.94Å
177T92.4Very high93.2Very high1 Ų133.6 Ų33.61%0.00618%0.184CC..SBendtrans-76.8-36.1170.7-52.70000110K19 D269 L280 Y281K19-T177 VanDerWaalsContact CD-O 3.27Å; K19-T177 WeakPolarHBondContact CD-O 3.48Å; K19-T177 WeakPolarHBondContact CE-O 3.36Å; K19-T177 PolarHBondContact NZ-O 3.09Å; T177-D269 WeakPolarHBondContact CA-OD1 3.32Å; T177-D269 VanDerWaalsContact CB-OD1 3.26Å; T177-D269 WeakPolarHBondContact CB-OD1 3.47Å; T177-D269 PolarHBondContact N-OD1 3.42Å; T177-L280 HydrophobicContact CG2-CB 4.11Å; T177-L280 HydrophobicContact CG2-CD2 4.29Å; T177-Y281 HydrophobicContact CG2-CE1 4.22Å
178V92.6Very high93.3Very high14 Ų1435.1 Ų35.19%0.08519%0.192CC..SBendtrans-65-47178.1179.80000110.9K19 S176 L265 L266 D269 L280 A283K19-V178 VanDerWaalsContact NZ-CA 3.34Å; K19-V178 PolarHBondContact NZ-O 2.9Å; S176-V178 PolarHBondContact OG-N 2.68Å; S176-V178 VanDerWaalsContact OG-N 3.15Å; V178-L265 HydrophobicContact CG2-CD2 4.44Å; V178-L266 HydrophobicContact CG1-CD2 4.41Å; V178-D269 HydrophobicContact CG2-CB 3.9Å; V178-D269 PolarHBondContact N-OD1 3.11Å; V178-D269 VanDerWaalsContact N-OD1 3.13Å; V178-L280 HydrophobicContact CG2-CB 4.26Å; V178-L280 HydrophobicContact CG2-CG 4.2Å; V178-A283 HydrophobicContact CG1-CB 3.75Å; V178-A283 HydrophobicContact CG2-CB 4.28Å
179L93.7Very high93.4Very high16 Ų1638.8 Ų38.88%0.08421%0.208CC..SBendtrans-122.791.5-179.6-68.6104.8000110.7W101 E105 F109 S176 L181 Y182 I187 L266W101-L179 HydrophobicContact CH2-CB 4.2Å; E105-L179 HydrophobicContact CB-CD2 4.13Å; E105-L179 HydrophobicContact CG-CD2 4.22Å; F109-L179 HydrophobicContact CE2-CD2 3.96Å; S176-L179 WeakPolarHBondContact CB-O 3.31Å; S176-L179 CarbonylContact O-C 3.55Å; S176-L179 PolarHBondContact OG-N 3.33Å; L179-L181 PolarHBondContact O-N 3.28Å; L179-Y182 HydrophobicContact CB-CD2 3.84Å; L179-Y182 HydrophobicContact CB-CG 3.98Å; L179-Y182 HydrophobicContact CD2-CD2 3.83Å; L179-Y182 HydrophobicContact CD2-CE2 3.92Å; L179-Y182 HydrophobicContact CD2-CG 4.21Å; L179-Y182 HydrophobicContact CG-CD2 4.49Å; L179-Y182 PolarHBondContact O-N 3.06Å; L179-I187 HydrophobicContact CD1-CD1 3.93Å; L179-L266 HydrophobicContact CD1-CD2 4.45Å
180P92.6Very high93.5Very high1 Ų136.3 Ų36.31%0.00620%0.195CC..THydrogen-bonded Turntrans-60-15.7-166.2-30.638.4000118.4H13 Y14 T17 K19 C175 S176H13-P180 HydrophobicContact CB-CB 4.09Å; H13-P180 PolarHBondContact CD2-O 3.42Å; H13-P180 VanDerWaalsContact CD2-O 3.28Å; Y14-P180 HydrophobicContact CD1-CG 4.24Å; Y14-P180 HydrophobicContact CD2-CB 3.88Å; Y14-P180 HydrophobicContact CD2-CG 3.93Å; Y14-P180 HydrophobicContact CE1-CG 4.13Å; Y14-P180 HydrophobicContact CE2-CB 3.98Å; Y14-P180 HydrophobicContact CE2-CG 3.84Å; Y14-P180 HydrophobicContact CG-CB 4.41Å; Y14-P180 HydrophobicContact CG-CG 4.15Å; T17-P180 HydrophobicContact CG2-CB 3.97Å; T17-P180 HydrophobicContact CG2-CG 4.24Å; K19-P180 HydrophobicContact CD-CG 4.19Å; C175-P180 PolarHBondContact SG-O 3.39Å; S176-P180 WeakPolarHBondContact O-CA 3.41Å
181L93.8Very high93.8Very high0 Ų026.9 Ų26.90%015%0.151CC..THydrogen-bonded Turntrans-105.5-5.6176.1-7665000112.9I10 H13 Y14 P98 W101 F102 C168 L179I10-L181 HydrophobicContact CG1-CD2 4.41Å; H13-L181 HydrophobicContact CB-CD1 3.83Å; Y14-L181 HydrophobicContact CE2-CD1 4.31Å; P98-L181 HydrophobicContact CB-CD2 4.45Å; W101-L181 HydrophobicContact CD2-CD1 4.36Å; W101-L181 HydrophobicContact CD2-CD2 4.02Å; W101-L181 HydrophobicContact CE3-CB 3.87Å; W101-L181 HydrophobicContact CE3-CD1 4.48Å; W101-L181 HydrophobicContact CE3-CD2 3.77Å; W101-L181 HydrophobicContact CE3-CG 4.26Å; W101-L181 HydrophobicContact CG-CD2 4.39Å; W101-L181 HydrophobicContact CH2-CB 3.91Å; W101-L181 HydrophobicContact CH2-CD1 4.48Å; W101-L181 HydrophobicContact CZ2-CD1 4.34Å; W101-L181 HydrophobicContact CZ3-CB 3.5Å; W101-L181 HydrophobicContact CZ3-CD2 4.3Å; W101-L181 HydrophobicContact CZ3-CG 4.32Å; F102-L181 HydrophobicContact CE1-CB 3.95Å; F102-L181 HydrophobicContact CE2-CD2 4.26Å; F102-L181 HydrophobicContact CZ-CB 3.86Å; F102-L181 HydrophobicContact CZ-CD2 4.14Å; C168-L181 PolarHBondContact N-O 2.98Å; C168-L181 PolarHBondContact SG-O 3.44Å; C168-L181 VanDerWaalsContact SG-O 3.42Å; L179-L181 PolarHBondContact O-N 3.28Å
182Y95.4Very high94Very high1 Ų127.9 Ų27.90%0.00416%0.155CC..BIsolated β-bridgetrans-87.5141.4178.4-83.6-112.9000111W101 F102 E105 G106 F109 P162 C168 S176 L179 Y186 I187W101-Y182 HydrophobicContact CE3-CE2 4.41Å; W101-Y182 AromaticContact CH2-CD2 3.57Å; W101-Y182 HydrophobicContact CH2-CD2 3.57Å; W101-Y182 AromaticContact CH2-CE2 3.82Å; W101-Y182 HydrophobicContact CH2-CE2 3.82Å; W101-Y182 AromaticContact CZ3-CD2 3.4Å; W101-Y182 HydrophobicContact CZ3-CD2 3.4Å; W101-Y182 VanDerWaalsContact CZ3-CD2 3.4Å; W101-Y182 AromaticContact CZ3-CE2 3.36Å; W101-Y182 HydrophobicContact CZ3-CE2 3.36Å; F102-Y182 AromaticContact CD1-CE2 3.97Å; F102-Y182 HydrophobicContact CD1-CE2 3.97Å; F102-Y182 HydrophobicContact CE1-CD2 4.36Å; F102-Y182 HydrophobicContact CE1-CE2 4.26Å; E105-Y182 HydrophobicContact CB-CE2 3.82Å; E105-Y182 HydrophobicContact CG-CE2 4.47Å; G106-Y182 WeakPolarHBondContact CA-OH 3.08Å; G106-Y182 PolarHBondContact N-OH 3.02Å; F109-Y182 HydrophobicContact CD2-CE1 4.43Å; F109-Y182 HydrophobicContact CE2-CE1 4.11Å; F109-Y182 HydrophobicContact CZ-CE1 4.5Å; P162-Y182 HydrophobicContact CB-CD1 4.38Å; P162-Y182 HydrophobicContact CB-CE1 4Å; P162-Y182 HydrophobicContact CG-CD1 3.92Å; P162-Y182 HydrophobicContact CG-CE1 3.31Å; C168-Y182 PolarHBondContact SG-O 2.9Å; S176-Y182 PolarHBondContact N-O 3.17Å; L179-Y182 HydrophobicContact CB-CD2 3.84Å; L179-Y182 HydrophobicContact CB-CG 3.98Å; L179-Y182 HydrophobicContact CD2-CD2 3.83Å; L179-Y182 HydrophobicContact CD2-CE2 3.92Å; L179-Y182 HydrophobicContact CD2-CG 4.21Å; L179-Y182 HydrophobicContact CG-CD2 4.49Å; L179-Y182 PolarHBondContact O-N 3.06Å; Y182-Y186 AromaticContact CD1-CD1 3.38Å; Y182-Y186 HydrophobicContact CD1-CD1 3.38Å; Y182-Y186 AromaticContact CD1-CE1 3.35Å; Y182-Y186 HydrophobicContact CD1-CE1 3.35Å; Y182-Y186 HydrophobicContact CD1-CG 4.4Å; Y182-Y186 AromaticContact CE1-CD1 3.82Å; Y182-Y186 HydrophobicContact CE1-CD1 3.82Å; Y182-Y186 AromaticContact CE1-CE1 3.25Å; Y182-Y186 HydrophobicContact CE1-CE1 3.25Å; Y182-Y186 AromaticContact CE1-CZ 3.92Å; Y182-I187 HydrophobicContact CD1-CD1 3.82Å; Y182-I187 HydrophobicContact CG-CD1 4.19Å
183H95.8Very high94.3Very high38 Ų3826.8 Ų26.818%0.17615%0.152CC..BIsolated β-bridgetrans-77.5135.7175.2-162.5-83.5000110.9C168 S174 T185 Y186 I187C168-H183 HydrophobicContact CB-CB 4.27Å; S174-H183 WeakPolarHBondContact CB-NE2 3.33Å; H183-T185 VanDerWaalsContact C-N 3.25Å; H183-T185 PolarHBondContact CE1-OG1 3.35Å; H183-T185 VanDerWaalsContact CE1-OG1 3.28Å; H183-T185 PolarHBondContact ND1-N 2.96Å; H183-T185 PolarHBondContact ND1-OG1 2.9Å; H183-T185 PolarHBondContact O-N 2.84Å; H183-Y186 WeakPolarHBondContact O-CB 3.42Å; H183-Y186 PolarHBondContact O-N 3.38Å; H183-I187 PolarHBondContact O-N 2.88Å
184K94.7Very high94.4Very high25 Ų2522.6 Ų22.611%0.10912%0.124CC..Hα-helixtrans-54.5-39.1179.7-76.8-179.8169.8-163.80113.1S174 C175 Y186 I187 L188 D269 V270 C272S174-K184 WeakPolarHBondContact O-CG 3.48Å; S174-K184 PolarHBondContact O-N 3.37Å; C175-K184 VanDerWaalsContact O-CE 3.28Å; C175-K184 WeakPolarHBondContact O-CE 3.29Å; K184-Y186 VanDerWaalsContact C-N 3.34Å; K184-Y186 PolarHBondContact O-N 2.84Å; K184-I187 PolarHBondContact O-N 3.06Å; K184-L188 WeakPolarHBondContact O-CB 3.49Å; K184-L188 PolarHBondContact O-N 2.94Å; K184-D269 VanDerWaalsContact CE-O 3.25Å; K184-D269 WeakPolarHBondContact CE-O 3.38Å; K184-D269 PolarHBondContact NZ-O 3.4Å; K184-V270 HydrophobicContact CB-CG2 4.41Å; K184-V270 PolarHBondContact NZ-O 3.36Å; K184-V270 WeakPolarHBondContact O-CG2 3.36Å; K184-C272 PolarHBondContact NZ-O 2.94Å
185T95.6Very high94.4Very high68 Ų6822.5 Ų22.542%0.41712%0.124SC..Hα-helixtrans-66.4-32.5178.263.80000113.5W166 H183 F189W166-T185 PolarHBondContact NE1-OG1 3.48Å; W166-T185 VanDerWaalsContact NE1-OG1 3.08Å; H183-T185 VanDerWaalsContact C-N 3.25Å; H183-T185 PolarHBondContact CE1-OG1 3.35Å; H183-T185 VanDerWaalsContact CE1-OG1 3.28Å; H183-T185 PolarHBondContact ND1-N 2.96Å; H183-T185 PolarHBondContact ND1-OG1 2.9Å; H183-T185 PolarHBondContact O-N 2.84Å; T185-F189 WeakPolarHBondContact O-CB 3.21Å; T185-F189 PolarHBondContact O-N 3.1Å
186Y95.8Very high94.4Very high0 Ų027.1 Ų27.10%015%0.152CC..Hα-helixtrans-67.3-45.3173.2168.5-85000110.4F109 L158 L161 P162 W166 Y182 H183 K184 L188 F189 C190F109-Y186 HydrophobicContact CE1-CE1 4.13Å; F109-Y186 HydrophobicContact CZ-CE1 4.32Å; L158-Y186 PolarHBondContact O-OH 3.21Å; L161-Y186 HydrophobicContact CB-CD2 4.35Å; L161-Y186 HydrophobicContact CB-CE2 3.89Å; L161-Y186 HydrophobicContact CD1-CE2 4.33Å; P162-Y186 HydrophobicContact CG-CD1 4.3Å; P162-Y186 HydrophobicContact CG-CD2 4.12Å; P162-Y186 HydrophobicContact CG-CE1 3.89Å; P162-Y186 HydrophobicContact CG-CE2 3.69Å; P162-Y186 HydrophobicContact CG-CG 4.38Å; W166-Y186 HydrophobicContact CD2-CD2 4.07Å; W166-Y186 HydrophobicContact CE3-CD2 4.12Å; W166-Y186 HydrophobicContact CG-CD2 4.27Å; Y182-Y186 AromaticContact CD1-CD1 3.38Å; Y182-Y186 HydrophobicContact CD1-CD1 3.38Å; Y182-Y186 AromaticContact CD1-CE1 3.35Å; Y182-Y186 HydrophobicContact CD1-CE1 3.35Å; Y182-Y186 HydrophobicContact CD1-CG 4.4Å; Y182-Y186 AromaticContact CE1-CD1 3.82Å; Y182-Y186 HydrophobicContact CE1-CD1 3.82Å; Y182-Y186 AromaticContact CE1-CE1 3.25Å; Y182-Y186 HydrophobicContact CE1-CE1 3.25Å; Y182-Y186 AromaticContact CE1-CZ 3.92Å; H183-Y186 WeakPolarHBondContact O-CB 3.42Å; H183-Y186 PolarHBondContact O-N 3.38Å; K184-Y186 VanDerWaalsContact C-N 3.34Å; K184-Y186 PolarHBondContact O-N 2.84Å; Y186-L188 VanDerWaalsContact C-N 3.29Å; Y186-L188 PolarHBondContact O-N 3.24Å; Y186-F189 WeakPolarHBondContact O-CB 3.38Å; Y186-F189 PolarHBondContact O-N 3.42Å; Y186-C190 PolarHBondContact O-N 2.83Å
187I95.6Very high94.3Very high1 Ų127.9 Ų27.91%0.00516%0.156CC..Hα-helixtrans-59.9-43177.4-62.8-61.2000110.5F109 L179 Y182 H183 K184 T191 L266 V270F109-I187 HydrophobicContact CZ-CD1 3.95Å; L179-I187 HydrophobicContact CD1-CD1 3.93Å; Y182-I187 HydrophobicContact CD1-CD1 3.82Å; Y182-I187 HydrophobicContact CG-CD1 4.19Å; H183-I187 PolarHBondContact O-N 2.88Å; K184-I187 PolarHBondContact O-N 3.06Å; I187-T191 VanDerWaalsContact O-CB 3.24Å; I187-T191 WeakPolarHBondContact O-CB 3.48Å; I187-T191 PolarHBondContact O-N 3.01Å; I187-T191 PolarHBondContact O-OG1 2.88Å; I187-L266 HydrophobicContact CG2-CB 4.02Å; I187-L266 HydrophobicContact CG2-CD2 3.92Å; I187-L266 HydrophobicContact CG2-CG 4.38Å; I187-V270 HydrophobicContact CB-CG2 4.34Å; I187-V270 HydrophobicContact CG2-CG2 4.16Å
188L96.3Very high94.1Very high70 Ų7028.4 Ų28.437%0.36616%0.158SC..Hα-helixtrans-58.8-51174.1-177.461.6000111.3K184 Y186 C190 T191 T192 L267 V270K184-L188 WeakPolarHBondContact O-CB 3.49Å; K184-L188 PolarHBondContact O-N 2.94Å; Y186-L188 VanDerWaalsContact C-N 3.29Å; Y186-L188 PolarHBondContact O-N 3.24Å; L188-C190 PolarHBondContact O-N 3.06Å; L188-T191 PolarHBondContact O-N 2.88Å; L188-T192 WeakPolarHBondContact O-CB 3.44Å; L188-T192 PolarHBondContact O-N 3.28Å; L188-T192 PolarHBondContact O-OG1 3.18Å; L188-T192 VanDerWaalsContact O-OG1 3.05Å; L188-L267 HydrophobicContact CD1-CD2 3.85Å; L188-V270 HydrophobicContact CB-CG1 4.25Å; L188-V270 HydrophobicContact CB-CG2 4.08Å; L188-V270 HydrophobicContact CD1-CG1 4.46Å; L188-V270 HydrophobicContact CD2-CG1 4.37Å
189F96.2Very high94Very high78 Ų7833.4 Ų33.434%0.34218%0.182SC..Hα-helixtrans-54.9-52.6178.5168.2-104.3000112.1L158 L161 W166 T185 Y186 T191 T192 V193L158-F189 HydrophobicContact CD2-CE1 3.74Å; L158-F189 HydrophobicContact CD2-CZ 4.19Å; L161-F189 HydrophobicContact CD1-CE1 4.34Å; W166-F189 HydrophobicContact CH2-CB 4.05Å; W166-F189 HydrophobicContact CH2-CD1 4.1Å; W166-F189 HydrophobicContact CH2-CD2 4.44Å; W166-F189 AromaticContact CH2-CG 3.94Å; W166-F189 HydrophobicContact CH2-CG 3.94Å; W166-F189 HydrophobicContact CZ2-CB 4.39Å; W166-F189 HydrophobicContact CZ3-CD1 4.16Å; W166-F189 HydrophobicContact CZ3-CE1 4.46Å; W166-F189 HydrophobicContact CZ3-CG 4.44Å; T185-F189 WeakPolarHBondContact O-CB 3.21Å; T185-F189 PolarHBondContact O-N 3.1Å; Y186-F189 WeakPolarHBondContact O-CB 3.38Å; Y186-F189 PolarHBondContact O-N 3.42Å; F189-T191 PolarHBondContact O-N 3.33Å; F189-T192 PolarHBondContact O-N 3.33Å; F189-V193 HydrophobicContact CD2-CG2 4.13Å; F189-V193 HydrophobicContact CE1-CG2 4.49Å; F189-V193 HydrophobicContact CE2-CG2 3.76Å; F189-V193 HydrophobicContact CZ-CG2 3.96Å; F189-V193 VanDerWaalsContact O-CG2 3.32Å; F189-V193 WeakPolarHBondContact O-CG2 3.4Å; F189-V193 PolarHBondContact O-N 3.23Å
190C94.5Very high93.9Very high3 Ų334.5 Ų34.52%0.0219%0.193CC..Hα-helixtrans-61.9-43.9178.6-71.90000112.1F109 Y186 L188 T192 V193 F194F109-C190 HydrophobicContact CE1-CB 4.06Å; Y186-C190 PolarHBondContact O-N 2.83Å; L188-C190 PolarHBondContact O-N 3.06Å; C190-T192 PolarHBondContact O-N 2.93Å; C190-V193 PolarHBondContact O-N 3.08Å; C190-F194 HydrophobicContact CB-CD2 4.37Å; C190-F194 HydrophobicContact CB-CE2 4.12Å; C190-F194 WeakPolarHBondContact O-CB 3.49Å; C190-F194 WeakPolarHBondContact O-CD2 3.49Å; C190-F194 WeakPolarHBondContact O-CG 3.3Å; C190-F194 PolarHBondContact O-N 2.85Å
191T94.6Very high93.8Very high3 Ų334.8 Ų34.82%0.01820%0.195CC..Hα-helixtrans-62.1-43.4179.5-570000111.1I187 L188 F189 S195 F263 L266 L267I187-T191 VanDerWaalsContact O-CB 3.24Å; I187-T191 WeakPolarHBondContact O-CB 3.48Å; I187-T191 PolarHBondContact O-N 3.01Å; I187-T191 PolarHBondContact O-OG1 2.88Å; L188-T191 PolarHBondContact O-N 2.88Å; F189-T191 PolarHBondContact O-N 3.33Å; T191-S195 WeakPolarHBondContact O-CB 3.13Å; T191-S195 PolarHBondContact O-N 3.18Å; T191-S195 PolarHBondContact O-OG 3.29Å; T191-F263 HydrophobicContact CG2-CB 4.09Å; T191-F263 HydrophobicContact CG2-CD1 4.12Å; T191-F263 HydrophobicContact CG2-CG 4.18Å; T191-L266 HydrophobicContact CG2-CB 4.34Å; T191-L267 HydrophobicContact CG2-CD2 4.13Å; T191-L267 HydrophobicContact CG2-CG 4.04Å
192T94.6Very high93.4Very high72 Ų7235.9 Ų35.944%0.44220%0.202SC..Hα-helixtrans-64.1-48.5175.9-60.50000111.5L188 F189 C190 F194 S195 V196L188-T192 WeakPolarHBondContact O-CB 3.44Å; L188-T192 PolarHBondContact O-N 3.28Å; L188-T192 PolarHBondContact O-OG1 3.18Å; L188-T192 VanDerWaalsContact O-OG1 3.05Å; F189-T192 PolarHBondContact O-N 3.33Å; C190-T192 PolarHBondContact O-N 2.93Å; T192-F194 PolarHBondContact O-N 3.15Å; T192-S195 PolarHBondContact O-N 2.93Å; T192-V196 WeakPolarHBondContact O-CG2 3.26Å; T192-V196 PolarHBondContact O-N 3.42Å
193V94.4Very high93.1Very high42 Ų4239.2 Ų39.226%0.25522%0.222SC..Hα-helixtrans-59.2-49.9179.5168.80000111.1F189 C190 S195 V196 I197F189-V193 HydrophobicContact CD2-CG2 4.13Å; F189-V193 HydrophobicContact CE1-CG2 4.49Å; F189-V193 HydrophobicContact CE2-CG2 3.76Å; F189-V193 HydrophobicContact CZ-CG2 3.96Å; F189-V193 VanDerWaalsContact O-CG2 3.32Å; F189-V193 WeakPolarHBondContact O-CG2 3.4Å; F189-V193 PolarHBondContact O-N 3.23Å; C190-V193 PolarHBondContact O-N 3.08Å; V193-S195 PolarHBondContact O-N 2.96Å; V193-V196 PolarHBondContact O-N 2.76Å; V193-I197 HydrophobicContact CG1-CD1 3.91Å; V193-I197 WeakPolarHBondContact O-CG1 3.35Å; V193-I197 PolarHBondContact O-N 3.38Å; V193-I197 VanDerWaalsContact O-N 3.11Å
194F92.6Very high92.8Very high5 Ų538.9 Ų38.92%0.02222%0.221CC..Hα-helixtrans-64.7-41.8178.5-64.8-44.8000111.7F109 L112 A113 V116 C190 T192 V196 I197 L198 F263F109-F194 HydrophobicContact CD1-CE2 4.29Å; L112-F194 HydrophobicContact CD2-CD2 4.06Å; L112-F194 HydrophobicContact CD2-CE2 3.78Å; L112-F194 HydrophobicContact CD2-CZ 4.34Å; L112-F194 HydrophobicContact CG-CE2 4.14Å; L112-F194 HydrophobicContact CG-CZ 4.21Å; A113-F194 HydrophobicContact CB-CE1 3.83Å; A113-F194 HydrophobicContact CB-CZ 3.84Å; V116-F194 HydrophobicContact CG1-CD1 4.3Å; C190-F194 HydrophobicContact CB-CD2 4.37Å; C190-F194 HydrophobicContact CB-CE2 4.12Å; C190-F194 WeakPolarHBondContact O-CB 3.49Å; C190-F194 WeakPolarHBondContact O-CD2 3.49Å; C190-F194 WeakPolarHBondContact O-CG 3.3Å; C190-F194 PolarHBondContact O-N 2.85Å; T192-F194 PolarHBondContact O-N 3.15Å; F194-V196 VanDerWaalsContact C-N 3.34Å; F194-V196 PolarHBondContact O-N 2.83Å; F194-I197 PolarHBondContact O-N 3.34Å; F194-I197 VanDerWaalsContact O-N 3.15Å; F194-L198 VanDerWaalsContact O-CG 3.23Å; F194-L198 WeakPolarHBondContact O-CG 3.45Å; F194-L198 PolarHBondContact O-N 3.47Å; F194-F263 HydrophobicContact CB-CE1 4.17Å; F194-F263 HydrophobicContact CB-CE2 4.34Å; F194-F263 HydrophobicContact CB-CZ 3.59Å
195S91.9Very high92.2Very high34 Ų3440.3 Ų40.324%0.23823%0.226CC..Hα-helixtrans-57.6-44.7176.6-640000112.3T191 T192 V193 I197 L198 M199 F263T191-S195 WeakPolarHBondContact O-CB 3.13Å; T191-S195 PolarHBondContact O-N 3.18Å; T191-S195 PolarHBondContact O-OG 3.29Å; T192-S195 PolarHBondContact O-N 2.93Å; V193-S195 PolarHBondContact O-N 2.96Å; S195-I197 PolarHBondContact O-N 2.95Å; S195-L198 PolarHBondContact O-N 2.9Å; S195-M199 WeakPolarHBondContact O-CB 3.38Å; S195-M199 VanDerWaalsContact O-CG 3.3Å; S195-M199 WeakPolarHBondContact O-CG 3.33Å; S195-M199 PolarHBondContact O-N 3.32Å; S195-F263 WeakPolarHBondContact OG-CD2 3.29Å
196V93.8Very high91.6Very high97 Ų9739.4 Ų39.459%0.58823%0.225SC*.Hα-helixtrans-61.4-44.2176.51700000111.1T192 V193 F194 M199 A200T192-V196 WeakPolarHBondContact O-CG2 3.26Å; T192-V196 PolarHBondContact O-N 3.42Å; V193-V196 PolarHBondContact O-N 2.76Å; F194-V196 VanDerWaalsContact C-N 3.34Å; F194-V196 PolarHBondContact O-N 2.83Å; V196-M199 PolarHBondContact O-N 3.27Å; V196-A200 WeakPolarHBondContact O-CB 3.23Å; V196-A200 PolarHBondContact O-N 3.43Å
197I92.4Very high91.1Very high17 Ų1746.9 Ų46.99%0.08725%0.254CS..Hα-helixtrans-64.2-44.6177.9-64.8162.2000111V116 F117 L120 V193 F194 S195 M199 A200 I201V116-I197 HydrophobicContact CG1-CB 4Å; V116-I197 HydrophobicContact CG1-CD1 4.42Å; V116-I197 HydrophobicContact CG1-CG2 3.41Å; V116-I197 VanDerWaalsContact CG1-CG2 3.41Å; F117-I197 HydrophobicContact CD1-CD1 4Å; F117-I197 HydrophobicContact CE1-CD1 3.34Å; F117-I197 HydrophobicContact CE1-CG1 4.43Å; F117-I197 HydrophobicContact CZ-CD1 3.7Å; L120-I197 HydrophobicContact CB-CG2 4.02Å; L120-I197 HydrophobicContact CD2-CG2 3.95Å; L120-I197 HydrophobicContact CG-CG2 4.37Å; V193-I197 HydrophobicContact CG1-CD1 3.91Å; V193-I197 WeakPolarHBondContact O-CG1 3.35Å; V193-I197 PolarHBondContact O-N 3.38Å; V193-I197 VanDerWaalsContact O-N 3.11Å; F194-I197 PolarHBondContact O-N 3.34Å; F194-I197 VanDerWaalsContact O-N 3.15Å; S195-I197 PolarHBondContact O-N 2.95Å; I197-M199 PolarHBondContact O-N 3.15Å; I197-A200 WeakPolarHBondContact O-CB 3.48Å; I197-A200 PolarHBondContact O-N 3.48Å; I197-I201 HydrophobicContact CG2-CD1 4.02Å; I197-I201 HydrophobicContact CG2-CG1 4.49Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 3.41Å
198L89.8Confident90.4Very high12 Ų1247.5 Ų47.56%0.06326%0.257CS..Hα-helixtrans-60.9-46178.2-64.7-151.4000110.9V116 F194 S195 A200 I201 V202 F255 W259 F263V116-L198 HydrophobicContact CB-CD2 4.41Å; V116-L198 HydrophobicContact CG1-CD2 3.62Å; V116-L198 HydrophobicContact CG2-CD2 3.92Å; F194-L198 VanDerWaalsContact O-CG 3.23Å; F194-L198 WeakPolarHBondContact O-CG 3.45Å; F194-L198 PolarHBondContact O-N 3.47Å; S195-L198 PolarHBondContact O-N 2.9Å; L198-A200 VanDerWaalsContact C-N 3.31Å; L198-A200 PolarHBondContact O-N 3.39Å; L198-I201 HydrophobicContact CD2-CD1 4.28Å; L198-I201 WeakPolarHBondContact O-CB 3.41Å; L198-I201 PolarHBondContact O-N 3.31Å; L198-I201 VanDerWaalsContact O-N 3.15Å; L198-V202 WeakPolarHBondContact O-CG2 3.28Å; L198-V202 PolarHBondContact O-N 3.48Å; L198-F255 HydrophobicContact CB-CE1 3.86Å; L198-F255 HydrophobicContact CD1-CD1 4.46Å; L198-F255 HydrophobicContact CD1-CE1 3.53Å; L198-F255 HydrophobicContact CD1-CZ 3.85Å; L198-F255 HydrophobicContact CD2-CE1 3.53Å; L198-F255 HydrophobicContact CD2-CZ 3.35Å; L198-F255 HydrophobicContact CG-CE1 3.77Å; L198-F255 HydrophobicContact CG-CZ 4.07Å; L198-W259 HydrophobicContact CD1-CB 3.57Å; L198-W259 HydrophobicContact CD1-CD2 4.13Å; L198-W259 HydrophobicContact CD1-CG 3.56Å; L198-F263 HydrophobicContact CD1-CD2 4.43Å; L198-F263 HydrophobicContact CD1-CE2 3.39Å; L198-F263 HydrophobicContact CD1-CZ 3.79Å; L198-F263 HydrophobicContact CG-CE2 3.93Å; L198-F263 HydrophobicContact CG-CZ 4.3Å
199M90.9Very high89.5Confident118 Ų11846.6 Ų46.658%0.58125%0.249SC*.Hα-helixtrans-61.2-39.4175.2-72.2-55.6-61.300112.2S195 V196 I197 I201 V202 V203S195-M199 WeakPolarHBondContact O-CB 3.38Å; S195-M199 VanDerWaalsContact O-CG 3.3Å; S195-M199 WeakPolarHBondContact O-CG 3.33Å; S195-M199 PolarHBondContact O-N 3.32Å; V196-M199 PolarHBondContact O-N 3.27Å; I197-M199 PolarHBondContact O-N 3.15Å; M199-I201 VanDerWaalsContact C-N 3.35Å; M199-I201 PolarHBondContact O-N 3.21Å; M199-V202 WeakPolarHBondContact O-CB 3.46Å; M199-V202 PolarHBondContact O-N 3.44Å; M199-V203 WeakPolarHBondContact O-CG2 3.4Å; M199-V203 PolarHBondContact O-N 3.45Å
200A91.6Very high88.8Confident39 Ų3945.2 Ų45.232%0.32225%0.252SS..Hα-helixtrans-62-42.2174.200000111.8L120 V196 I197 L198 V203 L204L120-A200 HydrophobicContact CD1-CB 4.38Å; V196-A200 WeakPolarHBondContact O-CB 3.23Å; V196-A200 PolarHBondContact O-N 3.43Å; I197-A200 WeakPolarHBondContact O-CB 3.48Å; I197-A200 PolarHBondContact O-N 3.48Å; L198-A200 VanDerWaalsContact C-N 3.31Å; L198-A200 PolarHBondContact O-N 3.39Å; A200-V203 PolarHBondContact O-N 3.39Å; A200-L204 WeakPolarHBondContact O-CB 3.32Å; A200-L204 VanDerWaalsContact O-CG 3.25Å; A200-L204 WeakPolarHBondContact O-CG 3.44Å; A200-L204 PolarHBondContact O-N 2.91Å
201I88.6Confident88.1Confident7 Ų746.6 Ų46.64%0.03626%0.259CS..Hα-helixtrans-59.2-48.1174.5-67.6165.3000110.4L119 L120 I197 L198 M199 V203 L204 Y205L119-I201 HydrophobicContact CB-CD1 3.88Å; L120-I201 HydrophobicContact CB-CD1 4.16Å; L120-I201 HydrophobicContact CB-CG1 4.09Å; L120-I201 HydrophobicContact CD1-CG1 3.93Å; I197-I201 HydrophobicContact CG2-CD1 4.02Å; I197-I201 HydrophobicContact CG2-CG1 4.49Å; I197-I201 WeakPolarHBondContact O-CG1 3.43Å; I197-I201 PolarHBondContact O-N 3.41Å; L198-I201 HydrophobicContact CD2-CD1 4.28Å; L198-I201 WeakPolarHBondContact O-CB 3.41Å; L198-I201 PolarHBondContact O-N 3.31Å; L198-I201 VanDerWaalsContact O-N 3.15Å; M199-I201 VanDerWaalsContact C-N 3.35Å; M199-I201 PolarHBondContact O-N 3.21Å; I201-V203 PolarHBondContact O-N 3.49Å; I201-L204 PolarHBondContact O-N 3.38Å; I201-Y205 HydrophobicContact CG2-CD2 3.56Å; I201-Y205 HydrophobicContact CG2-CE2 3.56Å; I201-Y205 VanDerWaalsContact O-CD2 3.28Å; I201-Y205 WeakPolarHBondContact O-CD2 3.41Å; I201-Y205 PolarHBondContact O-N 3.11Å
202V87Confident87.2Confident24 Ų2448.5 Ų48.515%0.14527%0.271CS..Hα-helixtrans-55.4-50.5176.4172.40000111.2L198 M199 L204 Y205 A206 L252 I256L198-V202 WeakPolarHBondContact O-CG2 3.28Å; L198-V202 PolarHBondContact O-N 3.48Å; M199-V202 WeakPolarHBondContact O-CB 3.46Å; M199-V202 PolarHBondContact O-N 3.44Å; V202-L204 PolarHBondContact O-N 2.92Å; V202-Y205 PolarHBondContact O-N 2.89Å; V202-A206 WeakPolarHBondContact O-CB 3.42Å; V202-A206 PolarHBondContact O-N 3.12Å; V202-L252 HydrophobicContact CB-CD1 3.76Å; V202-L252 HydrophobicContact CG1-CD1 3.53Å; V202-L252 HydrophobicContact CG1-CD2 4.08Å; V202-L252 HydrophobicContact CG1-CG 4.42Å; V202-L252 HydrophobicContact CG2-CD1 3.3Å; V202-I256 HydrophobicContact CG2-CD1 4.48Å
203V89.2Confident86.4Confident71 Ų7149.9 Ų49.943%0.4327%0.268SS..Hα-helixtrans-63.1-41.2-179.5171.50000111.4M199 A200 I201 A206 R207M199-V203 WeakPolarHBondContact O-CG2 3.4Å; M199-V203 PolarHBondContact O-N 3.45Å; A200-V203 PolarHBondContact O-N 3.39Å; I201-V203 PolarHBondContact O-N 3.49Å; V203-A206 PolarHBondContact O-N 3.4Å; V203-R207 WeakPolarHBondContact O-CB 3.34Å; V203-R207 WeakPolarHBondContact O-CG 3.33Å; V203-R207 PolarHBondContact O-N 2.88Å
204L87.7Confident85.5Confident30 Ų3050.6 Ų50.616%0.15727%0.272CS..Hα-helixtrans-62.5-45.7176.7-74171.2000111.5L120 A123 I124 A200 I201 V202 R207 I208L120-L204 HydrophobicContact CD1-CD1 3.96Å; A123-L204 HydrophobicContact CB-CB 4.34Å; A123-L204 HydrophobicContact CB-CD1 4.07Å; I124-L204 HydrophobicContact CG1-CD1 3.84Å; A200-L204 WeakPolarHBondContact O-CB 3.32Å; A200-L204 VanDerWaalsContact O-CG 3.25Å; A200-L204 WeakPolarHBondContact O-CG 3.44Å; A200-L204 PolarHBondContact O-N 2.91Å; I201-L204 PolarHBondContact O-N 3.38Å; V202-L204 PolarHBondContact O-N 2.92Å; L204-R207 PolarHBondContact O-N 3.34Å; L204-I208 WeakPolarHBondContact O-CB 3.35Å; L204-I208 VanDerWaalsContact O-CG1 3.24Å; L204-I208 WeakPolarHBondContact O-CG1 3.43Å; L204-I208 PolarHBondContact O-N 2.95Å
205Y82.8Confident84.6Confident56 Ų5654.5 Ų54.522%0.2229%0.287CS..Hα-helixtrans-65.6-38.8176.5-83.2-68000112.5A123 I201 V202 I208 Y209A123-Y205 HydrophobicContact CB-CD2 4.48Å; A123-Y205 HydrophobicContact CB-CE2 3.96Å; I201-Y205 HydrophobicContact CG2-CD2 3.56Å; I201-Y205 HydrophobicContact CG2-CE2 3.56Å; I201-Y205 VanDerWaalsContact O-CD2 3.28Å; I201-Y205 WeakPolarHBondContact O-CD2 3.41Å; I201-Y205 PolarHBondContact O-N 3.11Å; V202-Y205 PolarHBondContact O-N 2.89Å; Y205-I208 HydrophobicContact CD1-CD1 4.3Å; Y205-I208 PolarHBondContact O-N 3.33Å; Y205-Y209 WeakPolarHBondContact O-CB 3.37Å; Y205-Y209 PolarHBondContact O-N 3.05Å
206A83.8Confident83.6Confident48 Ų4854.2 Ų54.240%0.39729%0.285SS..Hα-helixtrans-62.3-42173.300000111.9V202 V203 Y209 A210V202-A206 WeakPolarHBondContact O-CB 3.42Å; V202-A206 PolarHBondContact O-N 3.12Å; V203-A206 PolarHBondContact O-N 3.4Å; A206-Y209 WeakPolarHBondContact O-CB 3.27Å; A206-Y209 PolarHBondContact O-N 3.29Å; A206-A210 PolarHBondContact O-N 3.3Å
207R85.7Confident82.4Confident157 Ų15756.2 Ų56.259%0.59228%0.282SS*.Hα-helixtrans-65.8-44175.1-77.3-175.9173.9-161.5-0.2112.4V203 L204 Y209 A210 L211V203-R207 WeakPolarHBondContact O-CB 3.34Å; V203-R207 WeakPolarHBondContact O-CG 3.33Å; V203-R207 PolarHBondContact O-N 2.88Å; L204-R207 PolarHBondContact O-N 3.34Å; R207-Y209 VanDerWaalsContact C-N 3.26Å; R207-Y209 PolarHBondContact O-N 3.48Å; R207-A210 PolarHBondContact O-N 3.15Å; R207-L211 WeakPolarHBondContact O-CB 3.36Å; R207-L211 PolarHBondContact O-N 3.29Å
208I80.1Confident81.3Confident14 Ų1462.3 Ų62.37%0.07231%0.308CS..Hα-helixtrans-54.7-47.7173.5-74166.2000109.5R126 H127 M130 L204 Y205 L211 V212R126-I208 HydrophobicContact CB-CD1 4.09Å; H127-I208 HydrophobicContact CB-CD1 4.02Å; H127-I208 HydrophobicContact CB-CG1 4.02Å; M130-I208 HydrophobicContact CE-CG2 4.12Å; M130-I208 HydrophobicContact SD-CG2 3.47Å; M130-I208 WeakPolarHBondContact SD-CG2 3.25Å; L204-I208 WeakPolarHBondContact O-CB 3.35Å; L204-I208 VanDerWaalsContact O-CG1 3.24Å; L204-I208 WeakPolarHBondContact O-CG1 3.43Å; L204-I208 PolarHBondContact O-N 2.95Å; Y205-I208 HydrophobicContact CD1-CD1 4.3Å; Y205-I208 PolarHBondContact O-N 3.33Å; I208-L211 PolarHBondContact O-N 2.98Å; I208-V212 WeakPolarHBondContact O-CG2 3.26Å; I208-V212 PolarHBondContact O-N 3.45Å
209Y76.8Confident80.3Confident51 Ų5167.2 Ų67.220%0.233%0.333CS..Hα-helixtrans-61-50177.8165.6-112.1000112.7Y205 A206 R207 L211 V212 R213 L245Y205-Y209 WeakPolarHBondContact O-CB 3.37Å; Y205-Y209 PolarHBondContact O-N 3.05Å; A206-Y209 WeakPolarHBondContact O-CB 3.27Å; A206-Y209 PolarHBondContact O-N 3.29Å; R207-Y209 VanDerWaalsContact C-N 3.26Å; R207-Y209 PolarHBondContact O-N 3.48Å; Y209-L211 VanDerWaalsContact C-N 3.25Å; Y209-L211 PolarHBondContact O-N 3.24Å; Y209-V212 PolarHBondContact O-N 3.43Å; Y209-R213 HydrophobicContact CE2-CB 4.22Å; Y209-R213 WeakPolarHBondContact O-CB 3.35Å; Y209-R213 PolarHBondContact O-N 3.29Å; Y209-R213 WeakPolarHBondContact OH-CD 3.43Å; Y209-R213 PolarHBondContact OH-NH1 3.04Å; Y209-L245 HydrophobicContact CD1-CD1 4.3Å; Y209-L245 HydrophobicContact CD2-CB 4.48Å; Y209-L245 HydrophobicContact CD2-CD1 3.85Å; Y209-L245 HydrophobicContact CE1-CD1 3.73Å; Y209-L245 HydrophobicContact CE2-CB 3.78Å; Y209-L245 HydrophobicContact CE2-CD1 3.29Å; Y209-L245 HydrophobicContact CE2-CD2 4.22Å; Y209-L245 HydrophobicContact CE2-CG 3.91Å; Y209-L245 HydrophobicContact CG-CD1 4.32Å; Y209-L245 VanDerWaalsContact OH-CD1 3.29Å; Y209-L245 WeakPolarHBondContact OH-CD1 3.33Å; Y209-L245 WeakPolarHBondContact OH-CD2 3.21Å
210A82.1Confident79.2Confident49 Ų4963.8 Ų63.841%0.40532%0.319SS..Hα-helixtrans-58.6-39.3179.300000111.9A206 R207 T214A206-A210 PolarHBondContact O-N 3.3Å; R207-A210 PolarHBondContact O-N 3.15Å; A210-T214 WeakPolarHBondContact O-CB 3.41Å; A210-T214 PolarHBondContact O-N 3.02Å; A210-T214 PolarHBondContact O-OG1 3.2Å
211L80.9Confident78.1Confident33 Ų3369.4 Ų69.417%0.17334%0.336CS..Hα-helixtrans-64.6-48.8176178.3153.9000111.8L131 R207 I208 Y209 T214 R215L131-L211 HydrophobicContact CD2-CD1 3.35Å; L131-L211 HydrophobicContact CG-CD1 3.99Å; R207-L211 WeakPolarHBondContact O-CB 3.36Å; R207-L211 PolarHBondContact O-N 3.29Å; I208-L211 PolarHBondContact O-N 2.98Å; Y209-L211 VanDerWaalsContact C-N 3.25Å; Y209-L211 PolarHBondContact O-N 3.24Å; L211-T214 PolarHBondContact O-N 2.92Å; L211-R215 WeakPolarHBondContact O-CG 3.28Å; L211-R215 PolarHBondContact O-N 3.43Å
212V74.3Confident77.2Confident43 Ų4378.1 Ų78.126%0.26137%0.369SS..Hα-helixtrans-61.7-46.2178.7171.70000110.4M130 I208 Y209 T214 R215 S216M130-V212 HydrophobicContact SD-CG2 4.01Å; I208-V212 WeakPolarHBondContact O-CG2 3.26Å; I208-V212 PolarHBondContact O-N 3.45Å; Y209-V212 PolarHBondContact O-N 3.43Å; V212-T214 VanDerWaalsContact C-N 3.34Å; V212-T214 PolarHBondContact O-N 3.37Å; V212-R215 PolarHBondContact O-N 3.03Å; V212-S216 PolarHBondContact O-N 3.32Å; V212-S216 PolarHBondContact O-OG 3.16Å
213R77.4Confident76.1Confident101 Ų10183.6 Ų83.638%0.38139%0.391SS..Hα-helixtrans-60.7-42.6178.1-173.7177.7-173.8178.20.4112.1Y209 S216 R217Y209-R213 HydrophobicContact CE2-CB 4.22Å; Y209-R213 WeakPolarHBondContact O-CB 3.35Å; Y209-R213 PolarHBondContact O-N 3.29Å; Y209-R213 WeakPolarHBondContact OH-CD 3.43Å; Y209-R213 PolarHBondContact OH-NH1 3.04Å; R213-S216 PolarHBondContact O-N 3.33Å; R213-R217 WeakPolarHBondContact O-CB 3.4Å; R213-R217 WeakPolarHBondContact O-CG 3.49Å; R213-R217 PolarHBondContact O-N 2.96Å
214T76.7Confident75.1Confident57 Ų5785.4 Ų85.435%0.3540%0.402SS..Hα-helixtrans-65.4-41.3179.4-58.20000111A210 L211 V212 R217 K218A210-T214 WeakPolarHBondContact O-CB 3.41Å; A210-T214 PolarHBondContact O-N 3.02Å; A210-T214 PolarHBondContact O-OG1 3.2Å; L211-T214 PolarHBondContact O-N 2.92Å; V212-T214 VanDerWaalsContact C-N 3.34Å; V212-T214 PolarHBondContact O-N 3.37Å; T214-R217 PolarHBondContact O-N 3.13Å; T214-K218 WeakPolarHBondContact O-CG 3.14Å; T214-K218 PolarHBondContact O-N 3.41Å
215R73Confident74.3Confident86 Ų8688.3 Ų88.333%0.32542%0.424SS..Hα-helixtrans-66.1-44.6175.6-70.7-178.7-179.5179.31.8112.3M130 L131 L211 V212 R217 K218 L219M130-R215 PolarHBondContact O-NH1 2.92Å; M130-R215 PolarHBondContact O-NH2 3.01Å; L131-R215 PolarHBondContact O-NH2 2.86Å; L211-R215 WeakPolarHBondContact O-CG 3.28Å; L211-R215 PolarHBondContact O-N 3.43Å; V212-R215 PolarHBondContact O-N 3.03Å; R215-R217 PolarHBondContact O-N 3.2Å; R215-K218 PolarHBondContact O-N 3.14Å; R215-L219 WeakPolarHBondContact O-CG 3.46Å; R215-L219 PolarHBondContact O-N 2.91Å
216S70.4Confident73.9Confident28 Ų2891.6 Ų91.620%0.19645%0.446CS..Hα-helixtrans-59.6-44.3175.1-64.90000112.1V212 R213 L219 V220 S241V212-S216 PolarHBondContact O-N 3.32Å; V212-S216 PolarHBondContact O-OG 3.16Å; R213-S216 PolarHBondContact O-N 3.33Å; S216-L219 PolarHBondContact O-N 3.43Å; S216-V220 WeakPolarHBondContact O-CG2 3.49Å; S216-V220 PolarHBondContact O-N 2.93Å; S216-V220 VanDerWaalsContact O-N 3.14Å; S216-S241 PolarHBondContact OG-OG 3.14Å
217R68.8Low72.9Confident140 Ų14092.6 Ų92.653%0.52846%0.461SS..Hα-helixtrans-64.5-42177.1-74.2-169.6-67.4-162.61.7112.8R213 T214 R215 L219 V220 F221R213-R217 WeakPolarHBondContact O-CB 3.4Å; R213-R217 WeakPolarHBondContact O-CG 3.49Å; R213-R217 PolarHBondContact O-N 2.96Å; T214-R217 PolarHBondContact O-N 3.13Å; R215-R217 PolarHBondContact O-N 3.2Å; R217-L219 VanDerWaalsContact C-N 3.33Å; R217-L219 PolarHBondContact O-N 3.35Å; R217-V220 PolarHBondContact O-N 3.34Å; R217-F221 WeakPolarHBondContact O-CB 3.34Å; R217-F221 PolarHBondContact O-N 3.28Å
218K71Confident71.8Confident144 Ų14495.5 Ų95.563%0.62647%0.472SS*.Hα-helixtrans-62.7-37.7176.3-74.9-174.1-177.1-169.70112.6T214 R215 F221 R222T214-K218 WeakPolarHBondContact O-CG 3.14Å; T214-K218 PolarHBondContact O-N 3.41Å; R215-K218 PolarHBondContact O-N 3.14Å; K218-F221 PolarHBondContact O-N 3.05Å; K218-R222 PolarHBondContact O-N 3.38Å
219L67.8Low70.8Confident115 Ų11598.9 Ų98.960%0.60251%0.51SS*.Hα-helixtrans-67.6-37.6176.2-70.9172.7000112.4R215 S216 R217 K223R215-L219 WeakPolarHBondContact O-CG 3.46Å; R215-L219 PolarHBondContact O-N 2.91Å; S216-L219 PolarHBondContact O-N 3.43Å; R217-L219 VanDerWaalsContact C-N 3.33Å; R217-L219 PolarHBondContact O-N 3.35Å; L219-K223 PolarHBondContact O-N 3.41Å
220V67.6Low69.8Low46 Ų4698.6 Ų98.628%0.27952%0.523SS..Hα-helixtrans-64.8-48.1172.4173.70000110.2S216 R217 R222 K223 V224S216-V220 WeakPolarHBondContact O-CG2 3.49Å; S216-V220 PolarHBondContact O-N 2.93Å; S216-V220 VanDerWaalsContact O-N 3.14Å; R217-V220 PolarHBondContact O-N 3.34Å; V220-R222 PolarHBondContact O-N 3.41Å; V220-K223 PolarHBondContact O-N 3.47Å; V220-K223 VanDerWaalsContact O-N 3.14Å; V220-V224 WeakPolarHBondContact O-CG2 3.47Å; V220-V224 PolarHBondContact O-N 3.35Å
221F67.8Low68.5Low157 Ų15799.6 Ų99.669%0.68954%0.538SS*.Hα-helixtrans-61.2-44179.9-170.1-95.8000112.9R217 K218 K223 V224 S225R217-F221 WeakPolarHBondContact O-CB 3.34Å; R217-F221 PolarHBondContact O-N 3.28Å; K218-F221 PolarHBondContact O-N 3.05Å; F221-K223 VanDerWaalsContact C-N 3.3Å; F221-K223 PolarHBondContact O-N 3.1Å; F221-V224 PolarHBondContact O-N 3.29Å; F221-S225 WeakPolarHBondContact O-CB 3.09Å; F221-S225 PolarHBondContact O-N 2.68Å
222R69.8Low67.2Low190 Ų190101.6 Ų101.672%0.71755%0.554SS**Hα-helixtrans-60-36.3173.7-97.6179.277.8167.83.3113K218 V220 N226K218-R222 PolarHBondContact O-N 3.38Å; V220-R222 PolarHBondContact O-N 3.41Å; R222-N226 WeakPolarHBondContact O-CB 3.48Å; R222-N226 PolarHBondContact O-N 2.97Å; R222-N226 VanDerWaalsContact O-N 3.1Å
223K65.7Low66.3Low140 Ų140102 Ų10261%0.60956%0.563SS**Hα-helixtrans-71.6-37.7177.9-85-174.9174.9-178.50112.8L219 V220 F221 N226L219-K223 PolarHBondContact O-N 3.41Å; V220-K223 PolarHBondContact O-N 3.47Å; V220-K223 VanDerWaalsContact O-N 3.14Å; F221-K223 VanDerWaalsContact C-N 3.3Å; F221-K223 PolarHBondContact O-N 3.1Å; K223-N226 PolarHBondContact O-N 3.49Å
224V67.6Low65.2Low109 Ų109100.2 Ų100.266%0.66157%0.565SS**Hα-helixtrans-65.8-45.9174.5175.10000110.3V220 F221 N226 G227V220-V224 WeakPolarHBondContact O-CG2 3.47Å; V220-V224 PolarHBondContact O-N 3.35Å; F221-V224 PolarHBondContact O-N 3.29Å; V224-N226 VanDerWaalsContact C-N 3.29Å; V224-N226 PolarHBondContact O-N 3.12Å; V224-G227 PolarHBondContact O-N 3.26Å
225S71.3Confident64Low90 Ų90100.2 Ų100.263%0.62957%0.567SS**Hα-helixtrans-63.7-29.4177.7-173.60000113.8F221 G227F221-S225 WeakPolarHBondContact O-CB 3.09Å; F221-S225 PolarHBondContact O-N 2.68Å; S225-G227 VanDerWaalsContact C-N 3.33Å
226N74.6Confident63.4Low125 Ų125101.8 Ų101.867%0.66858%0.577SS**THydrogen-bonded Turntrans-87.710.3178-93.947000114R222 K223 V224 R228R222-N226 WeakPolarHBondContact O-CB 3.48Å; R222-N226 PolarHBondContact O-N 2.97Å; R222-N226 VanDerWaalsContact O-N 3.1Å; K223-N226 PolarHBondContact O-N 3.49Å; V224-N226 VanDerWaalsContact C-N 3.29Å; V224-N226 PolarHBondContact O-N 3.12Å; N226-R228 PolarHBondContact O-N 3.42Å
227G61.1Low62.8Low69 Ų69102.3 Ų102.371%0.71158%0.58SS**THydrogen-bonded Turntrans65.27170.700000116.6V224 S225 G229V224-G227 PolarHBondContact O-N 3.26Å; S225-G227 VanDerWaalsContact C-N 3.33Å; G227-G229 VanDerWaalsContact C-N 3.3Å; G227-G229 PolarHBondContact O-N 3.41Å
228R63.5Low62.2Low219 Ų21998.6 Ų98.683%0.82658%0.576SS**  trans-79.880.5175.6-86.2177.8162.3161.3-5.3109.9N226 G230N226-R228 PolarHBondContact O-N 3.42Å; R228-G230 PolarHBondContact O-N 3.21Å
229G58.8Low61.9Low84 Ų8497.5 Ų97.587%0.86657%0.573SS**  trans-59.1111.8175.200000112.2G227G227-G229 VanDerWaalsContact C-N 3.3Å; G227-G229 PolarHBondContact O-N 3.41Å
230G55.6Low61.7Low46 Ų4699 Ų9947%0.47458%0.575SS.*  trans-153.582.2172.600000109.8R228 S232 A233R228-G230 PolarHBondContact O-N 3.21Å; G230-S232 PolarHBondContact O-N 3Å; G230-A233 PolarHBondContact O-N 3.17Å; G230-A233 VanDerWaalsContact O-N 3.17Å
231G55.9Low61.4Low70 Ų7098.2 Ų98.272%0.72257%0.571SS**Hα-helixtrans-56.4-19.9-173.700000115.6
232S52.8Low61.1Low74 Ų7494.6 Ų94.652%0.51756%0.557SS.*Hα-helixtrans-76.4-30.6178.6175.50000114.5G230 S235 K236G230-S232 PolarHBondContact O-N 3Å; S232-S235 PolarHBondContact O-OG 2.9Å; S232-K236 WeakPolarHBondContact O-CG 3.14Å; S232-K236 PolarHBondContact O-N 3.32Å
233A55.1Low61Low53 Ų5388 Ų8844%0.43854%0.544SS..Hα-helixtrans-81.2-26.5-175.800000112.7G230 S237G230-A233 PolarHBondContact O-N 3.17Å; G230-A233 VanDerWaalsContact O-N 3.17Å; A233-S237 WeakPolarHBondContact O-CB 3.46Å; A233-S237 PolarHBondContact O-N 3Å
234S53.7Low60.9Low63 Ų6386.4 Ų86.444%0.44154%0.541SS..Hα-helixtrans-68.2-46.1177.1-179.60000111.7S237 S238S234-S237 PolarHBondContact O-N 3.28Å; S234-S238 WeakPolarHBondContact O-CB 3.48Å; S234-S238 PolarHBondContact O-N 2.94Å
235S53.4Low60.8Low56 Ų5682.5 Ų82.539%0.39252%0.517SS..Hα-helixtrans-62.8-46.5176.275.40000111.2S232 S237 S238 E239S232-S235 PolarHBondContact O-OG 2.9Å; S235-S237 VanDerWaalsContact C-N 3.32Å; S235-S237 PolarHBondContact O-N 3.48Å; S235-S238 PolarHBondContact O-N 3.29Å; S235-E239 WeakPolarHBondContact O-CB 3.33Å; S235-E239 VanDerWaalsContact O-CG 3.29Å; S235-E239 WeakPolarHBondContact O-CG 3.13Å; S235-E239 PolarHBondContact O-N 2.93Å
236K58.9Low60.7Low119 Ų11985 Ų8552%0.51752%0.516SS..Hα-helixtrans-61.7-33.9177.4-74179.5176.81750113.6S232 K240S232-K236 WeakPolarHBondContact O-CG 3.14Å; S232-K236 PolarHBondContact O-N 3.32Å; K236-K240 WeakPolarHBondContact O-CB 3.42Å; K236-K240 VanDerWaalsContact O-CG 3.24Å; K236-K240 WeakPolarHBondContact O-CG 3.4Å; K236-K240 PolarHBondContact O-N 3.45Å; K236-K240 VanDerWaalsContact O-N 3.08Å
237S57.5Low60.4Low39 Ų3981 Ų8127%0.27350%0.497SS..Hα-helixtrans-74.2-39.1176.7178.60000112.2A233 S234 S235 S241A233-S237 WeakPolarHBondContact O-CB 3.46Å; A233-S237 PolarHBondContact O-N 3Å; S234-S237 PolarHBondContact O-N 3.28Å; S235-S237 VanDerWaalsContact C-N 3.32Å; S235-S237 PolarHBondContact O-N 3.48Å; S237-S241 WeakPolarHBondContact O-CB 3.41Å; S237-S241 PolarHBondContact O-N 3.38Å; S237-S241 VanDerWaalsContact O-N 3.07Å; S237-S241 PolarHBondContact O-OG 3.4Å
238S57.7Low60.8Low63 Ų6379.8 Ų79.844%0.44148%0.475SS..Hα-helixtrans-65.2-46.2173.5-168.30000110.9S234 S235 K240 S241 M242S234-S238 WeakPolarHBondContact O-CB 3.48Å; S234-S238 PolarHBondContact O-N 2.94Å; S235-S238 PolarHBondContact O-N 3.29Å; S238-K240 PolarHBondContact O-N 3.49Å; S238-S241 PolarHBondContact O-N 3.46Å; S238-S241 VanDerWaalsContact O-N 3.17Å; S238-M242 VanDerWaalsContact O-CG 3.3Å; S238-M242 WeakPolarHBondContact O-CG 3.22Å; S238-M242 PolarHBondContact O-N 3.49Å
239E63.4Low61.3Low121 Ų12173.4 Ų73.457%0.56546%0.456SS*.Hα-helixtrans-58.6-47.8175.8-77.3168.1-167.900112.5S235 S241 M242 A243S235-E239 WeakPolarHBondContact O-CB 3.33Å; S235-E239 VanDerWaalsContact O-CG 3.29Å; S235-E239 WeakPolarHBondContact O-CG 3.13Å; S235-E239 PolarHBondContact O-N 2.93Å; E239-S241 VanDerWaalsContact C-N 3.31Å; E239-S241 PolarHBondContact O-N 3.46Å; E239-M242 PolarHBondContact O-N 3.46Å; E239-A243 WeakPolarHBondContact O-CB 3.41Å; E239-A243 PolarHBondContact O-N 3.48Å
240K63.2Low62.2Low147 Ų14774.4 Ų74.464%0.63944%0.441SS*.Hα-helixtrans-61.3-39.8175.5-75.6175.1-177.1-178.40112.1K236 S238 A243 L244K236-K240 WeakPolarHBondContact O-CB 3.42Å; K236-K240 VanDerWaalsContact O-CG 3.24Å; K236-K240 WeakPolarHBondContact O-CG 3.4Å; K236-K240 PolarHBondContact O-N 3.45Å; K236-K240 VanDerWaalsContact O-N 3.08Å; S238-K240 PolarHBondContact O-N 3.49Å; K240-A243 PolarHBondContact O-N 3.47Å; K240-L244 VanDerWaalsContact O-CG 3.31Å; K240-L244 WeakPolarHBondContact O-CG 3.28Å; K240-L244 PolarHBondContact O-N 2.91Å; K240-L244 VanDerWaalsContact O-N 3.1Å
241S62.2Low63.1Low28 Ų2873.8 Ų73.820%0.19643%0.427CS..Hα-helixtrans-67.6-36.7177.4-58.50000111.9S216 S237 S238 E239 L245S216-S241 PolarHBondContact OG-OG 3.14Å; S237-S241 WeakPolarHBondContact O-CB 3.41Å; S237-S241 PolarHBondContact O-N 3.38Å; S237-S241 VanDerWaalsContact O-N 3.07Å; S237-S241 PolarHBondContact O-OG 3.4Å; S238-S241 PolarHBondContact O-N 3.46Å; S238-S241 VanDerWaalsContact O-N 3.17Å; E239-S241 VanDerWaalsContact C-N 3.31Å; E239-S241 PolarHBondContact O-N 3.46Å; S241-L245 WeakPolarHBondContact O-CB 3.14Å; S241-L245 PolarHBondContact O-N 2.81Å; S241-L245 VanDerWaalsContact O-N 3.08Å
242M62.2Low64.1Low81 Ų8172.5 Ų72.540%0.39940%0.404SS..Hα-helixtrans-72.1-36.8175.2-70.1-63.4149.600112.5S238 E239 L245 K246S238-M242 VanDerWaalsContact O-CG 3.3Å; S238-M242 WeakPolarHBondContact O-CG 3.22Å; S238-M242 PolarHBondContact O-N 3.49Å; E239-M242 PolarHBondContact O-N 3.46Å; M242-L245 PolarHBondContact O-N 3.01Å; M242-L245 HydrophobicContact SD-CD2 4.05Å; M242-K246 WeakPolarHBondContact O-CG 3.48Å; M242-K246 PolarHBondContact O-N 3.02Å
243A66.4Low65.5Low53 Ų5372.2 Ų72.244%0.43840%0.402SS..Hα-helixtrans-64.8-41.8175.300000112E239 K240 K246 T247E239-A243 WeakPolarHBondContact O-CB 3.41Å; E239-A243 PolarHBondContact O-N 3.48Å; K240-A243 PolarHBondContact O-N 3.47Å; A243-K246 PolarHBondContact O-N 3.26Å; A243-T247 PolarHBondContact O-N 2.9Å; A243-T247 VanDerWaalsContact O-N 3.1Å; A243-T247 PolarHBondContact O-OG1 3.26Å
244L64.3Low66.8Low105 Ų10571 Ų7155%0.5539%0.39SS..Hα-helixtrans-64.3-42.4173.8-70.4168.8000111.6K240 T247 V248K240-L244 VanDerWaalsContact O-CG 3.31Å; K240-L244 WeakPolarHBondContact O-CG 3.28Å; K240-L244 PolarHBondContact O-N 2.91Å; K240-L244 VanDerWaalsContact O-N 3.1Å; L244-T247 PolarHBondContact O-N 3.25Å; L244-V248 WeakPolarHBondContact O-CG2 3.24Å; L244-V248 PolarHBondContact O-N 3.47Å
245L64.9Low68.2Low28 Ų2868.9 Ų68.915%0.14737%0.373CS..Hα-helixtrans-59.8-48.6175172.754.4000112.3Y209 S241 M242 T247 V248 I249Y209-L245 HydrophobicContact CD1-CD1 4.3Å; Y209-L245 HydrophobicContact CD2-CB 4.48Å; Y209-L245 HydrophobicContact CD2-CD1 3.85Å; Y209-L245 HydrophobicContact CE1-CD1 3.73Å; Y209-L245 HydrophobicContact CE2-CB 3.78Å; Y209-L245 HydrophobicContact CE2-CD1 3.29Å; Y209-L245 HydrophobicContact CE2-CD2 4.22Å; Y209-L245 HydrophobicContact CE2-CG 3.91Å; Y209-L245 HydrophobicContact CG-CD1 4.32Å; Y209-L245 VanDerWaalsContact OH-CD1 3.29Å; Y209-L245 WeakPolarHBondContact OH-CD1 3.33Å; Y209-L245 WeakPolarHBondContact OH-CD2 3.21Å; S241-L245 WeakPolarHBondContact O-CB 3.14Å; S241-L245 PolarHBondContact O-N 2.81Å; S241-L245 VanDerWaalsContact O-N 3.08Å; M242-L245 PolarHBondContact O-N 3.01Å; M242-L245 HydrophobicContact SD-CD2 4.05Å; L245-T247 VanDerWaalsContact C-N 3.28Å; L245-T247 PolarHBondContact O-N 3.19Å; L245-V248 PolarHBondContact O-N 3.36Å; L245-I249 HydrophobicContact CD1-CD1 3.44Å; L245-I249 VanDerWaalsContact CD1-CD1 3.44Å; L245-I249 HydrophobicContact CD1-CG1 3.84Å; L245-I249 HydrophobicContact CG-CD1 3.81Å; L245-I249 WeakPolarHBondContact O-CG1 3.29Å; L245-I249 PolarHBondContact O-N 3.29Å
246K68.7Low69.8Low142 Ų14270 Ų7062%0.61737%0.374SS*.Hα-helixtrans-56.4-45.6177.9-76.3178.7179.3-173.60110.8M242 A243 V248 I249 I250M242-K246 WeakPolarHBondContact O-CG 3.48Å; M242-K246 PolarHBondContact O-N 3.02Å; A243-K246 PolarHBondContact O-N 3.26Å; K246-V248 PolarHBondContact O-N 3.42Å; K246-I249 PolarHBondContact O-N 3.23Å; K246-I250 WeakPolarHBondContact O-CB 3.5Å; K246-I250 WeakPolarHBondContact O-CD1 3.39Å; K246-I250 WeakPolarHBondContact O-CG1 3.47Å; K246-I250 PolarHBondContact O-N 3.3Å
247T70.1Confident71.2Confident42 Ų4267.1 Ų67.126%0.25837%0.372SS..Hα-helixtrans-63.1-42.9179.8-48.80000111.8A243 L244 L245 I250 V251 T304A243-T247 PolarHBondContact O-N 2.9Å; A243-T247 VanDerWaalsContact O-N 3.1Å; A243-T247 PolarHBondContact O-OG1 3.26Å; L244-T247 PolarHBondContact O-N 3.25Å; L245-T247 VanDerWaalsContact C-N 3.28Å; L245-T247 PolarHBondContact O-N 3.19Å; T247-I250 PolarHBondContact O-N 2.91Å; T247-V251 HydrophobicContact CG2-CG2 4.49Å; T247-V251 WeakPolarHBondContact O-CG2 3.45Å; T247-V251 PolarHBondContact O-N 3.47Å; T247-T304 HydrophobicContact CG2-CG2 3.63Å
248V68.3Low72.8Confident42 Ų4265.7 Ų65.726%0.25536%0.362SS..Hα-helixtrans-66.8-41.4178.2173.10000112L244 L245 K246 V251 L252L244-V248 WeakPolarHBondContact O-CG2 3.24Å; L244-V248 PolarHBondContact O-N 3.47Å; L245-V248 PolarHBondContact O-N 3.36Å; K246-V248 PolarHBondContact O-N 3.42Å; V248-V251 PolarHBondContact O-N 3.08Å; V248-L252 VanDerWaalsContact O-CB 3.26Å; V248-L252 WeakPolarHBondContact O-CB 3.42Å; V248-L252 PolarHBondContact O-N 2.9Å
249I74.1Confident74.3Confident86 Ų8663.6 Ų63.644%0.44134%0.344SS..Hα-helixtrans-62.8-45.2175.1-71.9167.6000110.1L245 K246 V251 L252 S253L245-I249 HydrophobicContact CD1-CD1 3.44Å; L245-I249 VanDerWaalsContact CD1-CD1 3.44Å; L245-I249 HydrophobicContact CD1-CG1 3.84Å; L245-I249 HydrophobicContact CG-CD1 3.81Å; L245-I249 WeakPolarHBondContact O-CG1 3.29Å; L245-I249 PolarHBondContact O-N 3.29Å; K246-I249 PolarHBondContact O-N 3.23Å; I249-V251 PolarHBondContact O-N 3.28Å; I249-L252 PolarHBondContact O-N 2.75Å; I249-S253 VanDerWaalsContact O-CB 3.28Å; I249-S253 WeakPolarHBondContact O-CB 3.32Å; I249-S253 PolarHBondContact O-N 3.39Å; I249-S253 PolarHBondContact O-OG 2.69Å
250I77.9Confident75.7Confident105 Ų10559.4 Ų59.454%0.53833%0.33SS..Hα-helixtrans-60-47.6178.9-69162.4000110.6K246 T247 L252 S253 C254K246-I250 WeakPolarHBondContact O-CB 3.5Å; K246-I250 WeakPolarHBondContact O-CD1 3.39Å; K246-I250 WeakPolarHBondContact O-CG1 3.47Å; K246-I250 PolarHBondContact O-N 3.3Å; T247-I250 PolarHBondContact O-N 2.91Å; I250-L252 PolarHBondContact O-N 2.91Å; I250-S253 PolarHBondContact O-N 3.5Å; I250-C254 VanDerWaalsContact O-CB 3.22Å; I250-C254 WeakPolarHBondContact O-CB 3.19Å; I250-C254 PolarHBondContact O-N 2.92Å
251V75.1Confident77.2Confident32 Ų3254 Ų5419%0.19431%0.31CS..Hα-helixtrans-57.4-50176.8171.40000110.8T247 V248 I249 C254 F255 I300T247-V251 HydrophobicContact CG2-CG2 4.49Å; T247-V251 WeakPolarHBondContact O-CG2 3.45Å; T247-V251 PolarHBondContact O-N 3.47Å; V248-V251 PolarHBondContact O-N 3.08Å; I249-V251 PolarHBondContact O-N 3.28Å; V251-C254 PolarHBondContact O-N 3.18Å; V251-F255 WeakPolarHBondContact O-CB 3.35Å; V251-F255 PolarHBondContact O-N 3.37Å; V251-I300 HydrophobicContact CB-CD1 4.29Å; V251-I300 HydrophobicContact CG1-CD1 3.81Å; V251-I300 HydrophobicContact CG2-CB 4.39Å; V251-I300 HydrophobicContact CG2-CD1 3.88Å; V251-I300 HydrophobicContact CG2-CG1 3.74Å; V251-I300 HydrophobicContact CG2-CG2 3.79Å
252L76.8Confident78.7Confident43 Ų4353.1 Ų53.123%0.22530%0.303CS..Hα-helixtrans-64.4-46.6-177.5176.662.2000112.1V202 V248 I249 I250 C254 F255 I256V202-L252 HydrophobicContact CB-CD1 3.76Å; V202-L252 HydrophobicContact CG1-CD1 3.53Å; V202-L252 HydrophobicContact CG1-CD2 4.08Å; V202-L252 HydrophobicContact CG1-CG 4.42Å; V202-L252 HydrophobicContact CG2-CD1 3.3Å; V248-L252 VanDerWaalsContact O-CB 3.26Å; V248-L252 WeakPolarHBondContact O-CB 3.42Å; V248-L252 PolarHBondContact O-N 2.9Å; I249-L252 PolarHBondContact O-N 2.75Å; I250-L252 PolarHBondContact O-N 2.91Å; L252-C254 VanDerWaalsContact C-N 3.34Å; L252-F255 WeakPolarHBondContact O-CB 3.3Å; L252-F255 PolarHBondContact O-N 2.86Å; L252-I256 HydrophobicContact CD1-CD1 3.93Å; L252-I256 HydrophobicContact CD1-CG1 4.35Å; L252-I256 HydrophobicContact CG-CD1 4.04Å; L252-I256 WeakPolarHBondContact O-CG1 3.43Å; L252-I256 PolarHBondContact O-N 2.95Å
253S81.2Confident80.1Confident68 Ų6850.1 Ų50.148%0.47629%0.288SS..Hα-helixtrans-64.2-40.8179.4-65.60000111.4I249 I250 I256 A257I249-S253 VanDerWaalsContact O-CB 3.28Å; I249-S253 WeakPolarHBondContact O-CB 3.32Å; I249-S253 PolarHBondContact O-N 3.39Å; I249-S253 PolarHBondContact O-OG 2.69Å; I250-S253 PolarHBondContact O-N 3.5Å; S253-I256 PolarHBondContact O-N 2.68Å; S253-A257 WeakPolarHBondContact O-CB 3.42Å; S253-A257 PolarHBondContact O-N 2.95Å
254C83.4Confident81.5Confident28 Ų2853 Ų5319%0.18930%0.295CS..Hα-helixtrans-63.7-44176.2-173.20000111.3I250 V251 L252 I256 A257 C258 M296I250-C254 VanDerWaalsContact O-CB 3.22Å; I250-C254 WeakPolarHBondContact O-CB 3.19Å; I250-C254 PolarHBondContact O-N 2.92Å; V251-C254 PolarHBondContact O-N 3.18Å; L252-C254 VanDerWaalsContact C-N 3.34Å; C254-I256 PolarHBondContact O-N 3.43Å; C254-A257 PolarHBondContact O-N 2.94Å; C254-C258 WeakPolarHBondContact O-CB 3.24Å; C254-C258 PolarHBondContact O-N 3.05Å; C254-C258 PolarHBondContact O-SG 3.18Å; C254-M296 HydrophobicContact CB-CE 4.44Å; C254-M296 WeakPolarHBondContact SG-CG 3.42Å
255F82.3Confident83Confident18 Ų1848.2 Ų48.28%0.07927%0.27CS..Hα-helixtrans-58.7-49.4176.9-166.6-100.9000112.3L119 L198 V251 L252 A257 C258 W259 N293L119-F255 HydrophobicContact CD1-CD2 4.5Å; L119-F255 HydrophobicContact CD1-CE2 3.56Å; L119-F255 HydrophobicContact CD1-CZ 4.15Å; L198-F255 HydrophobicContact CB-CE1 3.86Å; L198-F255 HydrophobicContact CD1-CD1 4.46Å; L198-F255 HydrophobicContact CD1-CE1 3.53Å; L198-F255 HydrophobicContact CD1-CZ 3.85Å; L198-F255 HydrophobicContact CD2-CE1 3.53Å; L198-F255 HydrophobicContact CD2-CZ 3.35Å; L198-F255 HydrophobicContact CG-CE1 3.77Å; L198-F255 HydrophobicContact CG-CZ 4.07Å; V251-F255 WeakPolarHBondContact O-CB 3.35Å; V251-F255 PolarHBondContact O-N 3.37Å; L252-F255 WeakPolarHBondContact O-CB 3.3Å; L252-F255 PolarHBondContact O-N 2.86Å; F255-A257 PolarHBondContact O-N 3.45Å; F255-C258 PolarHBondContact O-N 2.91Å; F255-W259 AromaticContact CD2-CD1 3.8Å; F255-W259 AromaticContact CD2-NE1 3.85Å; F255-W259 AromaticContact CE1-CD1 3.94Å; F255-W259 AromaticContact CE2-CD1 3.58Å; F255-W259 AromaticContact CE2-NE1 3.39Å; F255-W259 AromaticContact CZ-CD1 3.66Å; F255-W259 AromaticContact CZ-NE1 3.75Å; F255-W259 PolarHBondContact O-N 3.47Å; F255-W259 VanDerWaalsContact O-N 3.14Å; F255-N293 WeakPolarHBondContact CD2-OD1 3.42Å
256I86.8Confident84.4Confident81 Ų8147.6 Ų47.642%0.41527%0.267SS..Hα-helixtrans-63.4-43.7178-65.8168.5000110.6V202 L252 S253 C254 C258 W259 A260V202-I256 HydrophobicContact CG2-CD1 4.48Å; L252-I256 HydrophobicContact CD1-CD1 3.93Å; L252-I256 HydrophobicContact CD1-CG1 4.35Å; L252-I256 HydrophobicContact CG-CD1 4.04Å; L252-I256 WeakPolarHBondContact O-CG1 3.43Å; L252-I256 PolarHBondContact O-N 2.95Å; S253-I256 PolarHBondContact O-N 2.68Å; C254-I256 PolarHBondContact O-N 3.43Å; I256-C258 VanDerWaalsContact C-N 3.29Å; I256-C258 PolarHBondContact O-N 3.16Å; I256-W259 PolarHBondContact O-N 3.38Å; I256-A260 HydrophobicContact CG2-CB 4.18Å; I256-A260 WeakPolarHBondContact O-CB 3.38Å; I256-A260 PolarHBondContact O-N 3.41Å
257A89.6Confident85.7Confident58 Ų5844.7 Ų44.748%0.47926%0.257SS..Hα-helixtrans-63.5-33.4-179.400000112.9S253 C254 F255 P261S253-A257 WeakPolarHBondContact O-CB 3.42Å; S253-A257 PolarHBondContact O-N 2.95Å; C254-A257 PolarHBondContact O-N 2.94Å; F255-A257 PolarHBondContact O-N 3.45Å; A257-P261 VanDerWaalsContact O-CD 3.23Å; A257-P261 WeakPolarHBondContact O-CD 3.49Å; A257-P261 WeakPolarHBondContact O-CG 3.44Å
258C89.8Confident86.9Confident9 Ų945.8 Ų45.86%0.06126%0.261CS..Hα-helixtrans-76.2-40.6177.5-70.20000113C254 F255 I256 A290 N293C254-C258 WeakPolarHBondContact O-CB 3.24Å; C254-C258 PolarHBondContact O-N 3.05Å; C254-C258 PolarHBondContact O-SG 3.18Å; F255-C258 PolarHBondContact O-N 2.91Å; I256-C258 VanDerWaalsContact C-N 3.29Å; I256-C258 PolarHBondContact O-N 3.16Å; C258-A290 WeakPolarHBondContact O-CA 3.43Å; C258-N293 HydrophobicContact CB-CB 3.8Å
259W90.5Very high88.2Confident19 Ų1943.8 Ų43.87%0.07225%0.249CC..Hα-helixtrans-94-38.2-171.2-71.3105.2000114.8L112 L198 F255 I256 P261 L262 F263 A290 N293L112-W259 HydrophobicContact CD1-CE3 4.23Å; L112-W259 HydrophobicContact CD1-CH2 3.05Å; L112-W259 HydrophobicContact CD1-CZ2 3.81Å; L112-W259 HydrophobicContact CD1-CZ3 3.25Å; L112-W259 HydrophobicContact CD2-CZ3 4.13Å; L112-W259 HydrophobicContact CG-CH2 4.36Å; L112-W259 HydrophobicContact CG-CZ3 4.34Å; L198-W259 HydrophobicContact CD1-CB 3.57Å; L198-W259 HydrophobicContact CD1-CD2 4.13Å; L198-W259 HydrophobicContact CD1-CG 3.56Å; F255-W259 AromaticContact CD2-CD1 3.8Å; F255-W259 AromaticContact CD2-NE1 3.85Å; F255-W259 AromaticContact CE1-CD1 3.94Å; F255-W259 AromaticContact CE2-CD1 3.58Å; F255-W259 AromaticContact CE2-NE1 3.39Å; F255-W259 AromaticContact CZ-CD1 3.66Å; F255-W259 AromaticContact CZ-NE1 3.75Å; F255-W259 PolarHBondContact O-N 3.47Å; F255-W259 VanDerWaalsContact O-N 3.14Å; I256-W259 PolarHBondContact O-N 3.38Å; W259-P261 VanDerWaalsContact C-CD 3.5Å; W259-L262 HydrophobicContact CZ3-CD2 4.32Å; W259-L262 PolarHBondContact O-N 3.4Å; W259-F263 HydrophobicContact CB-CE2 4.48Å; W259-F263 HydrophobicContact CE3-CE1 4.23Å; W259-F263 HydrophobicContact CE3-CZ 4.19Å; W259-F263 PolarHBondContact O-N 3.3Å; W259-F263 VanDerWaalsContact O-N 3.13Å; W259-A290 HydrophobicContact CE3-CB 4.1Å; W259-A290 HydrophobicContact CH2-CB 4.09Å; W259-A290 HydrophobicContact CZ3-CB 3.8Å; W259-N293 HydrophobicContact CZ2-CB 4.24Å; W259-N293 VanDerWaalsContact NE1-CG 3.32Å; W259-N293 PolarHBondContact NE1-ND2 3.23Å; W259-N293 VanDerWaalsContact NE1-ND2 3.17Å
260A91.4Very high89.1Confident32 Ų3241.3 Ų41.326%0.26424%0.238SC..Hα-helixtrans-58.6-42.2-173.600000113.4I256 L262 F263 I264I256-A260 HydrophobicContact CG2-CB 4.18Å; I256-A260 WeakPolarHBondContact O-CB 3.38Å; I256-A260 PolarHBondContact O-N 3.41Å; A260-L262 VanDerWaalsContact C-N 3.3Å; A260-L262 PolarHBondContact O-N 3.17Å; A260-F263 PolarHBondContact O-N 2.94Å; A260-I264 WeakPolarHBondContact O-CB 3.31Å; A260-I264 VanDerWaalsContact O-CG1 3.26Å; A260-I264 WeakPolarHBondContact O-CG1 3.27Å; A260-I264 PolarHBondContact O-N 3.25Å
261P94.8Very high89.9Confident34 Ų3440.3 Ų40.322%0.22125%0.246CC..Hα-helixtrans-59.5-40.1178.7-26.437.9000112.9A257 W259 L265 F286 L289A257-P261 VanDerWaalsContact O-CD 3.23Å; A257-P261 WeakPolarHBondContact O-CD 3.49Å; A257-P261 WeakPolarHBondContact O-CG 3.44Å; W259-P261 VanDerWaalsContact C-CD 3.5Å; P261-L265 WeakPolarHBondContact O-CB 3.27Å; P261-L265 PolarHBondContact O-N 3.44Å; P261-F286 HydrophobicContact CB-CD1 3.62Å; P261-F286 HydrophobicContact CB-CE1 4.02Å; P261-L289 HydrophobicContact CB-CD2 4.26Å; P261-L289 HydrophobicContact CG-CD2 3.89Å
262L93.7Very high90.7Very high10 Ų1039.4 Ų39.45%0.05224%0.24CC..Hα-helixtrans-68.2-44.4178.1-179.464.1000111.5W259 A260 I264 L265 L266 F286 L287 A290W259-L262 HydrophobicContact CZ3-CD2 4.32Å; W259-L262 PolarHBondContact O-N 3.4Å; A260-L262 VanDerWaalsContact C-N 3.3Å; A260-L262 PolarHBondContact O-N 3.17Å; L262-I264 PolarHBondContact O-N 3.43Å; L262-L265 WeakPolarHBondContact O-CB 3.35Å; L262-L265 PolarHBondContact O-N 3Å; L262-L266 HydrophobicContact CD1-CG 4.41Å; L262-L266 HydrophobicContact CG-CD1 4.24Å; L262-L266 WeakPolarHBondContact O-CG 3.38Å; L262-L266 PolarHBondContact O-N 2.99Å; L262-F286 HydrophobicContact CD1-CB 4.13Å; L262-L287 HydrophobicContact CD1-CD2 3.73Å; L262-L287 HydrophobicContact CD1-CG 4.14Å; L262-L287 HydrophobicContact CD2-CD2 4Å; L262-A290 HydrophobicContact CB-CB 4.37Å; L262-A290 HydrophobicContact CD2-CB 3.67Å
263F93.4Very high91.3Very high18 Ų1843 Ų438%0.07926%0.26CS..Hα-helixtrans-65.4-39.1178.5-69.4-14.1000112.8T191 F194 S195 L198 W259 A260 L265 L266 L267T191-F263 HydrophobicContact CG2-CB 4.09Å; T191-F263 HydrophobicContact CG2-CD1 4.12Å; T191-F263 HydrophobicContact CG2-CG 4.18Å; F194-F263 HydrophobicContact CB-CE1 4.17Å; F194-F263 HydrophobicContact CB-CE2 4.34Å; F194-F263 HydrophobicContact CB-CZ 3.59Å; S195-F263 WeakPolarHBondContact OG-CD2 3.29Å; L198-F263 HydrophobicContact CD1-CD2 4.43Å; L198-F263 HydrophobicContact CD1-CE2 3.39Å; L198-F263 HydrophobicContact CD1-CZ 3.79Å; L198-F263 HydrophobicContact CG-CE2 3.93Å; L198-F263 HydrophobicContact CG-CZ 4.3Å; W259-F263 HydrophobicContact CB-CE2 4.48Å; W259-F263 HydrophobicContact CE3-CE1 4.23Å; W259-F263 HydrophobicContact CE3-CZ 4.19Å; W259-F263 PolarHBondContact O-N 3.3Å; W259-F263 VanDerWaalsContact O-N 3.13Å; A260-F263 PolarHBondContact O-N 2.94Å; F263-L265 VanDerWaalsContact C-N 3.3Å; F263-L265 PolarHBondContact O-N 2.89Å; F263-L266 PolarHBondContact O-N 3.44Å; F263-L267 WeakPolarHBondContact O-CB 3.37Å; F263-L267 WeakPolarHBondContact O-CG 3.41Å; F263-L267 PolarHBondContact O-N 3.43Å
264I94.9Very high91.7Very high114 Ų11441.3 Ų41.359%0.58525%0.245SC*.Hα-helixtrans-61.3-43.1173.5-67.3165.2000110.1A260 L262 L266 L267 L268A260-I264 WeakPolarHBondContact O-CB 3.31Å; A260-I264 VanDerWaalsContact O-CG1 3.26Å; A260-I264 WeakPolarHBondContact O-CG1 3.27Å; A260-I264 PolarHBondContact O-N 3.25Å; L262-I264 PolarHBondContact O-N 3.43Å; I264-L266 PolarHBondContact O-N 3.39Å; I264-L267 PolarHBondContact O-N 3.03Å; I264-L268 WeakPolarHBondContact O-CB 3.18Å; I264-L268 PolarHBondContact O-N 3.46Å
265L95.8Very high91.8Very high4 Ų446.8 Ų46.82%0.02126%0.262CS..Hα-helixtrans-61.8-43.1176.7-170.279.7000112.2V178 P261 L262 F263 L268 D269 I279 L280 A283 F286V178-L265 HydrophobicContact CG2-CD2 4.44Å; P261-L265 WeakPolarHBondContact O-CB 3.27Å; P261-L265 PolarHBondContact O-N 3.44Å; L262-L265 WeakPolarHBondContact O-CB 3.35Å; L262-L265 PolarHBondContact O-N 3Å; F263-L265 VanDerWaalsContact C-N 3.3Å; F263-L265 PolarHBondContact O-N 2.89Å; L265-L268 WeakPolarHBondContact O-CB 3.37Å; L265-L268 PolarHBondContact O-N 3.39Å; L265-D269 WeakPolarHBondContact O-CB 3.44Å; L265-D269 PolarHBondContact O-N 2.87Å; L265-I279 HydrophobicContact CD1-CG1 4.06Å; L265-I279 HydrophobicContact CD1-CG2 4.22Å; L265-L280 HydrophobicContact CD1-CD1 4.21Å; L265-A283 HydrophobicContact CD2-CB 3.69Å; L265-F286 HydrophobicContact CB-CD1 4.47Å; L265-F286 HydrophobicContact CD1-CD2 4.32Å; L265-F286 HydrophobicContact CD1-CE2 4.1Å; L265-F286 HydrophobicContact CD1-CZ 4.29Å; L265-F286 HydrophobicContact CD2-CB 4.04Å; L265-F286 HydrophobicContact CD2-CD2 3.78Å; L265-F286 HydrophobicContact CD2-CE2 4.38Å; L265-F286 HydrophobicContact CD2-CG 3.9Å
266L95.1Very high92.1Very high15 Ų1552.9 Ų52.98%0.07929%0.292CS..Hα-helixtrans-68.6-38178.8-67.8175.8000112.2V178 L179 I187 T191 L262 F263 I264 L268 D269 V270V178-L266 HydrophobicContact CG1-CD2 4.41Å; L179-L266 HydrophobicContact CD1-CD2 4.45Å; I187-L266 HydrophobicContact CG2-CB 4.02Å; I187-L266 HydrophobicContact CG2-CD2 3.92Å; I187-L266 HydrophobicContact CG2-CG 4.38Å; T191-L266 HydrophobicContact CG2-CB 4.34Å; L262-L266 HydrophobicContact CD1-CG 4.41Å; L262-L266 HydrophobicContact CG-CD1 4.24Å; L262-L266 WeakPolarHBondContact O-CG 3.38Å; L262-L266 PolarHBondContact O-N 2.99Å; F263-L266 PolarHBondContact O-N 3.44Å; I264-L266 PolarHBondContact O-N 3.39Å; L266-L268 VanDerWaalsContact C-N 3.33Å; L266-D269 PolarHBondContact O-N 3.42Å; L266-V270 WeakPolarHBondContact O-CG2 3.46Å; L266-V270 PolarHBondContact O-N 3.21Å; L266-V270 VanDerWaalsContact O-N 3.09Å
267L95.5Very high92.4Very high80 Ų8050.4 Ų50.442%0.41928%0.282SS..Hα-helixtrans-64.6-40.4172.4-71.2174.2000111.4L188 T191 F263 I264 D269 V270 A271L188-L267 HydrophobicContact CD1-CD2 3.85Å; T191-L267 HydrophobicContact CG2-CD2 4.13Å; T191-L267 HydrophobicContact CG2-CG 4.04Å; F263-L267 WeakPolarHBondContact O-CB 3.37Å; F263-L267 WeakPolarHBondContact O-CG 3.41Å; F263-L267 PolarHBondContact O-N 3.43Å; I264-L267 PolarHBondContact O-N 3.03Å; L267-D269 VanDerWaalsContact C-N 3.33Å; L267-V270 PolarHBondContact O-N 3.3Å; L267-A271 WeakPolarHBondContact O-CB 3.23Å; L267-A271 PolarHBondContact O-N 2.96Å
268L95.4Very high92.4Very high65 Ų6551.2 Ų51.234%0.3429%0.289SS..Hα-helixtrans-63.7-39.3174.2-175.965.6000111.6I264 L265 L266 V270 A271 C272 I279 L280I264-L268 WeakPolarHBondContact O-CB 3.18Å; I264-L268 PolarHBondContact O-N 3.46Å; L265-L268 WeakPolarHBondContact O-CB 3.37Å; L265-L268 PolarHBondContact O-N 3.39Å; L266-L268 VanDerWaalsContact C-N 3.33Å; L268-V270 VanDerWaalsContact C-N 3.31Å; L268-V270 PolarHBondContact O-N 3.24Å; L268-A271 PolarHBondContact O-N 3.37Å; L268-C272 HydrophobicContact CD1-CB 4.46Å; L268-C272 WeakPolarHBondContact O-CB 3.42Å; L268-C272 PolarHBondContact O-N 3.49Å; L268-I279 HydrophobicContact CD2-CG2 3.46Å; L268-I279 VanDerWaalsContact CD2-CG2 3.46Å; L268-L280 HydrophobicContact CD2-CD1 3.75Å; L268-L280 HydrophobicContact CG-CD1 3.98Å
269D94.4Very high92.5Very high0 Ų054.2 Ų54.20%030%0.303CS..Hα-helixtrans-64.1-34.1176.6178.463.3000113.2S176 T177 V178 K184 L265 L266 L267 L280S176-D269 WeakPolarHBondContact CB-OD2 3.41Å; S176-D269 PolarHBondContact OG-OD2 2.94Å; T177-D269 WeakPolarHBondContact CA-OD1 3.32Å; T177-D269 VanDerWaalsContact CB-OD1 3.26Å; T177-D269 WeakPolarHBondContact CB-OD1 3.47Å; T177-D269 PolarHBondContact N-OD1 3.42Å; V178-D269 HydrophobicContact CG2-CB 3.9Å; V178-D269 PolarHBondContact N-OD1 3.11Å; V178-D269 VanDerWaalsContact N-OD1 3.13Å; K184-D269 VanDerWaalsContact CE-O 3.25Å; K184-D269 WeakPolarHBondContact CE-O 3.38Å; K184-D269 PolarHBondContact NZ-O 3.4Å; L265-D269 WeakPolarHBondContact O-CB 3.44Å; L265-D269 PolarHBondContact O-N 2.87Å; L266-D269 PolarHBondContact O-N 3.42Å; L267-D269 VanDerWaalsContact C-N 3.33Å; D269-L280 HydrophobicContact CB-CD2 4Å; D269-L280 HydrophobicContact CB-CG 4.13Å; D269-L280 WeakPolarHBondContact OD1-CD2 2.99Å
270V94.4Very high92.6Very high35 Ų3553.3 Ų53.321%0.21230%0.3CS..Hα-helixtrans-70.3-45.1172.8174.20000110.9K184 I187 L188 L266 L267 L268K184-V270 HydrophobicContact CB-CG2 4.41Å; K184-V270 PolarHBondContact NZ-O 3.36Å; K184-V270 WeakPolarHBondContact O-CG2 3.36Å; I187-V270 HydrophobicContact CB-CG2 4.34Å; I187-V270 HydrophobicContact CG2-CG2 4.16Å; L188-V270 HydrophobicContact CB-CG1 4.25Å; L188-V270 HydrophobicContact CB-CG2 4.08Å; L188-V270 HydrophobicContact CD1-CG1 4.46Å; L188-V270 HydrophobicContact CD2-CG1 4.37Å; L266-V270 WeakPolarHBondContact O-CG2 3.46Å; L266-V270 PolarHBondContact O-N 3.21Å; L266-V270 VanDerWaalsContact O-N 3.09Å; L267-V270 PolarHBondContact O-N 3.3Å; L268-V270 VanDerWaalsContact C-N 3.31Å; L268-V270 PolarHBondContact O-N 3.24Å
271A93.6Very high92.5Very high84 Ų8455.7 Ų55.769%0.69430%0.303SS*.Hα-helixtrans-78.4-25-174.400000114.4L267 L268L267-A271 WeakPolarHBondContact O-CB 3.23Å; L267-A271 PolarHBondContact O-N 2.96Å; L268-A271 PolarHBondContact O-N 3.37Å
272C92.6Very high92.2Very high13 Ų1360.3 Ų60.39%0.08832%0.319CS..SBendtrans-92.9141.1-175-167.40000111.8K184 L268 C277K184-C272 PolarHBondContact NZ-O 2.94Å; L268-C272 HydrophobicContact CD1-CB 4.46Å; L268-C272 WeakPolarHBondContact O-CB 3.42Å; L268-C272 PolarHBondContact O-N 3.49Å; C272-C277 HydrophobicContact CB-CB 4Å; C272-C277 WeakPolarHBondContact CB-SG 3.26Å; C272-C277 WeakPolarHBondContact SG-CB 3.12Å; C272-C277 PolarHBondContact SG-N 3.28Å; C272-C277 CovalentContact SG-SG 2.04Å; C272-C277 PolarHBondContact SG-SG 3.08Å
273D89.6Confident92Very high119 Ų11960.1 Ų60.164%0.63632%0.319SS*.PPolyproline II helixtrans-69.1153170.9-70.1-38.5000111.7R275 M276D273-R275 PolarHBondContact O-N 3.37Å; D273-M276 HydrophobicContact CB-CG 3.94Å; D273-M276 WeakPolarHBondContact O-CB 3.49Å; D273-M276 PolarHBondContact O-N 3.03Å
274I88.2Confident91.7Very high31 Ų3163 Ų6316%0.15933%0.333CS..THydrogen-bonded Turntrans-61.6137.7-176.2-67.1168.3000109.3F16 M276F16-I274 HydrophobicContact CD1-CD1 3.86Å; F16-I274 HydrophobicContact CE1-CD1 3.25Å; F16-I274 HydrophobicContact CZ-CD1 4.14Å; F16-I274 WeakPolarHBondContact O-CG2 3.48Å; I274-M276 PolarHBondContact O-N 2.95Å
275R86Confident91.4Very high143 Ų14364.2 Ų64.254%0.5433%0.33SS..THydrogen-bonded Turntrans67.80.2-177.3-59.7163.8178.9-152.7-3117N15 F16 D273N15-R275 PolarHBondContact O-NH2 2.83Å; F16-R275 PolarHBondContact O-NE 3.37Å; F16-R275 PolarHBondContact O-NH2 3.14Å; D273-R275 PolarHBondContact O-N 3.37Å
276M89.2Confident91.3Very high147 Ų14766.2 Ų66.272%0.72434%0.339SS*.THydrogen-bonded Turntrans-83.1-43.5178.5-65.8-65-73.600112.6D273 I274 A278D273-M276 HydrophobicContact CB-CG 3.94Å; D273-M276 WeakPolarHBondContact O-CB 3.49Å; D273-M276 PolarHBondContact O-N 3.03Å; I274-M276 PolarHBondContact O-N 2.95Å; M276-A278 PolarHBondContact O-N 2.92Å
277C92.4Very high91Very high28 Ų2868.2 Ų68.219%0.18935%0.349CS..  trans-94.3100.8-173.6-67.70000112.5C272 I279 L280C272-C277 HydrophobicContact CB-CB 4Å; C272-C277 WeakPolarHBondContact CB-SG 3.26Å; C272-C277 WeakPolarHBondContact SG-CB 3.12Å; C272-C277 PolarHBondContact SG-N 3.28Å; C272-C277 CovalentContact SG-SG 2.04Å; C272-C277 PolarHBondContact SG-SG 3.08Å; C277-I279 PolarHBondContact O-N 3.48Å; C277-I279 VanDerWaalsContact O-N 3.15Å; C277-L280 HydrophobicContact CB-CD1 3.56Å; C277-L280 HydrophobicContact CB-CD2 3.98Å; C277-L280 HydrophobicContact CB-CG 4.32Å; C277-L280 PolarHBondContact O-N 2.91Å
278A90.4Very high90.8Very high76 Ų7664.8 Ų64.863%0.62833%0.332SS*.G310 helixtrans-59.7-26.5-179.700000114.3M276 L280 Y281M276-A278 PolarHBondContact O-N 2.92Å; A278-L280 VanDerWaalsContact C-N 3.28Å; A278-L280 PolarHBondContact O-N 3.15Å; A278-Y281 WeakPolarHBondContact O-CD2 3.04Å; A278-Y281 PolarHBondContact O-N 3.13Å
279I92.1Very high90.6Very high71 Ų7164.9 Ų64.936%0.36433%0.333SS..G310 helixtrans-66.7-26.5-179.1-168.262.3000113.1L265 L268 C277 Y281 K282 F286L265-I279 HydrophobicContact CD1-CG1 4.06Å; L265-I279 HydrophobicContact CD1-CG2 4.22Å; L268-I279 HydrophobicContact CD2-CG2 3.46Å; L268-I279 VanDerWaalsContact CD2-CG2 3.46Å; C277-I279 PolarHBondContact O-N 3.48Å; C277-I279 VanDerWaalsContact O-N 3.15Å; I279-Y281 PolarHBondContact O-N 3.27Å; I279-K282 PolarHBondContact O-N 3.49Å; I279-F286 HydrophobicContact CD1-CE2 4.03Å; I279-F286 HydrophobicContact CD1-CZ 3.98Å; I279-F286 HydrophobicContact CG1-CE2 4.22Å; I279-F286 HydrophobicContact CG1-CZ 4.08Å
280L91.3Very high90.4Very high1 Ų165 Ų651%0.00533%0.334CS..G310 helixtrans-65.7-23.3-179.7-80.247.7000112.4T177 V178 L265 L268 D269 C277 A278 K282T177-L280 HydrophobicContact CG2-CB 4.11Å; T177-L280 HydrophobicContact CG2-CD2 4.29Å; V178-L280 HydrophobicContact CG2-CB 4.26Å; V178-L280 HydrophobicContact CG2-CG 4.2Å; L265-L280 HydrophobicContact CD1-CD1 4.21Å; L268-L280 HydrophobicContact CD2-CD1 3.75Å; L268-L280 HydrophobicContact CG-CD1 3.98Å; D269-L280 HydrophobicContact CB-CD2 4Å; D269-L280 HydrophobicContact CB-CG 4.13Å; D269-L280 WeakPolarHBondContact OD1-CD2 2.99Å; C277-L280 HydrophobicContact CB-CD1 3.56Å; C277-L280 HydrophobicContact CB-CD2 3.98Å; C277-L280 HydrophobicContact CB-CG 4.32Å; C277-L280 PolarHBondContact O-N 2.91Å; A278-L280 VanDerWaalsContact C-N 3.28Å; A278-L280 PolarHBondContact O-N 3.15Å; L280-K282 VanDerWaalsContact C-N 3.26Å; L280-K282 PolarHBondContact O-N 2.47Å
281Y89.1Confident90.1Very high82 Ų8264 Ų6432%0.32233%0.328SS..G310 helixtrans-77.1-12.5176.3-60.7-81.8000113.2T17 G18 K19 T177 A278 I279T17-Y281 WeakPolarHBondContact O-CE1 3.41Å; T17-Y281 PolarHBondContact O-OH 3.21Å; G18-Y281 WeakPolarHBondContact O-CE1 3.44Å; K19-Y281 HydrophobicContact CG-CD1 3.71Å; K19-Y281 HydrophobicContact CG-CE1 3.71Å; T177-Y281 HydrophobicContact CG2-CE1 4.22Å; A278-Y281 WeakPolarHBondContact O-CD2 3.04Å; A278-Y281 PolarHBondContact O-N 3.13Å; I279-Y281 PolarHBondContact O-N 3.27Å
282K89.2Confident89.9Confident131 Ų13163.4 Ų63.457%0.5731%0.312SS*.G310 helixtrans-100.419.1176.6-62.4-172.2179.4-178.80113I279 L280 E284 W285 F286I279-K282 PolarHBondContact O-N 3.49Å; L280-K282 VanDerWaalsContact C-N 3.26Å; L280-K282 PolarHBondContact O-N 2.47Å; K282-E284 PolarHBondContact O-N 3.2Å; K282-E284 VanDerWaalsContact O-N 3.08Å; K282-W285 PolarHBondContact O-N 2.91Å; K282-F286 WeakPolarHBondContact O-CD2 3.18Å
283A89.2Confident89.6Confident5 Ų562.9 Ų62.94%0.04131%0.309CS..Hα-helixtrans-55.3-27.5-176.200000114.6V178 L265 W285 F286 L287V178-A283 HydrophobicContact CG1-CB 3.75Å; V178-A283 HydrophobicContact CG2-CB 4.28Å; L265-A283 HydrophobicContact CD2-CB 3.69Å; A283-W285 VanDerWaalsContact C-N 3.26Å; A283-W285 PolarHBondContact O-N 3.11Å; A283-F286 PolarHBondContact O-N 2.91Å; A283-F286 VanDerWaalsContact O-N 3.08Å; A283-L287 WeakPolarHBondContact O-CG 3.18Å; A283-L287 PolarHBondContact O-N 2.03Å
284E86.3Confident89.6Confident79 Ų7957.5 Ų57.537%0.36928%0.281SS..Hα-helixtrans-55.1-38.9178.4-64.8175.9171.200112.4F36 Y82 K282 L287 A288F36-E284 HydrophobicContact CE2-CB 4.45Å; Y82-E284 PolarHBondContact OH-O 3.33Å; K282-E284 PolarHBondContact O-N 3.2Å; K282-E284 VanDerWaalsContact O-N 3.08Å; E284-L287 PolarHBondContact O-N 2.94Å; E284-A288 WeakPolarHBondContact O-CB 3.32Å; E284-A288 PolarHBondContact O-N 2.91Å
285W90.4Very high89.5Confident140 Ų14056.5 Ų56.553%0.5328%0.277SS..Hα-helixtrans-67.3-38177.3-68.796.8000113D32 F36 K282 A283 L289D32-W285 HydrophobicContact CB-CH2 4Å; D32-W285 HydrophobicContact CB-CZ2 3.77Å; F36-W285 AromaticContact CE1-CE3 3.95Å; F36-W285 HydrophobicContact CE1-CE3 3.95Å; F36-W285 HydrophobicContact CE1-CH2 4.5Å; F36-W285 AromaticContact CE1-CZ3 3.86Å; F36-W285 HydrophobicContact CE1-CZ3 3.86Å; F36-W285 AromaticContact CZ-CD2 3.89Å; F36-W285 HydrophobicContact CZ-CD2 3.89Å; F36-W285 AromaticContact CZ-CE3 3.61Å; F36-W285 HydrophobicContact CZ-CE3 3.61Å; F36-W285 HydrophobicContact CZ-CH2 4.12Å; F36-W285 HydrophobicContact CZ-CZ2 4.37Å; F36-W285 AromaticContact CZ-CZ3 3.73Å; F36-W285 HydrophobicContact CZ-CZ3 3.73Å; K282-W285 PolarHBondContact O-N 2.91Å; A283-W285 VanDerWaalsContact C-N 3.26Å; A283-W285 PolarHBondContact O-N 3.11Å; W285-L289 WeakPolarHBondContact O-CB 3.49Å; W285-L289 PolarHBondContact O-N 3.21Å
286F92.9Very high89.4Confident46 Ų4652.1 Ų52.120%0.20226%0.263CS..Hα-helixtrans-72-38.1178.4-63.2-94.6000111.2P261 L262 L265 I279 K282 A283 L289 A290P261-F286 HydrophobicContact CB-CD1 3.62Å; P261-F286 HydrophobicContact CB-CE1 4.02Å; L262-F286 HydrophobicContact CD1-CB 4.13Å; L265-F286 HydrophobicContact CB-CD1 4.47Å; L265-F286 HydrophobicContact CD1-CD2 4.32Å; L265-F286 HydrophobicContact CD1-CE2 4.1Å; L265-F286 HydrophobicContact CD1-CZ 4.29Å; L265-F286 HydrophobicContact CD2-CB 4.04Å; L265-F286 HydrophobicContact CD2-CD2 3.78Å; L265-F286 HydrophobicContact CD2-CE2 4.38Å; L265-F286 HydrophobicContact CD2-CG 3.9Å; I279-F286 HydrophobicContact CD1-CE2 4.03Å; I279-F286 HydrophobicContact CD1-CZ 3.98Å; I279-F286 HydrophobicContact CG1-CE2 4.22Å; I279-F286 HydrophobicContact CG1-CZ 4.08Å; K282-F286 WeakPolarHBondContact O-CD2 3.18Å; A283-F286 PolarHBondContact O-N 2.91Å; A283-F286 VanDerWaalsContact O-N 3.08Å; F286-L289 PolarHBondContact O-N 3.03Å; F286-A290 PolarHBondContact O-N 2.92Å
287L89.5Confident89.2Confident56 Ų5645.4 Ų45.429%0.29323%0.23SC..Hα-helixtrans-64.8-45.8173.1-71169.4000111.3Y82 L262 A283 E284 L289 A290 V291Y82-L287 HydrophobicContact CE2-CB 4.36Å; L262-L287 HydrophobicContact CD1-CD2 3.73Å; L262-L287 HydrophobicContact CD1-CG 4.14Å; L262-L287 HydrophobicContact CD2-CD2 4Å; A283-L287 WeakPolarHBondContact O-CG 3.18Å; A283-L287 PolarHBondContact O-N 2.03Å; E284-L287 PolarHBondContact O-N 2.94Å; L287-L289 VanDerWaalsContact C-N 3.3Å; L287-L289 PolarHBondContact O-N 2.98Å; L287-A290 PolarHBondContact O-N 3.43Å; L287-A290 VanDerWaalsContact O-N 3.17Å; L287-V291 WeakPolarHBondContact O-CG2 3.4Å; L287-V291 PolarHBondContact O-N 3.31Å
288A89.8Confident88.7Confident9 Ų944.2 Ų44.27%0.07422%0.222CC..Hα-helixtrans-59.4-42.1176.400000111.8F36 Y82 E284 A290 V291 L292F36-A288 HydrophobicContact CD1-CB 3.57Å; F36-A288 HydrophobicContact CD2-CB 4.5Å; F36-A288 HydrophobicContact CE1-CB 3.38Å; F36-A288 HydrophobicContact CE2-CB 4.35Å; F36-A288 HydrophobicContact CG-CB 4.15Å; F36-A288 HydrophobicContact CZ-CB 3.81Å; Y82-A288 HydrophobicContact CE1-CB 4.44Å; Y82-A288 PolarHBondContact OH-N 3.4Å; E284-A288 WeakPolarHBondContact O-CB 3.32Å; E284-A288 PolarHBondContact O-N 2.91Å; A288-A290 PolarHBondContact O-N 3.47Å; A288-V291 PolarHBondContact O-N 2.95Å; A288-L292 WeakPolarHBondContact O-CG 3.43Å; A288-L292 PolarHBondContact O-N 3.18Å
289L91.8Very high88.1Confident66 Ų6644 Ų4435%0.34621%0.21SC..Hα-helixtrans-63.9-38.3176-176.562.7000112.8P261 W285 F286 L287 L292P261-L289 HydrophobicContact CB-CD2 4.26Å; P261-L289 HydrophobicContact CG-CD2 3.89Å; W285-L289 WeakPolarHBondContact O-CB 3.49Å; W285-L289 PolarHBondContact O-N 3.21Å; F286-L289 PolarHBondContact O-N 3.03Å; L287-L289 VanDerWaalsContact C-N 3.3Å; L287-L289 PolarHBondContact O-N 2.98Å; L289-L292 HydrophobicContact CD1-CD1 4.38Å; L289-L292 WeakPolarHBondContact O-CB 2.84Å; L289-L292 PolarHBondContact O-N 2.94Å
290A90.2Very high87.3Confident3 Ų342.1 Ų42.13%0.02520%0.2CC..Hα-helixtrans-67.1-41.4174.300000111.7C258 W259 L262 F286 L287 A288 L292 N293C258-A290 WeakPolarHBondContact O-CA 3.43Å; W259-A290 HydrophobicContact CE3-CB 4.1Å; W259-A290 HydrophobicContact CH2-CB 4.09Å; W259-A290 HydrophobicContact CZ3-CB 3.8Å; L262-A290 HydrophobicContact CB-CB 4.37Å; L262-A290 HydrophobicContact CD2-CB 3.67Å; F286-A290 PolarHBondContact O-N 2.92Å; L287-A290 PolarHBondContact O-N 3.43Å; L287-A290 VanDerWaalsContact O-N 3.17Å; A288-A290 PolarHBondContact O-N 3.47Å; A290-L292 VanDerWaalsContact C-N 3.29Å; A290-L292 PolarHBondContact O-N 3.22Å; A290-N293 WeakPolarHBondContact O-CB 3.5Å; A290-N293 PolarHBondContact O-N 2.9Å; A290-N293 VanDerWaalsContact O-N 3.12Å
291V88.4Confident86.5Confident14 Ų1443.2 Ų43.29%0.08521%0.205CC..Hα-helixtrans-65.2-31.7177.2171.10000112I43 Y82 M108 L287 A288 N293 S294I43-V291 HydrophobicContact CD1-CG1 3.55Å; I43-V291 WeakPolarHBondContact CD1-O 3.08Å; Y82-V291 HydrophobicContact CD1-CB 4.17Å; Y82-V291 HydrophobicContact CD1-CG1 3.86Å; Y82-V291 HydrophobicContact CD1-CG2 3.87Å; Y82-V291 HydrophobicContact CD2-CG2 4.41Å; Y82-V291 HydrophobicContact CE1-CB 4.36Å; Y82-V291 HydrophobicContact CE1-CG1 4.43Å; Y82-V291 HydrophobicContact CE1-CG2 4.18Å; Y82-V291 HydrophobicContact CG-CG2 4.03Å; M108-V291 HydrophobicContact CE-CG2 4.17Å; L287-V291 WeakPolarHBondContact O-CG2 3.4Å; L287-V291 PolarHBondContact O-N 3.31Å; A288-V291 PolarHBondContact O-N 2.95Å; V291-N293 PolarHBondContact O-N 3.13Å; V291-N293 VanDerWaalsContact O-N 3.1Å; V291-S294 WeakPolarHBondContact O-CB 3.47Å; V291-S294 PolarHBondContact O-N 3.22Å
292L88.6Confident85.8Confident71 Ų7140.4 Ų40.437%0.37220%0.196SC..THydrogen-bonded Turntrans-58.1-23173.4-80.6171.2000113.5V39 A288 L289 A290 S294 A295V39-L292 HydrophobicContact CG1-CD2 3.38Å; V39-L292 HydrophobicContact CG1-CG 4.15Å; V39-L292 HydrophobicContact CG2-CD2 4.48Å; A288-L292 WeakPolarHBondContact O-CG 3.43Å; A288-L292 PolarHBondContact O-N 3.18Å; L289-L292 HydrophobicContact CD1-CD1 4.38Å; L289-L292 WeakPolarHBondContact O-CB 2.84Å; L289-L292 PolarHBondContact O-N 2.94Å; A290-L292 VanDerWaalsContact C-N 3.29Å; A290-L292 PolarHBondContact O-N 3.22Å; L292-S294 PolarHBondContact O-N 3.2Å; L292-A295 WeakPolarHBondContact O-CB 3.43Å; L292-A295 PolarHBondContact O-N 3.11Å
293N88.1Confident84.9Confident3 Ų340.4 Ų40.42%0.01620%0.202CC..Hα-helixtrans-58-32.3172.6-175.270.2000112.4F255 C258 W259 A290 V291 A295 M296F255-N293 WeakPolarHBondContact CD2-OD1 3.42Å; C258-N293 HydrophobicContact CB-CB 3.8Å; W259-N293 HydrophobicContact CZ2-CB 4.24Å; W259-N293 VanDerWaalsContact NE1-CG 3.32Å; W259-N293 PolarHBondContact NE1-ND2 3.23Å; W259-N293 VanDerWaalsContact NE1-ND2 3.17Å; A290-N293 WeakPolarHBondContact O-CB 3.5Å; A290-N293 PolarHBondContact O-N 2.9Å; A290-N293 VanDerWaalsContact O-N 3.12Å; V291-N293 PolarHBondContact O-N 3.13Å; V291-N293 VanDerWaalsContact O-N 3.1Å; N293-A295 VanDerWaalsContact C-N 3.26Å; N293-A295 PolarHBondContact O-N 3.28Å; N293-M296 WeakPolarHBondContact O-CB 2.94Å; N293-M296 PolarHBondContact O-N 2.88Å; N293-M296 VanDerWaalsContact O-N 3.08Å
294S88Confident83.7Confident6 Ų644.1 Ų44.14%0.04222%0.224CC..Hα-helixtrans-68.4-21.3177.8-67.80000113.5N47 D75 V291 L292N47-S294 PolarHBondContact ND2-O 3.01Å; D75-S294 WeakPolarHBondContact OD1-CB 3.27Å; D75-S294 PolarHBondContact OD1-OG 3.48Å; V291-S294 WeakPolarHBondContact O-CB 3.47Å; V291-S294 PolarHBondContact O-N 3.22Å; L292-S294 PolarHBondContact O-N 3.2Å
295A87Confident83Confident9 Ų941.8 Ų41.87%0.07422%0.216CC..Hα-helixtrans-78.9-24170.600000112.3F42 I43 L292 N293F42-A295 HydrophobicContact CD1-CB 4.47Å; I43-A295 HydrophobicContact CG1-CB 3.88Å; L292-A295 WeakPolarHBondContact O-CB 3.43Å; L292-A295 PolarHBondContact O-N 3.11Å; N293-A295 VanDerWaalsContact C-N 3.26Å; N293-A295 PolarHBondContact O-N 3.28Å
296M84.1Confident82.1Confident52 Ų5239.3 Ų39.326%0.25621%0.213SC..Hα-helixtrans-75.6-27.3-176.2-64.1-63.4-4900112.4C254 N293 L299 I300C254-M296 HydrophobicContact CB-CE 4.44Å; C254-M296 WeakPolarHBondContact SG-CG 3.42Å; N293-M296 WeakPolarHBondContact O-CB 2.94Å; N293-M296 PolarHBondContact O-N 2.88Å; N293-M296 VanDerWaalsContact O-N 3.08Å; M296-L299 HydrophobicContact CE-CD1 4.19Å; M296-L299 WeakPolarHBondContact O-CB 3.27Å; M296-L299 PolarHBondContact O-N 2.81Å; M296-L299 HydrophobicContact SD-CD1 3.97Å; M296-I300 HydrophobicContact CB-CD1 4.48Å; M296-I300 WeakPolarHBondContact O-CD1 3.43Å; M296-I300 WeakPolarHBondContact O-CG1 3.43Å; M296-I300 PolarHBondContact O-N 2.8Å
297N84.4Confident81.4Confident6 Ų640.8 Ų40.83%0.03222%0.221CC..Hα-helixtrans-59.2-52.2-177-69.8-30.2000112.8D75 L299 I300 Y301D75-N297 PolarHBondContact OD2-ND2 3.2Å; N297-L299 VanDerWaalsContact C-N 3.34Å; N297-L299 PolarHBondContact O-N 3.44Å; N297-I300 PolarHBondContact O-N 3.04Å; N297-Y301 HydrophobicContact CB-CE2 4.27Å; N297-Y301 VanDerWaalsContact O-CD2 3.23Å; N297-Y301 WeakPolarHBondContact O-CD2 3.15Å; N297-Y301 WeakPolarHBondContact O-CE2 3.28Å; N297-Y301 VanDerWaalsContact O-CG 3.27Å; N297-Y301 PolarHBondContact O-N 3.12Å; N297-Y301 VanDerWaalsContact O-N 3.14Å
298P82.6Confident80.7Confident3 Ų338.5 Ų38.52%0.01921%0.209CC..Hα-helixtrans-56.7-40.1172.7-26.634.3000114.5E46 V50 I300 Y301 T302E46-P298 HydrophobicContact CB-CB 4.48Å; E46-P298 HydrophobicContact CB-CG 4.11Å; V50-P298 HydrophobicContact CG2-CB 3.92Å; V50-P298 HydrophobicContact CG2-CG 3.99Å; P298-I300 VanDerWaalsContact C-N 3.35Å; P298-I300 PolarHBondContact O-N 3.26Å; P298-Y301 PolarHBondContact O-N 2.76Å; P298-T302 WeakPolarHBondContact O-CG2 3.25Å; P298-T302 PolarHBondContact O-N 3.32Å; P298-T302 PolarHBondContact O-OG1 2.82Å; P298-T302 VanDerWaalsContact O-OG1 3.11Å
299L76.7Confident80.4Confident71 Ų7144 Ų4437%0.37223%0.228SC..Hα-helixtrans-61.8-44.3176.9-68.1175.5000111.1M296 N297 Y301 T302 L303M296-L299 HydrophobicContact CE-CD1 4.19Å; M296-L299 WeakPolarHBondContact O-CB 3.27Å; M296-L299 PolarHBondContact O-N 2.81Å; M296-L299 HydrophobicContact SD-CD1 3.97Å; N297-L299 VanDerWaalsContact C-N 3.34Å; N297-L299 PolarHBondContact O-N 3.44Å; L299-Y301 VanDerWaalsContact C-N 3.28Å; L299-Y301 PolarHBondContact O-N 3.22Å; L299-T302 PolarHBondContact O-N 3.46Å; L299-T302 PolarHBondContact O-OG1 2.86Å; L299-L303 WeakPolarHBondContact O-CB 3.26Å; L299-L303 WeakPolarHBondContact O-CG 3.38Å; L299-L303 PolarHBondContact O-N 3.08Å
300I76.2Confident79.9Confident32 Ų3248.6 Ų48.616%0.16424%0.24CC..Hα-helixtrans-59.9-42.3177.1-65.5164.4000110.1V251 M296 N297 P298 T304V251-I300 HydrophobicContact CB-CD1 4.29Å; V251-I300 HydrophobicContact CG1-CD1 3.81Å; V251-I300 HydrophobicContact CG2-CB 4.39Å; V251-I300 HydrophobicContact CG2-CD1 3.88Å; V251-I300 HydrophobicContact CG2-CG1 3.74Å; V251-I300 HydrophobicContact CG2-CG2 3.79Å; M296-I300 HydrophobicContact CB-CD1 4.48Å; M296-I300 WeakPolarHBondContact O-CD1 3.43Å; M296-I300 WeakPolarHBondContact O-CG1 3.43Å; M296-I300 PolarHBondContact O-N 2.8Å; N297-I300 PolarHBondContact O-N 3.04Å; P298-I300 VanDerWaalsContact C-N 3.35Å; P298-I300 PolarHBondContact O-N 3.26Å; I300-T304 HydrophobicContact CG2-CG2 4.1Å; I300-T304 VanDerWaalsContact O-CB 3.26Å; I300-T304 WeakPolarHBondContact O-CB 3.41Å; I300-T304 WeakPolarHBondContact O-CG2 3.42Å; I300-T304 PolarHBondContact O-N 3.33Å; I300-T304 PolarHBondContact O-OG1 3.01Å
301Y73.3Confident79.5Confident24 Ų2449 Ų499%0.09424%0.244CC..Hα-helixtrans-69.7-39.8-178.9-48-39.2000113.6I68 L71 N297 P298 L299 L303 T304 S305 M308I68-Y301 HydrophobicContact CG2-CD2 3.99Å; I68-Y301 HydrophobicContact CG2-CE1 4.47Å; I68-Y301 HydrophobicContact CG2-CE2 3.59Å; L71-Y301 WeakPolarHBondContact CD2-OH 3.48Å; N297-Y301 HydrophobicContact CB-CE2 4.27Å; N297-Y301 VanDerWaalsContact O-CD2 3.23Å; N297-Y301 WeakPolarHBondContact O-CD2 3.15Å; N297-Y301 WeakPolarHBondContact O-CE2 3.28Å; N297-Y301 VanDerWaalsContact O-CG 3.27Å; N297-Y301 PolarHBondContact O-N 3.12Å; N297-Y301 VanDerWaalsContact O-N 3.14Å; P298-Y301 PolarHBondContact O-N 2.76Å; L299-Y301 VanDerWaalsContact C-N 3.28Å; L299-Y301 PolarHBondContact O-N 3.22Å; Y301-L303 VanDerWaalsContact C-N 3.34Å; Y301-T304 PolarHBondContact O-OG1 3.15Å; Y301-S305 WeakPolarHBondContact O-CB 3.27Å; Y301-S305 PolarHBondContact O-N 2.79Å; Y301-M308 WeakPolarHBondContact CB-SD 3.43Å; Y301-M308 HydrophobicContact CD2-CE 4.45Å; Y301-M308 HydrophobicContact CD2-SD 4Å; Y301-M308 HydrophobicContact CG-CE 4.17Å; Y301-M308 HydrophobicContact CG-SD 3.9Å
302T75.1Confident79.3Confident23 Ų2350 Ų5014%0.14125%0.247CC..Hα-helixtrans-69.9-32.3178.654.40000112P298 L299 F312P298-T302 WeakPolarHBondContact O-CG2 3.25Å; P298-T302 PolarHBondContact O-N 3.32Å; P298-T302 PolarHBondContact O-OG1 2.82Å; P298-T302 VanDerWaalsContact O-OG1 3.11Å; L299-T302 PolarHBondContact O-N 3.46Å; L299-T302 PolarHBondContact O-OG1 2.86Å; T302-F312 HydrophobicContact CG2-CB 4.45Å; T302-F312 HydrophobicContact CG2-CD1 4.4Å; T302-F312 HydrophobicContact CG2-CD2 4.44Å; T302-F312 HydrophobicContact CG2-CG 4.21Å
303L69.3Low79Confident131 Ų13151.1 Ų51.169%0.68625%0.253SS*.Hα-helixtrans-77-36.9175.1-67.3173.5000112.9L299 Y301L299-L303 WeakPolarHBondContact O-CB 3.26Å; L299-L303 WeakPolarHBondContact O-CG 3.38Å; L299-L303 PolarHBondContact O-N 3.08Å; Y301-L303 VanDerWaalsContact C-N 3.34Å
304T65.8Low78.8Confident83 Ų8358.1 Ų58.151%0.50928%0.283SS..Hα-helixtrans-86-23.2-176.157.40000113.7T247 I300 Y301T247-T304 HydrophobicContact CG2-CG2 3.63Å; I300-T304 HydrophobicContact CG2-CG2 4.1Å; I300-T304 VanDerWaalsContact O-CB 3.26Å; I300-T304 WeakPolarHBondContact O-CB 3.41Å; I300-T304 WeakPolarHBondContact O-CG2 3.42Å; I300-T304 PolarHBondContact O-N 3.33Å; I300-T304 PolarHBondContact O-OG1 3.01Å; Y301-T304 PolarHBondContact O-OG1 3.15Å
305S70.4Confident78.5Confident30 Ų3058.1 Ų58.121%0.2128%0.283CS..  trans-128.4108.5-175.4-177.10000113.2Y301 E307 M308 R309Y301-S305 WeakPolarHBondContact O-CB 3.27Å; Y301-S305 PolarHBondContact O-N 2.79Å; S305-E307 PolarHBondContact O-N 2.83Å; S305-E307 PolarHBondContact OG-N 3.03Å; S305-M308 PolarHBondContact O-N 2.79Å; S305-M308 PolarHBondContact OG-N 3.13Å; S305-R309 WeakPolarHBondContact O-CB 3.49Å; S305-R309 PolarHBondContact O-N 3.47Å
306N72.9Confident78.2Confident88 Ų8861.9 Ų61.947%0.47130%0.302SS..Hα-helixtrans-59.2-29.7171.6-73.9-40.8000113.2R309 R310N306-R309 PolarHBondContact OD1-NH2 2.9Å; N306-R310 WeakPolarHBondContact O-CG 3.36Å; N306-R310 PolarHBondContact O-N 3.12Å; N306-R310 PolarHBondContact O-NE 3.45Å
307E76.4Confident77.9Confident76 Ų7665.2 Ų65.236%0.35532%0.318SS..Hα-helixtrans-71.1-45.2177.3-58.3-162.6154.700111.5K59 F60 S305 R310 A311K59-E307 VanDerWaalsContact CE-OE2 3.29Å; K59-E307 WeakPolarHBondContact CE-OE2 3.48Å; K59-E307 IonicContact NZ-OE1 2.72Å; K59-E307 PolarHBondContact NZ-OE1 3.43Å; K59-E307 IonicContact NZ-OE2 3.1Å; K59-E307 PolarHBondContact NZ-OE2 3.42Å; K59-E307 VanDerWaalsContact NZ-OE2 3.1Å; F60-E307 HydrophobicContact CE1-CB 4.48Å; S305-E307 PolarHBondContact O-N 2.83Å; S305-E307 PolarHBondContact OG-N 3.03Å; E307-R310 PolarHBondContact O-N 3.42Å; E307-A311 PolarHBondContact O-N 3.33Å; E307-A311 VanDerWaalsContact O-N 3.14Å
308M75.1Confident77Confident9 Ų967.8 Ų67.84%0.04434%0.336CS..Hα-helixtrans-68-42.4178.6-163.2-177.3-66.600110.9Y65 I68 Y301 S305 R310 A311 F312Y65-M308 HydrophobicContact CD1-CE 4.32Å; Y65-M308 HydrophobicContact CE1-CE 4.18Å; I68-M308 HydrophobicContact CD1-CE 3.94Å; I68-M308 HydrophobicContact CG2-CE 4.18Å; Y301-M308 WeakPolarHBondContact CB-SD 3.43Å; Y301-M308 HydrophobicContact CD2-CE 4.45Å; Y301-M308 HydrophobicContact CD2-SD 4Å; Y301-M308 HydrophobicContact CG-CE 4.17Å; Y301-M308 HydrophobicContact CG-SD 3.9Å; S305-M308 PolarHBondContact O-N 2.79Å; S305-M308 PolarHBondContact OG-N 3.13Å; M308-R310 VanDerWaalsContact C-N 3.34Å; M308-R310 PolarHBondContact O-N 3.05Å; M308-A311 PolarHBondContact O-N 3.09Å; M308-F312 VanDerWaalsContact O-CB 3.3Å; M308-F312 WeakPolarHBondContact O-CB 3.4Å; M308-F312 PolarHBondContact O-N 3.47Å
309R83.3Confident75.9Confident125 Ų12570.9 Ų70.947%0.47236%0.357SS..Hα-helixtrans-55.4-46.2175.5-174.8168.859.7141-2112.7S305 N306 F312 L313S305-R309 WeakPolarHBondContact O-CB 3.49Å; S305-R309 PolarHBondContact O-N 3.47Å; N306-R309 PolarHBondContact OD1-NH2 2.9Å; R309-F312 PolarHBondContact O-N 3.06Å; R309-L313 HydrophobicContact CG-CD1 4.37Å; R309-L313 WeakPolarHBondContact O-CG 3.43Å; R309-L313 PolarHBondContact O-N 3.31Å
310R82.8Confident74.9Confident161 Ų16171.3 Ų71.361%0.60837%0.366SS*.Hα-helixtrans-64-42.5177.3-78.8-175.3-73-113.12.9112.5N306 E307 M308 K314N306-R310 WeakPolarHBondContact O-CG 3.36Å; N306-R310 PolarHBondContact O-N 3.12Å; N306-R310 PolarHBondContact O-NE 3.45Å; E307-R310 PolarHBondContact O-N 3.42Å; M308-R310 VanDerWaalsContact C-N 3.34Å; M308-R310 PolarHBondContact O-N 3.05Å; R310-K314 WeakPolarHBondContact O-CB 3.43Å; R310-K314 PolarHBondContact O-N 2.88Å
311A80.8Confident73.5Confident13 Ų1374.4 Ų74.411%0.10739%0.386CS..Hα-helixtrans-66-41.5177.800000111.6T53 F60 E307 M308 K314 T315T53-A311 HydrophobicContact CG2-CB 3.55Å; F60-A311 HydrophobicContact CE2-CB 3.5Å; F60-A311 HydrophobicContact CZ-CB 3.77Å; E307-A311 PolarHBondContact O-N 3.33Å; E307-A311 VanDerWaalsContact O-N 3.14Å; M308-A311 PolarHBondContact O-N 3.09Å; A311-K314 WeakPolarHBondContact O-CB 3.47Å; A311-K314 PolarHBondContact O-N 3.33Å; A311-T315 PolarHBondContact O-N 3.5Å; A311-T315 PolarHBondContact O-OG1 3.19Å
312F83.4Confident71.9Confident34 Ų3478.5 Ų78.515%0.14942%0.417CS..Hα-helixtrans-60.5-48.4176.9-168-90.5000111.8L49 V50 T302 M308 R309 K314 T315 L316L49-F312 HydrophobicContact CB-CE2 3.99Å; L49-F312 HydrophobicContact CB-CZ 4.28Å; L49-F312 HydrophobicContact CD2-CD1 4.12Å; L49-F312 HydrophobicContact CD2-CD2 4.17Å; L49-F312 HydrophobicContact CD2-CE1 3.47Å; L49-F312 VanDerWaalsContact CD2-CE1 3.47Å; L49-F312 HydrophobicContact CD2-CE2 3.54Å; L49-F312 HydrophobicContact CD2-CG 4.45Å; L49-F312 HydrophobicContact CD2-CZ 3.16Å; L49-F312 HydrophobicContact CG-CD2 3.92Å; L49-F312 HydrophobicContact CG-CE1 4.28Å; L49-F312 HydrophobicContact CG-CE2 3.47Å; L49-F312 VanDerWaalsContact CG-CE2 3.47Å; L49-F312 HydrophobicContact CG-CZ 3.7Å; V50-F312 HydrophobicContact CG2-CE2 4.14Å; T302-F312 HydrophobicContact CG2-CB 4.45Å; T302-F312 HydrophobicContact CG2-CD1 4.4Å; T302-F312 HydrophobicContact CG2-CD2 4.44Å; T302-F312 HydrophobicContact CG2-CG 4.21Å; M308-F312 VanDerWaalsContact O-CB 3.3Å; M308-F312 WeakPolarHBondContact O-CB 3.4Å; M308-F312 PolarHBondContact O-N 3.47Å; R309-F312 PolarHBondContact O-N 3.06Å; F312-K314 VanDerWaalsContact C-N 3.32Å; F312-K314 PolarHBondContact O-N 2.92Å; F312-T315 PolarHBondContact O-N 3.47Å; F312-L316 PolarHBondContact O-N 3.49Å
313L82.6Confident70.3Confident95 Ų9583.1 Ų83.150%0.49745%0.445SS..Hα-helixtrans-60.4-40.8174.5-71.6171.8000112R309 L316 M317R309-L313 HydrophobicContact CG-CD1 4.37Å; R309-L313 WeakPolarHBondContact O-CG 3.43Å; R309-L313 PolarHBondContact O-N 3.31Å; L313-L316 PolarHBondContact O-N 3.47Å; L313-M317 WeakPolarHBondContact O-CB 3.44Å; L313-M317 WeakPolarHBondContact O-CG 3.08Å; L313-M317 PolarHBondContact O-N 3.38Å
314K83.8Confident68.7Low149 Ų14987.8 Ų87.865%0.64845%0.454SS*.Hα-helixtrans-63.1-42.8175.7-172.4-179.8-179.7-177.60111.7R310 A311 F312 M317 C318R310-K314 WeakPolarHBondContact O-CB 3.43Å; R310-K314 PolarHBondContact O-N 2.88Å; A311-K314 WeakPolarHBondContact O-CB 3.47Å; A311-K314 PolarHBondContact O-N 3.33Å; F312-K314 VanDerWaalsContact C-N 3.32Å; F312-K314 PolarHBondContact O-N 2.92Å; K314-M317 PolarHBondContact O-N 3.41Å; K314-C318 WeakPolarHBondContact O-CB 3.46Å; K314-C318 PolarHBondContact O-N 3.43Å; K314-C318 PolarHBondContact O-SG 2.9Å; K314-C318 VanDerWaalsContact O-SG 3.41Å
315T81.6Confident67.5Low7 Ų789.6 Ų89.64%0.04347%0.467CS..Hα-helixtrans-63.4-44.6176.9-52.40000111L49 L52 T53 A311 F312 M317 C318 C319L49-T315 HydrophobicContact CD1-CG2 3.51Å; L52-T315 HydrophobicContact CB-CG2 4.2Å; T53-T315 WeakPolarHBondContact OG1-CB 3.47Å; T53-T315 PolarHBondContact OG1-OG1 3.4Å; A311-T315 PolarHBondContact O-N 3.5Å; A311-T315 PolarHBondContact O-OG1 3.19Å; F312-T315 PolarHBondContact O-N 3.47Å; T315-M317 PolarHBondContact O-N 3.02Å; T315-C318 PolarHBondContact O-N 2.72Å; T315-C319 PolarHBondContact O-N 3.19Å; T315-C319 PolarHBondContact O-SG 3.33Å
316L80.6Confident66.2Low88 Ų8894.4 Ų94.446%0.46150%0.501SS..Hα-helixtrans-59.8-45.6176.8-170.872000111.6L49 F312 L313 C319 S320L49-L316 HydrophobicContact CD2-CD1 4.06Å; F312-L316 PolarHBondContact O-N 3.49Å; L313-L316 PolarHBondContact O-N 3.47Å; L316-C319 PolarHBondContact O-N 2.94Å; L316-S320 PolarHBondContact O-N 3.01Å; L316-S320 PolarHBondContact O-OG 3.47Å
317M77.9Confident64.5Low122 Ų12293.2 Ų93.260%0.60151%0.509SS*.Hα-helixtrans-65.8-39.8177.1-66-104.9-76.700112L313 K314 T315 C319 S320 V321L313-M317 WeakPolarHBondContact O-CB 3.44Å; L313-M317 WeakPolarHBondContact O-CG 3.08Å; L313-M317 PolarHBondContact O-N 3.38Å; K314-M317 PolarHBondContact O-N 3.41Å; T315-M317 PolarHBondContact O-N 3.02Å; M317-C319 VanDerWaalsContact C-N 3.29Å; M317-C319 PolarHBondContact O-N 3.23Å; M317-S320 VanDerWaalsContact CA-OG 3.3Å; M317-S320 WeakPolarHBondContact CA-OG 3.04Å; M317-S320 PolarHBondContact O-N 3.36Å; M317-S320 PolarHBondContact O-OG 3.04Å; M317-V321 VanDerWaalsContact O-CB 3.28Å; M317-V321 WeakPolarHBondContact O-CB 3.05Å; M317-V321 WeakPolarHBondContact O-CG2 3.44Å; M317-V321 PolarHBondContact O-N 3.23Å
318C66.6Low62.9Low59 Ų5999.7 Ų99.740%0.39954%0.536SS..Hα-helixtrans-69.5-24.4175.1-760000113.2K314 T315 C322K314-C318 WeakPolarHBondContact O-CB 3.46Å; K314-C318 PolarHBondContact O-N 3.43Å; K314-C318 PolarHBondContact O-SG 2.9Å; K314-C318 VanDerWaalsContact O-SG 3.41Å; T315-C318 PolarHBondContact O-N 2.72Å; C318-C322 PolarHBondContact O-SG 3.15Å; C318-C322 VanDerWaalsContact O-SG 3.41Å
319C58.5Low60.9Low69 Ų69108.3 Ų108.347%0.46657%0.574SS.*Hα-helixtrans-81.5-23.7172.3-66.90000112.7T315 L316 M317T315-C319 PolarHBondContact O-N 3.19Å; T315-C319 PolarHBondContact O-SG 3.33Å; L316-C319 PolarHBondContact O-N 2.94Å; M317-C319 VanDerWaalsContact C-N 3.29Å; M317-C319 PolarHBondContact O-N 3.23Å
320S55.5Low58.8Low79 Ų79107.3 Ų107.355%0.55259%0.586SS**Hα-helixtrans-92-17.2174.934.20000113.5L316 M317L316-S320 PolarHBondContact O-N 3.01Å; L316-S320 PolarHBondContact O-OG 3.47Å; M317-S320 VanDerWaalsContact CA-OG 3.3Å; M317-S320 WeakPolarHBondContact CA-OG 3.04Å; M317-S320 PolarHBondContact O-N 3.36Å; M317-S320 PolarHBondContact O-OG 3.04Å
321V48Very low56.6Low97 Ų97110.7 Ų110.759%0.58860%0.599SS**  trans-107.449.1176.2-172.30000110.4M317 T323M317-V321 VanDerWaalsContact O-CB 3.28Å; M317-V321 WeakPolarHBondContact O-CB 3.05Å; M317-V321 WeakPolarHBondContact O-CG2 3.44Å; M317-V321 PolarHBondContact O-N 3.23Å; V321-T323 VanDerWaalsContact C-N 3.32Å
322C40.5Very low54.3Low111 Ų111114.9 Ų114.975%0.7563%0.625SS**  trans-94.414.2163.6-79.30000112.7C318C318-C322 PolarHBondContact O-SG 3.15Å; C318-C322 VanDerWaalsContact O-SG 3.41Å
323T40.4Very low52.2Low120 Ų120121.1 Ų121.174%0.73666%0.658SS**SBendtrans-124.767.7169.745.60000110.7V321V321-T323 VanDerWaalsContact C-N 3.32Å
324R34.8Very low49.7Very low228 Ų228125.1 Ų125.186%0.8668%0.677SS**SBendtrans175.9142.9139.6-97.3163-174.1-167.62.4111.7
325P40.6Very low47.2Very low121 Ų121121.1 Ų121.179%0.78668%0.678SS**  trans-75.1152.1-179.932.6-33.9000111.7G327P325-G327 PolarHBondContact O-N 3.24Å
326S44.1Very low44.7Very low132 Ų132125.7 Ų125.792%0.92372%0.716SS**  trans-18.2107.1172.1-169.90000116.2
327G36.1Very low42.2Very low63 Ų63130.1 Ų130.165%0.64973%0.734SS**  trans-130.7123.116000000108.4P325 F329P325-G327 PolarHBondContact O-N 3.24Å; G327-F329 PolarHBondContact O-N 2.75Å
328K43.9Very low39.8Very low212 Ų212134.3 Ų134.392%0.92275%0.749SS**  trans-49.7110.1179.9-69.1171.7178.3173.60110.4S330K328-S330 PolarHBondContact O-N 2.04Å
329F33.5Very low37.9Very low189 Ų189136.6 Ų136.683%0.82977%0.766SS**  trans-90.4105173.2-148.9-94.2000109.4G327G327-F329 PolarHBondContact O-N 2.75Å
330S38.8Very low36.6Very low105 Ų105145 Ų14573%0.73479%0.788SS**PPolyproline II helixtrans-59137.3165.6-65.50000109.9K328K328-S330 PolarHBondContact O-N 2.04Å
331R36.4Very low35.3Very low231 Ų231146.8 Ų146.887%0.87280%0.801SS**PPolyproline II helixtrans-58.9135.4179.2-66.6177.6171.5-172.9-1.2110.6I333R331-I333 PolarHBondContact O-N 2.8Å
332P33.3Very low34.5Very low101 Ų101151.8 Ų151.866%0.65681%0.814SS**PPolyproline II helixtrans-77.6121.1157.513.70.6000108.5M334P332-M334 PolarHBondContact O-N 3.28Å
333I39Very low34Very low165 Ų165152.2 Ų152.285%0.84682%0.818SS**  trans-68.1114.9166.7-65.3169.4000106.7R331R331-I333 PolarHBondContact O-N 2.8Å
334M30.4Very low33.5Very low180 Ų180153.9 Ų153.989%0.88782%0.823SS**  trans-117.971.3165.3-152.2175.5-47.300107.7P332P332-M334 PolarHBondContact O-N 3.28Å
335G29.9Very low33.2Very low65 Ų65150.5 Ų150.567%0.6782%0.822SS**  trans-98.2101.9160.200000107.3
336A29.6Very low32.7Very low102 Ų102149.8 Ų149.884%0.84382%0.82SS**  trans-99.680.6159.800000106.7F338A336-F338 PolarHBondContact O-N 3.49Å
337E28.4Very low32.1Very low182 Ų182148.4 Ų148.485%0.8581%0.81SS**  trans-73110.6156.4-78.3-173.3146.800106.9S339E337-S339 PolarHBondContact O-N 3.44Å
338F27.4Very low31.9Very low209 Ų209153.8 Ų153.892%0.91782%0.818SS**  trans-75.992.2171.4-159.4-95.3000107.5A336 R340A336-F338 PolarHBondContact O-N 3.49Å; F338-R340 PolarHBondContact O-N 3.23Å
339S27.1Very low31.8Very low107 Ų107149.3 Ų149.375%0.74881%0.811SS**  trans-62.9129.7173.3-90.60000110.9E337E337-S339 PolarHBondContact O-N 3.44Å
340R31.1Very low31.7Very low246 Ų246146.6 Ų146.693%0.92881%0.805SS**  trans-66128.8170.1-75.2169.3156.9170.2-8.7109.9F338F338-R340 PolarHBondContact O-N 3.23Å
341S27.7Very low31.4Very low117 Ų117151.4 Ų151.482%0.81881%0.812SS**  trans-97.7107.2154.857.60000108.8
342K31.1Very low31.1Very low201 Ų201147.3 Ų147.387%0.87481%0.808SS**  trans-138.4115.7151.4-94.9-166.7175.1-172.90107.9
343S30.6Very low31.1Very low120 Ų120151.5 Ų151.584%0.83982%0.819SS**  trans-62.7145.8178.238.60000113.3
344D29.4Very low30.9Very low155 Ų155149 Ų14983%0.82981%0.813SS**  trans-62.5150.1174-62.1-52.7000114
345N29.4Very low30.8Very low158 Ų158149.3 Ų149.385%0.84581%0.813SS**  -177.6124.1120.2-128.1-4.9000111.5
346S30.6Very low30.7Very low105 Ų105156.7 Ų156.773%0.73482%0.822SS**  163.3128112.766.60000114.6
347S31Very low30.7Very low104 Ų104156.1 Ų156.173%0.72781%0.811SS**  trans67.3104.2143.857.60000122.9
348H32.1Very low31.1Very low175 Ų175152.8 Ų152.881%0.8181%0.805SS**  37.1162.1122.3-86.8-59.6000122.8
349P42.1Very low31.2Very low118 Ų118154.6 Ų154.677%0.76681%0.806SS**  cis-132.1168.8-0.329-5.9000116.8
350N30.4Very low31.5Very low132 Ų132158.2 Ų158.271%0.70681%0.812SS**  trans-55.3147.9170.5-72.6-21.8000114.3
351K32.5Very low31.6Very low206 Ų206153.4 Ų153.490%0.89681%0.809SS**  trans-137.5130141.5-89.5-170.6175.1-177.40109.9
352D31.1Very low31.8Very low146 Ų146154 Ų15478%0.78181%0.808SS**  trans-68.6141.7177-52.5-69.9000112.2
353E31.4Very low31.8Very low189 Ų189151.1 Ų151.188%0.88381%0.807SS**  172.6138.6122.5-97.7-165.2143.100110.8
354P35.6Very low31.8Very low112 Ų112150.8 Ų150.873%0.72780%0.804SS**  trans-104.4162.3174.639-30.3000113.3
355E29.1Very low32Very low187 Ų187149 Ų14987%0.87480%0.804SS**  trans88.7107.6141.7-148.8163.8-154.800119.7
356Y26.6Very low32.1Very low220 Ų220145.1 Ų145.186%0.86380%0.801SS**  -166.2126.8123.6-162.5-102.5000113.8
357S30.2Very low32.3Very low89 Ų89147.8 Ų147.862%0.62281%0.807SS**  trans2.4155.7157-127.20000124.1
358P37.1Very low32.7Very low112 Ų112150.8 Ų150.873%0.72781%0.813SS**  trans-93.8155.9-169.437.7-29.4000113.6
359R30Very low32.9Very low247 Ų247148.6 Ų148.693%0.93281%0.813SS**  trans-133123158.7-89.3-171.2173.3-178-1.6111.5
360E31.6Very low32.6Very low184 Ų184147.9 Ų147.986%0.8681%0.811SS**  trans-60145163-59.8173.9141.100110.7
361T33.3Very low32.8Very low144 Ų144146.9 Ų146.988%0.88381%0.814SS**  trans-145.2125.6144.76.50000111.3
362V32.5Very low33.1Very low131 Ų131146.7 Ų146.779%0.79484%0.838SS**  trans-60.6136.2178.3170.40000111.4
363V32.1Very low33.2Very low139 Ų139146.7 Ų146.784%0.84284%0.841SS**  trans-81.8120.1165.5172.90000108.1
364S30.5Very low33.3Very low113 Ų113144.5 Ų144.579%0.7984%0.839SS**  trans-110.9132168.4-174.80000110.5
365S33.8Very low33.2Very low118 Ų118146.3 Ų146.383%0.82585%0.845SS**  trans-61.3157.5174.5-54.20000113.9
366G31.1Very low33.4Very low76 Ų76143.9 Ų143.978%0.78484%0.844SS**  trans160.895.7158.100000115.6
367N34.5Very low33.8Very low161 Ų161139.1 Ų139.186%0.86184%0.842SS**  trans-55.1153.6158.5-97.2-14.1000111.5
368I38.1Very low34.1Very low167 Ų167142.5 Ų142.586%0.85686%0.857SS**  -169133127.1-88145.4000109.5
369T37.9Very low33.8Very low129 Ų129144.6 Ų144.679%0.79187%0.866SS**  trans-78.3143.1169.343.30000112.6
370S35.2Very low34.1Very low104 Ų104136.8 Ų136.873%0.72786%0.861SS**  trans176.4116.8130.256.50000112.4
371S35.4Very low34.4Very low111 Ų111132.8 Ų132.878%0.77686%0.861SS**  trans26.2125.8133.252.50000121.1
372S37.8Very low34.5Very low201 Ų201131.8 Ų131.8100%1.40686%0.859SS**  -132.40129.2-68.50000109

Retrieved 372 of 372 residues in 2237.3 ms (Link to these results)

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