Z4YKR8_MOUSE Loading...

Transient receptor potential cation channel, subfamily V, member 1

AlphaFold DB , UniProt , Accession Z4YKR8, Species MOUSE (Mus musculus, Mouse), Gene Trpv1, Length 471 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
1M42.8Very low49.2Very low186 Ų18686.8 Ų86.892%0.91644%0.44SS*.  0-57.70-165.1178.9161.800112.6E4 I5M1-E4 PolarHBondContact O-N 2.89Å; M1-I5 HydrophobicContact CE-CD1 4.19Å; M1-I5 HydrophobicContact CG-CD1 4.07Å; M1-I5 WeakPolarHBondContact O-CD1 3.45Å; M1-I5 VanDerWaalsContact O-CG1 3.27Å; M1-I5 WeakPolarHBondContact O-CG1 3.12Å; M1-I5 PolarHBondContact O-N 3.46Å
2Y44.5Very low49Very low72 Ų7289.5 Ų89.528%0.28246%0.456SS..Hα-helixtrans-66.2-42.3179.9-170.7-108.1000114E4 I5 L6 P29 M45Y2-E4 PolarHBondContact O-N 3.14Å; Y2-I5 PolarHBondContact O-N 3.44Å; Y2-L6 HydrophobicContact CD1-CD1 3.83Å; Y2-L6 HydrophobicContact CD1-CG 4.37Å; Y2-L6 HydrophobicContact CE1-CD1 3.4Å; Y2-L6 VanDerWaalsContact CE1-CD1 3.4Å; Y2-L6 HydrophobicContact CE1-CG 4.07Å; Y2-L6 PolarHBondContact O-N 2.99Å; Y2-P29 WeakPolarHBondContact OH-CB 3.46Å; Y2-M45 HydrophobicContact CD1-CE 3.88Å; Y2-M45 HydrophobicContact CD2-CE 3.35Å; Y2-M45 HydrophobicContact CD2-SD 4.08Å; Y2-M45 HydrophobicContact CE1-CE 3.89Å; Y2-M45 HydrophobicContact CE2-CE 3.39Å; Y2-M45 HydrophobicContact CG-CE 3.6Å; Y2-M45 HydrophobicContact CG-CG 4.28Å; Y2-M45 HydrophobicContact CG-SD 4.14Å
3N45.2Very low48.9Very low66 Ų6691.5 Ų91.535%0.35346%0.462SS..Hα-helixtrans-59.8-45.4173-79.10.7000112.1I5 L6 I7 V48N3-I5 VanDerWaalsContact C-N 3.29Å; N3-I5 PolarHBondContact O-N 3.01Å; N3-L6 PolarHBondContact O-N 3.34Å; N3-I7 HydrophobicContact CB-CD1 4.37Å; N3-I7 WeakPolarHBondContact O-CB 3.45Å; N3-I7 WeakPolarHBondContact O-CD1 3.48Å; N3-I7 WeakPolarHBondContact O-CG1 3.46Å; N3-I7 PolarHBondContact O-N 3.44Å; N3-V48 VanDerWaalsContact ND2-CG1 3.31Å; N3-V48 WeakPolarHBondContact ND2-CG1 3.49Å; N3-V48 WeakPolarHBondContact OD1-CG1 3.41Å
4E46.8Very low49.2Very low112 Ų11289.4 Ų89.452%0.52346%0.458SS..Hα-helixtrans-57.8-42.3175.6-67.5-60.8150.600111.8M1 Y2 I7 L8M1-E4 PolarHBondContact O-N 2.89Å; Y2-E4 PolarHBondContact O-N 3.14Å; E4-I7 PolarHBondContact O-N 3.24Å; E4-L8 VanDerWaalsContact O-CB 3.23Å; E4-L8 WeakPolarHBondContact O-CB 3.31Å; E4-L8 WeakPolarHBondContact O-CD1 2.94Å; E4-L8 PolarHBondContact O-N 2.82Å
5I51.9Low48.8Very low85 Ų8591.2 Ų91.244%0.43648%0.475SS..Hα-helixtrans-66.1-40177.4-67.4163.3000111.7M1 Y2 N3 G9M1-I5 HydrophobicContact CE-CD1 4.19Å; M1-I5 HydrophobicContact CG-CD1 4.07Å; M1-I5 WeakPolarHBondContact O-CD1 3.45Å; M1-I5 VanDerWaalsContact O-CG1 3.27Å; M1-I5 WeakPolarHBondContact O-CG1 3.12Å; M1-I5 PolarHBondContact O-N 3.46Å; Y2-I5 PolarHBondContact O-N 3.44Å; N3-I5 VanDerWaalsContact C-N 3.29Å; N3-I5 PolarHBondContact O-N 3.01Å; I5-G9 WeakPolarHBondContact O-CA 3.36Å; I5-G9 PolarHBondContact O-N 2.98Å
6L53.6Low48.6Very low37 Ų3791.1 Ų91.119%0.19448%0.475CS..Hα-helixtrans-68.6-39.8175.5-73.6177.6000112Y2 N3 G9 A10 L18Y2-L6 HydrophobicContact CD1-CD1 3.83Å; Y2-L6 HydrophobicContact CD1-CG 4.37Å; Y2-L6 HydrophobicContact CE1-CD1 3.4Å; Y2-L6 VanDerWaalsContact CE1-CD1 3.4Å; Y2-L6 HydrophobicContact CE1-CG 4.07Å; Y2-L6 PolarHBondContact O-N 2.99Å; N3-L6 PolarHBondContact O-N 3.34Å; L6-G9 PolarHBondContact O-N 3.36Å; L6-A10 VanDerWaalsContact O-CB 3.25Å; L6-A10 WeakPolarHBondContact O-CB 3.35Å; L6-A10 PolarHBondContact O-N 3.36Å; L6-L18 HydrophobicContact CD2-CB 3.97Å
7I53Low49Very low80 Ų8091.5 Ų91.541%0.4147%0.471SS..Hα-helixtrans-68.5-45.2178-67.9164.1000110.5N3 E4 K11N3-I7 HydrophobicContact CB-CD1 4.37Å; N3-I7 WeakPolarHBondContact O-CB 3.45Å; N3-I7 WeakPolarHBondContact O-CD1 3.48Å; N3-I7 WeakPolarHBondContact O-CG1 3.46Å; N3-I7 PolarHBondContact O-N 3.44Å; E4-I7 PolarHBondContact O-N 3.24Å; I7-K11 HydrophobicContact CG2-CD 4.47Å; I7-K11 WeakPolarHBondContact O-CB 3.4Å; I7-K11 WeakPolarHBondContact O-CG 3.47Å; I7-K11 PolarHBondContact O-N 2.87Å
8L50.1Low49Very low91 Ų9189.9 Ų89.948%0.47646%0.464SS..Hα-helixtrans-64.4-42.2173.3-94.7135.8000111.5E4 K11 L12E4-L8 VanDerWaalsContact O-CB 3.23Å; E4-L8 WeakPolarHBondContact O-CB 3.31Å; E4-L8 WeakPolarHBondContact O-CD1 2.94Å; E4-L8 PolarHBondContact O-N 2.82Å; L8-K11 PolarHBondContact O-N 3.35Å; L8-L12 HydrophobicContact CB-CD1 4.46Å; L8-L12 HydrophobicContact CD2-CD1 4.14Å; L8-L12 VanDerWaalsContact O-CB 3.31Å; L8-L12 WeakPolarHBondContact O-CB 3.08Å; L8-L12 WeakPolarHBondContact O-CD1 3.23Å; L8-L12 WeakPolarHBondContact O-CG 3.31Å; L8-L12 PolarHBondContact O-N 3.34Å
9G50.2Low49.3Very low14 Ų1492.4 Ų92.414%0.14447%0.473CS..Hα-helixtrans-62.7-43.317700000112.5I5 L6 K11 L12 H13I5-G9 WeakPolarHBondContact O-CA 3.36Å; I5-G9 PolarHBondContact O-N 2.98Å; L6-G9 PolarHBondContact O-N 3.36Å; G9-K11 VanDerWaalsContact C-N 3.33Å; G9-K11 PolarHBondContact O-N 2.99Å; G9-L12 PolarHBondContact O-N 2.86Å; G9-H13 PolarHBondContact O-N 3.25Å
10A53.1Low49.5Very low48 Ų4892.6 Ų92.640%0.39747%0.472SS..Hα-helixtrans-67-31.8174.300000112.8L6L6-A10 VanDerWaalsContact O-CB 3.25Å; L6-A10 WeakPolarHBondContact O-CB 3.35Å; L6-A10 PolarHBondContact O-N 3.36Å
11K49.5Very low49.5Very low164 Ų16492.3 Ų92.371%0.71347%0.471SS*.Hα-helixtrans-72.8-39.5173.3-81.7179.5176.71790113I7 L8 G9I7-K11 HydrophobicContact CG2-CD 4.47Å; I7-K11 WeakPolarHBondContact O-CB 3.4Å; I7-K11 WeakPolarHBondContact O-CG 3.47Å; I7-K11 PolarHBondContact O-N 2.87Å; L8-K11 PolarHBondContact O-N 3.35Å; G9-K11 VanDerWaalsContact C-N 3.33Å; G9-K11 PolarHBondContact O-N 2.99Å
12L47.8Very low49.7Very low119 Ų11987.4 Ų87.462%0.62345%0.451SS*.Hα-helixtrans-80.3-38.1-176.2-76.8159.5000112.5L8 G9L8-L12 HydrophobicContact CB-CD1 4.46Å; L8-L12 HydrophobicContact CD2-CD1 4.14Å; L8-L12 VanDerWaalsContact O-CB 3.31Å; L8-L12 WeakPolarHBondContact O-CB 3.08Å; L8-L12 WeakPolarHBondContact O-CD1 3.23Å; L8-L12 WeakPolarHBondContact O-CG 3.31Å; L8-L12 PolarHBondContact O-N 3.34Å; G9-L12 PolarHBondContact O-N 2.86Å
13H46.8Very low50Low115 Ų11588 Ų8853%0.53246%0.46SS..  trans-136.787.3177.7-68.4-67.5000111.4G9 T15 L16G9-H13 PolarHBondContact O-N 3.25Å; H13-T15 PolarHBondContact O-N 3.44Å; H13-T15 VanDerWaalsContact O-N 3.11Å; H13-L16 HydrophobicContact CB-CB 3.93Å; H13-L16 PolarHBondContact O-N 2.9Å; H13-L16 VanDerWaalsContact O-N 3.12Å
14P53.2Low50Low63 Ų6395.1 Ų95.141%0.40949%0.487SS..THydrogen-bonded Turntrans-60.9-23-179-22.232000114.3R372P14-R372 PolarHBondContact O-NH2 3.15Å
15T43Very low50Low116 Ų11698.2 Ų98.271%0.71250%0.499SS*.THydrogen-bonded Turntrans-86.3-19.9-179.253.40000113.4H13H13-T15 PolarHBondContact O-N 3.44Å; H13-T15 VanDerWaalsContact O-N 3.11Å
16L46.4Very low50.1Low90 Ų9096.7 Ų96.747%0.47151%0.505SS..  trans-94.4103.6-179.4-114.899.6000110.2H13 L18 L21H13-L16 HydrophobicContact CB-CB 3.93Å; H13-L16 PolarHBondContact O-N 2.9Å; H13-L16 VanDerWaalsContact O-N 3.12Å; L16-L18 PolarHBondContact O-N 3.4Å; L16-L21 HydrophobicContact CD2-CD1 3.56Å; L16-L21 HydrophobicContact CG-CD1 4.31Å
17K55.5Low50.2Low97 Ų9796.8 Ų96.842%0.42251%0.505SS..  trans-78.590.3175.6-64.4175.9-177.8177.40109.8E19 E20 L21K17-E19 PolarHBondContact O-N 3.14Å; K17-E19 VanDerWaalsContact O-N 3.09Å; K17-E20 HydrophobicContact CB-CB 4.09Å; K17-E20 HydrophobicContact CB-CG 4.26Å; K17-E20 HydrophobicContact CD-CG 4.4Å; K17-E20 WeakPolarHBondContact CD-OE2 3.22Å; K17-E20 IonicContact NZ-OE2 3.74Å; K17-E20 PolarHBondContact O-N 3.04Å; K17-L21 PolarHBondContact O-N 2.86Å; K17-L21 VanDerWaalsContact O-N 3.13Å
18L48.8Very low50.8Low63 Ų6395.4 Ų95.433%0.3350%0.5SS..THydrogen-bonded Turntrans-52.3-33.5178.1-84.1114.2000112.6L6 L16 E20 L21 P29L6-L18 HydrophobicContact CD2-CB 3.97Å; L16-L18 PolarHBondContact O-N 3.4Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.14Å; L18-L21 HydrophobicContact CG-CD1 4.32Å; L18-L21 PolarHBondContact O-N 3.2Å; L18-P29 WeakPolarHBondContact O-CG 3.32Å
19E53.9Low51.2Low137 Ų13792.5 Ų92.564%0.6449%0.487SS*.THydrogen-bonded Turntrans-65.6-30.4177.4-60-179.6-176.800114.5K17 P29K17-E19 PolarHBondContact O-N 3.14Å; K17-E19 VanDerWaalsContact O-N 3.09Å; E19-P29 WeakPolarHBondContact O-CD 3.35Å
20E53.4Low51.6Low97 Ų9793.7 Ų93.745%0.45349%0.49SS..THydrogen-bonded Turntrans-96.6-10.1-179.3-63.9-172.8155.400112.1K17 L18 T22 R354K17-E20 HydrophobicContact CB-CB 4.09Å; K17-E20 HydrophobicContact CB-CG 4.26Å; K17-E20 HydrophobicContact CD-CG 4.4Å; K17-E20 WeakPolarHBondContact CD-OE2 3.22Å; K17-E20 IonicContact NZ-OE2 3.74Å; K17-E20 PolarHBondContact O-N 3.04Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.14Å; E20-T22 PolarHBondContact O-N 3.21Å; E20-R354 IonicContact OE1-NH2 2.92Å; E20-R354 PolarHBondContact OE1-NH2 2.64Å
21L49.1Very low51.8Low87 Ų8791.7 Ų91.746%0.45547%0.473SS..  trans-68.9102.5176.9-82.7163.2000110.8L16 K17 L18L16-L21 HydrophobicContact CD2-CD1 3.56Å; L16-L21 HydrophobicContact CG-CD1 4.31Å; K17-L21 PolarHBondContact O-N 2.86Å; K17-L21 VanDerWaalsContact O-N 3.13Å; L18-L21 HydrophobicContact CG-CD1 4.32Å; L18-L21 PolarHBondContact O-N 3.2Å
22T48.6Very low52.3Low82 Ų8286.6 Ų86.650%0.50345%0.453SS..  trans-78.1132.9171.356.80000110.6E20 L27 T28E20-T22 PolarHBondContact O-N 3.21Å; T22-L27 WeakPolarHBondContact CA-O 3.27Å; T22-T28 HydrophobicContact CG2-CG2 4.32Å
23N48.9Very low52.8Low85 Ų8582.1 Ų82.146%0.45543%0.433SS..  trans-62.6169.1166.9-169.3-4.4000110.1K25 G26 L27 L32N23-K25 PolarHBondContact O-N 3.33Å; N23-G26 PolarHBondContact O-N 2.85Å; N23-L27 PolarHBondContact N-O 2.86Å; N23-L32 HydrophobicContact CB-CD1 3.95Å
24K46.2Very low53.2Low215 Ų21577.5 Ų77.594%0.93542%0.416SS*.THydrogen-bonded Turntrans-50.9-11.9175.4-64.2-172.5178.5-176.70115.1
25K46.5Very low53.1Low178 Ų17876.6 Ų76.677%0.77441%0.411SS*.THydrogen-bonded Turntrans-98.77.4173.4-62.9-173.5177.3-176.30114.6N23 L27N23-K25 PolarHBondContact O-N 3.33Å; K25-L27 VanDerWaalsContact C-N 3.3Å; K25-L27 HydrophobicContact CB-CD1 4.17Å; K25-L27 HydrophobicContact CB-CG 4.34Å; K25-L27 PolarHBondContact O-N 3.44Å
26G55.2Low53.6Low53 Ų5374 Ų7455%0.54640%0.397SS..SBendtrans73.913.3-177.900000115.1N23N23-G26 PolarHBondContact O-N 2.85Å
27L55.5Low53.6Low38 Ų3872.1 Ų72.120%0.19940%0.399CS..  trans-93124.7-176.2-65.3167.5000110.8T22 N23 K25 A31T22-L27 WeakPolarHBondContact CA-O 3.27Å; N23-L27 PolarHBondContact N-O 2.86Å; K25-L27 VanDerWaalsContact C-N 3.3Å; K25-L27 HydrophobicContact CB-CD1 4.17Å; K25-L27 HydrophobicContact CB-CG 4.34Å; K25-L27 PolarHBondContact O-N 3.44Å; L27-A31 HydrophobicContact CB-CB 4.24Å; L27-A31 HydrophobicContact CD2-CB 3.85Å
28T64.6Low53.3Low52 Ų5277.3 Ų77.332%0.31942%0.422SS..  trans-66.9161169.359.40000110.7T22 L30 A31 L32T22-T28 HydrophobicContact CG2-CG2 4.32Å; T28-L30 PolarHBondContact O-N 2.92Å; T28-A31 CarbonylContact O-C 3.59Å; T28-A31 WeakPolarHBondContact O-CA 3.38Å; T28-A31 WeakPolarHBondContact O-CB 3.46Å; T28-A31 PolarHBondContact O-N 2.78Å; T28-A31 WeakPolarHBondContact OG1-CB 3.5Å; T28-A31 PolarHBondContact OG1-N 3.4Å; T28-L32 WeakPolarHBondContact O-CB 3.4Å; T28-L32 PolarHBondContact O-N 3.01Å
29P58.5Low53.4Low29 Ų2979.9 Ų79.919%0.18844%0.435CS..Hα-helixtrans-56.7-33.2177.6-22.831.1000113.5Y2 L18 E19 L32 A33Y2-P29 WeakPolarHBondContact OH-CB 3.46Å; L18-P29 WeakPolarHBondContact O-CG 3.32Å; E19-P29 WeakPolarHBondContact O-CD 3.35Å; P29-L32 PolarHBondContact O-N 3.47Å; P29-A33 VanDerWaalsContact O-CB 3.27Å; P29-A33 WeakPolarHBondContact O-CB 2.91Å; P29-A33 PolarHBondContact O-N 3.11Å
30L59.6Low53.3Low40 Ų4076.7 Ų76.721%0.20944%0.439CS..Hα-helixtrans-65.3-47.5172.7179.959.9000111.7T28 L32 A33 A34 L46 L51 L339T28-L30 PolarHBondContact O-N 2.92Å; L30-L32 PolarHBondContact O-N 3.12Å; L30-A33 PolarHBondContact O-N 3.37Å; L30-A34 WeakPolarHBondContact O-CB 2.95Å; L30-A34 PolarHBondContact O-N 3.24Å; L30-L46 HydrophobicContact CD1-CD2 4.19Å; L30-L51 HydrophobicContact CD1-CD1 3.49Å; L30-L51 VanDerWaalsContact CD1-CD1 3.49Å; L30-L51 HydrophobicContact CD1-CD2 3.66Å; L30-L51 HydrophobicContact CD1-CG 4.02Å; L30-L51 HydrophobicContact CD2-CD1 4.33Å; L30-L51 HydrophobicContact CG-CD1 4.46Å; L30-L339 HydrophobicContact CG-CD1 4.2Å
31A56.6Low53.6Low6 Ų677.3 Ų77.35%0.0545%0.445CS..Hα-helixtrans-64.6-31.6175.500000111.2L27 T28 S35 L339L27-A31 HydrophobicContact CB-CB 4.24Å; L27-A31 HydrophobicContact CD2-CB 3.85Å; T28-A31 CarbonylContact O-C 3.59Å; T28-A31 WeakPolarHBondContact O-CA 3.38Å; T28-A31 WeakPolarHBondContact O-CB 3.46Å; T28-A31 PolarHBondContact O-N 2.78Å; T28-A31 WeakPolarHBondContact OG1-CB 3.5Å; T28-A31 PolarHBondContact OG1-N 3.4Å; A31-S35 WeakPolarHBondContact O-CB 3.37Å; A31-S35 PolarHBondContact O-N 3.34Å; A31-S35 PolarHBondContact O-OG 2.69Å; A31-L339 HydrophobicContact CB-CD1 4.47Å; A31-L339 HydrophobicContact CB-CD2 4.09Å
32L59.8Low54.3Low56 Ų5675.6 Ų75.629%0.29343%0.433SS..Hα-helixtrans-76.3-38.2178.6-156.4142.6000111.7N23 T28 P29 L30 A34 S35 S36N23-L32 HydrophobicContact CB-CD1 3.95Å; T28-L32 WeakPolarHBondContact O-CB 3.4Å; T28-L32 PolarHBondContact O-N 3.01Å; P29-L32 PolarHBondContact O-N 3.47Å; L30-L32 PolarHBondContact O-N 3.12Å; L32-A34 VanDerWaalsContact C-N 3.33Å; L32-S35 PolarHBondContact O-N 2.96Å; L32-S36 WeakPolarHBondContact O-CB 3.38Å; L32-S36 PolarHBondContact O-N 3.32Å; L32-S36 PolarHBondContact O-OG 3.13Å
33A58.1Low54.7Low25 Ų2573 Ų7321%0.20742%0.415CS..Hα-helixtrans-65.2-37.5171.600000111.8P29 L30 M45P29-A33 VanDerWaalsContact O-CB 3.27Å; P29-A33 WeakPolarHBondContact O-CB 2.91Å; P29-A33 PolarHBondContact O-N 3.11Å; L30-A33 PolarHBondContact O-N 3.37Å; A33-M45 HydrophobicContact CB-CE 3.55Å
34A55.7Low55.2Low19 Ų1973.2 Ų73.216%0.15742%0.416CS..Hα-helixtrans-76.2-29.8174.700000113.6L30 L32 L339L30-A34 WeakPolarHBondContact O-CB 2.95Å; L30-A34 PolarHBondContact O-N 3.24Å; L32-A34 VanDerWaalsContact C-N 3.33Å; A34-L339 HydrophobicContact CB-CD1 3.97Å
35S50.7Low56Low44 Ų4465.7 Ų65.731%0.30839%0.385SS..Hα-helixtrans-102.5-25.6-173.363.80000115.8A31 L32 G37A31-S35 WeakPolarHBondContact O-CB 3.37Å; A31-S35 PolarHBondContact O-N 3.34Å; A31-S35 PolarHBondContact O-OG 2.69Å; L32-S35 PolarHBondContact O-N 2.96Å; S35-G37 PolarHBondContact O-N 2.7Å
36S53.5Low56.7Low61 Ų6157.8 Ų57.843%0.42735%0.351SS..  trans-81.982.8176.4-710000110.6L32 K38L32-S36 WeakPolarHBondContact O-CB 3.38Å; L32-S36 PolarHBondContact O-N 3.32Å; L32-S36 PolarHBondContact O-OG 3.13Å; S36-K38 PolarHBondContact O-N 3.48Å
37G46.5Very low57.1Low50 Ų5057.2 Ų57.252%0.51534%0.335SS..THydrogen-bonded Turntrans-69.531.3-176.700000117.3S35S35-G37 PolarHBondContact O-N 2.7Å
38K50.3Low57.7Low207 Ų20757 Ų5790%0.934%0.335SS*.THydrogen-bonded Turntrans-102.3-6.4-178.6-84.7-172.8176.9-176.70115.7S36S36-K38 PolarHBondContact O-N 3.48Å
39I51.2Low57.8Low116 Ų11658.5 Ų58.560%0.59534%0.339SS*.  trans-108.7115-174.4-57.5162.6000109.1N41 R42I39-N41 PolarHBondContact O-N 3.22Å; I39-N41 VanDerWaalsContact O-N 3.1Å; I39-R42 PolarHBondContact O-N 3.38Å; I39-R42 VanDerWaalsContact O-N 3.16Å
40G51.7Low58.3Low71 Ų7159.4 Ų59.473%0.73235%0.345SS*.THydrogen-bonded Turntrans-54.7-27-179.600000114.3R42G40-R42 PolarHBondContact O-N 3.24Å
41N59.9Low58.7Low110 Ų11059.2 Ų59.259%0.58834%0.344SS*.THydrogen-bonded Turntrans-96.224.1-177.9-62.75000113.8I39 H43 D44 M45I39-N41 PolarHBondContact O-N 3.22Å; I39-N41 VanDerWaalsContact O-N 3.1Å; N41-H43 PolarHBondContact O-N 3.4Å; N41-D44 PolarHBondContact O-N 2.93Å; N41-D44 VanDerWaalsContact O-N 3.14Å; N41-M45 PolarHBondContact O-N 3.34Å
42R61.9Low59.6Low51 Ų5159.9 Ų59.919%0.19235%0.347CS..Hα-helixtrans-55-33.117862.7-176.5-178.61781.1113.9I39 G40 L46 D142 L332I39-R42 PolarHBondContact O-N 3.38Å; I39-R42 VanDerWaalsContact O-N 3.16Å; G40-R42 PolarHBondContact O-N 3.24Å; R42-L46 WeakPolarHBondContact O-CG 3.21Å; R42-L46 PolarHBondContact O-N 2.98Å; R42-D142 IonicContact CZ-OD1 3.35Å; R42-D142 IonicContact CZ-OD2 3.86Å; R42-D142 VanDerWaalsContact NH1-CG 3.26Å; R42-D142 IonicContact NH1-OD1 2.99Å; R42-D142 PolarHBondContact NH1-OD1 3.14Å; R42-D142 IonicContact NH1-OD2 2.81Å; R42-D142 PolarHBondContact NH1-OD2 3.46Å; R42-D142 IonicContact NH2-OD1 2.79Å; R42-D142 PolarHBondContact NH2-OD1 3.47Å; R42-D142 IonicContact NH2-OD2 3.98Å; R42-L332 HydrophobicContact CG-CD2 4.07Å
43H57.7Low60.4Low27 Ų2762.8 Ų62.813%0.12535%0.353CS..Hα-helixtrans-68.2-41.1-179.3-63.1-77.2000110.7N41 M45 L46 L47 N328 L332N41-H43 PolarHBondContact O-N 3.4Å; H43-M45 PolarHBondContact O-N 2.71Å; H43-L46 PolarHBondContact O-N 3.42Å; H43-L47 WeakPolarHBondContact O-CG 3.35Å; H43-L47 PolarHBondContact O-N 2.92Å; H43-L47 VanDerWaalsContact O-N 3.16Å; H43-N328 HydrophobicContact CB-CB 3.99Å; H43-N328 PolarHBondContact ND1-O 3.43Å; H43-N328 VanDerWaalsContact ND1-O 3.1Å; H43-L332 WeakPolarHBondContact CE1-CD2 3.32Å; H43-L332 WeakPolarHBondContact ND1-CB 3.4Å
44D60.3Low61.3Low89 Ų8963.3 Ų63.348%0.47635%0.353SS..Hα-helixtrans-71.1-32.6-178.1-57.5-26.3000112.6N41 L46 L47N41-D44 PolarHBondContact O-N 2.93Å; N41-D44 VanDerWaalsContact O-N 3.14Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 3.47Å; D44-L47 PolarHBondContact O-N 3.47Å
45M62Low62.3Low58 Ų5863 Ų6329%0.28635%0.348SS..Hα-helixtrans-70.8-28.4176.4-170.9173.7143.700112.9Y2 A33 N41 H43 V48Y2-M45 HydrophobicContact CD1-CE 3.88Å; Y2-M45 HydrophobicContact CD2-CE 3.35Å; Y2-M45 HydrophobicContact CD2-SD 4.08Å; Y2-M45 HydrophobicContact CE1-CE 3.89Å; Y2-M45 HydrophobicContact CE2-CE 3.39Å; Y2-M45 HydrophobicContact CG-CE 3.6Å; Y2-M45 HydrophobicContact CG-CG 4.28Å; Y2-M45 HydrophobicContact CG-SD 4.14Å; A33-M45 HydrophobicContact CB-CE 3.55Å; N41-M45 PolarHBondContact O-N 3.34Å; H43-M45 PolarHBondContact O-N 2.71Å; M45-V48 VanDerWaalsContact O-CG2 3.24Å; M45-V48 WeakPolarHBondContact O-CG2 3.39Å
46L61.7Low63.7Low12 Ų1264.2 Ų64.26%0.06335%0.349CS..Hα-helixtrans-86.8-14.2175.7-65.5173.4000113.3L30 R42 H43 D44 L51 L332L30-L46 HydrophobicContact CD1-CD2 4.19Å; R42-L46 WeakPolarHBondContact O-CG 3.21Å; R42-L46 PolarHBondContact O-N 2.98Å; H43-L46 PolarHBondContact O-N 3.42Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 3.47Å; L46-L51 HydrophobicContact CB-CD2 4.2Å; L46-L51 HydrophobicContact CD2-CD2 3.3Å; L46-L51 HydrophobicContact CG-CD2 4.31Å; L46-L332 HydrophobicContact CD1-CB 4.37Å; L46-L332 HydrophobicContact CD1-CD1 3.12Å; L46-L332 HydrophobicContact CD1-CG 4.31Å
47L62.6Low64.9Low41 Ų4163.2 Ų63.222%0.21534%0.339CS..  trans-78.9-6.8174-73.3168.1000113.4H43 D44 E49 N328 K331H43-L47 WeakPolarHBondContact O-CG 3.35Å; H43-L47 PolarHBondContact O-N 2.92Å; H43-L47 VanDerWaalsContact O-N 3.16Å; D44-L47 PolarHBondContact O-N 3.47Å; L47-E49 PolarHBondContact O-N 3.32Å; L47-E49 VanDerWaalsContact O-N 3.17Å; L47-N328 HydrophobicContact CD1-CB 3.95Å; L47-N328 WeakPolarHBondContact CD1-ND2 3.34Å; L47-N328 VanDerWaalsContact CD1-OD1 3.3Å; L47-N328 WeakPolarHBondContact CD1-OD1 3.43Å; L47-K331 HydrophobicContact CD2-CD 3.39Å
48V68.3Low66.5Low32 Ų3262.2 Ų62.219%0.19432%0.321CS..SBendtrans-53.5123.7174.5178.40000108.9N3 M45 P50 L51 N52N3-V48 VanDerWaalsContact ND2-CG1 3.31Å; N3-V48 WeakPolarHBondContact ND2-CG1 3.49Å; N3-V48 WeakPolarHBondContact OD1-CG1 3.41Å; M45-V48 VanDerWaalsContact O-CG2 3.24Å; M45-V48 WeakPolarHBondContact O-CG2 3.39Å; V48-P50 HydrophobicContact CG1-CG 3.81Å; V48-L51 WeakPolarHBondContact O-CB 3.45Å; V48-L51 PolarHBondContact O-N 3.28Å; V48-N52 PolarHBondContact O-N 2.95Å
49E66.7Low68.1Low84 Ų8453.1 Ų53.139%0.39328%0.28SS..Hα-helixtrans-44.1-52.6-168.8-160.583.2-15000114L47 L51 N52 R53 V377 E379L47-E49 PolarHBondContact O-N 3.32Å; L47-E49 VanDerWaalsContact O-N 3.17Å; E49-L51 VanDerWaalsContact C-N 3.31Å; E49-L51 PolarHBondContact O-N 3.42Å; E49-N52 PolarHBondContact O-N 2.89Å; E49-R53 WeakPolarHBondContact O-CB 3.34Å; E49-R53 VanDerWaalsContact O-CG 3.3Å; E49-R53 WeakPolarHBondContact O-CG 3.48Å; E49-R53 PolarHBondContact O-N 3.39Å; E49-R53 IonicContact OE1-NE 3.84Å; E49-V377 HydrophobicContact CG-CG1 4.45Å; E49-E379 HydrophobicContact CG-CG 4.04Å
50P68.9Low69.6Low48 Ų4851.6 Ų51.631%0.31227%0.273SS..Hα-helixtrans-59.7-37.4178.719.4-34.4000113.7V48 L54 V377V48-P50 HydrophobicContact CG1-CG 3.81Å; P50-L54 VanDerWaalsContact O-CB 3.3Å; P50-L54 WeakPolarHBondContact O-CB 3.25Å; P50-L54 PolarHBondContact O-N 2.84Å; P50-V377 HydrophobicContact CB-CG2 3.98Å
51L69.4Low70.9Confident37 Ų3755.2 Ų55.219%0.19427%0.265CS..Hα-helixtrans-74.6-41.9-178.7-161.782.5000111.7L30 L46 V48 E49 R53 L54 L55L30-L51 HydrophobicContact CD1-CD1 3.49Å; L30-L51 VanDerWaalsContact CD1-CD1 3.49Å; L30-L51 HydrophobicContact CD1-CD2 3.66Å; L30-L51 HydrophobicContact CD1-CG 4.02Å; L30-L51 HydrophobicContact CD2-CD1 4.33Å; L30-L51 HydrophobicContact CG-CD1 4.46Å; L46-L51 HydrophobicContact CB-CD2 4.2Å; L46-L51 HydrophobicContact CD2-CD2 3.3Å; L46-L51 HydrophobicContact CG-CD2 4.31Å; V48-L51 WeakPolarHBondContact O-CB 3.45Å; V48-L51 PolarHBondContact O-N 3.28Å; E49-L51 VanDerWaalsContact C-N 3.31Å; E49-L51 PolarHBondContact O-N 3.42Å; L51-R53 VanDerWaalsContact C-N 3.3Å; L51-R53 PolarHBondContact O-N 3.46Å; L51-L54 PolarHBondContact O-N 3.37Å; L51-L55 HydrophobicContact CD2-CD1 4.37Å; L51-L55 HydrophobicContact CG-CD1 4.29Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 VanDerWaalsContact O-CG 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.5Å; L51-L55 PolarHBondContact O-N 3.17Å
52N74.9Confident71.8Confident20 Ų2050.8 Ų50.811%0.10724%0.241CC..Hα-helixtrans-62.4-40.8176.6-177.343000110.8V48 E49 Q56 K331V48-N52 PolarHBondContact O-N 2.95Å; E49-N52 PolarHBondContact O-N 2.89Å; N52-Q56 WeakPolarHBondContact O-CB 3.48Å; N52-Q56 PolarHBondContact O-N 2.85Å; N52-K331 PolarHBondContact ND2-NZ 3.5Å
53R76.3Confident72.7Confident116 Ų11648.3 Ų48.344%0.43823%0.231SC..Hα-helixtrans-67.1-42.3175.5-69.3-71.6-173.9161.74.8112.5E49 L51 Q56 D57 F375 V377E49-R53 WeakPolarHBondContact O-CB 3.34Å; E49-R53 VanDerWaalsContact O-CG 3.3Å; E49-R53 WeakPolarHBondContact O-CG 3.48Å; E49-R53 PolarHBondContact O-N 3.39Å; E49-R53 IonicContact OE1-NE 3.84Å; L51-R53 VanDerWaalsContact C-N 3.3Å; L51-R53 PolarHBondContact O-N 3.46Å; R53-Q56 PolarHBondContact O-N 3.37Å; R53-D57 PolarHBondContact O-N 3.46Å; R53-F375 HydrophobicContact CB-CE1 3.99Å; R53-V377 HydrophobicContact CG-CG1 4.22Å
54L77.3Confident74Confident37 Ų3751.2 Ų51.219%0.19424%0.243CC..Hα-helixtrans-61-46.4175.3-178.971000112P50 L51 Q56 D57 K58 F375P50-L54 VanDerWaalsContact O-CB 3.3Å; P50-L54 WeakPolarHBondContact O-CB 3.25Å; P50-L54 PolarHBondContact O-N 2.84Å; L51-L54 PolarHBondContact O-N 3.37Å; L54-Q56 VanDerWaalsContact C-N 3.26Å; L54-Q56 PolarHBondContact O-N 3.06Å; L54-D57 PolarHBondContact O-N 3.39Å; L54-K58 WeakPolarHBondContact O-CG 3.38Å; L54-K58 PolarHBondContact O-N 2.99Å; L54-F375 HydrophobicContact CB-CD1 4.33Å; L54-F375 HydrophobicContact CB-CE1 4.17Å; L54-F375 HydrophobicContact CB-CZ 4.41Å; L54-F375 HydrophobicContact CD1-CB 4.46Å; L54-F375 HydrophobicContact CD1-CD1 4.28Å; L54-F375 HydrophobicContact CD1-CD2 3.63Å; L54-F375 HydrophobicContact CD1-CE1 4.48Å; L54-F375 HydrophobicContact CD1-CE2 3.86Å; L54-F375 HydrophobicContact CD1-CG 3.87Å; L54-F375 HydrophobicContact CD1-CZ 4.29Å
55L76.4Confident75.1Confident11 Ų1155.9 Ų55.96%0.05826%0.255CS..Hα-helixtrans-64.5-33.1177.5-72.9168.8000111.8L51 W59 A335 I338L51-L55 HydrophobicContact CD2-CD1 4.37Å; L51-L55 HydrophobicContact CG-CD1 4.29Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 VanDerWaalsContact O-CG 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.5Å; L51-L55 PolarHBondContact O-N 3.17Å; L55-W59 WeakPolarHBondContact O-CB 3.49Å; L55-W59 PolarHBondContact O-N 3.09Å; L55-A335 HydrophobicContact CD1-CB 3.64Å; L55-A335 HydrophobicContact CD2-CB 4.3Å; L55-I338 HydrophobicContact CB-CD1 4.16Å; L55-I338 HydrophobicContact CD2-CD1 4.04Å; L55-I338 HydrophobicContact CD2-CG2 4.2Å; L55-I338 WeakPolarHBondContact O-CD1 3.21Å
56Q79.8Confident76.2Confident70 Ų7055.1 Ų55.133%0.32725%0.251SS..Hα-helixtrans-70-44.2175.8-170.8164.9-9.800112.3N52 R53 L54 K58 W59 D60N52-Q56 WeakPolarHBondContact O-CB 3.48Å; N52-Q56 PolarHBondContact O-N 2.85Å; R53-Q56 PolarHBondContact O-N 3.37Å; L54-Q56 VanDerWaalsContact C-N 3.26Å; L54-Q56 PolarHBondContact O-N 3.06Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.46Å; Q56-W59 WeakPolarHBondContact O-CB 3.37Å; Q56-W59 PolarHBondContact O-N 2.97Å; Q56-W59 VanDerWaalsContact O-N 3.14Å; Q56-D60 PolarHBondContact O-N 3.27Å
57D79.1Confident77.4Confident40 Ų4055.1 Ų55.121%0.21425%0.251CS..Hα-helixtrans-59-45.4173.9173.168.8000111.5R53 L54 W59 D60 R61 S355 F375R53-D57 PolarHBondContact O-N 3.46Å; L54-D57 PolarHBondContact O-N 3.39Å; D57-W59 VanDerWaalsContact C-N 3.3Å; D57-W59 PolarHBondContact O-N 3.21Å; D57-D60 PolarHBondContact O-N 3.01Å; D57-R61 WeakPolarHBondContact O-CB 3Å; D57-R61 PolarHBondContact O-N 3.02Å; D57-R61 IonicContact OD1-CZ 2.69Å; D57-R61 IonicContact OD1-NE 3.47Å; D57-R61 IonicContact OD1-NH2 3.84Å; D57-R61 PolarHBondContact OD1-NH2 3.45Å; D57-R61 IonicContact OD2-CZ 3.66Å; D57-R61 IonicContact OD2-NE 3.62Å; D57-R61 IonicContact OD2-NH2 2.92Å; D57-R61 PolarHBondContact OD2-NH2 3.09Å; D57-S355 PolarHBondContact OD2-OG 3.14Å; D57-F375 HydrophobicContact CB-CE2 3.96Å; D57-F375 HydrophobicContact CB-CZ 3.9Å
58K81.4Confident78.5Confident30 Ų3056.5 Ų56.513%0.1325%0.253CS..Hα-helixtrans-59.5-41.4175-74.6176.2161-151.90112.3L54 Q56 F62 V63 I338 E342L54-K58 WeakPolarHBondContact O-CG 3.38Å; L54-K58 PolarHBondContact O-N 2.99Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.46Å; K58-F62 PolarHBondContact O-N 3.13Å; K58-V63 PolarHBondContact O-N 3.04Å; K58-I338 HydrophobicContact CB-CG2 4.39Å; K58-I338 HydrophobicContact CD-CG2 4.48Å; K58-E342 VanDerWaalsContact CD-OE1 3.22Å; K58-E342 WeakPolarHBondContact CD-OE1 3.14Å; K58-E342 VanDerWaalsContact CE-OE1 3.22Å; K58-E342 WeakPolarHBondContact CE-OE1 3.46Å; K58-E342 VanDerWaalsContact NZ-CD 3.29Å; K58-E342 IonicContact NZ-OE1 3.55Å; K58-E342 PolarHBondContact NZ-OE1 2.95Å; K58-E342 IonicContact NZ-OE2 3.87Å; K58-E342 PolarHBondContact NZ-OE2 3.14Å
59W83.2Confident79.5Confident15 Ų1561.2 Ų61.26%0.05727%0.272CS..Iπ-helixtrans-61.5-54.5178.1-178.5-95.3000111.7L55 Q56 D57 R61 V63 K64 F67 G191 R334 I338L55-W59 WeakPolarHBondContact O-CB 3.49Å; L55-W59 PolarHBondContact O-N 3.09Å; Q56-W59 WeakPolarHBondContact O-CB 3.37Å; Q56-W59 PolarHBondContact O-N 2.97Å; Q56-W59 VanDerWaalsContact O-N 3.14Å; D57-W59 VanDerWaalsContact C-N 3.3Å; D57-W59 PolarHBondContact O-N 3.21Å; W59-R61 PolarHBondContact O-N 2.96Å; W59-V63 HydrophobicContact CD2-CB 4.47Å; W59-V63 HydrophobicContact CE3-CB 3.85Å; W59-V63 HydrophobicContact CE3-CG1 3.55Å; W59-V63 HydrophobicContact CH2-CG1 4.5Å; W59-V63 HydrophobicContact CZ3-CB 4.31Å; W59-V63 HydrophobicContact CZ3-CG1 3.53Å; W59-V63 PolarHBondContact O-N 3.04Å; W59-K64 WeakPolarHBondContact O-CB 3.34Å; W59-K64 PolarHBondContact O-N 3.4Å; W59-F67 HydrophobicContact CH2-CB 4.38Å; W59-F67 HydrophobicContact CH2-CD1 4.36Å; W59-F67 HydrophobicContact CH2-CD2 4.31Å; W59-F67 HydrophobicContact CH2-CG 4.09Å; W59-G191 WeakPolarHBondContact CZ2-O 3.42Å; W59-R334 HydrophobicContact CD2-CG 4.3Å; W59-R334 HydrophobicContact CE3-CG 3.89Å; W59-R334 HydrophobicContact CZ3-CG 4.07Å; W59-I338 HydrophobicContact CB-CD1 4.25Å; W59-I338 HydrophobicContact CE3-CD1 4.11Å; W59-I338 HydrophobicContact CE3-CG1 3.77Å; W59-I338 HydrophobicContact CZ3-CG1 4.41Å
60D82.4Confident80.5Confident84 Ų8460.7 Ų60.745%0.44927%0.271SS..Iπ-helixtrans-70.1-33.9-173.5-70.6-34.5000112.6Q56 D57Q56-D60 PolarHBondContact O-N 3.27Å; D57-D60 PolarHBondContact O-N 3.01Å
61R79.6Confident81.5Confident147 Ų14761 Ų6156%0.55527%0.268SS*.Iπ-helixtrans-70.2-42.8-178.7-167.9175.2-62.2-1571.7112.8D57 W59D57-R61 WeakPolarHBondContact O-CB 3Å; D57-R61 PolarHBondContact O-N 3.02Å; D57-R61 IonicContact OD1-CZ 2.69Å; D57-R61 IonicContact OD1-NE 3.47Å; D57-R61 IonicContact OD1-NH2 3.84Å; D57-R61 PolarHBondContact OD1-NH2 3.45Å; D57-R61 IonicContact OD2-CZ 3.66Å; D57-R61 IonicContact OD2-NE 3.62Å; D57-R61 IonicContact OD2-NH2 2.92Å; D57-R61 PolarHBondContact OD2-NH2 3.09Å; W59-R61 PolarHBondContact O-N 2.96Å
62F77.3Confident82.6Confident17 Ų1764.9 Ų64.98%0.07528%0.284CS..Iπ-helixtrans-145.7-43.5-167.2123.3-80.1000115.3K58 K64 R65 I66 E342 F345 F353K58-F62 PolarHBondContact O-N 3.13Å; F62-K64 PolarHBondContact O-N 2.75Å; F62-R65 PolarHBondContact O-N 3.02Å; F62-R65 VanDerWaalsContact O-N 3.12Å; F62-I66 HydrophobicContact CD2-CD1 3.25Å; F62-I66 HydrophobicContact CD2-CG1 4.25Å; F62-I66 HydrophobicContact CE2-CD1 3.22Å; F62-I66 HydrophobicContact CE2-CG1 4.5Å; F62-I66 HydrophobicContact CG-CD1 4.37Å; F62-I66 HydrophobicContact CZ-CD1 4.28Å; F62-I66 PolarHBondContact O-N 2.78Å; F62-E342 HydrophobicContact CE1-CG 4.38Å; F62-F345 HydrophobicContact CD2-CZ 4.33Å; F62-F345 HydrophobicContact CE1-CE2 4.26Å; F62-F345 HydrophobicContact CE2-CD1 4.4Å; F62-F345 HydrophobicContact CE2-CD2 4.12Å; F62-F345 AromaticContact CE2-CE1 3.69Å; F62-F345 HydrophobicContact CE2-CE1 3.69Å; F62-F345 AromaticContact CE2-CE2 3.38Å; F62-F345 HydrophobicContact CE2-CE2 3.38Å; F62-F345 AromaticContact CE2-CZ 3.14Å; F62-F345 HydrophobicContact CE2-CZ 3.14Å; F62-F345 AromaticContact CZ-CD2 3.78Å; F62-F345 HydrophobicContact CZ-CD2 3.78Å; F62-F345 HydrophobicContact CZ-CE1 4.26Å; F62-F345 AromaticContact CZ-CE2 3.05Å; F62-F345 HydrophobicContact CZ-CE2 3.05Å; F62-F345 AromaticContact CZ-CZ 3.37Å; F62-F345 HydrophobicContact CZ-CZ 3.37Å; F62-F353 HydrophobicContact CB-CD1 4.48Å; F62-F353 HydrophobicContact CB-CE1 4.46Å; F62-F353 HydrophobicContact CD2-CD1 4.17Å; F62-F353 HydrophobicContact CD2-CD2 4.21Å; F62-F353 AromaticContact CD2-CE1 4Å; F62-F353 HydrophobicContact CD2-CE1 4Å; F62-F353 AromaticContact CD2-CE2 4Å; F62-F353 HydrophobicContact CD2-CE2 4Å; F62-F353 HydrophobicContact CD2-CG 4.3Å; F62-F353 AromaticContact CD2-CZ 3.91Å; F62-F353 HydrophobicContact CD2-CZ 3.91Å; F62-F353 AromaticContact CE2-CD2 3.87Å; F62-F353 HydrophobicContact CE2-CD2 3.87Å; F62-F353 AromaticContact CE2-CE2 3.81Å; F62-F353 HydrophobicContact CE2-CE2 3.81Å; F62-F353 HydrophobicContact CE2-CG 4.28Å; F62-F353 HydrophobicContact CE2-CZ 4.2Å; F62-F353 HydrophobicContact CG-CD1 4.37Å; F62-F353 HydrophobicContact CG-CE1 4.48Å; F62-F353 HydrophobicContact CZ-CD2 4.39Å
63V81.8Confident83.4Confident0 Ų067.2 Ų67.20%030%0.298CS..Iπ-helixtrans-63.2-39.2-173.2-176.70000109.8K58 W59 R65 I66 F67 I338K58-V63 PolarHBondContact O-N 3.04Å; W59-V63 HydrophobicContact CD2-CB 4.47Å; W59-V63 HydrophobicContact CE3-CB 3.85Å; W59-V63 HydrophobicContact CE3-CG1 3.55Å; W59-V63 HydrophobicContact CH2-CG1 4.5Å; W59-V63 HydrophobicContact CZ3-CB 4.31Å; W59-V63 HydrophobicContact CZ3-CG1 3.53Å; W59-V63 PolarHBondContact O-N 3.04Å; V63-R65 VanDerWaalsContact C-N 3.33Å; V63-R65 PolarHBondContact O-N 2.91Å; V63-I66 PolarHBondContact O-N 3.36Å; V63-F67 WeakPolarHBondContact O-CB 3.2Å; V63-F67 PolarHBondContact O-N 3.42Å; V63-I338 HydrophobicContact CB-CG1 4.46Å; V63-I338 HydrophobicContact CG1-CG1 4.2Å; V63-I338 HydrophobicContact CG2-CB 4.42Å; V63-I338 HydrophobicContact CG2-CG1 4.11Å; V63-I338 HydrophobicContact CG2-CG2 4.1Å
64K84Confident84.2Confident87 Ų8762 Ų6238%0.37828%0.279SS..Hα-helixtrans-53.9-47.3176.6-175.3176.9-179.3-179.60112.1W59 F62 Y68W59-K64 WeakPolarHBondContact O-CB 3.34Å; W59-K64 PolarHBondContact O-N 3.4Å; F62-K64 PolarHBondContact O-N 2.75Å; K64-Y68 HydrophobicContact CD-CE2 4.11Å; K64-Y68 HydrophobicContact CG-CD2 3.78Å; K64-Y68 HydrophobicContact CG-CE2 3.36Å; K64-Y68 WeakPolarHBondContact O-CD2 3.43Å; K64-Y68 PolarHBondContact O-N 3.02Å
65R84.8Confident85Confident188 Ų18861.1 Ų61.171%0.70928%0.275SS*.Hα-helixtrans-65.4-44.8-178.9-65-177-169.2172.33.2111.8F62 V63 Y68 F69F62-R65 PolarHBondContact O-N 3.02Å; F62-R65 VanDerWaalsContact O-N 3.12Å; V63-R65 VanDerWaalsContact C-N 3.33Å; V63-R65 PolarHBondContact O-N 2.91Å; R65-Y68 PolarHBondContact O-N 2.91Å; R65-F69 WeakPolarHBondContact O-CB 3.11Å; R65-F69 PolarHBondContact O-N 2.99Å
66I84.4Confident85.9Confident42 Ų4264 Ų6422%0.21529%0.291CS..Hα-helixtrans-71.7-37.7-178.3-66178.3000111.2F62 V63 F69 N70 T341 F345F62-I66 HydrophobicContact CD2-CD1 3.25Å; F62-I66 HydrophobicContact CD2-CG1 4.25Å; F62-I66 HydrophobicContact CE2-CD1 3.22Å; F62-I66 HydrophobicContact CE2-CG1 4.5Å; F62-I66 HydrophobicContact CG-CD1 4.37Å; F62-I66 HydrophobicContact CZ-CD1 4.28Å; F62-I66 PolarHBondContact O-N 2.78Å; V63-I66 PolarHBondContact O-N 3.36Å; I66-F69 PolarHBondContact O-N 3.47Å; I66-N70 WeakPolarHBondContact O-CB 3.42Å; I66-N70 VanDerWaalsContact O-CG 3.26Å; I66-N70 PolarHBondContact O-N 3.28Å; I66-N70 PolarHBondContact O-ND2 2.92Å; I66-T341 HydrophobicContact CG2-CG2 4.21Å; I66-F345 HydrophobicContact CD1-CE1 3.49Å; I66-F345 VanDerWaalsContact CD1-CE1 3.49Å; I66-F345 HydrophobicContact CD1-CZ 3.34Å; I66-F345 HydrophobicContact CG2-CZ 4.25Å
67F85.9Confident86.6Confident11 Ų1161.6 Ų61.65%0.04828%0.279CS..Hα-helixtrans-61.5-45.8175.2-173-89.3000111.1W59 V63 N70 F71 Y188 T337W59-F67 HydrophobicContact CH2-CB 4.38Å; W59-F67 HydrophobicContact CH2-CD1 4.36Å; W59-F67 HydrophobicContact CH2-CD2 4.31Å; W59-F67 HydrophobicContact CH2-CG 4.09Å; V63-F67 WeakPolarHBondContact O-CB 3.2Å; V63-F67 PolarHBondContact O-N 3.42Å; F67-N70 PolarHBondContact O-N 2.92Å; F67-F71 WeakPolarHBondContact O-CB 3.38Å; F67-F71 PolarHBondContact O-N 3.3Å; F67-Y188 HydrophobicContact CE1-CD1 4.14Å; F67-Y188 WeakPolarHBondContact CE1-O 3.36Å; F67-Y188 HydrophobicContact CE2-CD1 4.25Å; F67-Y188 AromaticContact CZ-CD1 3.88Å; F67-Y188 HydrophobicContact CZ-CD1 3.88Å; F67-T337 HydrophobicContact CD2-CG2 4.11Å; F67-T337 HydrophobicContact CE2-CG2 4.03Å
68Y87.2Confident87.3Confident70 Ų7059.8 Ų59.828%0.27527%0.269SS..Hα-helixtrans-66.8-36.4174.7-72.7-52.8000113.3K64 R65 F71 F72 F192K64-Y68 HydrophobicContact CD-CE2 4.11Å; K64-Y68 HydrophobicContact CG-CD2 3.78Å; K64-Y68 HydrophobicContact CG-CE2 3.36Å; K64-Y68 WeakPolarHBondContact O-CD2 3.43Å; K64-Y68 PolarHBondContact O-N 3.02Å; R65-Y68 PolarHBondContact O-N 2.91Å; Y68-F71 WeakPolarHBondContact O-CB 3.31Å; Y68-F71 PolarHBondContact O-N 2.77Å; Y68-F72 WeakPolarHBondContact O-CB 3.1Å; Y68-F72 PolarHBondContact O-N 3.06Å; Y68-F192 HydrophobicContact CD1-CZ 4.44Å; Y68-F192 AromaticContact CE1-CE1 3.7Å; Y68-F192 HydrophobicContact CE1-CE1 3.7Å; Y68-F192 AromaticContact CE1-CE2 3.98Å; Y68-F192 HydrophobicContact CE1-CE2 3.98Å; Y68-F192 AromaticContact CE1-CZ 3.39Å; Y68-F192 HydrophobicContact CE1-CZ 3.39Å; Y68-F192 AromaticContact CZ-CE1 3.76Å; Y68-F192 AromaticContact CZ-CZ 3.97Å; Y68-F192 WeakPolarHBondContact OH-CD1 3.42Å; Y68-F192 WeakPolarHBondContact OH-CE1 3.4Å
69F89.1Confident88Confident132 Ų13262.4 Ų62.458%0.57928%0.284SS*.Hα-helixtrans-62.4-47.3173.4-179.5-99.1000111.4R65 I66 F71 F72 V73R65-F69 WeakPolarHBondContact O-CB 3.11Å; R65-F69 PolarHBondContact O-N 2.99Å; I66-F69 PolarHBondContact O-N 3.47Å; F69-F71 VanDerWaalsContact C-N 3.32Å; F69-F71 PolarHBondContact O-N 2.9Å; F69-F72 PolarHBondContact O-N 3.49Å; F69-V73 HydrophobicContact CD1-CG2 4.26Å; F69-V73 HydrophobicContact CE1-CG2 3.84Å; F69-V73 HydrophobicContact CE2-CG2 4.29Å; F69-V73 HydrophobicContact CZ-CG2 3.86Å; F69-V73 WeakPolarHBondContact O-CG2 3.22Å; F69-V73 PolarHBondContact O-N 3.23Å
70N88Confident88.5Confident72 Ų7264.3 Ų64.339%0.38529%0.294SS..Hα-helixtrans-61.6-40.6175.8-72.6-18.4000111.9I66 F67 V73 Y74 Y188I66-N70 WeakPolarHBondContact O-CB 3.42Å; I66-N70 VanDerWaalsContact O-CG 3.26Å; I66-N70 PolarHBondContact O-N 3.28Å; I66-N70 PolarHBondContact O-ND2 2.92Å; F67-N70 PolarHBondContact O-N 2.92Å; N70-V73 PolarHBondContact O-N 2.94Å; N70-Y74 WeakPolarHBondContact O-CB 3.41Å; N70-Y74 PolarHBondContact O-N 2.95Å; N70-Y188 HydrophobicContact CB-CE1 4.32Å
71F90Very high89.1Confident56 Ų5660.5 Ų60.525%0.24627%0.274CS..Hα-helixtrans-59.5-47.8173.4171.6-116.2000111.5F67 Y68 F69 Y74 C75 M185 Y188F67-F71 WeakPolarHBondContact O-CB 3.38Å; F67-F71 PolarHBondContact O-N 3.3Å; Y68-F71 WeakPolarHBondContact O-CB 3.31Å; Y68-F71 PolarHBondContact O-N 2.77Å; F69-F71 VanDerWaalsContact C-N 3.32Å; F69-F71 PolarHBondContact O-N 2.9Å; F71-Y74 PolarHBondContact O-N 3.22Å; F71-C75 WeakPolarHBondContact CE2-SG 3.13Å; F71-C75 VanDerWaalsContact CZ-SG 3.51Å; F71-C75 PolarHBondContact O-N 3.48Å; F71-C75 PolarHBondContact O-SG 3.39Å; F71-M185 HydrophobicContact CE2-CE 3.86Å; F71-M185 HydrophobicContact CE2-CG 4.17Å; F71-M185 HydrophobicContact CZ-CE 3.89Å; F71-Y188 HydrophobicContact CB-CD1 3.71Å; F71-Y188 HydrophobicContact CB-CE1 4.21Å; F71-Y188 HydrophobicContact CB-CG 4.05Å; F71-Y188 HydrophobicContact CD2-CD1 4.06Å; F71-Y188 AromaticContact CD2-CD2 3.88Å; F71-Y188 HydrophobicContact CD2-CD2 3.88Å; F71-Y188 AromaticContact CD2-CG 3.47Å; F71-Y188 HydrophobicContact CD2-CG 3.47Å; F71-Y188 VanDerWaalsContact CD2-CG 3.47Å; F71-Y188 HydrophobicContact CE2-CG 4.36Å; F71-Y188 HydrophobicContact CG-CD1 4.36Å; F71-Y188 HydrophobicContact CG-CG 4.2Å
72F91.9Very high89.8Confident118 Ų11855.6 Ų55.652%0.51826%0.26SS..Hα-helixtrans-62-45.8179.1179.8-104.5000112Y68 F69 Y74 C75 L76Y68-F72 WeakPolarHBondContact O-CB 3.1Å; Y68-F72 PolarHBondContact O-N 3.06Å; F69-F72 PolarHBondContact O-N 3.49Å; F72-Y74 VanDerWaalsContact C-N 3.3Å; F72-Y74 PolarHBondContact O-N 2.92Å; F72-C75 WeakPolarHBondContact O-CB 3.32Å; F72-C75 PolarHBondContact O-N 3.41Å; F72-L76 HydrophobicContact CD1-CD1 3.92Å; F72-L76 HydrophobicContact CD1-CG 4.46Å; F72-L76 HydrophobicContact CE1-CD1 3.38Å; F72-L76 HydrophobicContact CE1-CG 4.1Å; F72-L76 HydrophobicContact CE2-CG 4.46Å; F72-L76 HydrophobicContact CZ-CD1 3.74Å; F72-L76 HydrophobicContact CZ-CD2 4.27Å; F72-L76 HydrophobicContact CZ-CG 4.1Å; F72-L76 WeakPolarHBondContact O-CG 3.39Å; F72-L76 PolarHBondContact O-N 3.39Å
73V92.4Very high90.4Very high69 Ų6957.7 Ų57.742%0.41828%0.275SS..Hα-helixtrans-60.4-40.6175.3174.30000111.2F69 N70 L76 Y77F69-V73 HydrophobicContact CD1-CG2 4.26Å; F69-V73 HydrophobicContact CE1-CG2 3.84Å; F69-V73 HydrophobicContact CE2-CG2 4.29Å; F69-V73 HydrophobicContact CZ-CG2 3.86Å; F69-V73 WeakPolarHBondContact O-CG2 3.22Å; F69-V73 PolarHBondContact O-N 3.23Å; N70-V73 PolarHBondContact O-N 2.94Å; V73-L76 PolarHBondContact O-N 3.4Å; V73-Y77 WeakPolarHBondContact O-CB 3.22Å; V73-Y77 PolarHBondContact O-N 2.87Å
74Y93Very high90.8Very high5 Ų558.2 Ų58.22%0.0228%0.279CS..Hα-helixtrans-66.8-39.6176.4-172.2-107.6000112.9N70 F71 F72 L76 Y77 M78 F121 F149 G181 N184 M185 Y188N70-Y74 WeakPolarHBondContact O-CB 3.41Å; N70-Y74 PolarHBondContact O-N 2.95Å; F71-Y74 PolarHBondContact O-N 3.22Å; F72-Y74 VanDerWaalsContact C-N 3.3Å; F72-Y74 PolarHBondContact O-N 2.92Å; Y74-L76 VanDerWaalsContact C-N 3.35Å; Y74-Y77 HydrophobicContact CD2-CD1 4.04Å; Y74-Y77 AromaticContact CE2-CD1 3.85Å; Y74-Y77 HydrophobicContact CE2-CD1 3.85Å; Y74-Y77 HydrophobicContact CE2-CE1 4.18Å; Y74-Y77 WeakPolarHBondContact O-CB 3.3Å; Y74-Y77 PolarHBondContact O-N 3.39Å; Y74-M78 HydrophobicContact CD1-CG 4.18Å; Y74-M78 HydrophobicContact CE1-CG 3.72Å; Y74-M78 HydrophobicContact CE1-SD 4.39Å; Y74-M78 HydrophobicContact CE2-CG 4.35Å; Y74-M78 HydrophobicContact CE2-SD 4.45Å; Y74-M78 WeakPolarHBondContact O-CG 3.13Å; Y74-M78 PolarHBondContact O-N 3.3Å; Y74-F121 HydrophobicContact CD2-CE2 4.14Å; Y74-F121 AromaticContact CD2-CZ 3.7Å; Y74-F121 HydrophobicContact CD2-CZ 3.7Å; Y74-F121 HydrophobicContact CE2-CE2 4.01Å; Y74-F121 AromaticContact CE2-CZ 3.88Å; Y74-F121 HydrophobicContact CE2-CZ 3.88Å; Y74-F149 HydrophobicContact CD2-CE1 4.41Å; Y74-F149 HydrophobicContact CE1-CE1 4.26Å; Y74-F149 HydrophobicContact CE2-CD1 4.37Å; Y74-F149 AromaticContact CE2-CE1 3.73Å; Y74-F149 HydrophobicContact CE2-CE1 3.73Å; Y74-F149 AromaticContact CZ-CE1 3.63Å; Y74-G181 WeakPolarHBondContact OH-CA 3.49Å; Y74-G181 PolarHBondContact OH-O 3.38Å; Y74-N184 WeakPolarHBondContact OH-CB 3.23Å; Y74-M185 HydrophobicContact CE1-CB 4.41Å; Y74-Y188 HydrophobicContact CD1-CD2 4Å; Y74-Y188 AromaticContact CD1-CE2 3.47Å; Y74-Y188 HydrophobicContact CD1-CE2 3.47Å; Y74-Y188 VanDerWaalsContact CD1-CE2 3.47Å; Y74-Y188 HydrophobicContact CD2-CE2 4.45Å; Y74-Y188 HydrophobicContact CE1-CE2 4.19Å; Y74-Y188 AromaticContact CG-CE2 3.61Å; Y74-Y188 HydrophobicContact CG-CE2 3.61Å
75C93.9Very high91.1Very high19 Ų1955.1 Ų55.113%0.12827%0.27CS..Hα-helixtrans-60.7-45.7174.2-65.70000110.9F71 F72 Y77 M78 I79 M185F71-C75 WeakPolarHBondContact CE2-SG 3.13Å; F71-C75 VanDerWaalsContact CZ-SG 3.51Å; F71-C75 PolarHBondContact O-N 3.48Å; F71-C75 PolarHBondContact O-SG 3.39Å; F72-C75 WeakPolarHBondContact O-CB 3.32Å; F72-C75 PolarHBondContact O-N 3.41Å; C75-Y77 PolarHBondContact O-N 2.95Å; C75-M78 PolarHBondContact O-N 3.47Å; C75-I79 VanDerWaalsContact O-CG1 3.28Å; C75-I79 WeakPolarHBondContact O-CG1 3.49Å; C75-I79 PolarHBondContact O-N 3.22Å; C75-M185 WeakPolarHBondContact SG-CE 3.4Å
76L94.1Very high91.3Very high73 Ų7354.8 Ų54.838%0.38227%0.269SS..Hα-helixtrans-60.4-44.7175.1-71.2178.9000111.7F72 V73 Y74 M78 I79 I80F72-L76 HydrophobicContact CD1-CD1 3.92Å; F72-L76 HydrophobicContact CD1-CG 4.46Å; F72-L76 HydrophobicContact CE1-CD1 3.38Å; F72-L76 HydrophobicContact CE1-CG 4.1Å; F72-L76 HydrophobicContact CE2-CG 4.46Å; F72-L76 HydrophobicContact CZ-CD1 3.74Å; F72-L76 HydrophobicContact CZ-CD2 4.27Å; F72-L76 HydrophobicContact CZ-CG 4.1Å; F72-L76 WeakPolarHBondContact O-CG 3.39Å; F72-L76 PolarHBondContact O-N 3.39Å; V73-L76 PolarHBondContact O-N 3.4Å; Y74-L76 VanDerWaalsContact C-N 3.35Å; L76-M78 VanDerWaalsContact C-N 3.33Å; L76-M78 PolarHBondContact O-N 2.84Å; L76-I79 PolarHBondContact O-N 3.2Å; L76-I80 WeakPolarHBondContact O-CB 3.4Å; L76-I80 VanDerWaalsContact O-CG1 3.25Å; L76-I80 WeakPolarHBondContact O-CG1 3.33Å; L76-I80 PolarHBondContact O-N 3.43Å
77Y94.5Very high91.4Very high19 Ų1960.2 Ų60.28%0.07529%0.288CS..Hα-helixtrans-55.7-46.7174.1166.4-100.5000111.8V73 Y74 C75 I80 F81 F121 Q152V73-Y77 WeakPolarHBondContact O-CB 3.22Å; V73-Y77 PolarHBondContact O-N 2.87Å; Y74-Y77 HydrophobicContact CD2-CD1 4.04Å; Y74-Y77 AromaticContact CE2-CD1 3.85Å; Y74-Y77 HydrophobicContact CE2-CD1 3.85Å; Y74-Y77 HydrophobicContact CE2-CE1 4.18Å; Y74-Y77 WeakPolarHBondContact O-CB 3.3Å; Y74-Y77 PolarHBondContact O-N 3.39Å; C75-Y77 PolarHBondContact O-N 2.95Å; Y77-I80 PolarHBondContact O-N 3.28Å; Y77-F81 VanDerWaalsContact O-CB 3.31Å; Y77-F81 WeakPolarHBondContact O-CB 3.34Å; Y77-F81 PolarHBondContact O-N 3.12Å; Y77-F121 HydrophobicContact CD1-CE2 4.2Å; Y77-F121 HydrophobicContact CE1-CE2 4.06Å; Y77-Q152 PolarHBondContact OH-NE2 3.2Å
78M95Very high91.2Very high1 Ų162.1 Ų62.11%0.00530%0.295CS..Hα-helixtrans-67.6-37.9179.4-73-55.5-5400113.1Y74 C75 L76 F81 T82 L178 W182Y74-M78 HydrophobicContact CD1-CG 4.18Å; Y74-M78 HydrophobicContact CE1-CG 3.72Å; Y74-M78 HydrophobicContact CE1-SD 4.39Å; Y74-M78 HydrophobicContact CE2-CG 4.35Å; Y74-M78 HydrophobicContact CE2-SD 4.45Å; Y74-M78 WeakPolarHBondContact O-CG 3.13Å; Y74-M78 PolarHBondContact O-N 3.3Å; C75-M78 PolarHBondContact O-N 3.47Å; L76-M78 VanDerWaalsContact C-N 3.33Å; L76-M78 PolarHBondContact O-N 2.84Å; M78-F81 HydrophobicContact CE-CD1 4.43Å; M78-F81 PolarHBondContact O-N 3.34Å; M78-T82 WeakPolarHBondContact O-CB 3.41Å; M78-T82 PolarHBondContact O-N 2.88Å; M78-T82 PolarHBondContact O-OG1 3.05Å; M78-L178 HydrophobicContact CE-CD1 3.99Å; M78-W182 HydrophobicContact CB-CH2 4.49Å; M78-W182 HydrophobicContact CB-CZ2 4.28Å; M78-W182 HydrophobicContact CE-CB 4.42Å; M78-W182 VanDerWaalsContact CE-CD1 3.48Å; M78-W182 HydrophobicContact CE-CD2 4.07Å; M78-W182 HydrophobicContact CE-CG 3.76Å; M78-W182 VanDerWaalsContact CE-N 3.34Å
79I94.8Very high90.8Very high86 Ų8660.6 Ų60.644%0.44129%0.294SS..Hα-helixtrans-64-46.1175-69.1164.8000110.1C75 L76 F81 T82 T83C75-I79 VanDerWaalsContact O-CG1 3.28Å; C75-I79 WeakPolarHBondContact O-CG1 3.49Å; C75-I79 PolarHBondContact O-N 3.22Å; L76-I79 PolarHBondContact O-N 3.2Å; I79-F81 VanDerWaalsContact C-N 3.34Å; I79-F81 PolarHBondContact O-N 3.27Å; I79-T82 PolarHBondContact O-N 3.36Å; I79-T83 WeakPolarHBondContact O-CB 3.31Å; I79-T83 PolarHBondContact O-N 2.96Å; I79-T83 PolarHBondContact O-OG1 3.39Å
80I93.9Very high89.9Confident54 Ų5460.6 Ų60.628%0.27730%0.304SS..Hα-helixtrans-64.3-42.2178.6-65.8167.1000110.4L76 Y77 T82 T83 A84 L113L76-I80 WeakPolarHBondContact O-CB 3.4Å; L76-I80 VanDerWaalsContact O-CG1 3.25Å; L76-I80 WeakPolarHBondContact O-CG1 3.33Å; L76-I80 PolarHBondContact O-N 3.43Å; Y77-I80 PolarHBondContact O-N 3.28Å; I80-T82 PolarHBondContact O-N 3.47Å; I80-T83 PolarHBondContact O-N 3.42Å; I80-A84 WeakPolarHBondContact O-CB 3.46Å; I80-A84 PolarHBondContact O-N 3.15Å; I80-L113 HydrophobicContact CB-CD2 4.47Å; I80-L113 HydrophobicContact CD1-CD2 3.32Å; I80-L113 HydrophobicContact CG1-CD2 4.41Å; I80-L113 HydrophobicContact CG2-CB 4.47Å; I80-L113 HydrophobicContact CG2-CD2 4Å
81F94.4Very high88.8Confident4 Ų465.6 Ų65.62%0.01833%0.325CS..Hα-helixtrans-65-40177.3-176.4-143.1000112.5Y77 M78 I79 A84 A85 S114 M156 M174 S177 L178Y77-F81 VanDerWaalsContact O-CB 3.31Å; Y77-F81 WeakPolarHBondContact O-CB 3.34Å; Y77-F81 PolarHBondContact O-N 3.12Å; M78-F81 HydrophobicContact CE-CD1 4.43Å; M78-F81 PolarHBondContact O-N 3.34Å; I79-F81 VanDerWaalsContact C-N 3.34Å; I79-F81 PolarHBondContact O-N 3.27Å; F81-A84 PolarHBondContact O-N 2.87Å; F81-A85 WeakPolarHBondContact O-CB 3.42Å; F81-A85 PolarHBondContact O-N 2.89Å; F81-S114 WeakPolarHBondContact CA-OG 3.28Å; F81-M156 HydrophobicContact CD2-CE 3.97Å; F81-M156 HydrophobicContact CD2-SD 4.49Å; F81-M156 HydrophobicContact CE1-SD 4.43Å; F81-M156 HydrophobicContact CE2-CE 3.55Å; F81-M156 HydrophobicContact CE2-SD 3.6Å; F81-M156 HydrophobicContact CZ-CE 4.13Å; F81-M156 HydrophobicContact CZ-SD 3.58Å; F81-M156 VanDerWaalsContact CZ-SD 3.58Å; F81-M174 HydrophobicContact CE2-CG 3.97Å; F81-M174 HydrophobicContact CZ-CG 3.95Å; F81-S177 WeakPolarHBondContact CZ-OG 3.42Å; F81-L178 HydrophobicContact CD1-CB 4.43Å; F81-L178 HydrophobicContact CD1-CD1 3.54Å; F81-L178 HydrophobicContact CE1-CB 3.79Å; F81-L178 HydrophobicContact CE1-CD1 3.79Å; F81-L178 HydrophobicContact CE1-CG 4.42Å; F81-L178 HydrophobicContact CG-CD1 4.15Å; F81-L178 HydrophobicContact CZ-CB 4.22Å
82T94.5Very high87.5Confident44 Ų4465.2 Ų65.227%0.2734%0.337SS..Hα-helixtrans-64.2-42.4174.3-54.40000111.1M78 I79 I80 A85 Y86 W182M78-T82 WeakPolarHBondContact O-CB 3.41Å; M78-T82 PolarHBondContact O-N 2.88Å; M78-T82 PolarHBondContact O-OG1 3.05Å; I79-T82 PolarHBondContact O-N 3.36Å; I80-T82 PolarHBondContact O-N 3.47Å; T82-A85 PolarHBondContact O-N 3.17Å; T82-Y86 WeakPolarHBondContact O-CB 3.38Å; T82-Y86 PolarHBondContact O-N 2.69Å; T82-W182 WeakPolarHBondContact OG1-CZ2 3.4Å; T82-W182 PolarHBondContact OG1-NE1 2.99Å
83T91.5Very high86.5Confident62 Ų6265 Ų6538%0.3834%0.341SS..Hα-helixtrans-63.5-43.8178-56.50000111I79 I80 Y86 Y87I79-T83 WeakPolarHBondContact O-CB 3.31Å; I79-T83 PolarHBondContact O-N 2.96Å; I79-T83 PolarHBondContact O-OG1 3.39Å; I80-T83 PolarHBondContact O-N 3.42Å; T83-Y86 PolarHBondContact O-N 3.32Å; T83-Y87 HydrophobicContact CG2-CD2 3.53Å; T83-Y87 HydrophobicContact CG2-CE2 3.59Å; T83-Y87 WeakPolarHBondContact O-CD2 3.48Å; T83-Y87 PolarHBondContact O-N 2.92Å
84A89.4Confident85.6Confident11 Ų1161.8 Ų61.89%0.09132%0.321CS..Hα-helixtrans-63.5-39.3175.100000112.3I80 F81 E111I80-A84 WeakPolarHBondContact O-CB 3.46Å; I80-A84 PolarHBondContact O-N 3.15Å; F81-A84 PolarHBondContact O-N 2.87Å; A84-E111 HydrophobicContact CB-CG 4.3Å
85A90Very high84.8Confident22 Ų2264.8 Ų64.818%0.18234%0.342CS..Hα-helixtrans-69.2-35.9175.900000112.8F81 T82 R88 M174 L178F81-A85 WeakPolarHBondContact O-CB 3.42Å; F81-A85 PolarHBondContact O-N 2.89Å; T82-A85 PolarHBondContact O-N 3.17Å; A85-R88 WeakPolarHBondContact O-CB 3.45Å; A85-M174 HydrophobicContact CB-CE 3.95Å; A85-M174 HydrophobicContact CB-SD 4.48Å; A85-L178 HydrophobicContact CB-CD2 4.06Å
86Y89.9Confident83.8Confident180 Ų18065.6 Ų65.671%0.70634%0.342SS*.Hα-helixtrans-74.5-46.7-178.4-178.9-100.6000112.9T82 T83 R88T82-Y86 WeakPolarHBondContact O-CB 3.38Å; T82-Y86 PolarHBondContact O-N 2.69Å; T83-Y86 PolarHBondContact O-N 3.32Å; Y86-R88 PolarHBondContact O-N 3.46Å; Y86-R88 VanDerWaalsContact O-N 3.11Å
87Y85.8Confident82.7Confident157 Ų15771.2 Ų71.262%0.61636%0.363SS*.THydrogen-bonded Turntrans-79.615.4179.3-70.1-63.2000114T83 R107T83-Y87 HydrophobicContact CG2-CD2 3.53Å; T83-Y87 HydrophobicContact CG2-CE2 3.59Å; T83-Y87 WeakPolarHBondContact O-CD2 3.48Å; T83-Y87 PolarHBondContact O-N 2.92Å; Y87-R107 WeakPolarHBondContact O-CD 3.4Å
88R81.1Confident81.6Confident51 Ų5173.9 Ų73.919%0.19238%0.379CS..  trans-68.3130177.2178.7176.6170-103.9-11.7110.3A85 Y86 V90 Y96 Y170A85-R88 WeakPolarHBondContact O-CB 3.45Å; Y86-R88 PolarHBondContact O-N 3.46Å; Y86-R88 VanDerWaalsContact O-N 3.11Å; R88-V90 PolarHBondContact O-N 3.48Å; R88-Y96 PolarHBondContact NH2-OH 2.72Å; R88-Y170 VanDerWaalsContact CZ-OH 3.29Å; R88-Y170 VanDerWaalsContact NE-CZ 3.32Å; R88-Y170 PolarHBondContact NE-OH 3.3Å; R88-Y170 VanDerWaalsContact NH2-CE1 3.27Å; R88-Y170 PolarHBondContact NH2-OH 2.74Å
89P79.1Confident80.4Confident37 Ų3779 Ų7924%0.2441%0.406CS..  trans-66.1129.1173.326.7-32.6000110.5Y96P89-Y96 HydrophobicContact CB-CD1 4.38Å; P89-Y96 HydrophobicContact CB-CE1 4.36Å; P89-Y96 HydrophobicContact CG-CD1 3.74Å; P89-Y96 HydrophobicContact CG-CD2 3.72Å; P89-Y96 HydrophobicContact CG-CE1 3.88Å; P89-Y96 HydrophobicContact CG-CE2 3.86Å; P89-Y96 HydrophobicContact CG-CG 3.66Å; P89-Y96 PolarHBondContact O-OH 3.46Å; P89-Y96 VanDerWaalsContact O-OH 3.13Å
90V70.7Confident79.6Confident132 Ų13281 Ų8180%0.842%0.418SS*.SBendtrans-79.4-26.6-178.7-178.30000111.3R88R88-V90 PolarHBondContact O-N 3.48Å
91E63.9Low79.2Confident177 Ų17782.3 Ų82.383%0.82743%0.428SS*.SBendtrans-98.7127.3-175.4-61-171.7176.300112.1Y96E91-Y96 WeakPolarHBondContact O-CE1 3.49Å
92G64.1Low78.7Confident48 Ų4887 Ų8750%0.49546%0.457SS..SBendtrans120.5166.7175.200000115.1
93L69.6Low78.1Confident114 Ų11487.1 Ų87.160%0.59747%0.467SS*.PPolyproline II helixtrans-88.8135.8168-83140.2000109
94P75.4Confident77.6Confident1 Ų185.3 Ų85.31%0.00646%0.455CS..SBendtrans-65.1149.5170.328.7-33.1000109.7Y163 H166 Y170P94-Y163 HydrophobicContact CB-CD2 3.46Å; P94-Y163 VanDerWaalsContact CB-CD2 3.46Å; P94-Y163 HydrophobicContact CB-CE2 3.39Å; P94-Y163 HydrophobicContact CB-CG 4.29Å; P94-Y163 HydrophobicContact CG-CD2 4.43Å; P94-H166 PolarHBondContact O-ND1 2.65Å; P94-Y170 HydrophobicContact CB-CE1 4.16Å; P94-Y170 HydrophobicContact CG-CD1 4.31Å; P94-Y170 HydrophobicContact CG-CE1 3.83Å
95P74.3Confident77.5Confident69 Ų6990.4 Ų90.445%0.44847%0.473SS..SBendcis-77.5141.8-6.831.9-32.3000112Y163 H166P95-Y163 WeakPolarHBondContact CA-OH 3.47Å; P95-Y163 HydrophobicContact CB-CE1 3.92Å; P95-H166 WeakPolarHBondContact CD-CE1 3.41Å; P95-H166 WeakPolarHBondContact CD-ND1 3.14Å
96Y74.6Confident77.4Confident36 Ų3696.6 Ų96.614%0.14150%0.496CS..PPolyproline II helixtrans-74137.4-179.5-56.7-78.7000110.9R88 P89 E91 L98 Y163 Y170R88-Y96 PolarHBondContact NH2-OH 2.72Å; P89-Y96 HydrophobicContact CB-CD1 4.38Å; P89-Y96 HydrophobicContact CB-CE1 4.36Å; P89-Y96 HydrophobicContact CG-CD1 3.74Å; P89-Y96 HydrophobicContact CG-CD2 3.72Å; P89-Y96 HydrophobicContact CG-CE1 3.88Å; P89-Y96 HydrophobicContact CG-CE2 3.86Å; P89-Y96 HydrophobicContact CG-CG 3.66Å; P89-Y96 PolarHBondContact O-OH 3.46Å; P89-Y96 VanDerWaalsContact O-OH 3.13Å; E91-Y96 WeakPolarHBondContact O-CE1 3.49Å; Y96-L98 PolarHBondContact O-N 3.3Å; Y96-Y163 HydrophobicContact CD2-CE2 4.27Å; Y96-Y163 HydrophobicContact CE2-CE2 4.23Å; Y96-Y163 PolarHBondContact N-OH 2.95Å; Y96-Y170 VanDerWaalsContact CE2-OH 3.29Å; Y96-Y170 WeakPolarHBondContact CE2-OH 3.36Å; Y96-Y170 PolarHBondContact OH-OH 2.78Å
97K70.8Confident77.2Confident190 Ų19089.7 Ų89.783%0.82647%0.468SS*.PPolyproline II helixtrans-63.7131.1174-68.6-177178.8179.70109.2N99K97-N99 PolarHBondContact O-N 3Å
98L71.5Confident77.3Confident76 Ų7684.3 Ų84.340%0.39845%0.452SS..  trans-76107.2176.1-161.877000108.6Y96 D104 Y105 V108Y96-L98 PolarHBondContact O-N 3.3Å; L98-D104 HydrophobicContact CD1-CB 3.95Å; L98-Y105 HydrophobicContact CD2-CE1 4.14Å; L98-V108 HydrophobicContact CD1-CG2 3.62Å
99N69.6Low77.7Confident108 Ų10886.1 Ų86.158%0.57847%0.469SS*.  trans-78.1133.3162.1-64.9-19.7000105.6K97 T101 D104K97-N99 PolarHBondContact O-N 3Å; N99-T101 PolarHBondContact O-N 3.06Å; N99-D104 WeakPolarHBondContact O-CB 2.94Å
100N76.5Confident78.3Confident129 Ų12985 Ų8569%0.6946%0.463SS*.  trans-7245.3-173.2-66.2-36.4000113Y105N100-Y105 PolarHBondContact OD1-OH 3.48Å
101T85.6Confident79.2Confident80 Ų8081.2 Ų81.249%0.49144%0.437SS..  trans-89.9142.3178.4-39.60000109.3N99 G103 D104 Y105N99-T101 PolarHBondContact O-N 3.06Å; T101-G103 PolarHBondContact O-N 3.39Å; T101-G103 VanDerWaalsContact O-N 3.13Å; T101-D104 PolarHBondContact O-N 2.95Å; T101-D104 PolarHBondContact OG1-OD2 3.06Å; T101-Y105 VanDerWaalsContact O-CD2 3.31Å; T101-Y105 WeakPolarHBondContact O-CD2 3.2Å; T101-Y105 PolarHBondContact O-N 3.41Å
102V84.1Confident80.5Confident104 Ų10478 Ų7863%0.6343%0.425SS*.Hα-helixtrans-52.6-38.1177.6179.80000112D104 Y105 F106V102-D104 PolarHBondContact O-N 2.97Å; V102-Y105 PolarHBondContact O-N 3.45Å; V102-F106 HydrophobicContact CG1-CD2 3.87Å; V102-F106 HydrophobicContact CG1-CE2 3.59Å; V102-F106 VanDerWaalsContact O-CD2 3.23Å; V102-F106 WeakPolarHBondContact O-CD2 3.25Å; V102-F106 PolarHBondContact O-N 2.9Å
103G82Confident82Confident46 Ų4679.7 Ų79.747%0.47442%0.422SS..Hα-helixtrans-65-34.8176.800000114.6T101 F106 R107T101-G103 PolarHBondContact O-N 3.39Å; T101-G103 VanDerWaalsContact O-N 3.13Å; G103-F106 PolarHBondContact O-N 3.1Å; G103-R107 PolarHBondContact O-N 3.36Å
104D82.6Confident83.1Confident23 Ų2374.4 Ų74.412%0.12339%0.394CS..Hα-helixtrans-70-36.3178-73.7-50.8000111.2L98 N99 T101 V102 R107 V108L98-D104 HydrophobicContact CD1-CB 3.95Å; N99-D104 WeakPolarHBondContact O-CB 2.94Å; T101-D104 PolarHBondContact O-N 2.95Å; T101-D104 PolarHBondContact OG1-OD2 3.06Å; V102-D104 PolarHBondContact O-N 2.97Å; D104-R107 PolarHBondContact O-N 3.01Å; D104-R107 IonicContact OD1-CZ 3.91Å; D104-R107 IonicContact OD1-NH1 2.91Å; D104-R107 PolarHBondContact OD1-NH1 2.83Å; D104-R107 IonicContact OD1-NH2 3.93Å; D104-R107 PolarHBondContact OD1-NH2 3.41Å; D104-V108 WeakPolarHBondContact O-CG2 3.36Å; D104-V108 PolarHBondContact O-N 3.5Å
105Y87.3Confident84Confident119 Ų11976.6 Ų76.647%0.46741%0.407SS..Hα-helixtrans-63.9-43.7172.9-72.1-72.3000112.4L98 N100 T101 V102 V108 T109L98-Y105 HydrophobicContact CD2-CE1 4.14Å; N100-Y105 PolarHBondContact OD1-OH 3.48Å; T101-Y105 VanDerWaalsContact O-CD2 3.31Å; T101-Y105 WeakPolarHBondContact O-CD2 3.2Å; T101-Y105 PolarHBondContact O-N 3.41Å; V102-Y105 PolarHBondContact O-N 3.45Å; Y105-V108 PolarHBondContact O-N 3.28Å; Y105-T109 WeakPolarHBondContact O-CB 3.32Å; Y105-T109 PolarHBondContact O-N 2.88Å; Y105-T109 PolarHBondContact O-OG1 3.46Å
106F86.8Confident85Confident152 Ų15276.2 Ų76.267%0.66741%0.406SS*.Hα-helixtrans-62.9-41.3175.8-81.7-68.1000112V102 G103 T109 G110V102-F106 HydrophobicContact CG1-CD2 3.87Å; V102-F106 HydrophobicContact CG1-CE2 3.59Å; V102-F106 VanDerWaalsContact O-CD2 3.23Å; V102-F106 WeakPolarHBondContact O-CD2 3.25Å; V102-F106 PolarHBondContact O-N 2.9Å; G103-F106 PolarHBondContact O-N 3.1Å; F106-T109 PolarHBondContact O-N 3.05Å; F106-G110 PolarHBondContact O-N 3.15Å
107R86.1Confident85.8Confident35 Ų3575 Ų7513%0.13241%0.405CS..Hα-helixtrans-60.2-53.2175.6-175.4-176.470.7-130.2-10.6111.5Y87 G103 D104 T109 G110 E111Y87-R107 WeakPolarHBondContact O-CD 3.4Å; G103-R107 PolarHBondContact O-N 3.36Å; D104-R107 PolarHBondContact O-N 3.01Å; D104-R107 IonicContact OD1-CZ 3.91Å; D104-R107 IonicContact OD1-NH1 2.91Å; D104-R107 PolarHBondContact OD1-NH1 2.83Å; D104-R107 IonicContact OD1-NH2 3.93Å; D104-R107 PolarHBondContact OD1-NH2 3.41Å; R107-T109 VanDerWaalsContact C-N 3.26Å; R107-T109 PolarHBondContact O-N 2.72Å; R107-G110 WeakPolarHBondContact O-CA 3.43Å; R107-G110 PolarHBondContact O-N 2.72Å; R107-E111 IonicContact NE-OE1 2.77Å; R107-E111 PolarHBondContact O-N 2.96Å
108V87.4Confident86.9Confident44 Ų4466 Ų6627%0.26737%0.366SS..Hα-helixtrans-61.3-38.3-179.5171.30000111.2L98 D104 Y105 G110 E111 I112L98-V108 HydrophobicContact CD1-CG2 3.62Å; D104-V108 WeakPolarHBondContact O-CG2 3.36Å; D104-V108 PolarHBondContact O-N 3.5Å; Y105-V108 PolarHBondContact O-N 3.28Å; V108-G110 VanDerWaalsContact C-N 3.34Å; V108-G110 PolarHBondContact O-N 3.37Å; V108-E111 PolarHBondContact O-N 2.63Å; V108-I112 HydrophobicContact CG1-CD1 3.75Å; V108-I112 HydrophobicContact CG1-CG1 4.3Å; V108-I112 VanDerWaalsContact O-CG1 3.27Å; V108-I112 WeakPolarHBondContact O-CG1 3.43Å; V108-I112 PolarHBondContact O-N 3.38Å
109T90.4Very high88Confident89 Ų8964.8 Ų64.855%0.54636%0.361SS..Hα-helixtrans-61.2-43.7174.5-56.20000111.2Y105 F106 R107 I112 L113Y105-T109 WeakPolarHBondContact O-CB 3.32Å; Y105-T109 PolarHBondContact O-N 2.88Å; Y105-T109 PolarHBondContact O-OG1 3.46Å; F106-T109 PolarHBondContact O-N 3.05Å; R107-T109 VanDerWaalsContact C-N 3.26Å; R107-T109 PolarHBondContact O-N 2.72Å; T109-I112 PolarHBondContact O-N 2.98Å; T109-L113 WeakPolarHBondContact O-CB 3.31Å; T109-L113 PolarHBondContact O-N 2.96Å
110G90.5Very high89.1Confident12 Ų1266.3 Ų66.312%0.12436%0.36CS..Hα-helixtrans-64.2-38.6175.300000113.4F106 R107 V108 L113 S114F106-G110 PolarHBondContact O-N 3.15Å; R107-G110 WeakPolarHBondContact O-CA 3.43Å; R107-G110 PolarHBondContact O-N 2.72Å; V108-G110 VanDerWaalsContact C-N 3.34Å; V108-G110 PolarHBondContact O-N 3.37Å; G110-L113 PolarHBondContact O-N 3.42Å; G110-S114 VanDerWaalsContact O-CB 3.31Å; G110-S114 WeakPolarHBondContact O-CB 3.33Å; G110-S114 PolarHBondContact O-N 3.41Å; G110-S114 PolarHBondContact O-OG 3.43Å
111E90.1Very high89.9Confident53 Ų5361.1 Ų61.125%0.24833%0.331CS..Hα-helixtrans-64.4-48.8174.5-71.9175.1-176.300111.3A84 R107 V108 L113 S114 V115A84-E111 HydrophobicContact CB-CG 4.3Å; R107-E111 IonicContact NE-OE1 2.77Å; R107-E111 PolarHBondContact O-N 2.96Å; V108-E111 PolarHBondContact O-N 2.63Å; E111-L113 VanDerWaalsContact C-N 3.31Å; E111-L113 PolarHBondContact O-N 2.99Å; E111-S114 PolarHBondContact O-N 3.1Å; E111-S114 VanDerWaalsContact O-N 3.17Å; E111-V115 WeakPolarHBondContact O-CG2 3.47Å; E111-V115 PolarHBondContact O-N 3.4Å
112I92.1Very high90.2Very high111 Ų11159.7 Ų59.757%0.56932%0.318SS*.Hα-helixtrans-59.1-44.8177.1-68167000110.3V108 T109 S114 V115 S116V108-I112 HydrophobicContact CG1-CD1 3.75Å; V108-I112 HydrophobicContact CG1-CG1 4.3Å; V108-I112 VanDerWaalsContact O-CG1 3.27Å; V108-I112 WeakPolarHBondContact O-CG1 3.43Å; V108-I112 PolarHBondContact O-N 3.38Å; T109-I112 PolarHBondContact O-N 2.98Å; I112-S114 VanDerWaalsContact C-N 3.33Å; I112-S114 PolarHBondContact O-N 2.83Å; I112-V115 PolarHBondContact O-N 3.23Å; I112-S116 WeakPolarHBondContact O-CB 3.05Å; I112-S116 PolarHBondContact O-N 3.44Å; I112-S116 PolarHBondContact O-OG 3.27Å
113L93.9Very high90.5Very high83 Ų8361 Ų6144%0.43532%0.316SS..Hα-helixtrans-64-41.5178.5-166.173.3000111.2I80 T109 G110 E111 V115 S116 G117I80-L113 HydrophobicContact CB-CD2 4.47Å; I80-L113 HydrophobicContact CD1-CD2 3.32Å; I80-L113 HydrophobicContact CG1-CD2 4.41Å; I80-L113 HydrophobicContact CG2-CB 4.47Å; I80-L113 HydrophobicContact CG2-CD2 4Å; T109-L113 WeakPolarHBondContact O-CB 3.31Å; T109-L113 PolarHBondContact O-N 2.96Å; G110-L113 PolarHBondContact O-N 3.42Å; E111-L113 VanDerWaalsContact C-N 3.31Å; E111-L113 PolarHBondContact O-N 2.99Å; L113-V115 PolarHBondContact O-N 3.39Å; L113-S116 WeakPolarHBondContact CA-OG 3.33Å; L113-S116 PolarHBondContact O-N 2.93Å; L113-S116 PolarHBondContact O-OG 3.5Å; L113-G117 PolarHBondContact O-N 2.84Å
114S93.8Very high90.7Very high2 Ų262.5 Ų62.51%0.01431%0.307CS..Hα-helixtrans-64.1-41178.5-58.80000112.1F81 G110 E111 I112 G117 G118F81-S114 WeakPolarHBondContact CA-OG 3.28Å; G110-S114 VanDerWaalsContact O-CB 3.31Å; G110-S114 WeakPolarHBondContact O-CB 3.33Å; G110-S114 PolarHBondContact O-N 3.41Å; G110-S114 PolarHBondContact O-OG 3.43Å; E111-S114 PolarHBondContact O-N 3.1Å; E111-S114 VanDerWaalsContact O-N 3.17Å; I112-S114 VanDerWaalsContact C-N 3.33Å; I112-S114 PolarHBondContact O-N 2.83Å; S114-G117 PolarHBondContact O-N 3.31Å; S114-G118 PolarHBondContact O-N 2.89Å
115V94.4Very high90.8Very high47 Ų4761.7 Ų61.729%0.28530%0.304SS..Hα-helixtrans-66.9-44174.81740000110.8E111 I112 L113 G117 G118 V119 M156 V160E111-V115 WeakPolarHBondContact O-CG2 3.47Å; E111-V115 PolarHBondContact O-N 3.4Å; I112-V115 PolarHBondContact O-N 3.23Å; L113-V115 PolarHBondContact O-N 3.39Å; V115-G117 VanDerWaalsContact C-N 3.29Å; V115-G117 PolarHBondContact O-N 3.21Å; V115-G118 PolarHBondContact O-N 2.9Å; V115-G118 VanDerWaalsContact O-N 3.1Å; V115-V119 HydrophobicContact CG1-CG2 4.35Å; V115-V119 WeakPolarHBondContact O-CG2 3.38Å; V115-V119 PolarHBondContact O-N 2.95Å; V115-M156 HydrophobicContact CG2-CE 4.22Å; V115-V160 HydrophobicContact CB-CG2 4.48Å; V115-V160 HydrophobicContact CG1-CG2 4.13Å; V115-V160 HydrophobicContact CG2-CG2 3.55Å
116S94.4Very high90.8Very high61 Ų6158.7 Ų58.743%0.42730%0.296SS..Hα-helixtrans-60.5-39.8177.875.50000112.1I112 L113 V119 Y120I112-S116 WeakPolarHBondContact O-CB 3.05Å; I112-S116 PolarHBondContact O-N 3.44Å; I112-S116 PolarHBondContact O-OG 3.27Å; L113-S116 WeakPolarHBondContact CA-OG 3.33Å; L113-S116 PolarHBondContact O-N 2.93Å; L113-S116 PolarHBondContact O-OG 3.5Å; S116-V119 PolarHBondContact O-N 3.21Å; S116-Y120 WeakPolarHBondContact O-CB 3.33Å; S116-Y120 PolarHBondContact O-N 3.35Å
117G92.7Very high90.6Very high11 Ų1156.9 Ų56.911%0.11329%0.289CS..Hα-helixtrans-64.4-42.6172.500000112.6L113 S114 V115 V119 Y120 F121L113-G117 PolarHBondContact O-N 2.84Å; S114-G117 PolarHBondContact O-N 3.31Å; V115-G117 VanDerWaalsContact C-N 3.29Å; V115-G117 PolarHBondContact O-N 3.21Å; G117-V119 PolarHBondContact O-N 3.49Å; G117-Y120 WeakPolarHBondContact O-CB 3.34Å; G117-Y120 PolarHBondContact O-N 3.04Å; G117-F121 WeakPolarHBondContact O-CD2 3.4Å; G117-F121 PolarHBondContact O-N 3.45Å
118G93.5Very high90.2Very high0 Ų056.8 Ų56.80%029%0.289CS..Hα-helixtrans-59.7-44.7175.300000112.8S114 V115 F121 F122S114-G118 PolarHBondContact O-N 2.89Å; V115-G118 PolarHBondContact O-N 2.9Å; V115-G118 VanDerWaalsContact O-N 3.1Å; G118-F121 PolarHBondContact O-N 3.48Å; G118-F122 WeakPolarHBondContact O-CB 3.42Å; G118-F122 PolarHBondContact O-N 2.77Å
119V95.1Very high89.7Confident51 Ų5157.3 Ų57.331%0.30929%0.288SS..Hα-helixtrans-63.2-43.2175.7172.80000111.2V115 S116 G117 F122 F123 L157V115-V119 HydrophobicContact CG1-CG2 4.35Å; V115-V119 WeakPolarHBondContact O-CG2 3.38Å; V115-V119 PolarHBondContact O-N 2.95Å; S116-V119 PolarHBondContact O-N 3.21Å; G117-V119 PolarHBondContact O-N 3.49Å; V119-F122 WeakPolarHBondContact O-CB 3.46Å; V119-F122 PolarHBondContact O-N 3.4Å; V119-F123 HydrophobicContact CG1-CD2 3.57Å; V119-F123 HydrophobicContact CG1-CE2 3.34Å; V119-F123 WeakPolarHBondContact O-CD2 3.39Å; V119-F123 PolarHBondContact O-N 3.29Å; V119-L157 HydrophobicContact CG2-CD2 3.9Å
120Y92.6Very high89Confident140 Ų14059.2 Ų59.255%0.54929%0.294SS..Hα-helixtrans-59-48.5175.5170.2-101000112.2S116 G117 F122 F123 R124S116-Y120 WeakPolarHBondContact O-CB 3.33Å; S116-Y120 PolarHBondContact O-N 3.35Å; G117-Y120 WeakPolarHBondContact O-CB 3.34Å; G117-Y120 PolarHBondContact O-N 3.04Å; Y120-F122 VanDerWaalsContact C-N 3.29Å; Y120-F122 PolarHBondContact O-N 2.86Å; Y120-F123 PolarHBondContact O-N 2.99Å; Y120-R124 WeakPolarHBondContact O-CB 3.41Å; Y120-R124 PolarHBondContact O-N 3.47Å
121F92.1Very high88Confident20 Ų2065.5 Ų65.59%0.08832%0.32CS..Hα-helixtrans-64.6-34.5177.5-74.5-59.1000112.5Y74 Y77 G117 G118 G125Y74-F121 HydrophobicContact CD2-CE2 4.14Å; Y74-F121 AromaticContact CD2-CZ 3.7Å; Y74-F121 HydrophobicContact CD2-CZ 3.7Å; Y74-F121 HydrophobicContact CE2-CE2 4.01Å; Y74-F121 AromaticContact CE2-CZ 3.88Å; Y74-F121 HydrophobicContact CE2-CZ 3.88Å; Y77-F121 HydrophobicContact CD1-CE2 4.2Å; Y77-F121 HydrophobicContact CE1-CE2 4.06Å; G117-F121 WeakPolarHBondContact O-CD2 3.4Å; G117-F121 PolarHBondContact O-N 3.45Å; G118-F121 PolarHBondContact O-N 3.48Å; F121-G125 PolarHBondContact O-N 3.18Å
122F93.3Very high86.8Confident50 Ų5067 Ų6722%0.21932%0.324CS..Hα-helixtrans-64.6-49.6175.9-175.7-108.3000112G118 V119 Y120 R124 G125 I126 F150 S153 L154 L157G118-F122 WeakPolarHBondContact O-CB 3.42Å; G118-F122 PolarHBondContact O-N 2.77Å; V119-F122 WeakPolarHBondContact O-CB 3.46Å; V119-F122 PolarHBondContact O-N 3.4Å; Y120-F122 VanDerWaalsContact C-N 3.29Å; Y120-F122 PolarHBondContact O-N 2.86Å; F122-R124 PolarHBondContact O-N 3.49Å; F122-G125 PolarHBondContact O-N 3.47Å; F122-I126 HydrophobicContact CD1-CD1 3.65Å; F122-I126 HydrophobicContact CE1-CD1 3.24Å; F122-I126 HydrophobicContact CE1-CG1 4.36Å; F122-I126 HydrophobicContact CE2-CD1 4.28Å; F122-I126 HydrophobicContact CG-CD1 4.34Å; F122-I126 HydrophobicContact CZ-CD1 3.6Å; F122-I126 HydrophobicContact CZ-CG1 4.41Å; F122-I126 WeakPolarHBondContact O-CG1 3.06Å; F122-I126 PolarHBondContact O-N 3.41Å; F122-F150 HydrophobicContact CD2-CD2 4.26Å; F122-F150 AromaticContact CD2-CE2 3.65Å; F122-F150 HydrophobicContact CD2-CE2 3.65Å; F122-F150 HydrophobicContact CD2-CZ 4.37Å; F122-F150 AromaticContact CE2-CE2 3.66Å; F122-F150 HydrophobicContact CE2-CE2 3.66Å; F122-F150 AromaticContact CE2-CZ 3.97Å; F122-F150 HydrophobicContact CE2-CZ 3.97Å; F122-S153 WeakPolarHBondContact CA-OG 3.46Å; F122-L154 HydrophobicContact CE2-CD1 4.48Å; F122-L157 HydrophobicContact CB-CD1 3.83Å; F122-L157 HydrophobicContact CD1-CD1 3.69Å; F122-L157 HydrophobicContact CD2-CD1 3.52Å; F122-L157 HydrophobicContact CE1-CD1 4.03Å; F122-L157 HydrophobicContact CE2-CD1 3.9Å; F122-L157 HydrophobicContact CG-CD1 3.4Å; F122-L157 VanDerWaalsContact CG-CD1 3.4Å; F122-L157 HydrophobicContact CZ-CD1 4.13Å
123F90Very high85.3Confident132 Ų13272.9 Ų72.958%0.57934%0.338SS*.Hα-helixtrans-64-41.5176.4-76.9-62.5000112.3V119 Y120 G125 I126 Q127V119-F123 HydrophobicContact CG1-CD2 3.57Å; V119-F123 HydrophobicContact CG1-CE2 3.34Å; V119-F123 WeakPolarHBondContact O-CD2 3.39Å; V119-F123 PolarHBondContact O-N 3.29Å; Y120-F123 PolarHBondContact O-N 2.99Å; F123-G125 VanDerWaalsContact C-N 3.3Å; F123-G125 PolarHBondContact O-N 3.45Å; F123-I126 PolarHBondContact O-N 2.82Å; F123-Q127 WeakPolarHBondContact O-CB 3.44Å; F123-Q127 PolarHBondContact O-N 2.97Å
124R85Confident83.4Confident78 Ų7871 Ų7129%0.29433%0.332SS..Hα-helixtrans-58.6-43.5173.4-179.9-178.5157.9-172.7-7.9111Y120 F122 Q127 Y128 E146Y120-R124 WeakPolarHBondContact O-CB 3.41Å; Y120-R124 PolarHBondContact O-N 3.47Å; F122-R124 PolarHBondContact O-N 3.49Å; R124-Q127 PolarHBondContact O-N 2.82Å; R124-Y128 WeakPolarHBondContact O-CB 3.42Å; R124-Y128 PolarHBondContact O-N 3.28Å; R124-E146 IonicContact NE-OE2 3.16Å; R124-E146 IonicContact NH2-OE1 3.15Å; R124-E146 PolarHBondContact NH2-OE1 3.22Å; R124-E146 IonicContact NH2-OE2 3.47Å; R124-E146 PolarHBondContact NH2-OE2 2.89Å
125G85.9Confident81.6Confident5 Ų574.6 Ų74.65%0.05236%0.356CS..Hα-helixtrans-63.2-45.7176.500000112.6F121 F122 F123 Q127 Y128 F129F121-G125 PolarHBondContact O-N 3.18Å; F122-G125 PolarHBondContact O-N 3.47Å; F123-G125 VanDerWaalsContact C-N 3.3Å; F123-G125 PolarHBondContact O-N 3.45Å; G125-Q127 PolarHBondContact O-N 2.71Å; G125-Y128 WeakPolarHBondContact O-CB 3.41Å; G125-Y128 PolarHBondContact O-N 2.95Å; G125-F129 WeakPolarHBondContact O-CD2 3.45Å; G125-F129 PolarHBondContact O-N 2.87Å
126I85.9Confident79.7Confident57 Ų5778.6 Ų78.629%0.29238%0.376SS..Hα-helixtrans-60.2-47.3175.5-70.1169.6000111F122 F123 Y128 F129 L130 F150F122-I126 HydrophobicContact CD1-CD1 3.65Å; F122-I126 HydrophobicContact CE1-CD1 3.24Å; F122-I126 HydrophobicContact CE1-CG1 4.36Å; F122-I126 HydrophobicContact CE2-CD1 4.28Å; F122-I126 HydrophobicContact CG-CD1 4.34Å; F122-I126 HydrophobicContact CZ-CD1 3.6Å; F122-I126 HydrophobicContact CZ-CG1 4.41Å; F122-I126 WeakPolarHBondContact O-CG1 3.06Å; F122-I126 PolarHBondContact O-N 3.41Å; F123-I126 PolarHBondContact O-N 2.82Å; I126-Y128 VanDerWaalsContact C-N 3.25Å; I126-Y128 PolarHBondContact O-N 3.43Å; I126-F129 PolarHBondContact O-N 3.5Å; I126-L130 HydrophobicContact CG2-CD1 3.66Å; I126-L130 HydrophobicContact CG2-CG 4.14Å; I126-L130 WeakPolarHBondContact O-CB 3.37Å; I126-L130 VanDerWaalsContact O-CG 3.32Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 2.87Å; I126-F150 HydrophobicContact CG1-CE2 4.17Å
127Q83.3Confident77.8Confident114 Ų11484.6 Ų84.653%0.53339%0.394SS..Hα-helixtrans-58.6-41177.4-177.6179.5-21.400111.2F123 R124 G125 L130 Q131F123-Q127 WeakPolarHBondContact O-CB 3.44Å; F123-Q127 PolarHBondContact O-N 2.97Å; R124-Q127 PolarHBondContact O-N 2.82Å; G125-Q127 PolarHBondContact O-N 2.71Å; Q127-L130 PolarHBondContact O-N 3.11Å; Q127-Q131 WeakPolarHBondContact O-CB 3.45Å; Q127-Q131 VanDerWaalsContact O-CG 3.31Å; Q127-Q131 WeakPolarHBondContact O-CG 3.29Å; Q127-Q131 PolarHBondContact O-N 3.01Å
128Y77.4Confident76.2Confident32 Ų3286.4 Ų86.413%0.12541%0.405CS..Hα-helixtrans-61-48.4175.6-178.7-97.4000112.3R124 G125 I126 R132 S143 E146R124-Y128 WeakPolarHBondContact O-CB 3.42Å; R124-Y128 PolarHBondContact O-N 3.28Å; G125-Y128 WeakPolarHBondContact O-CB 3.41Å; G125-Y128 PolarHBondContact O-N 2.95Å; I126-Y128 VanDerWaalsContact C-N 3.25Å; I126-Y128 PolarHBondContact O-N 3.43Å; Y128-R132 WeakPolarHBondContact O-CB 3.31Å; Y128-R132 PolarHBondContact O-N 2.86Å; Y128-R132 PolarHBondContact OH-NH1 3.33Å; Y128-S143 VanDerWaalsContact OH-CB 3.26Å; Y128-S143 WeakPolarHBondContact OH-CB 3.43Å; Y128-S143 PolarHBondContact OH-OG 3.28Å; Y128-E146 HydrophobicContact CD1-CB 4.13Å; Y128-E146 HydrophobicContact CD2-CG 4.49Å; Y128-E146 HydrophobicContact CE1-CB 3.88Å; Y128-E146 HydrophobicContact CE1-CG 4.24Å; Y128-E146 HydrophobicContact CE2-CG 4.12Å
129F77.6Confident74.5Confident55 Ų5587.2 Ų87.224%0.24141%0.409CS..Hα-helixtrans-64.2-41.4177.9-80-68.3000112.8G125 I126 R132 R133 P134 L139 I147 F150G125-F129 WeakPolarHBondContact O-CD2 3.45Å; G125-F129 PolarHBondContact O-N 2.87Å; I126-F129 PolarHBondContact O-N 3.5Å; F129-R132 PolarHBondContact O-N 3.49Å; F129-R133 PolarHBondContact O-N 3.33Å; F129-R133 VanDerWaalsContact O-N 3.14Å; F129-P134 HydrophobicContact CD1-CG 4.34Å; F129-L139 HydrophobicContact CE1-CD1 3.97Å; F129-L139 HydrophobicContact CE1-CD2 4.09Å; F129-I147 HydrophobicContact CZ-CG1 4.19Å; F129-F150 HydrophobicContact CD2-CG 4.49Å; F129-F150 HydrophobicContact CE2-CB 4.11Å; F129-F150 AromaticContact CE2-CD1 3.71Å; F129-F150 HydrophobicContact CE2-CD1 3.71Å; F129-F150 HydrophobicContact CE2-CD2 4.26Å; F129-F150 HydrophobicContact CE2-CE1 4.16Å; F129-F150 AromaticContact CE2-CG 3.75Å; F129-F150 HydrophobicContact CE2-CG 3.75Å; F129-F150 HydrophobicContact CZ-CD1 4.41Å
130L75.2Confident72.8Confident130 Ų13090.1 Ų90.168%0.68142%0.418SS*.Hα-helixtrans-65-42.4179.2-73.9173.4000112.2I126 Q127 R132I126-L130 HydrophobicContact CG2-CD1 3.66Å; I126-L130 HydrophobicContact CG2-CG 4.14Å; I126-L130 WeakPolarHBondContact O-CB 3.37Å; I126-L130 VanDerWaalsContact O-CG 3.32Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 2.87Å; Q127-L130 PolarHBondContact O-N 3.11Å; L130-R132 VanDerWaalsContact C-N 3.33Å; L130-R132 PolarHBondContact O-N 2.87Å
131Q69.2Low71.3Confident143 Ų14388.4 Ų88.467%0.66842%0.422SS*.Hα-helixtrans-69-31.1-179.8-74.3-177.15.400113Q127Q127-Q131 WeakPolarHBondContact O-CB 3.45Å; Q127-Q131 VanDerWaalsContact O-CG 3.31Å; Q127-Q131 WeakPolarHBondContact O-CG 3.29Å; Q127-Q131 PolarHBondContact O-N 3.01Å
132R65.8Low69.8Low86 Ų8690 Ų9033%0.32543%0.431SS..Hα-helixtrans-105.8-7.2-167.8-147.6167.8179.5160.72.2114.8Y128 F129 L130 P134 D340Y128-R132 WeakPolarHBondContact O-CB 3.31Å; Y128-R132 PolarHBondContact O-N 2.86Å; Y128-R132 PolarHBondContact OH-NH1 3.33Å; F129-R132 PolarHBondContact O-N 3.49Å; L130-R132 VanDerWaalsContact C-N 3.33Å; L130-R132 PolarHBondContact O-N 2.87Å; R132-P134 HydrophobicContact CB-CG 4.36Å; R132-P134 VanDerWaalsContact O-N 3.16Å; R132-D340 IonicContact NH1-OD2 3.57Å
133R59.7Low68.7Low233 Ų23387.9 Ų87.988%0.87942%0.422SS*.  trans25.870.6177.6-91.1-86.3-154.81715.1112F129F129-R133 PolarHBondContact O-N 3.33Å; F129-R133 VanDerWaalsContact O-N 3.14Å
134P55.4Low68.1Low45 Ų4585 Ų8529%0.29241%0.409SS..  trans-88.8155.5-159.1-10.629.2000113.4F129 R132 L139F129-P134 HydrophobicContact CD1-CG 4.34Å; R132-P134 HydrophobicContact CB-CG 4.36Å; R132-P134 VanDerWaalsContact O-N 3.16Å; P134-L139 HydrophobicContact CB-CD1 3.47Å; P134-L139 VanDerWaalsContact CB-CD1 3.47Å; P134-L139 HydrophobicContact CB-CD2 3.66Å; P134-L139 HydrophobicContact CB-CG 3.26Å; P134-L139 HydrophobicContact CG-CD1 3.73Å; P134-L139 HydrophobicContact CG-CD2 3.64Å; P134-L139 HydrophobicContact CG-CG 3.75Å
135S55.1Low67.8Low76 Ų7682 Ų8253%0.53140%0.399SS..  trans-84.6140.2159.666.50000109.7K137 S138 L139S135-K137 PolarHBondContact O-N 3.46Å; S135-K137 VanDerWaalsContact O-N 3.12Å; S135-S138 PolarHBondContact O-N 3.4Å; S135-S138 PolarHBondContact O-OG 3.23Å; S135-S138 PolarHBondContact OG-OG 2.92Å; S135-S138 VanDerWaalsContact OG-OG 3.14Å; S135-L139 PolarHBondContact O-N 2.9Å
136L53.6Low67.6Low132 Ų13282.8 Ų82.869%0.69140%0.401SS*.Hα-helixtrans-51.6-39-175.1-74.8172000113.4S138 L139 F140L136-S138 PolarHBondContact O-N 2.69Å; L136-L139 PolarHBondContact O-N 3.12Å; L136-F140 WeakPolarHBondContact O-CD2 3.3Å; L136-F140 PolarHBondContact O-N 2.87Å
137K56.2Low67.6Low186 Ų18681.3 Ų81.381%0.80939%0.394SS*.Hα-helixtrans-65.7-36.5179.4-67.6-172.8177.3-176.70113.3S135S135-K137 PolarHBondContact O-N 3.46Å; S135-K137 VanDerWaalsContact O-N 3.12Å
138S58.7Low67.8Low50 Ų5077.4 Ų77.435%0.3538%0.376SS..Hα-helixtrans-75.2-29.5178.666.90000112.7S135 L136 D142S135-S138 PolarHBondContact O-N 3.4Å; S135-S138 PolarHBondContact O-OG 3.23Å; S135-S138 PolarHBondContact OG-OG 2.92Å; S135-S138 VanDerWaalsContact OG-OG 3.14Å; L136-S138 PolarHBondContact O-N 2.69Å; S138-D142 PolarHBondContact O-N 3.44Å; S138-D142 VanDerWaalsContact O-N 3.14Å
139L58.1Low68.4Low16 Ų1676.2 Ų76.28%0.08437%0.372CS..Hα-helixtrans-67.4-47.3178.1-87.8174.5000113.1F129 P134 S135 L136 V141 S143 Y144 I147F129-L139 HydrophobicContact CE1-CD1 3.97Å; F129-L139 HydrophobicContact CE1-CD2 4.09Å; P134-L139 HydrophobicContact CB-CD1 3.47Å; P134-L139 VanDerWaalsContact CB-CD1 3.47Å; P134-L139 HydrophobicContact CB-CD2 3.66Å; P134-L139 HydrophobicContact CB-CG 3.26Å; P134-L139 HydrophobicContact CG-CD1 3.73Å; P134-L139 HydrophobicContact CG-CD2 3.64Å; P134-L139 HydrophobicContact CG-CG 3.75Å; S135-L139 PolarHBondContact O-N 2.9Å; L136-L139 PolarHBondContact O-N 3.12Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 2.88Å; L139-S143 CarbonylContact O-C 3.57Å; L139-S143 VanDerWaalsContact O-C 3.29Å; L139-S143 WeakPolarHBondContact O-CA 3.47Å; L139-S143 PolarHBondContact O-N 3.13Å; L139-Y144 PolarHBondContact O-N 3Å; L139-I147 HydrophobicContact CB-CD1 3.92Å; L139-I147 HydrophobicContact CD2-CD1 4.32Å
140F59.3Low69.1Low113 Ų11375.7 Ų75.750%0.49637%0.37SS..Hα-helixtrans-68.8-30.9-177.2-88.5-79.7000113.1L136L136-F140 WeakPolarHBondContact O-CD2 3.3Å; L136-F140 PolarHBondContact O-N 2.87Å
141V60.3Low69.9Low103 Ų10371.6 Ų71.662%0.62435%0.35SS*.Hα-helixtrans-90.9-38.8-175.4179.30000112.7L139L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 2.88Å
142D61.7Low71.1Confident53 Ų5364.8 Ų64.828%0.28332%0.318SS..Hα-helixtrans-108.2-10.1-172.7-70.1-24.9000113.7R42 S138R42-D142 IonicContact CZ-OD1 3.35Å; R42-D142 IonicContact CZ-OD2 3.86Å; R42-D142 VanDerWaalsContact NH1-CG 3.26Å; R42-D142 IonicContact NH1-OD1 2.99Å; R42-D142 PolarHBondContact NH1-OD1 3.14Å; R42-D142 IonicContact NH1-OD2 2.81Å; R42-D142 PolarHBondContact NH1-OD2 3.46Å; R42-D142 IonicContact NH2-OD1 2.79Å; R42-D142 PolarHBondContact NH2-OD1 3.47Å; R42-D142 IonicContact NH2-OD2 3.98Å; S138-D142 PolarHBondContact O-N 3.44Å; S138-D142 VanDerWaalsContact O-N 3.14Å
143S69.3Low72.5Confident6 Ų660.7 Ų60.74%0.04230%0.302CS..  trans-141.619.6-170.9-58.60000115.2Y128 L139 S145 E146 I147Y128-S143 VanDerWaalsContact OH-CB 3.26Å; Y128-S143 WeakPolarHBondContact OH-CB 3.43Å; Y128-S143 PolarHBondContact OH-OG 3.28Å; L139-S143 CarbonylContact O-C 3.57Å; L139-S143 VanDerWaalsContact O-C 3.29Å; L139-S143 WeakPolarHBondContact O-CA 3.47Å; L139-S143 PolarHBondContact O-N 3.13Å; S143-S145 VanDerWaalsContact C-N 3.28Å; S143-S145 PolarHBondContact O-N 3.34Å; S143-E146 PolarHBondContact O-N 3.02Å; S143-E146 VanDerWaalsContact O-N 3.14Å; S143-I147 PolarHBondContact O-N 2.93Å
144Y77.8Confident74.2Confident73 Ų7353.3 Ų53.329%0.28628%0.28SS..Hα-helixtrans-54.8-39.5-177.7173.6-108.9000113.7L139 E146 I147 L148L139-Y144 PolarHBondContact O-N 3Å; Y144-E146 VanDerWaalsContact C-N 3.34Å; Y144-E146 PolarHBondContact O-N 3.24Å; Y144-I147 WeakPolarHBondContact O-CB 3.34Å; Y144-I147 PolarHBondContact O-N 3.35Å; Y144-I147 VanDerWaalsContact O-N 3.11Å; Y144-L148 HydrophobicContact CD1-CD1 3.89Å; Y144-L148 HydrophobicContact CD1-CG 4.2Å; Y144-L148 HydrophobicContact CD2-CG 4.4Å; Y144-L148 HydrophobicContact CE1-CD1 3.21Å; Y144-L148 HydrophobicContact CE1-CD2 4.29Å; Y144-L148 HydrophobicContact CE1-CG 3.7Å; Y144-L148 HydrophobicContact CE2-CD1 4.33Å; Y144-L148 HydrophobicContact CE2-CD2 3.96Å; Y144-L148 HydrophobicContact CE2-CG 3.91Å; Y144-L148 VanDerWaalsContact CZ-CD1 3.48Å; Y144-L148 PolarHBondContact O-N 2.97Å; Y144-L148 WeakPolarHBondContact OH-CD2 3.38Å
145S78.3Confident76Confident13 Ų1354.6 Ų54.69%0.09128%0.281CS..Hα-helixtrans-61.1-38.8179.153.80000113.6S143 I147 L148 F149 Y187 R190S143-S145 VanDerWaalsContact C-N 3.28Å; S143-S145 PolarHBondContact O-N 3.34Å; S145-I147 VanDerWaalsContact C-N 3.33Å; S145-L148 PolarHBondContact O-N 3Å; S145-F149 WeakPolarHBondContact O-CD2 3.36Å; S145-F149 PolarHBondContact O-N 3.46Å; S145-F149 VanDerWaalsContact O-N 3.11Å; S145-Y187 VanDerWaalsContact CB-CD2 3.43Å; S145-Y187 WeakPolarHBondContact OG-CD2 3.3Å; S145-Y187 WeakPolarHBondContact OG-CE2 3.32Å; S145-R190 PolarHBondContact OG-NH1 3.05Å; S145-R190 VanDerWaalsContact OG-NH1 3.15Å
146E81.6Confident77.9Confident22 Ų2251.5 Ų51.510%0.10326%0.258CS..Hα-helixtrans-70-33.3176.8-64.5-67.8154.500111.2R124 Y128 S143 Y144 F149 F150R124-E146 IonicContact NE-OE2 3.16Å; R124-E146 IonicContact NH2-OE1 3.15Å; R124-E146 PolarHBondContact NH2-OE1 3.22Å; R124-E146 IonicContact NH2-OE2 3.47Å; R124-E146 PolarHBondContact NH2-OE2 2.89Å; Y128-E146 HydrophobicContact CD1-CB 4.13Å; Y128-E146 HydrophobicContact CD2-CG 4.49Å; Y128-E146 HydrophobicContact CE1-CB 3.88Å; Y128-E146 HydrophobicContact CE1-CG 4.24Å; Y128-E146 HydrophobicContact CE2-CG 4.12Å; S143-E146 PolarHBondContact O-N 3.02Å; S143-E146 VanDerWaalsContact O-N 3.14Å; Y144-E146 VanDerWaalsContact C-N 3.34Å; Y144-E146 PolarHBondContact O-N 3.24Å; E146-F149 PolarHBondContact O-N 3.33Å; E146-F150 PolarHBondContact O-N 3.07Å
147I85.3Confident79.8Confident27 Ų2747.1 Ų47.114%0.13824%0.235CC..Hα-helixtrans-65-42.7172.9-57.5170.4000110F129 L139 S143 Y144 S145 F149 F150 V151F129-I147 HydrophobicContact CZ-CG1 4.19Å; L139-I147 HydrophobicContact CB-CD1 3.92Å; L139-I147 HydrophobicContact CD2-CD1 4.32Å; S143-I147 PolarHBondContact O-N 2.93Å; Y144-I147 WeakPolarHBondContact O-CB 3.34Å; Y144-I147 PolarHBondContact O-N 3.35Å; Y144-I147 VanDerWaalsContact O-N 3.11Å; S145-I147 VanDerWaalsContact C-N 3.33Å; I147-F149 PolarHBondContact O-N 3.29Å; I147-F150 WeakPolarHBondContact O-CB 3.43Å; I147-F150 PolarHBondContact O-N 3.16Å; I147-V151 HydrophobicContact CG2-CG2 4.07Å; I147-V151 WeakPolarHBondContact O-CB 3.44Å; I147-V151 VanDerWaalsContact O-CG2 3.28Å; I147-V151 WeakPolarHBondContact O-CG2 3.2Å; I147-V151 PolarHBondContact O-N 2.96Å
148L87.9Confident81.7Confident31 Ų3141.1 Ų41.116%0.16221%0.214CC..Hα-helixtrans-63.4-39.8177.7-75.9-176.8000113.2Y144 S145 F150 V151 Q152 N184Y144-L148 HydrophobicContact CD1-CD1 3.89Å; Y144-L148 HydrophobicContact CD1-CG 4.2Å; Y144-L148 HydrophobicContact CD2-CG 4.4Å; Y144-L148 HydrophobicContact CE1-CD1 3.21Å; Y144-L148 HydrophobicContact CE1-CD2 4.29Å; Y144-L148 HydrophobicContact CE1-CG 3.7Å; Y144-L148 HydrophobicContact CE2-CD1 4.33Å; Y144-L148 HydrophobicContact CE2-CD2 3.96Å; Y144-L148 HydrophobicContact CE2-CG 3.91Å; Y144-L148 VanDerWaalsContact CZ-CD1 3.48Å; Y144-L148 PolarHBondContact O-N 2.97Å; Y144-L148 WeakPolarHBondContact OH-CD2 3.38Å; S145-L148 PolarHBondContact O-N 3Å; L148-F150 VanDerWaalsContact C-N 3.33Å; L148-V151 PolarHBondContact O-N 3.33Å; L148-Q152 VanDerWaalsContact O-CB 3.31Å; L148-Q152 WeakPolarHBondContact O-CB 3.32Å; L148-Q152 PolarHBondContact O-N 3.37Å; L148-N184 VanDerWaalsContact CB-OD1 3.23Å; L148-N184 WeakPolarHBondContact CB-OD1 3.46Å; L148-N184 PolarHBondContact O-ND2 3.18Å
149F90.7Very high83.3Confident8 Ų839 Ų394%0.03520%0.2CC..Hα-helixtrans-62.9-40.7172-77.4-68.4000111.6Y74 S145 E146 I147 S153 N184 Y187 Y188Y74-F149 HydrophobicContact CD2-CE1 4.41Å; Y74-F149 HydrophobicContact CE1-CE1 4.26Å; Y74-F149 HydrophobicContact CE2-CD1 4.37Å; Y74-F149 AromaticContact CE2-CE1 3.73Å; Y74-F149 HydrophobicContact CE2-CE1 3.73Å; Y74-F149 AromaticContact CZ-CE1 3.63Å; S145-F149 WeakPolarHBondContact O-CD2 3.36Å; S145-F149 PolarHBondContact O-N 3.46Å; S145-F149 VanDerWaalsContact O-N 3.11Å; E146-F149 PolarHBondContact O-N 3.33Å; I147-F149 PolarHBondContact O-N 3.29Å; F149-S153 PolarHBondContact O-N 3.42Å; F149-N184 HydrophobicContact CD1-CB 4.11Å; F149-N184 HydrophobicContact CE1-CB 3.65Å; F149-N184 HydrophobicContact CZ-CB 3.93Å; F149-Y187 AromaticContact CE2-CD1 3.93Å; F149-Y187 HydrophobicContact CE2-CD1 3.93Å; F149-Y187 HydrophobicContact CE2-CD2 4.44Å; F149-Y187 AromaticContact CE2-CG 3.86Å; F149-Y187 HydrophobicContact CE2-CG 3.86Å; F149-Y187 HydrophobicContact CZ-CD1 4.16Å; F149-Y187 HydrophobicContact CZ-CG 4.3Å; F149-Y188 HydrophobicContact CZ-CE2 4.15Å
150F91.7Very high84.9Confident44 Ų4439.7 Ų39.719%0.19320%0.204CC..Hα-helixtrans-65.2-46.4176.4179.9-107.2000112.3F122 I126 F129 E146 I147 L148 Q152 S153 L154F122-F150 HydrophobicContact CD2-CD2 4.26Å; F122-F150 AromaticContact CD2-CE2 3.65Å; F122-F150 HydrophobicContact CD2-CE2 3.65Å; F122-F150 HydrophobicContact CD2-CZ 4.37Å; F122-F150 AromaticContact CE2-CE2 3.66Å; F122-F150 HydrophobicContact CE2-CE2 3.66Å; F122-F150 AromaticContact CE2-CZ 3.97Å; F122-F150 HydrophobicContact CE2-CZ 3.97Å; I126-F150 HydrophobicContact CG1-CE2 4.17Å; F129-F150 HydrophobicContact CD2-CG 4.49Å; F129-F150 HydrophobicContact CE2-CB 4.11Å; F129-F150 AromaticContact CE2-CD1 3.71Å; F129-F150 HydrophobicContact CE2-CD1 3.71Å; F129-F150 HydrophobicContact CE2-CD2 4.26Å; F129-F150 HydrophobicContact CE2-CE1 4.16Å; F129-F150 AromaticContact CE2-CG 3.75Å; F129-F150 HydrophobicContact CE2-CG 3.75Å; F129-F150 HydrophobicContact CZ-CD1 4.41Å; E146-F150 PolarHBondContact O-N 3.07Å; I147-F150 WeakPolarHBondContact O-CB 3.43Å; I147-F150 PolarHBondContact O-N 3.16Å; L148-F150 VanDerWaalsContact C-N 3.33Å; F150-Q152 PolarHBondContact O-N 2.94Å; F150-S153 PolarHBondContact O-N 3.35Å; F150-S153 PolarHBondContact O-OG 2.76Å; F150-L154 PolarHBondContact O-N 2.91Å
151V92.5Very high86.5Confident43 Ų4338.6 Ų38.626%0.26121%0.207SC..Hα-helixtrans-62.3-43.1177.71720000110.7I147 L148 S153 L154 F155 M180I147-V151 HydrophobicContact CG2-CG2 4.07Å; I147-V151 WeakPolarHBondContact O-CB 3.44Å; I147-V151 VanDerWaalsContact O-CG2 3.28Å; I147-V151 WeakPolarHBondContact O-CG2 3.2Å; I147-V151 PolarHBondContact O-N 2.96Å; L148-V151 PolarHBondContact O-N 3.33Å; V151-S153 VanDerWaalsContact C-N 3.32Å; V151-S153 PolarHBondContact O-N 2.89Å; V151-L154 WeakPolarHBondContact O-CB 3.49Å; V151-L154 PolarHBondContact O-N 3.28Å; V151-F155 HydrophobicContact CG1-CD2 3.74Å; V151-F155 HydrophobicContact CG1-CE2 3.57Å; V151-F155 VanDerWaalsContact O-CD2 3.28Å; V151-F155 WeakPolarHBondContact O-CD2 3.46Å; V151-F155 PolarHBondContact O-N 2.91Å; V151-M180 HydrophobicContact CG1-SD 3.85Å
152Q94.9Very high88Confident0 Ų035.4 Ų35.40%019%0.186CC..Hα-helixtrans-58-44.6173.7178.2-89.8-27.400111.8Y77 L148 F150 L154 F155 M156 S177 M180Y77-Q152 PolarHBondContact OH-NE2 3.2Å; L148-Q152 VanDerWaalsContact O-CB 3.31Å; L148-Q152 WeakPolarHBondContact O-CB 3.32Å; L148-Q152 PolarHBondContact O-N 3.37Å; F150-Q152 PolarHBondContact O-N 2.94Å; Q152-L154 VanDerWaalsContact C-N 3.33Å; Q152-L154 PolarHBondContact O-N 3.08Å; Q152-F155 PolarHBondContact O-N 3.5Å; Q152-M156 PolarHBondContact O-N 3.05Å; Q152-M156 VanDerWaalsContact O-N 3.1Å; Q152-S177 WeakPolarHBondContact CG-O 3.18Å; Q152-M180 HydrophobicContact CB-CB 4.16Å; Q152-M180 HydrophobicContact CG-CB 4.3Å
153S94.4Very high89.3Confident0 Ų035 Ų350%018%0.181CC..Hα-helixtrans-64.3-36.2176.975.10000112.7F122 F149 F150 V151 M156 L157F122-S153 WeakPolarHBondContact CA-OG 3.46Å; F149-S153 PolarHBondContact O-N 3.42Å; F150-S153 PolarHBondContact O-N 3.35Å; F150-S153 PolarHBondContact O-OG 2.76Å; V151-S153 VanDerWaalsContact C-N 3.32Å; V151-S153 PolarHBondContact O-N 2.89Å; S153-M156 WeakPolarHBondContact O-CB 3.34Å; S153-M156 PolarHBondContact O-N 2.93Å; S153-L157 WeakPolarHBondContact O-CG 3.41Å; S153-L157 PolarHBondContact O-N 3.14Å
154L94.8Very high90.2Very high78 Ų7841.7 Ų41.741%0.40821%0.209SC..Hα-helixtrans-64.4-47.6176.6-178.565.7000111.4F122 F150 V151 Q152 M156 L157 V158F122-L154 HydrophobicContact CE2-CD1 4.48Å; F150-L154 PolarHBondContact O-N 2.91Å; V151-L154 WeakPolarHBondContact O-CB 3.49Å; V151-L154 PolarHBondContact O-N 3.28Å; Q152-L154 VanDerWaalsContact C-N 3.33Å; Q152-L154 PolarHBondContact O-N 3.08Å; L154-M156 PolarHBondContact O-N 3.12Å; L154-L157 PolarHBondContact O-N 3.21Å; L154-L157 VanDerWaalsContact O-N 3.14Å; L154-V158 WeakPolarHBondContact O-CG2 3.43Å; L154-V158 PolarHBondContact O-N 3.27Å
155F95.1Very high90.7Very high73 Ų7341.2 Ų41.232%0.3222%0.217SC..Hα-helixtrans-62.4-32.6176-80.6-72.8000112.7V151 Q152 S159 S173 M180V151-F155 HydrophobicContact CG1-CD2 3.74Å; V151-F155 HydrophobicContact CG1-CE2 3.57Å; V151-F155 VanDerWaalsContact O-CD2 3.28Å; V151-F155 WeakPolarHBondContact O-CD2 3.46Å; V151-F155 PolarHBondContact O-N 2.91Å; Q152-F155 PolarHBondContact O-N 3.5Å; F155-S159 PolarHBondContact O-N 3.43Å; F155-S173 PolarHBondContact O-OG 2.74Å; F155-M180 HydrophobicContact CB-CE 4.34Å; F155-M180 HydrophobicContact CD2-CE 3.18Å; F155-M180 HydrophobicContact CD2-SD 4.05Å; F155-M180 HydrophobicContact CE2-CE 3.49Å; F155-M180 VanDerWaalsContact CE2-CE 3.49Å; F155-M180 HydrophobicContact CE2-SD 4.15Å; F155-M180 HydrophobicContact CG-CE 3.84Å; F155-M180 HydrophobicContact CZ-CE 4.34Å
156M94.2Very high91Very high10 Ų1045.9 Ų45.95%0.04924%0.237CC..Hα-helixtrans-69.5-38.4172.9-172.562.8172.400112.4F81 V115 Q152 S153 L154 S159 V160F81-M156 HydrophobicContact CD2-CE 3.97Å; F81-M156 HydrophobicContact CD2-SD 4.49Å; F81-M156 HydrophobicContact CE1-SD 4.43Å; F81-M156 HydrophobicContact CE2-CE 3.55Å; F81-M156 HydrophobicContact CE2-SD 3.6Å; F81-M156 HydrophobicContact CZ-CE 4.13Å; F81-M156 HydrophobicContact CZ-SD 3.58Å; F81-M156 VanDerWaalsContact CZ-SD 3.58Å; V115-M156 HydrophobicContact CG2-CE 4.22Å; Q152-M156 PolarHBondContact O-N 3.05Å; Q152-M156 VanDerWaalsContact O-N 3.1Å; S153-M156 WeakPolarHBondContact O-CB 3.34Å; S153-M156 PolarHBondContact O-N 2.93Å; L154-M156 PolarHBondContact O-N 3.12Å; M156-S159 PolarHBondContact O-N 3.47Å; M156-S159 PolarHBondContact O-OG 3.27Å; M156-V160 WeakPolarHBondContact O-CG2 3.47Å; M156-V160 PolarHBondContact O-N 3.42Å
157L94.3Very high91.2Very high40 Ų4051 Ų5121%0.20926%0.256CS..Hα-helixtrans-69.7-38.7175-69.5176.8000111.9V119 F122 S153 L154 S159 V160 V161V119-L157 HydrophobicContact CG2-CD2 3.9Å; F122-L157 HydrophobicContact CB-CD1 3.83Å; F122-L157 HydrophobicContact CD1-CD1 3.69Å; F122-L157 HydrophobicContact CD2-CD1 3.52Å; F122-L157 HydrophobicContact CE1-CD1 4.03Å; F122-L157 HydrophobicContact CE2-CD1 3.9Å; F122-L157 HydrophobicContact CG-CD1 3.4Å; F122-L157 VanDerWaalsContact CG-CD1 3.4Å; F122-L157 HydrophobicContact CZ-CD1 4.13Å; S153-L157 WeakPolarHBondContact O-CG 3.41Å; S153-L157 PolarHBondContact O-N 3.14Å; L154-L157 PolarHBondContact O-N 3.21Å; L154-L157 VanDerWaalsContact O-N 3.14Å; L157-S159 VanDerWaalsContact C-N 3.3Å; L157-S159 PolarHBondContact O-N 2.88Å; L157-V160 PolarHBondContact O-N 2.92Å; L157-V161 WeakPolarHBondContact O-CG2 3.41Å; L157-V161 PolarHBondContact O-N 3.2Å
158V94.6Very high91.2Very high60 Ų6056.9 Ų56.936%0.36428%0.28SS..Hα-helixtrans-61-40.4174.1171.30000110.8L154 V160 V161 L162L154-V158 WeakPolarHBondContact O-CG2 3.43Å; L154-V158 PolarHBondContact O-N 3.27Å; V158-V160 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 3.32Å; V158-V161 PolarHBondContact O-N 3.22Å; V158-L162 HydrophobicContact CG1-CD1 3.79Å; V158-L162 HydrophobicContact CG1-CG 4.25Å; V158-L162 WeakPolarHBondContact O-CB 3.28Å; V158-L162 VanDerWaalsContact O-CG 3.28Å; V158-L162 WeakPolarHBondContact O-CG 3.42Å; V158-L162 PolarHBondContact O-N 2.77Å
159S92.4Very high91.2Very high6 Ų660.5 Ų60.54%0.04230%0.296CS..Hα-helixtrans-64-38.4176.170.70000112.1F155 M156 L157 L162 Y163 Y170F155-S159 PolarHBondContact O-N 3.43Å; M156-S159 PolarHBondContact O-N 3.47Å; M156-S159 PolarHBondContact O-OG 3.27Å; L157-S159 VanDerWaalsContact C-N 3.3Å; L157-S159 PolarHBondContact O-N 2.88Å; S159-L162 PolarHBondContact O-N 3.44Å; S159-Y163 WeakPolarHBondContact O-CB 3.38Å; S159-Y163 PolarHBondContact O-N 3.43Å; S159-Y170 WeakPolarHBondContact CB-O 3.14Å; S159-Y170 WeakPolarHBondContact O-CB 3.5Å
160V92.4Very high91.1Very high30 Ų3060.7 Ų60.718%0.18230%0.297CS..Hα-helixtrans-63.3-45.9174.5174.90000111.4V115 M156 L157 V158 L162 Y163 F164V115-V160 HydrophobicContact CB-CG2 4.48Å; V115-V160 HydrophobicContact CG1-CG2 4.13Å; V115-V160 HydrophobicContact CG2-CG2 3.55Å; M156-V160 WeakPolarHBondContact O-CG2 3.47Å; M156-V160 PolarHBondContact O-N 3.42Å; L157-V160 PolarHBondContact O-N 2.92Å; V158-V160 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 3.32Å; V160-L162 VanDerWaalsContact C-N 3.33Å; V160-L162 PolarHBondContact O-N 2.98Å; V160-Y163 WeakPolarHBondContact O-CB 3.33Å; V160-Y163 PolarHBondContact O-N 3.45Å; V160-F164 HydrophobicContact CG1-CD2 3.82Å; V160-F164 HydrophobicContact CG1-CE2 3.48Å; V160-F164 VanDerWaalsContact CG1-CE2 3.48Å; V160-F164 WeakPolarHBondContact O-CD2 3.38Å; V160-F164 PolarHBondContact O-N 3.14Å; V160-F164 VanDerWaalsContact O-N 3.1Å
161V93.1Very high91.1Very high90 Ų9060.5 Ų60.555%0.54530%0.299SS..Hα-helixtrans-62.1-42177.8172.90000111.3L157 V158 Y163 F164 S165L157-V161 WeakPolarHBondContact O-CG2 3.41Å; L157-V161 PolarHBondContact O-N 3.2Å; V158-V161 PolarHBondContact O-N 3.22Å; V161-Y163 VanDerWaalsContact C-N 3.35Å; V161-F164 PolarHBondContact O-N 2.93Å; V161-S165 WeakPolarHBondContact O-CB 3.4Å; V161-S165 PolarHBondContact O-N 3.34Å; V161-S165 PolarHBondContact O-OG 3.1Å
162L91.1Very high91Very high37 Ų3761 Ų6119%0.19431%0.308CS..Hα-helixtrans-68.7-33.3177.5-71172.9000112.4V158 S159 V160 S165 H166 R167 E169 Y170V158-L162 HydrophobicContact CG1-CD1 3.79Å; V158-L162 HydrophobicContact CG1-CG 4.25Å; V158-L162 WeakPolarHBondContact O-CB 3.28Å; V158-L162 VanDerWaalsContact O-CG 3.28Å; V158-L162 WeakPolarHBondContact O-CG 3.42Å; V158-L162 PolarHBondContact O-N 2.77Å; S159-L162 PolarHBondContact O-N 3.44Å; V160-L162 VanDerWaalsContact C-N 3.33Å; V160-L162 PolarHBondContact O-N 2.98Å; L162-S165 PolarHBondContact O-N 3.04Å; L162-H166 PolarHBondContact O-N 3.3Å; L162-R167 HydrophobicContact CD2-CB 4.27Å; L162-R167 HydrophobicContact CD2-CG 4.41Å; L162-R167 PolarHBondContact O-N 3.18Å; L162-R167 VanDerWaalsContact O-N 3.14Å; L162-E169 HydrophobicContact CD1-CB 4.42Å; L162-Y170 VanDerWaalsContact CB-CB 3.46Å
163Y88.8Confident90.9Very high44 Ų4461.5 Ų61.517%0.17331%0.311CS..Hα-helixtrans-62-46.6174-177.4-100.8000111.2P94 P95 Y96 S159 V160 V161 S165 H166 Y170P94-Y163 HydrophobicContact CB-CD2 3.46Å; P94-Y163 VanDerWaalsContact CB-CD2 3.46Å; P94-Y163 HydrophobicContact CB-CE2 3.39Å; P94-Y163 HydrophobicContact CB-CG 4.29Å; P94-Y163 HydrophobicContact CG-CD2 4.43Å; P95-Y163 WeakPolarHBondContact CA-OH 3.47Å; P95-Y163 HydrophobicContact CB-CE1 3.92Å; Y96-Y163 HydrophobicContact CD2-CE2 4.27Å; Y96-Y163 HydrophobicContact CE2-CE2 4.23Å; Y96-Y163 PolarHBondContact N-OH 2.95Å; S159-Y163 WeakPolarHBondContact O-CB 3.38Å; S159-Y163 PolarHBondContact O-N 3.43Å; V160-Y163 WeakPolarHBondContact O-CB 3.33Å; V160-Y163 PolarHBondContact O-N 3.45Å; V161-Y163 VanDerWaalsContact C-N 3.35Å; Y163-S165 VanDerWaalsContact C-N 3.3Å; Y163-S165 PolarHBondContact O-N 2.9Å; Y163-H166 PolarHBondContact O-N 2.92Å; Y163-Y170 HydrophobicContact CD2-CD2 4.01Å; Y163-Y170 HydrophobicContact CD2-CE1 4.26Å; Y163-Y170 AromaticContact CD2-CE2 3.56Å; Y163-Y170 HydrophobicContact CD2-CE2 3.56Å; Y163-Y170 HydrophobicContact CD2-CG 4.5Å; Y163-Y170 AromaticContact CD2-CZ 3.64Å; Y163-Y170 HydrophobicContact CE2-CE2 4.25Å; Y163-Y170 HydrophobicContact CG-CE2 4.49Å
164F88.8Confident90.8Very high146 Ų14662.7 Ų62.764%0.6432%0.317SS*.Hα-helixtrans-69.4-27.2174.8-71.2-64.5000113.3V160 V161 H166V160-F164 HydrophobicContact CG1-CD2 3.82Å; V160-F164 HydrophobicContact CG1-CE2 3.48Å; V160-F164 VanDerWaalsContact CG1-CE2 3.48Å; V160-F164 WeakPolarHBondContact O-CD2 3.38Å; V160-F164 PolarHBondContact O-N 3.14Å; V160-F164 VanDerWaalsContact O-N 3.1Å; V161-F164 PolarHBondContact O-N 2.93Å; F164-H166 PolarHBondContact O-CD2 3.17Å; F164-H166 PolarHBondContact O-N 3.46Å
165S87.4Confident90.8Very high64 Ų6462.8 Ų62.845%0.44832%0.321SS..THydrogen-bonded Turntrans-76.66.5175.1-55.40000113.8V161 L162 Y163 R167V161-S165 WeakPolarHBondContact O-CB 3.4Å; V161-S165 PolarHBondContact O-N 3.34Å; V161-S165 PolarHBondContact O-OG 3.1Å; L162-S165 PolarHBondContact O-N 3.04Å; Y163-S165 VanDerWaalsContact C-N 3.3Å; Y163-S165 PolarHBondContact O-N 2.9Å; S165-R167 PolarHBondContact O-N 3.41Å; S165-R167 VanDerWaalsContact O-N 3.12Å
166H84.9Confident90.8Very high110 Ų11065.3 Ų65.351%0.50933%0.332SS..THydrogen-bonded Turntrans56.823.3-177.1-58.5-89.6000114.2P94 P95 L162 Y163 F164P94-H166 PolarHBondContact O-ND1 2.65Å; P95-H166 WeakPolarHBondContact CD-CE1 3.41Å; P95-H166 WeakPolarHBondContact CD-ND1 3.14Å; L162-H166 PolarHBondContact O-N 3.3Å; Y163-H166 PolarHBondContact O-N 2.92Å; F164-H166 PolarHBondContact O-CD2 3.17Å; F164-H166 PolarHBondContact O-N 3.46Å
167R86.4Confident90.8Very high131 Ų13164.9 Ų64.949%0.49433%0.329SS..  trans-93.7132.6-177.9-62.9-65.3-70.1-171.2-3110.5L162 S165 E169 Y170L162-R167 HydrophobicContact CD2-CB 4.27Å; L162-R167 HydrophobicContact CD2-CG 4.41Å; L162-R167 PolarHBondContact O-N 3.18Å; L162-R167 VanDerWaalsContact O-N 3.14Å; S165-R167 PolarHBondContact O-N 3.41Å; S165-R167 VanDerWaalsContact O-N 3.12Å; R167-E169 IonicContact CZ-OE1 2.87Å; R167-E169 IonicContact NE-OE1 3.05Å; R167-E169 IonicContact NH2-OE1 2.74Å; R167-E169 PolarHBondContact NH2-OE1 3.18Å; R167-E169 PolarHBondContact O-N 3.47Å; R167-Y170 WeakPolarHBondContact O-CD1 3.48Å
168K85.5Confident90.8Very high150 Ų15064.4 Ų64.465%0.65233%0.327SS*.THydrogen-bonded Turntrans-66.7-14.2174.9-64-178.1-179.7179.50113.8Y170 V171K168-Y170 PolarHBondContact O-N 3Å; K168-V171 VanDerWaalsContact O-CG2 3.31Å; K168-V171 WeakPolarHBondContact O-CG2 3.35Å
169E87.1Confident90.9Very high106 Ų10664.1 Ų64.150%0.49533%0.331SS..THydrogen-bonded Turntrans-68.6-17.7-178.4-68.5164.1-14700113.7L162 R167 V171 A172L162-E169 HydrophobicContact CD1-CB 4.42Å; R167-E169 IonicContact CZ-OE1 2.87Å; R167-E169 IonicContact NE-OE1 3.05Å; R167-E169 IonicContact NH2-OE1 2.74Å; R167-E169 PolarHBondContact NH2-OE1 3.18Å; R167-E169 PolarHBondContact O-N 3.47Å; E169-V171 PolarHBondContact O-N 2.96Å; E169-A172 PolarHBondContact O-N 2.95Å
170Y90Very high90.8Very high13 Ų1365.7 Ų65.75%0.05134%0.338CS..Hα-helixtrans-55.6-28.3178.983.7-78.3000113.4R88 P94 Y96 S159 L162 Y163 R167 K168 S173 M174R88-Y170 VanDerWaalsContact CZ-OH 3.29Å; R88-Y170 VanDerWaalsContact NE-CZ 3.32Å; R88-Y170 PolarHBondContact NE-OH 3.3Å; R88-Y170 VanDerWaalsContact NH2-CE1 3.27Å; R88-Y170 PolarHBondContact NH2-OH 2.74Å; P94-Y170 HydrophobicContact CB-CE1 4.16Å; P94-Y170 HydrophobicContact CG-CD1 4.31Å; P94-Y170 HydrophobicContact CG-CE1 3.83Å; Y96-Y170 VanDerWaalsContact CE2-OH 3.29Å; Y96-Y170 WeakPolarHBondContact CE2-OH 3.36Å; Y96-Y170 PolarHBondContact OH-OH 2.78Å; S159-Y170 WeakPolarHBondContact CB-O 3.14Å; S159-Y170 WeakPolarHBondContact O-CB 3.5Å; L162-Y170 VanDerWaalsContact CB-CB 3.46Å; Y163-Y170 HydrophobicContact CD2-CD2 4.01Å; Y163-Y170 HydrophobicContact CD2-CE1 4.26Å; Y163-Y170 AromaticContact CD2-CE2 3.56Å; Y163-Y170 HydrophobicContact CD2-CE2 3.56Å; Y163-Y170 HydrophobicContact CD2-CG 4.5Å; Y163-Y170 AromaticContact CD2-CZ 3.64Å; Y163-Y170 HydrophobicContact CE2-CE2 4.25Å; Y163-Y170 HydrophobicContact CG-CE2 4.49Å; R167-Y170 WeakPolarHBondContact O-CD1 3.48Å; K168-Y170 PolarHBondContact O-N 3Å; Y170-S173 PolarHBondContact O-N 3.03Å; Y170-M174 WeakPolarHBondContact O-CB 3.1Å; Y170-M174 PolarHBondContact O-N 2.82Å
171V90.4Very high90.9Very high39 Ų3964.2 Ų64.224%0.23633%0.329CS..Hα-helixtrans-62.3-44.3178.3-172.40000111.2K168 E169 M174 V175K168-V171 VanDerWaalsContact O-CG2 3.31Å; K168-V171 WeakPolarHBondContact O-CG2 3.35Å; E169-V171 PolarHBondContact O-N 2.96Å; V171-M174 PolarHBondContact O-N 2.88Å; V171-V175 HydrophobicContact CG1-CG2 4.41Å; V171-V175 VanDerWaalsContact O-CG2 3.31Å; V171-V175 WeakPolarHBondContact O-CG2 3.33Å; V171-V175 PolarHBondContact O-N 2.96Å
172A91.4Very high90.9Very high54 Ų5465 Ų6545%0.44632%0.323SS..Hα-helixtrans-61.8-48.3179.300000110E169 M174 V175 F176E169-A172 PolarHBondContact O-N 2.95Å; A172-M174 VanDerWaalsContact C-N 3.3Å; A172-M174 PolarHBondContact O-N 3.38Å; A172-V175 PolarHBondContact O-N 2.59Å; A172-F176 WeakPolarHBondContact O-CD2 3.26Å; A172-F176 PolarHBondContact O-N 3.21Å
173S92.4Very high90.9Very high11 Ų1167 Ų678%0.07734%0.336CS..Hα-helixtrans-59.9-39.7176.7-165.70000112.4F155 Y170 F176 S177F155-S173 PolarHBondContact O-OG 2.74Å; Y170-S173 PolarHBondContact O-N 3.03Å; S173-F176 PolarHBondContact O-N 3.26Å; S173-S177 PolarHBondContact O-N 2.77Å
174M92.9Very high90.9Very high25 Ų2565.1 Ų65.112%0.12333%0.329CS..Hα-helixtrans-66.7-41.3177.1-174.2-176.874.400112.6F81 A85 Y170 V171 A172 S177 L178F81-M174 HydrophobicContact CE2-CG 3.97Å; F81-M174 HydrophobicContact CZ-CG 3.95Å; A85-M174 HydrophobicContact CB-CE 3.95Å; A85-M174 HydrophobicContact CB-SD 4.48Å; Y170-M174 WeakPolarHBondContact O-CB 3.1Å; Y170-M174 PolarHBondContact O-N 2.82Å; V171-M174 PolarHBondContact O-N 2.88Å; A172-M174 VanDerWaalsContact C-N 3.3Å; A172-M174 PolarHBondContact O-N 3.38Å; M174-S177 PolarHBondContact O-N 3.37Å; M174-S177 PolarHBondContact O-OG 3.34Å; M174-L178 WeakPolarHBondContact O-CB 3.34Å; M174-L178 PolarHBondContact O-N 2.95Å
175V94.4Very high90.9Very high80 Ų8060.8 Ų60.849%0.48531%0.312SS..Hα-helixtrans-66.4-41.1177.5172.20000110.5V171 A172 L178 A179V171-V175 HydrophobicContact CG1-CG2 4.41Å; V171-V175 VanDerWaalsContact O-CG2 3.31Å; V171-V175 WeakPolarHBondContact O-CG2 3.33Å; V171-V175 PolarHBondContact O-N 2.96Å; A172-V175 PolarHBondContact O-N 2.59Å; V175-L178 PolarHBondContact O-N 3.18Å; V175-A179 WeakPolarHBondContact O-CB 3.27Å; V175-A179 PolarHBondContact O-N 3.39Å
176F94Very high90.7Very high126 Ų12662.9 Ų62.955%0.55332%0.317SS*.Hα-helixtrans-61.1-45.4173.5-78.9-61.8000111.9A172 S173 L178 A179 M180A172-F176 WeakPolarHBondContact O-CD2 3.26Å; A172-F176 PolarHBondContact O-N 3.21Å; S173-F176 PolarHBondContact O-N 3.26Å; F176-L178 VanDerWaalsContact C-N 3.29Å; F176-L178 PolarHBondContact O-N 3.49Å; F176-A179 PolarHBondContact O-N 2.81Å; F176-M180 VanDerWaalsContact C-CE 3.48Å; F176-M180 HydrophobicContact CB-CE 3.86Å; F176-M180 WeakPolarHBondContact O-CB 3.23Å; F176-M180 WeakPolarHBondContact O-CE 3.43Å; F176-M180 PolarHBondContact O-N 3.4Å
177S95Very high90.7Very high0 Ų059.3 Ų59.30%030%0.3CS..Hα-helixtrans-64.6-33.9177.371.80000112.5F81 Q152 S173 M174 G181F81-S177 WeakPolarHBondContact CZ-OG 3.42Å; Q152-S177 WeakPolarHBondContact CG-O 3.18Å; S173-S177 PolarHBondContact O-N 2.77Å; M174-S177 PolarHBondContact O-N 3.37Å; M174-S177 PolarHBondContact O-OG 3.34Å; S177-G181 PolarHBondContact O-N 3.14Å
178L94.9Very high90.6Very high30 Ų3053.8 Ų53.816%0.15728%0.279CS..Hα-helixtrans-66.8-48.8175.1-176.665.6000112M78 F81 A85 M174 V175 F176 M180 G181 W182M78-L178 HydrophobicContact CE-CD1 3.99Å; F81-L178 HydrophobicContact CD1-CB 4.43Å; F81-L178 HydrophobicContact CD1-CD1 3.54Å; F81-L178 HydrophobicContact CE1-CB 3.79Å; F81-L178 HydrophobicContact CE1-CD1 3.79Å; F81-L178 HydrophobicContact CE1-CG 4.42Å; F81-L178 HydrophobicContact CG-CD1 4.15Å; F81-L178 HydrophobicContact CZ-CB 4.22Å; A85-L178 HydrophobicContact CB-CD2 4.06Å; M174-L178 WeakPolarHBondContact O-CB 3.34Å; M174-L178 PolarHBondContact O-N 2.95Å; V175-L178 PolarHBondContact O-N 3.18Å; F176-L178 VanDerWaalsContact C-N 3.29Å; F176-L178 PolarHBondContact O-N 3.49Å; L178-M180 VanDerWaalsContact C-N 3.35Å; L178-M180 PolarHBondContact O-N 3.22Å; L178-G181 PolarHBondContact O-N 2.78Å; L178-G181 VanDerWaalsContact O-N 3.16Å; L178-W182 PolarHBondContact O-N 2.88Å
179A95Very high90.5Very high54 Ų5448.1 Ų48.145%0.44626%0.257SS..Hα-helixtrans-61.5-43.4177.700000111.6V175 F176 W182 T183V175-A179 WeakPolarHBondContact O-CB 3.27Å; V175-A179 PolarHBondContact O-N 3.39Å; F176-A179 PolarHBondContact O-N 2.81Å; A179-W182 PolarHBondContact O-N 3.05Å; A179-T183 PolarHBondContact O-N 3.36Å; A179-T183 VanDerWaalsContact O-N 3.08Å; A179-T183 PolarHBondContact O-OG1 3.05Å
180M91.9Very high90Very high39 Ų3944.8 Ų44.819%0.19224%0.24CC..Hα-helixtrans-63.7-39.3173.2-82.7178.9-81.600112.2V151 Q152 F155 F176 L178 W182 T183 N184V151-M180 HydrophobicContact CG1-SD 3.85Å; Q152-M180 HydrophobicContact CB-CB 4.16Å; Q152-M180 HydrophobicContact CG-CB 4.3Å; F155-M180 HydrophobicContact CB-CE 4.34Å; F155-M180 HydrophobicContact CD2-CE 3.18Å; F155-M180 HydrophobicContact CD2-SD 4.05Å; F155-M180 HydrophobicContact CE2-CE 3.49Å; F155-M180 VanDerWaalsContact CE2-CE 3.49Å; F155-M180 HydrophobicContact CE2-SD 4.15Å; F155-M180 HydrophobicContact CG-CE 3.84Å; F155-M180 HydrophobicContact CZ-CE 4.34Å; F176-M180 VanDerWaalsContact C-CE 3.48Å; F176-M180 HydrophobicContact CB-CE 3.86Å; F176-M180 WeakPolarHBondContact O-CB 3.23Å; F176-M180 WeakPolarHBondContact O-CE 3.43Å; F176-M180 PolarHBondContact O-N 3.4Å; L178-M180 VanDerWaalsContact C-N 3.35Å; L178-M180 PolarHBondContact O-N 3.22Å; M180-W182 PolarHBondContact O-N 3.32Å; M180-T183 WeakPolarHBondContact O-CB 3.35Å; M180-T183 PolarHBondContact O-N 3.19Å; M180-N184 WeakPolarHBondContact O-CB 3.08Å; M180-N184 PolarHBondContact O-N 3.17Å; M180-N184 PolarHBondContact O-ND2 3.35Å; M180-N184 PolarHBondContact O-OD1 3.15Å
181G93.5Very high89.3Confident0 Ų044.5 Ų44.50%024%0.24CC..Hα-helixtrans-60.9-44177.200000113Y74 S177 L178 T183 N184 M185Y74-G181 WeakPolarHBondContact OH-CA 3.49Å; Y74-G181 PolarHBondContact OH-O 3.38Å; S177-G181 PolarHBondContact O-N 3.14Å; L178-G181 PolarHBondContact O-N 2.78Å; L178-G181 VanDerWaalsContact O-N 3.16Å; G181-T183 VanDerWaalsContact C-N 3.35Å; G181-T183 PolarHBondContact O-N 2.81Å; G181-N184 WeakPolarHBondContact O-CB 3.32Å; G181-N184 PolarHBondContact O-N 3.37Å; G181-M185 PolarHBondContact O-N 3.25Å
182W94Very high88.7Confident106 Ų10646.9 Ų46.940%0.40225%0.248SC..Hα-helixtrans-66.2-38.3174.8-79.1106.9000112.1M78 T82 L178 A179 M180 N184 M185M78-W182 HydrophobicContact CB-CH2 4.49Å; M78-W182 HydrophobicContact CB-CZ2 4.28Å; M78-W182 HydrophobicContact CE-CB 4.42Å; M78-W182 VanDerWaalsContact CE-CD1 3.48Å; M78-W182 HydrophobicContact CE-CD2 4.07Å; M78-W182 HydrophobicContact CE-CG 3.76Å; M78-W182 VanDerWaalsContact CE-N 3.34Å; T82-W182 WeakPolarHBondContact OG1-CZ2 3.4Å; T82-W182 PolarHBondContact OG1-NE1 2.99Å; L178-W182 PolarHBondContact O-N 2.88Å; A179-W182 PolarHBondContact O-N 3.05Å; M180-W182 PolarHBondContact O-N 3.32Å; W182-N184 VanDerWaalsContact C-N 3.29Å; W182-N184 PolarHBondContact O-N 3.21Å; W182-M185 HydrophobicContact CE3-SD 4Å; W182-M185 HydrophobicContact CZ3-CE 4.45Å; W182-M185 HydrophobicContact CZ3-SD 3.9Å; W182-M185 WeakPolarHBondContact O-CB 3.2Å; W182-M185 PolarHBondContact O-N 3.44Å; W182-M185 VanDerWaalsContact O-N 3.14Å
183T89.8Confident87.9Confident79 Ų7949.5 Ų49.549%0.48525%0.251SS..Hα-helixtrans-62.2-39.2173.3-54.90000111.4A179 M180 G181 M185 L186A179-T183 PolarHBondContact O-N 3.36Å; A179-T183 VanDerWaalsContact O-N 3.08Å; A179-T183 PolarHBondContact O-OG1 3.05Å; M180-T183 WeakPolarHBondContact O-CB 3.35Å; M180-T183 PolarHBondContact O-N 3.19Å; G181-T183 VanDerWaalsContact C-N 3.35Å; G181-T183 PolarHBondContact O-N 2.81Å; T183-M185 PolarHBondContact O-N 2.8Å; T183-L186 HydrophobicContact CG2-CD1 4.44Å; T183-L186 VanDerWaalsContact O-CB 3.24Å; T183-L186 WeakPolarHBondContact O-CB 3.38Å; T183-L186 WeakPolarHBondContact O-CG 3.47Å; T183-L186 PolarHBondContact O-N 3.17Å
184N89.6Confident87Confident5 Ų556.4 Ų56.43%0.02728%0.282CS..Hα-helixtrans-65.6-19.4177.6-70.5-12.5000113Y74 L148 F149 M180 G181 W182 L186 Y187Y74-N184 WeakPolarHBondContact OH-CB 3.23Å; L148-N184 VanDerWaalsContact CB-OD1 3.23Å; L148-N184 WeakPolarHBondContact CB-OD1 3.46Å; L148-N184 PolarHBondContact O-ND2 3.18Å; F149-N184 HydrophobicContact CD1-CB 4.11Å; F149-N184 HydrophobicContact CE1-CB 3.65Å; F149-N184 HydrophobicContact CZ-CB 3.93Å; M180-N184 WeakPolarHBondContact O-CB 3.08Å; M180-N184 PolarHBondContact O-N 3.17Å; M180-N184 PolarHBondContact O-ND2 3.35Å; M180-N184 PolarHBondContact O-OD1 3.15Å; G181-N184 WeakPolarHBondContact O-CB 3.32Å; G181-N184 PolarHBondContact O-N 3.37Å; W182-N184 VanDerWaalsContact C-N 3.29Å; W182-N184 PolarHBondContact O-N 3.21Å; N184-L186 PolarHBondContact O-N 3.43Å; N184-Y187 WeakPolarHBondContact O-CB 3.43Å; N184-Y187 PolarHBondContact O-N 3.48Å
185M87.7Confident86.4Confident55 Ų5560.6 Ų60.627%0.27130%0.303SS..G310 helixtrans-57.9-30.4171-162.9-165.6-167.200111.9F71 Y74 C75 G181 W182 T183 Y187 Y188F71-M185 HydrophobicContact CE2-CE 3.86Å; F71-M185 HydrophobicContact CE2-CG 4.17Å; F71-M185 HydrophobicContact CZ-CE 3.89Å; Y74-M185 HydrophobicContact CE1-CB 4.41Å; C75-M185 WeakPolarHBondContact SG-CE 3.4Å; G181-M185 PolarHBondContact O-N 3.25Å; W182-M185 HydrophobicContact CE3-SD 4Å; W182-M185 HydrophobicContact CZ3-CE 4.45Å; W182-M185 HydrophobicContact CZ3-SD 3.9Å; W182-M185 WeakPolarHBondContact O-CB 3.2Å; W182-M185 PolarHBondContact O-N 3.44Å; W182-M185 VanDerWaalsContact O-N 3.14Å; T183-M185 PolarHBondContact O-N 2.8Å; M185-Y187 PolarHBondContact O-N 3.49Å; M185-Y187 VanDerWaalsContact O-N 3.12Å; M185-Y188 PolarHBondContact O-N 3.47Å
186L84.3Confident85.6Confident108 Ų10856.8 Ų56.857%0.56528%0.28SS*.G310 helixtrans-59.1-24.8176.6-64.1175.7000112.6T183 N184 Y188 T189T183-L186 HydrophobicContact CG2-CD1 4.44Å; T183-L186 VanDerWaalsContact O-CB 3.24Å; T183-L186 WeakPolarHBondContact O-CB 3.38Å; T183-L186 WeakPolarHBondContact O-CG 3.47Å; T183-L186 PolarHBondContact O-N 3.17Å; N184-L186 PolarHBondContact O-N 3.43Å; L186-Y188 PolarHBondContact O-N 3.16Å; L186-T189 HydrophobicContact CD2-CG2 4.4Å; L186-T189 WeakPolarHBondContact O-CB 3.3Å; L186-T189 PolarHBondContact O-N 3.14Å; L186-T189 VanDerWaalsContact O-N 3.14Å; L186-T189 PolarHBondContact O-OG1 3.06Å
187Y83.8Confident84.9Confident34 Ų3452.7 Ų52.713%0.13326%0.263CS..G310 helixtrans-55.2-40.9173.4170.8-100.8000112.2S145 F149 N184 M185 T189 R190S145-Y187 VanDerWaalsContact CB-CD2 3.43Å; S145-Y187 WeakPolarHBondContact OG-CD2 3.3Å; S145-Y187 WeakPolarHBondContact OG-CE2 3.32Å; F149-Y187 AromaticContact CE2-CD1 3.93Å; F149-Y187 HydrophobicContact CE2-CD1 3.93Å; F149-Y187 HydrophobicContact CE2-CD2 4.44Å; F149-Y187 AromaticContact CE2-CG 3.86Å; F149-Y187 HydrophobicContact CE2-CG 3.86Å; F149-Y187 HydrophobicContact CZ-CD1 4.16Å; F149-Y187 HydrophobicContact CZ-CG 4.3Å; N184-Y187 WeakPolarHBondContact O-CB 3.43Å; N184-Y187 PolarHBondContact O-N 3.48Å; M185-Y187 PolarHBondContact O-N 3.49Å; M185-Y187 VanDerWaalsContact O-N 3.12Å; Y187-T189 PolarHBondContact O-N 2.93Å; Y187-R190 VanDerWaalsContact O-CB 3.32Å; Y187-R190 WeakPolarHBondContact O-CB 3.47Å; Y187-R190 VanDerWaalsContact O-CG 3.3Å; Y187-R190 WeakPolarHBondContact O-CG 3.31Å; Y187-R190 PolarHBondContact O-N 3.28Å
188Y84.8Confident84.2Confident15 Ų1559.4 Ų59.46%0.05929%0.289CS..G310 helixtrans-74.1-15.2-176.3-68.1-80.7000113.3F67 N70 F71 Y74 F149 M185 L186 R190 G191F67-Y188 HydrophobicContact CE1-CD1 4.14Å; F67-Y188 WeakPolarHBondContact CE1-O 3.36Å; F67-Y188 HydrophobicContact CE2-CD1 4.25Å; F67-Y188 AromaticContact CZ-CD1 3.88Å; F67-Y188 HydrophobicContact CZ-CD1 3.88Å; N70-Y188 HydrophobicContact CB-CE1 4.32Å; F71-Y188 HydrophobicContact CB-CD1 3.71Å; F71-Y188 HydrophobicContact CB-CE1 4.21Å; F71-Y188 HydrophobicContact CB-CG 4.05Å; F71-Y188 HydrophobicContact CD2-CD1 4.06Å; F71-Y188 AromaticContact CD2-CD2 3.88Å; F71-Y188 HydrophobicContact CD2-CD2 3.88Å; F71-Y188 AromaticContact CD2-CG 3.47Å; F71-Y188 HydrophobicContact CD2-CG 3.47Å; F71-Y188 VanDerWaalsContact CD2-CG 3.47Å; F71-Y188 HydrophobicContact CE2-CG 4.36Å; F71-Y188 HydrophobicContact CG-CD1 4.36Å; F71-Y188 HydrophobicContact CG-CG 4.2Å; Y74-Y188 HydrophobicContact CD1-CD2 4Å; Y74-Y188 AromaticContact CD1-CE2 3.47Å; Y74-Y188 HydrophobicContact CD1-CE2 3.47Å; Y74-Y188 VanDerWaalsContact CD1-CE2 3.47Å; Y74-Y188 HydrophobicContact CD2-CE2 4.45Å; Y74-Y188 HydrophobicContact CE1-CE2 4.19Å; Y74-Y188 AromaticContact CG-CE2 3.61Å; Y74-Y188 HydrophobicContact CG-CE2 3.61Å; F149-Y188 HydrophobicContact CZ-CE2 4.15Å; M185-Y188 PolarHBondContact O-N 3.47Å; L186-Y188 PolarHBondContact O-N 3.16Å; Y188-R190 PolarHBondContact O-N 3.24Å; Y188-R190 VanDerWaalsContact O-N 3.17Å; Y188-G191 PolarHBondContact O-N 3.21Å
189T83.3Confident83.4Confident31 Ų3159 Ų5919%0.1929%0.29CS..G310 helixtrans-62.8-21.8173.569.10000112.3L186 Y187 G191 F192 G196 A199L186-T189 HydrophobicContact CD2-CG2 4.4Å; L186-T189 WeakPolarHBondContact O-CB 3.3Å; L186-T189 PolarHBondContact O-N 3.14Å; L186-T189 VanDerWaalsContact O-N 3.14Å; L186-T189 PolarHBondContact O-OG1 3.06Å; Y187-T189 PolarHBondContact O-N 2.93Å; T189-G191 PolarHBondContact O-N 3.22Å; T189-F192 PolarHBondContact O-N 3.5Å; T189-G196 PolarHBondContact O-N 3.02Å; T189-A199 WeakPolarHBondContact OG1-CB 3.09Å
190R76.3Confident82.4Confident37 Ų3756.4 Ų56.414%0.1427%0.269CS..G310 helixtrans-59.6-24.9176.1-66.1177.3175.6171.3-1.1114S145 Y187 Y188 F192 E203 W330S145-R190 PolarHBondContact OG-NH1 3.05Å; S145-R190 VanDerWaalsContact OG-NH1 3.15Å; Y187-R190 VanDerWaalsContact O-CB 3.32Å; Y187-R190 WeakPolarHBondContact O-CB 3.47Å; Y187-R190 VanDerWaalsContact O-CG 3.3Å; Y187-R190 WeakPolarHBondContact O-CG 3.31Å; Y187-R190 PolarHBondContact O-N 3.28Å; Y188-R190 PolarHBondContact O-N 3.24Å; Y188-R190 VanDerWaalsContact O-N 3.17Å; R190-F192 VanDerWaalsContact C-N 3.27Å; R190-F192 PolarHBondContact O-N 3.28Å; R190-E203 IonicContact CZ-OE2 2.67Å; R190-E203 VanDerWaalsContact NH2-CD 3.26Å; R190-E203 IonicContact NH2-OE1 2.72Å; R190-E203 PolarHBondContact NH2-OE1 3.22Å; R190-E203 VanDerWaalsContact NH2-OE1 3.1Å; R190-E203 IonicContact NH2-OE2 3.1Å; R190-E203 PolarHBondContact NH2-OE2 3.41Å; R190-W330 PolarHBondContact O-NE1 3.12Å
191G76Confident81.7Confident6 Ų656 Ų566%0.06227%0.267CS..G310 helixtrans-70.1-21.8178.800000114W59 Y188 T189W59-G191 WeakPolarHBondContact CZ2-O 3.42Å; Y188-G191 PolarHBondContact O-N 3.21Å; T189-G191 PolarHBondContact O-N 3.22Å
192F78.5Confident80.9Confident89 Ų8960.1 Ų60.139%0.3929%0.288SS..SBendtrans-93.1134.7174.3-60.1-82.1000109.9Y68 T189 R190 Q194 M195 G196Y68-F192 HydrophobicContact CD1-CZ 4.44Å; Y68-F192 AromaticContact CE1-CE1 3.7Å; Y68-F192 HydrophobicContact CE1-CE1 3.7Å; Y68-F192 AromaticContact CE1-CE2 3.98Å; Y68-F192 HydrophobicContact CE1-CE2 3.98Å; Y68-F192 AromaticContact CE1-CZ 3.39Å; Y68-F192 HydrophobicContact CE1-CZ 3.39Å; Y68-F192 AromaticContact CZ-CE1 3.76Å; Y68-F192 AromaticContact CZ-CZ 3.97Å; Y68-F192 WeakPolarHBondContact OH-CD1 3.42Å; Y68-F192 WeakPolarHBondContact OH-CE1 3.4Å; T189-F192 PolarHBondContact O-N 3.5Å; R190-F192 VanDerWaalsContact C-N 3.27Å; R190-F192 PolarHBondContact O-N 3.28Å; F192-Q194 PolarHBondContact O-N 3.31Å; F192-M195 HydrophobicContact CB-CB 4.13Å; F192-M195 HydrophobicContact CB-CG 4.28Å; F192-G196 WeakPolarHBondContact O-CA 3.19Å; F192-G196 PolarHBondContact O-N 2.96Å
193Q74.4Confident80Confident110 Ų11056.9 Ų56.951%0.51428%0.277SS..Hα-helixtrans-62.8-43.5-174.8179.2172.7-19.600113.2I197 W330Q193-I197 WeakPolarHBondContact O-CD1 3.46Å; Q193-I197 VanDerWaalsContact O-CG1 3.29Å; Q193-I197 WeakPolarHBondContact O-CG1 3.36Å; Q193-W330 VanDerWaalsContact CA-CZ2 3.48Å; Q193-W330 HydrophobicContact CB-CH2 3.75Å; Q193-W330 HydrophobicContact CB-CZ2 3.69Å; Q193-W330 HydrophobicContact CG-CH2 3.52Å; Q193-W330 HydrophobicContact CG-CZ2 3.86Å; Q193-W330 HydrophobicContact CG-CZ3 3.9Å
194Q73.8Confident79.2Confident156 Ų15656 Ų5673%0.72927%0.267SS*.Hα-helixtrans-72-53.8-179.9-68.9173.5-13.500111F192 G196 I197 Y198F192-Q194 PolarHBondContact O-N 3.31Å; Q194-G196 VanDerWaalsContact C-N 3.32Å; Q194-G196 PolarHBondContact O-N 3.17Å; Q194-I197 PolarHBondContact O-N 3.14Å; Q194-Y198 WeakPolarHBondContact O-CD2 3.48Å; Q194-Y198 PolarHBondContact O-N 3.17Å
195M79Confident78.6Confident113 Ų11357.2 Ų57.256%0.55727%0.273SS*.Hα-helixtrans-64.4-35.1-178.6-57-62-90.700112.8F192 I197 Y198 A199F192-M195 HydrophobicContact CB-CB 4.13Å; F192-M195 HydrophobicContact CB-CG 4.28Å; M195-I197 PolarHBondContact O-N 3.22Å; M195-Y198 PolarHBondContact O-N 3.05Å; M195-A199 WeakPolarHBondContact O-CB 3.36Å; M195-A199 PolarHBondContact O-N 3.36Å
196G77.7Confident78.1Confident0 Ų058.3 Ų58.30%028%0.279CS..Hα-helixtrans-66.2-34.5179.800000113.5T189 F192 Q194 V200T189-G196 PolarHBondContact O-N 3.02Å; F192-G196 WeakPolarHBondContact O-CA 3.19Å; F192-G196 PolarHBondContact O-N 2.96Å; Q194-G196 VanDerWaalsContact C-N 3.32Å; Q194-G196 PolarHBondContact O-N 3.17Å; G196-V200 VanDerWaalsContact O-CG2 3.25Å; G196-V200 WeakPolarHBondContact O-CG2 3.31Å; G196-V200 PolarHBondContact O-N 3.35Å; G196-V200 VanDerWaalsContact O-N 3.14Å
197I79.8Confident77.5Confident39 Ų3956.4 Ų56.420%0.227%0.269CS..Hα-helixtrans-65-46.5174.1-69.5166.6000110.2Q193 Q194 M195 V200 M201 S326 W330Q193-I197 WeakPolarHBondContact O-CD1 3.46Å; Q193-I197 VanDerWaalsContact O-CG1 3.29Å; Q193-I197 WeakPolarHBondContact O-CG1 3.36Å; Q194-I197 PolarHBondContact O-N 3.14Å; M195-I197 PolarHBondContact O-N 3.22Å; I197-V200 PolarHBondContact O-N 2.88Å; I197-M201 PolarHBondContact O-N 3.05Å; I197-M201 VanDerWaalsContact O-N 3.08Å; I197-S326 WeakPolarHBondContact CG2-OG 3.13Å; I197-W330 HydrophobicContact CG1-CB 4.08Å; I197-W330 HydrophobicContact CG1-CD2 4.41Å; I197-W330 HydrophobicContact CG1-CG 4.06Å
198Y79.3Confident76.9Confident141 Ų14159.5 Ų59.555%0.55328%0.28SS*.Hα-helixtrans-64.9-41.4177.5-68.7-67000112.7Q194 M195 V200 M201 I202Q194-Y198 WeakPolarHBondContact O-CD2 3.48Å; Q194-Y198 PolarHBondContact O-N 3.17Å; M195-Y198 PolarHBondContact O-N 3.05Å; Y198-V200 VanDerWaalsContact C-N 3.34Å; Y198-V200 PolarHBondContact O-N 2.91Å; Y198-M201 HydrophobicContact CD1-CE 3.96Å; Y198-M201 WeakPolarHBondContact O-CB 3.23Å; Y198-M201 PolarHBondContact O-N 3.04Å; Y198-M201 VanDerWaalsContact O-N 3.17Å; Y198-I202 WeakPolarHBondContact O-CG1 3.38Å; Y198-I202 PolarHBondContact O-N 3.29Å
199A78.3Confident76.7Confident21 Ų2159 Ų5917%0.17428%0.279CS..Hα-helixtrans-60.6-43.217800000112T189 M195 M201 I202 E203T189-A199 WeakPolarHBondContact OG1-CB 3.09Å; M195-A199 WeakPolarHBondContact O-CB 3.36Å; M195-A199 PolarHBondContact O-N 3.36Å; A199-M201 VanDerWaalsContact C-N 3.32Å; A199-M201 PolarHBondContact O-N 3.25Å; A199-I202 PolarHBondContact O-N 3.36Å; A199-E203 VanDerWaalsContact O-CB 3.32Å; A199-E203 WeakPolarHBondContact O-CB 3.42Å; A199-E203 PolarHBondContact O-N 3.26Å
200V75.6Confident76.5Confident0 Ų060.3 Ų60.30%028%0.284CS..Hα-helixtrans-64.3-38.5175.3171.60000112.1G196 I197 Y198 K204 I329G196-V200 VanDerWaalsContact O-CG2 3.25Å; G196-V200 WeakPolarHBondContact O-CG2 3.31Å; G196-V200 PolarHBondContact O-N 3.35Å; G196-V200 VanDerWaalsContact O-N 3.14Å; I197-V200 PolarHBondContact O-N 2.88Å; Y198-V200 VanDerWaalsContact C-N 3.34Å; Y198-V200 PolarHBondContact O-N 2.91Å; V200-K204 HydrophobicContact CG1-CD 4.5Å; V200-K204 WeakPolarHBondContact O-CB 3.45Å; V200-K204 PolarHBondContact O-N 3.28Å; V200-K204 VanDerWaalsContact O-N 3.09Å; V200-I329 HydrophobicContact CG1-CB 4.27Å; V200-I329 HydrophobicContact CG1-CG2 3.59Å
201M76.1Confident76.5Confident30 Ų3062 Ų6215%0.14830%0.301CS..Hα-helixtrans-65-49.6178.3-171.5178.376.100111I197 Y198 A199 E203 K204 M205 V319 I322I197-M201 PolarHBondContact O-N 3.05Å; I197-M201 VanDerWaalsContact O-N 3.08Å; Y198-M201 HydrophobicContact CD1-CE 3.96Å; Y198-M201 WeakPolarHBondContact O-CB 3.23Å; Y198-M201 PolarHBondContact O-N 3.04Å; Y198-M201 VanDerWaalsContact O-N 3.17Å; A199-M201 VanDerWaalsContact C-N 3.32Å; A199-M201 PolarHBondContact O-N 3.25Å; M201-E203 PolarHBondContact O-N 3.39Å; M201-K204 PolarHBondContact O-N 2.91Å; M201-M205 WeakPolarHBondContact O-CB 3.36Å; M201-M205 PolarHBondContact O-N 2.98Å; M201-V319 HydrophobicContact CE-CG1 4.49Å; M201-V319 HydrophobicContact CE-CG2 4.37Å; M201-V319 HydrophobicContact CG-CG2 4.46Å; M201-V319 HydrophobicContact SD-CB 4.37Å; M201-V319 HydrophobicContact SD-CG1 3.89Å; M201-V319 HydrophobicContact SD-CG2 4.07Å; M201-I322 HydrophobicContact CB-CG2 4.18Å; M201-I322 HydrophobicContact CG-CG2 3.98Å
202I77.9Confident76.7Confident88 Ų8869.2 Ų69.245%0.45133%0.326SS..Hα-helixtrans-59.6-47177.2-68.5170.1000110.7Y198 A199 K204 M205 I206Y198-I202 WeakPolarHBondContact O-CG1 3.38Å; Y198-I202 PolarHBondContact O-N 3.29Å; A199-I202 PolarHBondContact O-N 3.36Å; I202-K204 PolarHBondContact O-N 3.35Å; I202-M205 PolarHBondContact O-N 3.5Å; I202-I206 HydrophobicContact CG2-CD1 3.54Å; I202-I206 HydrophobicContact CG2-CG1 4.29Å; I202-I206 WeakPolarHBondContact O-CB 3.47Å; I202-I206 VanDerWaalsContact O-CG1 3.27Å; I202-I206 WeakPolarHBondContact O-CG1 3.47Å; I202-I206 PolarHBondContact O-N 3.39Å
203E74.9Confident76.8Confident37 Ų3766.5 Ų66.517%0.17331%0.314CS..Hα-helixtrans-58.5-47.7-180-179.6179.6-175.900112.2R190 A199 M201 L207R190-E203 IonicContact CZ-OE2 2.67Å; R190-E203 VanDerWaalsContact NH2-CD 3.26Å; R190-E203 IonicContact NH2-OE1 2.72Å; R190-E203 PolarHBondContact NH2-OE1 3.22Å; R190-E203 VanDerWaalsContact NH2-OE1 3.1Å; R190-E203 IonicContact NH2-OE2 3.1Å; R190-E203 PolarHBondContact NH2-OE2 3.41Å; A199-E203 VanDerWaalsContact O-CB 3.32Å; A199-E203 WeakPolarHBondContact O-CB 3.42Å; A199-E203 PolarHBondContact O-N 3.26Å; M201-E203 PolarHBondContact O-N 3.39Å; E203-L207 HydrophobicContact CG-CD1 4.28Å; E203-L207 PolarHBondContact O-N 2.92Å
204K73Confident77.2Confident61 Ų6164.5 Ų64.527%0.26531%0.306SS..Hα-helixtrans-71-36.7179.5-74.7-168.2173.2-164.90112.9V200 M201 I202 R208 I322 I329V200-K204 HydrophobicContact CG1-CD 4.5Å; V200-K204 WeakPolarHBondContact O-CB 3.45Å; V200-K204 PolarHBondContact O-N 3.28Å; V200-K204 VanDerWaalsContact O-N 3.09Å; M201-K204 PolarHBondContact O-N 2.91Å; I202-K204 PolarHBondContact O-N 3.35Å; K204-R208 WeakPolarHBondContact O-CB 3.39Å; K204-R208 PolarHBondContact O-N 3.41Å; K204-R208 VanDerWaalsContact O-N 3.1Å; K204-I322 HydrophobicContact CB-CD1 3.65Å; K204-I322 HydrophobicContact CD-CD1 4.13Å; K204-I329 HydrophobicContact CD-CD1 4.43Å
205M76.6Confident77.8Confident31 Ų3164.1 Ų64.115%0.15330%0.302CS..Hα-helixtrans-64.9-45177.5-171.117877.200110.6M201 I202 D209 L210 M315 T318 V319M201-M205 WeakPolarHBondContact O-CB 3.36Å; M201-M205 PolarHBondContact O-N 2.98Å; I202-M205 PolarHBondContact O-N 3.5Å; M205-D209 WeakPolarHBondContact O-CA 3.28Å; M205-D209 VanDerWaalsContact O-CB 3.29Å; M205-D209 WeakPolarHBondContact O-CB 3.45Å; M205-D209 PolarHBondContact O-N 2.88Å; M205-L210 PolarHBondContact O-N 3.3Å; M205-M315 HydrophobicContact CE-CE 3.79Å; M205-M315 HydrophobicContact CE-CG 4.34Å; M205-M315 HydrophobicContact CE-SD 3.8Å; M205-M315 HydrophobicContact CG-CE 4.3Å; M205-M315 HydrophobicContact CG-CG 3.89Å; M205-M315 HydrophobicContact SD-CB 3.91Å; M205-M315 HydrophobicContact SD-CE 4.21Å; M205-M315 HydrophobicContact SD-CG 3.59Å; M205-M315 VanDerWaalsContact SD-CG 3.59Å; M205-M315 HydrophobicContact SD-SD 3.82Å; M205-T318 HydrophobicContact CB-CG2 4.47Å; M205-V319 HydrophobicContact SD-CG2 3.98Å
206I77.1Confident78.1Confident78 Ų7862 Ų6240%0.430%0.295SS..Iπ-helixtrans-64.4-54.1176.8-68.3171.4000110.5I202 R208 L210I202-I206 HydrophobicContact CG2-CD1 3.54Å; I202-I206 HydrophobicContact CG2-CG1 4.29Å; I202-I206 WeakPolarHBondContact O-CB 3.47Å; I202-I206 VanDerWaalsContact O-CG1 3.27Å; I202-I206 WeakPolarHBondContact O-CG1 3.47Å; I202-I206 PolarHBondContact O-N 3.39Å; I206-R208 PolarHBondContact O-N 3.23Å; I206-L210 HydrophobicContact CG2-CB 4.41Å; I206-L210 HydrophobicContact CG2-CD2 4.16Å; I206-L210 WeakPolarHBondContact O-CB 3.28Å; I206-L210 PolarHBondContact O-N 3.15Å
207L71.5Confident78.5Confident68 Ų6862.9 Ų62.936%0.35630%0.299SS..Iπ-helixtrans-67-36.9-172.4-77.6170.3000113.8E203 C211E203-L207 HydrophobicContact CG-CD1 4.28Å; E203-L207 PolarHBondContact O-N 2.92Å; L207-C211 VanDerWaalsContact O-CB 3.3Å; L207-C211 WeakPolarHBondContact O-CB 3.31Å; L207-C211 PolarHBondContact O-SG 3.17Å
208R72.2Confident78.9Confident99 Ų9964.3 Ų64.337%0.37431%0.306SS..Iπ-helixtrans-89.3-46.4-176.6-173.5179.464.8-153.84.2112.5K204 I206 R212 T318K204-R208 WeakPolarHBondContact O-CB 3.39Å; K204-R208 PolarHBondContact O-N 3.41Å; K204-R208 VanDerWaalsContact O-N 3.1Å; I206-R208 PolarHBondContact O-N 3.23Å; R208-R212 WeakPolarHBondContact O-CG 3.39Å; R208-T318 PolarHBondContact NH2-OG1 3.36Å
209D78.8Confident79.4Confident4 Ų461.7 Ų61.72%0.02131%0.305CS..Iπ-helixtrans-94.5-41.8-166.7-51.4-20.5000110.5M205 C211 R212 F213 L314 T318M205-D209 WeakPolarHBondContact O-CA 3.28Å; M205-D209 VanDerWaalsContact O-CB 3.29Å; M205-D209 WeakPolarHBondContact O-CB 3.45Å; M205-D209 PolarHBondContact O-N 2.88Å; D209-C211 VanDerWaalsContact C-N 3.34Å; D209-C211 PolarHBondContact O-N 3.41Å; D209-R212 PolarHBondContact O-N 3.44Å; D209-F213 WeakPolarHBondContact O-CB 3.36Å; D209-F213 PolarHBondContact O-N 2.82Å; D209-F213 VanDerWaalsContact O-N 3.12Å; D209-L314 HydrophobicContact CB-CB 4.27Å; D209-T318 WeakPolarHBondContact OD2-CB 3.12Å; D209-T318 WeakPolarHBondContact OD2-CG2 3.17Å; D209-T318 PolarHBondContact OD2-OG1 3.23Å
210L79.4Confident79.8Confident59 Ų5963.6 Ų63.631%0.30931%0.309SS..Iπ-helixtrans-63.8-38174.2-159.192.8000111.6M205 I206 R212 F213 M214M205-L210 PolarHBondContact O-N 3.3Å; I206-L210 HydrophobicContact CG2-CB 4.41Å; I206-L210 HydrophobicContact CG2-CD2 4.16Å; I206-L210 WeakPolarHBondContact O-CB 3.28Å; I206-L210 PolarHBondContact O-N 3.15Å; L210-R212 PolarHBondContact O-N 2.85Å; L210-F213 HydrophobicContact CD1-CD1 4.49Å; L210-F213 WeakPolarHBondContact O-CB 3.49Å; L210-F213 PolarHBondContact O-N 2.85Å; L210-M214 HydrophobicContact CD2-CG 4.34Å; L210-M214 HydrophobicContact CG-CG 4.21Å; L210-M214 WeakPolarHBondContact O-CB 3.24Å; L210-M214 VanDerWaalsContact O-CG 3.24Å; L210-M214 WeakPolarHBondContact O-CG 3.46Å; L210-M214 PolarHBondContact O-N 3.03Å
211C77.1Confident80.5Confident72 Ų7264 Ų6449%0.48631%0.311SS..Hα-helixtrans-64.1-41.1179.5-71.40000113L207 D209 F213 M214 F215L207-C211 VanDerWaalsContact O-CB 3.3Å; L207-C211 WeakPolarHBondContact O-CB 3.31Å; L207-C211 PolarHBondContact O-SG 3.17Å; D209-C211 VanDerWaalsContact C-N 3.34Å; D209-C211 PolarHBondContact O-N 3.41Å; C211-F213 VanDerWaalsContact C-N 3.32Å; C211-M214 PolarHBondContact O-N 3.17Å; C211-F215 PolarHBondContact O-N 3.35Å; C211-F215 VanDerWaalsContact O-N 3.16Å
212R80.2Confident81.2Confident158 Ų15868.5 Ų68.560%0.59633%0.33SS*.Hα-helixtrans-64.7-41.8175.9-71.3174.1179.6-179.3-1.7111R208 D209 L210 F215 V216R208-R212 WeakPolarHBondContact O-CG 3.39Å; D209-R212 PolarHBondContact O-N 3.44Å; L210-R212 PolarHBondContact O-N 2.85Å; R212-F215 PolarHBondContact O-N 3.16Å; R212-V216 PolarHBondContact O-N 2.75Å
213F81.1Confident81.8Confident32 Ų3266 Ų6614%0.1433%0.326CS..Hα-helixtrans-62.4-47.9175.3166.4-90.8000112.6D209 L210 C211 F215 V216 Y217 L307 L311D209-F213 WeakPolarHBondContact O-CB 3.36Å; D209-F213 PolarHBondContact O-N 2.82Å; D209-F213 VanDerWaalsContact O-N 3.12Å; L210-F213 HydrophobicContact CD1-CD1 4.49Å; L210-F213 WeakPolarHBondContact O-CB 3.49Å; L210-F213 PolarHBondContact O-N 2.85Å; C211-F213 VanDerWaalsContact C-N 3.32Å; F213-F215 PolarHBondContact O-N 3.19Å; F213-V216 PolarHBondContact O-N 3.42Å; F213-V216 VanDerWaalsContact O-N 3.13Å; F213-Y217 WeakPolarHBondContact O-CB 3.4Å; F213-Y217 PolarHBondContact O-N 2.92Å; F213-L307 HydrophobicContact CE1-CD2 4.02Å; F213-L307 HydrophobicContact CE2-CB 4.33Å; F213-L307 HydrophobicContact CE2-CD2 3.58Å; F213-L307 HydrophobicContact CE2-CG 4.49Å; F213-L307 HydrophobicContact CZ-CB 4.44Å; F213-L307 HydrophobicContact CZ-CD2 3.13Å; F213-L307 HydrophobicContact CZ-CG 4.32Å; F213-L311 HydrophobicContact CD2-CB 4.49Å; F213-L311 HydrophobicContact CD2-CD1 4.19Å; F213-L311 HydrophobicContact CE2-CB 4.16Å; F213-L311 HydrophobicContact CE2-CD1 4.1Å; F213-L311 HydrophobicContact CG-CD1 4.43Å; F213-L311 HydrophobicContact CZ-CD1 4.35Å
214M83Confident82.4Confident68 Ų6866 Ų6634%0.33533%0.326SS..Hα-helixtrans-59.4-35.7179.1-76.3-56.1-60.900111.2L210 C211 Y217 L218L210-M214 HydrophobicContact CD2-CG 4.34Å; L210-M214 HydrophobicContact CG-CG 4.21Å; L210-M214 WeakPolarHBondContact O-CB 3.24Å; L210-M214 VanDerWaalsContact O-CG 3.24Å; L210-M214 WeakPolarHBondContact O-CG 3.46Å; L210-M214 PolarHBondContact O-N 3.03Å; C211-M214 PolarHBondContact O-N 3.17Å; M214-Y217 HydrophobicContact CE-CD1 4.14Å; M214-Y217 PolarHBondContact O-N 3.49Å; M214-Y217 HydrophobicContact SD-CD1 4.46Å; M214-L218 WeakPolarHBondContact O-CB 3.33Å; M214-L218 WeakPolarHBondContact O-CG 3.31Å; M214-L218 PolarHBondContact O-N 3.32Å
215F85.4Confident83.2Confident147 Ų14763.2 Ų63.265%0.64531%0.314SS*.Hα-helixtrans-62.2-49.9175.1-179.5-98.3000112.2C211 R212 F213 Y217 L218 V219C211-F215 PolarHBondContact O-N 3.35Å; C211-F215 VanDerWaalsContact O-N 3.16Å; R212-F215 PolarHBondContact O-N 3.16Å; F213-F215 PolarHBondContact O-N 3.19Å; F215-Y217 VanDerWaalsContact C-N 3.35Å; F215-Y217 PolarHBondContact O-N 2.79Å; F215-L218 PolarHBondContact O-N 2.92Å; F215-V219 HydrophobicContact CE1-CG2 4.47Å; F215-V219 HydrophobicContact CZ-CG2 4.5Å; F215-V219 WeakPolarHBondContact O-CG2 3.27Å; F215-V219 PolarHBondContact O-N 3.14Å
216V85.1Confident83.7Confident70 Ų7064.9 Ų64.942%0.42433%0.326SS..Hα-helixtrans-61.3-46.8176.6179.50000110.1R212 F213 L218 V219 F220R212-V216 PolarHBondContact O-N 2.75Å; F213-V216 PolarHBondContact O-N 3.42Å; F213-V216 VanDerWaalsContact O-N 3.13Å; V216-L218 PolarHBondContact O-N 3.11Å; V216-V219 PolarHBondContact O-N 3.22Å; V216-F220 HydrophobicContact CG1-CD2 4.16Å; V216-F220 HydrophobicContact CG1-CE2 4.06Å; V216-F220 WeakPolarHBondContact O-CD2 3.38Å; V216-F220 PolarHBondContact O-N 3.05Å
217Y86.6Confident84.2Confident17 Ų1762.9 Ų62.97%0.06732%0.322CS..Hα-helixtrans-57.3-44.5178.4175.5-105.2000113F213 M214 F215 V219 F220 L221 F271 T274 L307F213-Y217 WeakPolarHBondContact O-CB 3.4Å; F213-Y217 PolarHBondContact O-N 2.92Å; M214-Y217 HydrophobicContact CE-CD1 4.14Å; M214-Y217 PolarHBondContact O-N 3.49Å; M214-Y217 HydrophobicContact SD-CD1 4.46Å; F215-Y217 VanDerWaalsContact C-N 3.35Å; F215-Y217 PolarHBondContact O-N 2.79Å; Y217-V219 VanDerWaalsContact C-N 3.33Å; Y217-V219 PolarHBondContact O-N 3.49Å; Y217-F220 PolarHBondContact O-N 3.47Å; Y217-L221 HydrophobicContact CE1-CB 4.37Å; Y217-L221 HydrophobicContact CE1-CD2 3.89Å; Y217-L221 WeakPolarHBondContact O-CB 3.39Å; Y217-L221 PolarHBondContact O-N 3.11Å; Y217-F271 HydrophobicContact CE1-CD2 4.06Å; Y217-F271 HydrophobicContact CE1-CE2 4.36Å; Y217-F271 VanDerWaalsContact OH-CD2 3.23Å; Y217-F271 WeakPolarHBondContact OH-CD2 3.39Å; Y217-T274 HydrophobicContact CE2-CG2 3.97Å; Y217-T274 PolarHBondContact OH-OG1 2.9Å; Y217-L307 HydrophobicContact CD2-CD2 3.8Å; Y217-L307 HydrophobicContact CE2-CD2 4.25Å
218L88.3Confident84.8Confident69 Ų6959.9 Ų59.936%0.36131%0.306SS..Hα-helixtrans-63-38.3179.2-75171.3000112.2M214 F215 V216 F220 L221 F222M214-L218 WeakPolarHBondContact O-CB 3.33Å; M214-L218 WeakPolarHBondContact O-CG 3.31Å; M214-L218 PolarHBondContact O-N 3.32Å; F215-L218 PolarHBondContact O-N 2.92Å; V216-L218 PolarHBondContact O-N 3.11Å; L218-F220 VanDerWaalsContact C-N 3.32Å; L218-F220 PolarHBondContact O-N 3.32Å; L218-L221 HydrophobicContact CD2-CD2 4.39Å; L218-L221 PolarHBondContact O-N 3.36Å; L218-F222 HydrophobicContact CB-CD2 4.44Å; L218-F222 HydrophobicContact CD2-CE2 4.27Å; L218-F222 WeakPolarHBondContact O-CB 3.29Å; L218-F222 WeakPolarHBondContact O-CD2 3.38Å; L218-F222 PolarHBondContact O-N 3.49Å
219V89.4Confident85.2Confident86 Ų8655.5 Ų55.552%0.52129%0.29SS..Hα-helixtrans-60.2-44.5175.6173.10000110.8F215 V216 Y217 G223F215-V219 HydrophobicContact CE1-CG2 4.47Å; F215-V219 HydrophobicContact CZ-CG2 4.5Å; F215-V219 WeakPolarHBondContact O-CG2 3.27Å; F215-V219 PolarHBondContact O-N 3.14Å; V216-V219 PolarHBondContact O-N 3.22Å; Y217-V219 VanDerWaalsContact C-N 3.33Å; Y217-V219 PolarHBondContact O-N 3.49Å; V219-G223 PolarHBondContact O-N 3.05Å
220F87.4Confident85.4Confident61 Ų6159.6 Ų59.627%0.26832%0.316SS..Hα-helixtrans-66.7-45.8175.5-82.1-100.4000111.8V216 Y217 L218 F222 G223 F224 L306V216-F220 HydrophobicContact CG1-CD2 4.16Å; V216-F220 HydrophobicContact CG1-CE2 4.06Å; V216-F220 WeakPolarHBondContact O-CD2 3.38Å; V216-F220 PolarHBondContact O-N 3.05Å; Y217-F220 PolarHBondContact O-N 3.47Å; L218-F220 VanDerWaalsContact C-N 3.32Å; L218-F220 PolarHBondContact O-N 3.32Å; F220-F222 PolarHBondContact O-N 3.31Å; F220-G223 PolarHBondContact O-N 3.41Å; F220-F224 HydrophobicContact CD1-CD2 4.28Å; F220-F224 AromaticContact CD1-CE2 3.79Å; F220-F224 HydrophobicContact CD1-CE2 3.79Å; F220-F224 HydrophobicContact CE1-CE2 4.37Å; F220-F224 WeakPolarHBondContact O-CB 3.33Å; F220-F224 VanDerWaalsContact O-CD2 3.32Å; F220-F224 WeakPolarHBondContact O-CD2 3.24Å; F220-F224 PolarHBondContact O-N 3.41Å; F220-L306 HydrophobicContact CD1-CD1 4.02Å; F220-L306 HydrophobicContact CD2-CD1 4.18Å; F220-L306 HydrophobicContact CE1-CD1 3.52Å; F220-L306 HydrophobicContact CE2-CD1 3.68Å; F220-L306 HydrophobicContact CG-CD1 4.34Å; F220-L306 HydrophobicContact CZ-CD1 3.33Å
221L89.3Confident85.3Confident8 Ų858.6 Ų58.64%0.04231%0.31CS..Hα-helixtrans-59-46.9179.9-177.365.6000111.6Y217 L218 S225 C267 L270 Y299Y217-L221 HydrophobicContact CE1-CB 4.37Å; Y217-L221 HydrophobicContact CE1-CD2 3.89Å; Y217-L221 WeakPolarHBondContact O-CB 3.39Å; Y217-L221 PolarHBondContact O-N 3.11Å; L218-L221 HydrophobicContact CD2-CD2 4.39Å; L218-L221 PolarHBondContact O-N 3.36Å; L221-S225 WeakPolarHBondContact O-CB 3.43Å; L221-S225 PolarHBondContact O-N 3.23Å; L221-C267 WeakPolarHBondContact CD2-SG 3.16Å; L221-C267 VanDerWaalsContact CG-SG 3.6Å; L221-L270 HydrophobicContact CD1-CB 3.8Å; L221-Y299 VanDerWaalsContact CD1-OH 3.29Å; L221-Y299 WeakPolarHBondContact CD1-OH 3.25Å
222F90.3Very high85.1Confident125 Ų12555.6 Ų55.655%0.54829%0.289SS..Hα-helixtrans-66.3-45.7177-81.9-67.9000112.1L218 F220 S225 T226L218-F222 HydrophobicContact CB-CD2 4.44Å; L218-F222 HydrophobicContact CD2-CE2 4.27Å; L218-F222 WeakPolarHBondContact O-CB 3.29Å; L218-F222 WeakPolarHBondContact O-CD2 3.38Å; L218-F222 PolarHBondContact O-N 3.49Å; F220-F222 PolarHBondContact O-N 3.31Å; F222-S225 PolarHBondContact O-N 2.99Å; F222-T226 WeakPolarHBondContact O-CG2 3.11Å; F222-T226 PolarHBondContact O-N 2.86Å; F222-T226 PolarHBondContact O-OG1 3.3Å; F222-T226 VanDerWaalsContact O-OG1 3.14Å
223G91Very high84.3Confident36 Ų3652.9 Ų52.937%0.37128%0.283SS..Hα-helixtrans-62-45.6-179.200000113.3V219 F220 T226 A227V219-G223 PolarHBondContact O-N 3.05Å; F220-G223 PolarHBondContact O-N 3.41Å; G223-T226 PolarHBondContact O-OG1 3.46Å; G223-A227 PolarHBondContact O-N 2.82Å
224F88.5Confident83Confident37 Ų3756.2 Ų56.216%0.16230%0.303CS..Hα-helixtrans-72.6-35.4176.6-79.7-94.4000112.2F220 T226 A227 V228 L270 L295 Y299 L302F220-F224 HydrophobicContact CD1-CD2 4.28Å; F220-F224 AromaticContact CD1-CE2 3.79Å; F220-F224 HydrophobicContact CD1-CE2 3.79Å; F220-F224 HydrophobicContact CE1-CE2 4.37Å; F220-F224 WeakPolarHBondContact O-CB 3.33Å; F220-F224 VanDerWaalsContact O-CD2 3.32Å; F220-F224 WeakPolarHBondContact O-CD2 3.24Å; F220-F224 PolarHBondContact O-N 3.41Å; F224-T226 VanDerWaalsContact C-N 3.35Å; F224-T226 PolarHBondContact O-N 2.77Å; F224-A227 PolarHBondContact O-N 3.14Å; F224-V228 WeakPolarHBondContact O-CB 3.14Å; F224-V228 VanDerWaalsContact O-CG2 3.29Å; F224-V228 WeakPolarHBondContact O-CG2 3.48Å; F224-V228 PolarHBondContact O-N 3.43Å; F224-L270 HydrophobicContact CB-CD1 4.29Å; F224-L295 HydrophobicContact CD1-CD1 3.89Å; F224-L295 HydrophobicContact CD1-CG 4.17Å; F224-L295 HydrophobicContact CE1-CD1 3.83Å; F224-L295 HydrophobicContact CE1-CG 4.46Å; F224-Y299 HydrophobicContact CB-CD2 3.67Å; F224-Y299 HydrophobicContact CB-CE2 4.16Å; F224-Y299 HydrophobicContact CB-CG 4.39Å; F224-Y299 AromaticContact CD1-CD2 4Å; F224-Y299 HydrophobicContact CD1-CD2 4Å; F224-Y299 HydrophobicContact CD1-CG 4.26Å; F224-Y299 AromaticContact CD2-CD2 3.89Å; F224-Y299 HydrophobicContact CD2-CD2 3.89Å; F224-Y299 AromaticContact CG-CD2 3.57Å; F224-Y299 HydrophobicContact CG-CD2 3.57Å; F224-Y299 HydrophobicContact CG-CE2 4.41Å; F224-Y299 HydrophobicContact CG-CG 4.27Å; F224-L302 HydrophobicContact CZ-CD1 3.86Å
225S88.3Confident81.5Confident2 Ų255.1 Ų55.11%0.01431%0.308CS..Hα-helixtrans-60.3-44.1173.5-175.90000111.6L221 F222 A227 V228 V229 L263 C267 L270L221-S225 WeakPolarHBondContact O-CB 3.43Å; L221-S225 PolarHBondContact O-N 3.23Å; F222-S225 PolarHBondContact O-N 2.99Å; S225-A227 PolarHBondContact O-N 3.12Å; S225-V228 PolarHBondContact O-N 2.88Å; S225-V229 WeakPolarHBondContact O-CG2 3.48Å; S225-V229 PolarHBondContact O-N 3.06Å; S225-L263 PolarHBondContact OG-O 3.33Å; S225-C267 PolarHBondContact OG-N 3.46Å; S225-L270 VanDerWaalsContact CA-CD1 3.47Å
226T88.4Confident79.9Confident66 Ų6653.5 Ų53.541%0.40530%0.301SS..Hα-helixtrans-62-43.2175.9490000112.5F222 G223 F224 V228 V229 T230 L263F222-T226 WeakPolarHBondContact O-CG2 3.11Å; F222-T226 PolarHBondContact O-N 2.86Å; F222-T226 PolarHBondContact O-OG1 3.3Å; F222-T226 VanDerWaalsContact O-OG1 3.14Å; G223-T226 PolarHBondContact O-OG1 3.46Å; F224-T226 VanDerWaalsContact C-N 3.35Å; F224-T226 PolarHBondContact O-N 2.77Å; T226-V228 PolarHBondContact O-N 3.06Å; T226-V229 PolarHBondContact O-N 2.93Å; T226-T230 WeakPolarHBondContact O-CG2 3.44Å; T226-T230 PolarHBondContact O-N 2.91Å; T226-T230 PolarHBondContact O-OG1 3.08Å; T226-L263 HydrophobicContact CG2-CD2 3.78Å
227A87.6Confident78.1Confident37 Ų3756 Ų5631%0.30631%0.312SS..Hα-helixtrans-65.9-37.5178.900000112.7G223 F224 S225 T230 L231 L295G223-A227 PolarHBondContact O-N 2.82Å; F224-A227 PolarHBondContact O-N 3.14Å; S225-A227 PolarHBondContact O-N 3.12Å; A227-T230 WeakPolarHBondContact CA-OG1 3.3Å; A227-T230 PolarHBondContact O-OG1 3.35Å; A227-L231 PolarHBondContact O-N 3.42Å; A227-L295 HydrophobicContact CB-CD2 3.88Å
228V83.3Confident76Confident5 Ų562.4 Ų62.43%0.0335%0.348CS..Hα-helixtrans-69.5-43.3175.7173.30000111F224 S225 T226 T230 L231 I232 T266 L270 F292 L295F224-V228 WeakPolarHBondContact O-CB 3.14Å; F224-V228 VanDerWaalsContact O-CG2 3.29Å; F224-V228 WeakPolarHBondContact O-CG2 3.48Å; F224-V228 PolarHBondContact O-N 3.43Å; S225-V228 PolarHBondContact O-N 2.88Å; T226-V228 PolarHBondContact O-N 3.06Å; V228-T230 VanDerWaalsContact C-N 3.35Å; V228-T230 PolarHBondContact O-N 3.41Å; V228-L231 WeakPolarHBondContact O-CB 3.43Å; V228-L231 PolarHBondContact O-N 2.82Å; V228-L231 VanDerWaalsContact O-N 3.15Å; V228-I232 HydrophobicContact CG1-CD1 3.79Å; V228-I232 WeakPolarHBondContact O-CD1 3.19Å; V228-I232 WeakPolarHBondContact O-CG1 3.4Å; V228-I232 PolarHBondContact O-N 3.24Å; V228-T266 HydrophobicContact CB-CG2 3.76Å; V228-T266 HydrophobicContact CG1-CG2 3.46Å; V228-T266 VanDerWaalsContact CG1-CG2 3.46Å; V228-L270 HydrophobicContact CG2-CD1 4.42Å; V228-F292 HydrophobicContact CG1-CD2 4.18Å; V228-F292 HydrophobicContact CG1-CE2 3.59Å; V228-L295 HydrophobicContact CG2-CD2 3.69Å; V228-L295 HydrophobicContact CG2-CG 4.46Å
229V81.8Confident74Confident7 Ų764 Ų644%0.04236%0.364CS..Hα-helixtrans-61.9-41177.1168.40000112.2S225 T226 L231 I232 E233 L263 T266S225-V229 WeakPolarHBondContact O-CG2 3.48Å; S225-V229 PolarHBondContact O-N 3.06Å; T226-V229 PolarHBondContact O-N 2.93Å; V229-L231 PolarHBondContact O-N 3.05Å; V229-I232 WeakPolarHBondContact O-CB 3.48Å; V229-I232 PolarHBondContact O-N 2.6Å; V229-E233 HydrophobicContact CG1-CG 4.33Å; V229-E233 PolarHBondContact O-N 2.64Å; V229-L263 HydrophobicContact CB-CD2 3.75Å; V229-L263 HydrophobicContact CG1-CD2 4Å; V229-L263 HydrophobicContact CG1-CG 4.35Å; V229-L263 HydrophobicContact CG2-CD2 3.68Å; V229-L263 HydrophobicContact CG2-CG 4.3Å; V229-T266 HydrophobicContact CG2-CG2 3.87Å; V229-T266 WeakPolarHBondContact CG2-OG1 3.37Å
230T81.9Confident71.8Confident90 Ų9066.9 Ų66.955%0.55238%0.376SS*.Hα-helixtrans-61.9-30.5176.748.40000112.9T226 A227 V228 I232T226-T230 WeakPolarHBondContact O-CG2 3.44Å; T226-T230 PolarHBondContact O-N 2.91Å; T226-T230 PolarHBondContact O-OG1 3.08Å; A227-T230 WeakPolarHBondContact CA-OG1 3.3Å; A227-T230 PolarHBondContact O-OG1 3.35Å; V228-T230 VanDerWaalsContact C-N 3.35Å; V228-T230 PolarHBondContact O-N 3.41Å; T230-I232 VanDerWaalsContact C-N 3.31Å
231L78.1Confident69.7Low37 Ų3769.7 Ų69.719%0.19440%0.401CS..Hα-helixtrans-75.5-22.7176.1-159.868.7000112.5A227 V228 V229 F288 V291 F292A227-L231 PolarHBondContact O-N 3.42Å; V228-L231 WeakPolarHBondContact O-CB 3.43Å; V228-L231 PolarHBondContact O-N 2.82Å; V228-L231 VanDerWaalsContact O-N 3.15Å; V229-L231 PolarHBondContact O-N 3.05Å; L231-F288 HydrophobicContact CD1-CB 3.92Å; L231-F288 HydrophobicContact CD1-CD2 4.01Å; L231-F288 HydrophobicContact CD1-CG 4.34Å; L231-F288 HydrophobicContact CG-CB 4.45Å; L231-V291 HydrophobicContact CD1-CG1 4.5Å; L231-V291 HydrophobicContact CD2-CB 4.4Å; L231-V291 HydrophobicContact CD2-CG1 4.37Å; L231-F292 HydrophobicContact CD2-CB 3.63Å; L231-F292 HydrophobicContact CD2-CD2 4.21Å; L231-F292 HydrophobicContact CD2-CG 4.43Å
232I71.4Confident67.3Low10 Ų1075.8 Ų75.85%0.05144%0.438CS..Hα-helixtrans-85.5-34.5-179.4-65.8162.4000111.6V228 V229 T230 D234 G235 F282 Y286V228-I232 HydrophobicContact CG1-CD1 3.79Å; V228-I232 WeakPolarHBondContact O-CD1 3.19Å; V228-I232 WeakPolarHBondContact O-CG1 3.4Å; V228-I232 PolarHBondContact O-N 3.24Å; V229-I232 WeakPolarHBondContact O-CB 3.48Å; V229-I232 PolarHBondContact O-N 2.6Å; T230-I232 VanDerWaalsContact C-N 3.31Å; I232-D234 VanDerWaalsContact C-N 3.29Å; I232-D234 PolarHBondContact O-N 3.14Å; I232-G235 PolarHBondContact O-N 2.98Å; I232-F282 HydrophobicContact CD1-CE1 3.68Å; I232-F282 HydrophobicContact CD1-CZ 3.87Å; I232-F282 HydrophobicContact CG1-CE1 4.38Å; I232-Y286 HydrophobicContact CB-CE1 4.4Å; I232-Y286 HydrophobicContact CG1-CE1 4.05Å; I232-Y286 HydrophobicContact CG2-CE1 4.05Å
233E63.2Low64.9Low101 Ų10178.2 Ų78.247%0.47245%0.451SS..Hα-helixtrans-66.5-26.4-176.8-77.6-176.516600113.9V229 G235V229-E233 HydrophobicContact CG1-CG 4.33Å; V229-E233 PolarHBondContact O-N 2.64Å; E233-G235 PolarHBondContact O-N 3.01Å
234D54.4Low62.2Low102 Ų10281.9 Ų81.955%0.54547%0.471SS..G310 helixtrans-72.6-25.7-178.3-113.3-6.5000113.6I232 K236I232-D234 VanDerWaalsContact C-N 3.29Å; I232-D234 PolarHBondContact O-N 3.14Å; D234-K236 VanDerWaalsContact C-N 3.29Å; D234-K236 PolarHBondContact O-N 3.03Å
235G52.7Low60.1Low44 Ų4485.5 Ų85.545%0.45450%0.498SS..G310 helixtrans-77.5-4-175.700000115.6I232 E233 D287I232-G235 PolarHBondContact O-N 2.98Å; E233-G235 PolarHBondContact O-N 3.01Å; G235-D287 WeakPolarHBondContact CA-OD2 3.45Å
236K51.7Low58.2Low113 Ų11390.7 Ų90.749%0.49153%0.532SS..G310 helixtrans-113.2-12.1-175.2-156.4167.8-178.6172.60114.6D234 N238 S259D234-K236 VanDerWaalsContact C-N 3.29Å; D234-K236 PolarHBondContact O-N 3.03Å; K236-N238 VanDerWaalsContact C-N 3.3Å; K236-N238 PolarHBondContact O-N 2.96Å; K236-S259 PolarHBondContact NZ-OG 2.67Å
237N45.6Very low55.9Low124 Ų12495.7 Ų95.766%0.66355%0.55SS**THydrogen-bonded Turntrans-81.1-3.7-174.5-69.9-21.1000114.6
238N43.8Very low53.6Low151 Ų151103.3 Ų103.381%0.80758%0.576SS**THydrogen-bonded Turntrans-10022.3178.7-73-15.1000114.8K236 L240K236-N238 VanDerWaalsContact C-N 3.3Å; K236-N238 PolarHBondContact O-N 2.96Å; N238-L240 VanDerWaalsContact C-N 3.34Å; N238-L240 PolarHBondContact O-N 3.1Å
239S46.4Very low51.1Low101 Ų101109.9 Ų109.971%0.70662%0.621SS**  trans-8978.4160.752.40000109.7
240L41.8Very low48.9Very low147 Ų147121.5 Ų121.577%0.7766%0.664SS**  trans-48.7136.2165.2-79.1160.5000109.7N238 V242N238-L240 VanDerWaalsContact C-N 3.34Å; N238-L240 PolarHBondContact O-N 3.1Å; L240-V242 PolarHBondContact O-N 3.49Å
241P43.5Very low46.7Very low121 Ų121120.9 Ų120.979%0.78668%0.676SS**  trans-73.893.617129.8-29.2000108E243P241-E243 PolarHBondContact O-N 2.73Å
242V39.7Very low44.5Very low136 Ų136124.6 Ų124.682%0.82471%0.705SS**  trans-77.4115.8166.61750000107.6L240L240-V242 PolarHBondContact O-N 3.49Å
243E40.6Very low42.9Very low175 Ų175128.5 Ų128.582%0.81874%0.738SS**  trans-62.4140.3174.9-70.1-177.3137.500112.5P241P241-E243 PolarHBondContact O-N 2.73Å
244S34.3Very low41.5Very low114 Ų114129.5 Ų129.580%0.79776%0.755SS**  trans82155.6153.575.50000120.5
245P43.9Very low40.6Very low112 Ų112135.4 Ų135.473%0.72777%0.77SS**  cis-122.5-179.7-31.933.6-14.3000112.4H247P245-H247 PolarHBondContact O-N 3.32Å
246P48.3Very low39.9Very low112 Ų112138.8 Ų138.873%0.72778%0.784SS**  trans-94.2106.2-162.534.6-28.2000112.9
247H39.8Very low39.4Very low171 Ų171136.8 Ų136.879%0.79280%0.795SS**  trans-145.8116.1162.4-83.8-56.2000114.7P245P245-H247 PolarHBondContact O-N 3.32Å
248K40.3Very low39.4Very low197 Ų197136.2 Ų136.286%0.85779%0.792SS**  trans53.394.9148.9-70.7176.5176171.80117.8
249C29.5Very low39.7Very low142 Ų142132.6 Ų132.696%0.95978%0.779SS**  trans-108.1107.8152.2-73.80000110.1
250R36Very low40Very low251 Ų251132 Ų13295%0.94776%0.762SS**  trans-103.3117.2167-172.2179.7-170.1179.82.8106.8
251G36.7Very low40.9Very low78 Ų78128 Ų12880%0.80474%0.741SS**SBendtrans74.688.5157.500000117.8
252S31.9Very low42.3Very low115 Ų115124.9 Ų124.980%0.80472%0.722SS**  trans-169.6140.7130.3-172.60000107.8C254S252-C254 PolarHBondContact O-N 3.1Å
253A36.1Very low44.3Very low91 Ų91122.9 Ų122.975%0.75271%0.707SS**  trans-57.2103.8-17000000112.6R255A253-R255 PolarHBondContact O-N 2.99Å
254C35.6Very low46.3Very low123 Ų123122.6 Ų122.683%0.83170%0.699SS**  trans-65.789.4157.7-61.90000107.5S252 P256S252-C254 PolarHBondContact O-N 3.1Å; C254-P256 WeakPolarHBondContact O-CD 3.47Å
255R35.4Very low48.5Very low226 Ų226118 Ų11885%0.85367%0.667SS**  trans-58.5122.2154.8-76.8-176.8179.3-178.90.2105.6A253 G257A253-R255 PolarHBondContact O-N 2.99Å; R255-G257 PolarHBondContact O-N 3.4Å
256P36.9Very low50.4Low114 Ų114112.8 Ų112.874%0.7463%0.633SS**  trans-61.6112.7168.325.2-29.1000106C254 N258C254-P256 WeakPolarHBondContact O-CD 3.47Å; P256-N258 PolarHBondContact O-N 3.05Å
257G41.6Very low52.3Low71 Ų71108.4 Ų108.473%0.73261%0.605SS**  trans-55.9113.6170.300000107.3R255 S259R255-G257 PolarHBondContact O-N 3.4Å; G257-S259 PolarHBondContact O-N 3.26Å
258N45.8Very low54.4Low112 Ų112103.6 Ų103.660%0.59958%0.584SS**  trans-51.8108.9178.4-87.1-0.4000108.4P256 Y260P256-N258 PolarHBondContact O-N 3.05Å; N258-Y260 VanDerWaalsContact C-N 3.28Å; N258-Y260 HydrophobicContact CB-CD2 3.66Å; N258-Y260 HydrophobicContact CB-CE2 3.24Å; N258-Y260 PolarHBondContact ND2-OH 3.19Å; N258-Y260 VanDerWaalsContact ND2-OH 3.09Å; N258-Y260 WeakPolarHBondContact O-CD2 3.08Å; N258-Y260 PolarHBondContact O-N 3.48Å
259S49.9Very low56.4Low76 Ų7695.8 Ų95.853%0.53155%0.551SS.*  trans-75.385.1176.2-164.90000108K236 G257 N261K236-S259 PolarHBondContact NZ-OG 2.67Å; G257-S259 PolarHBondContact O-N 3.26Å; S259-N261 PolarHBondContact O-N 3.14Å
260Y52.7Low59Low87 Ų8789.4 Ų89.434%0.34151%0.507SS..  trans-72.634.9175.9-71.6-80.2000113.2N258 S262 S265 E269 F282N258-Y260 VanDerWaalsContact C-N 3.28Å; N258-Y260 HydrophobicContact CB-CD2 3.66Å; N258-Y260 HydrophobicContact CB-CE2 3.24Å; N258-Y260 PolarHBondContact ND2-OH 3.19Å; N258-Y260 VanDerWaalsContact ND2-OH 3.09Å; N258-Y260 WeakPolarHBondContact O-CD2 3.08Å; N258-Y260 PolarHBondContact O-N 3.48Å; Y260-S262 PolarHBondContact O-N 3.33Å; Y260-S262 VanDerWaalsContact O-N 3.1Å; Y260-S265 PolarHBondContact O-OG 2.79Å; Y260-S265 VanDerWaalsContact O-OG 3.13Å; Y260-E269 WeakPolarHBondContact CD1-OE1 3.49Å; Y260-E269 WeakPolarHBondContact CE1-OE1 3.49Å; Y260-F282 HydrophobicContact CD2-CD2 4.2Å; Y260-F282 AromaticContact CD2-CE2 3.71Å; Y260-F282 HydrophobicContact CD2-CE2 3.71Å; Y260-F282 AromaticContact CG-CE2 3.89Å; Y260-F282 HydrophobicContact CG-CE2 3.89Å
261N60Low61.4Low65 Ų6581.5 Ų81.535%0.34848%0.48SS..  trans-89.936.4-171.4-66.721.3000112.4S259S259-N261 PolarHBondContact O-N 3.14Å
262S72.7Confident63.8Low55 Ų5582.6 Ų82.639%0.38546%0.462SS..SBendtrans-121.3136.3176.676.60000110.5Y260 Y264 S265 T266Y260-S262 PolarHBondContact O-N 3.33Å; Y260-S262 VanDerWaalsContact O-N 3.1Å; S262-Y264 PolarHBondContact O-N 2.74Å; S262-S265 PolarHBondContact N-OG 2.99Å; S262-S265 PolarHBondContact O-N 3.14Å; S262-S265 PolarHBondContact O-OG 3.16Å; S262-S265 WeakPolarHBondContact OG-CB 3.39Å; S262-S265 PolarHBondContact OG-N 3.46Å; S262-S265 VanDerWaalsContact OG-N 3.12Å; S262-S265 PolarHBondContact OG-OG 3.47Å; S262-T266 PolarHBondContact O-N 3.1Å
263L82Confident66.2Low94 Ų9479 Ų7949%0.49243%0.433SS..Hα-helixtrans-50.5-30.5171.9-73.2165.6000112.7S225 T226 V229 C267S225-L263 PolarHBondContact OG-O 3.33Å; T226-L263 HydrophobicContact CG2-CD2 3.78Å; V229-L263 HydrophobicContact CB-CD2 3.75Å; V229-L263 HydrophobicContact CG1-CD2 4Å; V229-L263 HydrophobicContact CG1-CG 4.35Å; V229-L263 HydrophobicContact CG2-CD2 3.68Å; V229-L263 HydrophobicContact CG2-CG 4.3Å; L263-C267 WeakPolarHBondContact O-CB 3.45Å; L263-C267 PolarHBondContact O-N 3.44Å
264Y83.6Confident68.4Low169 Ų16976.3 Ų76.366%0.66341%0.407SS*.Hα-helixtrans-67.9-45.5176.1178.8-106.6000112.9S262 C267 L268S262-Y264 PolarHBondContact O-N 2.74Å; Y264-C267 WeakPolarHBondContact O-CB 3.1Å; Y264-C267 PolarHBondContact O-N 3.46Å; Y264-L268 HydrophobicContact CD1-CD1 4.14Å; Y264-L268 HydrophobicContact CE1-CD1 3.49Å; Y264-L268 VanDerWaalsContact CE1-CD1 3.49Å; Y264-L268 HydrophobicContact CE1-CG 4.29Å; Y264-L268 HydrophobicContact CE2-CD1 4.25Å; Y264-L268 HydrophobicContact CE2-CG 4.28Å; Y264-L268 WeakPolarHBondContact O-CG 2.9Å; Y264-L268 PolarHBondContact O-N 3.32Å
265S80.7Confident70.7Confident18 Ų1876.1 Ų76.113%0.12640%0.396CS..Hα-helixtrans-65.2-44.8179.146.10000112Y260 S262 C267 L268 E269Y260-S265 PolarHBondContact O-OG 2.79Å; Y260-S265 VanDerWaalsContact O-OG 3.13Å; S262-S265 PolarHBondContact N-OG 2.99Å; S262-S265 PolarHBondContact O-N 3.14Å; S262-S265 PolarHBondContact O-OG 3.16Å; S262-S265 WeakPolarHBondContact OG-CB 3.39Å; S262-S265 PolarHBondContact OG-N 3.46Å; S262-S265 VanDerWaalsContact OG-N 3.12Å; S262-S265 PolarHBondContact OG-OG 3.47Å; S265-C267 VanDerWaalsContact C-N 3.32Å; S265-C267 PolarHBondContact O-N 2.81Å; S265-L268 PolarHBondContact O-N 3.31Å; S265-E269 WeakPolarHBondContact O-CG 3.32Å; S265-E269 PolarHBondContact O-N 3.17Å
266T83.7Confident72.7Confident2 Ų268.8 Ų68.81%0.01239%0.391CS..Hα-helixtrans-64.4-37.9176.4-52.30000111.8V228 V229 S262 L268 E269 L270V228-T266 HydrophobicContact CB-CG2 3.76Å; V228-T266 HydrophobicContact CG1-CG2 3.46Å; V228-T266 VanDerWaalsContact CG1-CG2 3.46Å; V229-T266 HydrophobicContact CG2-CG2 3.87Å; V229-T266 WeakPolarHBondContact CG2-OG1 3.37Å; S262-T266 PolarHBondContact O-N 3.1Å; T266-L268 PolarHBondContact O-N 3.43Å; T266-E269 PolarHBondContact O-N 3.08Å; T266-L270 HydrophobicContact CG2-CD1 4.34Å; T266-L270 WeakPolarHBondContact O-CG 3.44Å; T266-L270 PolarHBondContact O-N 3.36Å
267C87.4Confident74.7Confident19 Ų1970.1 Ų70.113%0.12839%0.389CS..Hα-helixtrans-61-43.3174.3-177.70000111.8L221 S225 L263 Y264 S265 F271L221-C267 WeakPolarHBondContact CD2-SG 3.16Å; L221-C267 VanDerWaalsContact CG-SG 3.6Å; S225-C267 PolarHBondContact OG-N 3.46Å; L263-C267 WeakPolarHBondContact O-CB 3.45Å; L263-C267 PolarHBondContact O-N 3.44Å; Y264-C267 WeakPolarHBondContact O-CB 3.1Å; Y264-C267 PolarHBondContact O-N 3.46Å; S265-C267 VanDerWaalsContact C-N 3.32Å; S265-C267 PolarHBondContact O-N 2.81Å; C267-F271 WeakPolarHBondContact O-CB 3.21Å; C267-F271 PolarHBondContact O-N 3.44Å
268L84.2Confident76.2Confident70 Ų7067.8 Ų67.837%0.36636%0.364SS..Hα-helixtrans-66.5-37.3176.2-73-179.7000112.9Y264 S265 T266 F271 K272Y264-L268 HydrophobicContact CD1-CD1 4.14Å; Y264-L268 HydrophobicContact CE1-CD1 3.49Å; Y264-L268 VanDerWaalsContact CE1-CD1 3.49Å; Y264-L268 HydrophobicContact CE1-CG 4.29Å; Y264-L268 HydrophobicContact CE2-CD1 4.25Å; Y264-L268 HydrophobicContact CE2-CG 4.28Å; Y264-L268 WeakPolarHBondContact O-CG 2.9Å; Y264-L268 PolarHBondContact O-N 3.32Å; S265-L268 PolarHBondContact O-N 3.31Å; T266-L268 PolarHBondContact O-N 3.43Å; L268-F271 PolarHBondContact O-N 3.44Å; L268-K272 WeakPolarHBondContact O-CG 3.46Å; L268-K272 PolarHBondContact O-N 2.91Å
269E81.1Confident77.4Confident34 Ų3468.5 Ų68.516%0.15937%0.368CS..Hα-helixtrans-66.7-47.1176.9-73.6173.3-177.800111.5Y260 S265 T266 F271 K272 F273Y260-E269 WeakPolarHBondContact CD1-OE1 3.49Å; Y260-E269 WeakPolarHBondContact CE1-OE1 3.49Å; S265-E269 WeakPolarHBondContact O-CG 3.32Å; S265-E269 PolarHBondContact O-N 3.17Å; T266-E269 PolarHBondContact O-N 3.08Å; E269-F271 VanDerWaalsContact C-N 3.28Å; E269-F271 PolarHBondContact O-N 3.3Å; E269-K272 WeakPolarHBondContact O-CB 3.06Å; E269-K272 PolarHBondContact O-N 3.49Å; E269-K272 VanDerWaalsContact O-N 3.09Å; E269-F273 WeakPolarHBondContact O-CD2 3.43Å; E269-F273 PolarHBondContact O-N 3.36Å
270L85.8Confident78.2Confident7 Ų770.1 Ų70.14%0.03737%0.371CS..Hα-helixtrans-59.3-39.9173.3-71.6174.2000111.7L221 F224 S225 V228 T266 K272 F273 T274 L296 Y299L221-L270 HydrophobicContact CD1-CB 3.8Å; F224-L270 HydrophobicContact CB-CD1 4.29Å; S225-L270 VanDerWaalsContact CA-CD1 3.47Å; V228-L270 HydrophobicContact CG2-CD1 4.42Å; T266-L270 HydrophobicContact CG2-CD1 4.34Å; T266-L270 WeakPolarHBondContact O-CG 3.44Å; T266-L270 PolarHBondContact O-N 3.36Å; L270-K272 PolarHBondContact O-N 3.49Å; L270-F273 WeakPolarHBondContact O-CB 3.27Å; L270-F273 PolarHBondContact O-N 2.74Å; L270-T274 PolarHBondContact O-N 2.84Å; L270-L296 HydrophobicContact CD2-CD1 3.78Å; L270-Y299 HydrophobicContact CB-CE1 3.94Å; L270-Y299 HydrophobicContact CD2-CD1 3.82Å; L270-Y299 HydrophobicContact CD2-CE1 3.87Å; L270-Y299 HydrophobicContact CD2-CG 4.36Å; L270-Y299 HydrophobicContact CG-CE1 4.46Å; L270-Y299 PolarHBondContact O-OH 3.1Å
271F86.5Confident78.7Confident86 Ų8673.7 Ų73.738%0.37739%0.39SS..Hα-helixtrans-60.6-43.9173.2-179.8-99.3000112.2Y217 C267 L268 E269 F273 T274 I275Y217-F271 HydrophobicContact CE1-CD2 4.06Å; Y217-F271 HydrophobicContact CE1-CE2 4.36Å; Y217-F271 VanDerWaalsContact OH-CD2 3.23Å; Y217-F271 WeakPolarHBondContact OH-CD2 3.39Å; C267-F271 WeakPolarHBondContact O-CB 3.21Å; C267-F271 PolarHBondContact O-N 3.44Å; L268-F271 PolarHBondContact O-N 3.44Å; E269-F271 VanDerWaalsContact C-N 3.28Å; E269-F271 PolarHBondContact O-N 3.3Å; F271-F273 VanDerWaalsContact C-N 3.3Å; F271-F273 PolarHBondContact O-N 3.41Å; F271-T274 PolarHBondContact O-N 3.09Å; F271-T274 VanDerWaalsContact O-N 3.09Å; F271-T274 PolarHBondContact O-OG1 2.98Å; F271-I275 HydrophobicContact CD1-CD1 4.06Å; F271-I275 HydrophobicContact CE1-CD1 3.36Å; F271-I275 HydrophobicContact CE1-CG1 4.43Å; F271-I275 HydrophobicContact CE2-CD1 4.4Å; F271-I275 HydrophobicContact CZ-CD1 3.56Å; F271-I275 HydrophobicContact CZ-CG1 4.42Å; F271-I275 PolarHBondContact O-N 3.48Å
272K85.8Confident78.6Confident100 Ų10072.3 Ų72.344%0.43538%0.381SS..Hα-helixtrans-59.5-40.3174.2-71.6172.1-176.8-179.40111.9L268 E269 L270 T274 I275 G276 M277 G278L268-K272 WeakPolarHBondContact O-CG 3.46Å; L268-K272 PolarHBondContact O-N 2.91Å; E269-K272 WeakPolarHBondContact O-CB 3.06Å; E269-K272 PolarHBondContact O-N 3.49Å; E269-K272 VanDerWaalsContact O-N 3.09Å; L270-K272 PolarHBondContact O-N 3.49Å; K272-T274 VanDerWaalsContact C-N 3.3Å; K272-T274 PolarHBondContact O-N 2.63Å; K272-I275 PolarHBondContact O-N 3.05Å; K272-G276 PolarHBondContact O-N 3.46Å; K272-G276 VanDerWaalsContact O-N 3.14Å; K272-M277 PolarHBondContact O-N 3.2Å; K272-G278 PolarHBondContact O-N 3.22Å
273F82.6Confident78.1Confident40 Ų4070.1 Ų70.118%0.17537%0.366CS..Hα-helixtrans-60.3-38.6174.1-80.3-69.7000112.3E269 L270 F271 I275 G276 G278 D279 L280 L296E269-F273 WeakPolarHBondContact O-CD2 3.43Å; E269-F273 PolarHBondContact O-N 3.36Å; L270-F273 WeakPolarHBondContact O-CB 3.27Å; L270-F273 PolarHBondContact O-N 2.74Å; F271-F273 VanDerWaalsContact C-N 3.3Å; F271-F273 PolarHBondContact O-N 3.41Å; F273-I275 VanDerWaalsContact C-N 3.29Å; F273-I275 PolarHBondContact O-N 3.34Å; F273-G276 PolarHBondContact O-N 2.91Å; F273-G276 VanDerWaalsContact O-N 3.11Å; F273-G278 VanDerWaalsContact CE1-C 3.47Å; F273-G278 WeakPolarHBondContact CE1-O 3.2Å; F273-D279 WeakPolarHBondContact CZ-O 3.07Å; F273-L280 HydrophobicContact CE1-CD2 3.97Å; F273-L280 HydrophobicContact CE1-CG 4.21Å; F273-L280 HydrophobicContact CZ-CD2 4.1Å; F273-L280 HydrophobicContact CZ-CG 4.48Å; F273-L296 HydrophobicContact CD2-CD1 3.9Å; F273-L296 HydrophobicContact CE1-CD2 4.22Å; F273-L296 HydrophobicContact CE2-CD1 4.12Å; F273-L296 HydrophobicContact CE2-CD2 4.39Å; F273-L296 HydrophobicContact CG-CD1 4.17Å; F273-L296 HydrophobicContact CZ-CD2 4.08Å
274T83.4Confident77Confident35 Ų3572.6 Ų72.622%0.21537%0.374CS..Hα-helixtrans-68.8-24.3178.657.20000114.7Y217 L270 F271 K272 Y299 T303Y217-T274 HydrophobicContact CE2-CG2 3.97Å; Y217-T274 PolarHBondContact OH-OG1 2.9Å; L270-T274 PolarHBondContact O-N 2.84Å; F271-T274 PolarHBondContact O-N 3.09Å; F271-T274 VanDerWaalsContact O-N 3.09Å; F271-T274 PolarHBondContact O-OG1 2.98Å; K272-T274 VanDerWaalsContact C-N 3.3Å; K272-T274 PolarHBondContact O-N 2.63Å; T274-Y299 HydrophobicContact CG2-CE1 3.49Å; T274-Y299 VanDerWaalsContact CG2-CE1 3.49Å; T274-Y299 VanDerWaalsContact CG2-CZ 3.49Å; T274-Y299 WeakPolarHBondContact CG2-OH 3.18Å; T274-T303 HydrophobicContact CG2-CG2 4.31Å
275I83.5Confident75.8Confident119 Ų11971.1 Ų71.161%0.6138%0.378SS*.Hα-helixtrans-84.5-20.6173.6-64.8175.1000111.2F271 K272 F273F271-I275 HydrophobicContact CD1-CD1 4.06Å; F271-I275 HydrophobicContact CE1-CD1 3.36Å; F271-I275 HydrophobicContact CE1-CG1 4.43Å; F271-I275 HydrophobicContact CE2-CD1 4.4Å; F271-I275 HydrophobicContact CZ-CD1 3.56Å; F271-I275 HydrophobicContact CZ-CG1 4.42Å; F271-I275 PolarHBondContact O-N 3.48Å; K272-I275 PolarHBondContact O-N 3.05Å; F273-I275 VanDerWaalsContact C-N 3.29Å; F273-I275 PolarHBondContact O-N 3.34Å
276G77.7Confident75.1Confident71 Ų7172.4 Ų72.473%0.73238%0.381SS*.THydrogen-bonded Turntrans93.714.6-173.500000114.3K272 F273K272-G276 PolarHBondContact O-N 3.46Å; K272-G276 VanDerWaalsContact O-N 3.14Å; F273-G276 PolarHBondContact O-N 2.91Å; F273-G276 VanDerWaalsContact O-N 3.11Å
277M78.1Confident74.1Confident143 Ų14378 Ų7870%0.70441%0.41SS*.  trans-105.519176.2-161.4-167.3169.600112.1K272K272-M277 PolarHBondContact O-N 3.2Å
278G73.3Confident73.4Confident21 Ų2182.4 Ų82.422%0.21643%0.428CS..  trans-85.1125.1-178.100000111.7K272 F273K272-G278 PolarHBondContact O-N 3.22Å; F273-G278 VanDerWaalsContact CE1-C 3.47Å; F273-G278 WeakPolarHBondContact CE1-O 3.2Å
279D71Confident72.9Confident128 Ų12883.6 Ų83.668%0.68443%0.43SS*.  trans-90130.6174.8-66.9-36.5000110.5F273 E281F273-D279 WeakPolarHBondContact CZ-O 3.07Å; D279-E281 PolarHBondContact O-N 2.74Å
280L66.6Low72.8Confident110 Ų11085.2 Ų85.258%0.57645%0.449SS*.G310 helixtrans-78.80.2177.8-70.4163.8000113.1F273 F282 T283 L296F273-L280 HydrophobicContact CE1-CD2 3.97Å; F273-L280 HydrophobicContact CE1-CG 4.21Å; F273-L280 HydrophobicContact CZ-CD2 4.1Å; F273-L280 HydrophobicContact CZ-CG 4.48Å; L280-F282 PolarHBondContact O-N 3.15Å; L280-F282 VanDerWaalsContact O-N 3.14Å; L280-T283 VanDerWaalsContact O-CB 3.25Å; L280-T283 WeakPolarHBondContact O-CB 3.42Å; L280-T283 PolarHBondContact O-N 3.21Å; L280-T283 PolarHBondContact O-OG1 3.38Å; L280-L296 HydrophobicContact CD2-CD2 3.65Å
281E62.2Low72.7Confident161 Ų16188.7 Ų88.775%0.75247%0.471SS*.G310 helixtrans-63.7-20.1-175.4-158.3176.2-178.300112.9D279 T283D279-E281 PolarHBondContact O-N 2.74Å; E281-T283 PolarHBondContact O-N 3.1Å
282F59.8Low72.5Confident37 Ų3785.1 Ų85.116%0.16246%0.455CS..G310 helixtrans-66.6-20172.8-171.8-113.1000113.3I232 Y260 L280 E284 Y286 F292I232-F282 HydrophobicContact CD1-CE1 3.68Å; I232-F282 HydrophobicContact CD1-CZ 3.87Å; I232-F282 HydrophobicContact CG1-CE1 4.38Å; Y260-F282 HydrophobicContact CD2-CD2 4.2Å; Y260-F282 AromaticContact CD2-CE2 3.71Å; Y260-F282 HydrophobicContact CD2-CE2 3.71Å; Y260-F282 AromaticContact CG-CE2 3.89Å; Y260-F282 HydrophobicContact CG-CE2 3.89Å; L280-F282 PolarHBondContact O-N 3.15Å; L280-F282 VanDerWaalsContact O-N 3.14Å; F282-E284 VanDerWaalsContact C-N 3.3Å; F282-E284 PolarHBondContact O-N 3.01Å; F282-Y286 AromaticContact CD1-CE2 3.77Å; F282-Y286 HydrophobicContact CD1-CE2 3.77Å; F282-Y286 AromaticContact CE1-CE2 3.74Å; F282-Y286 HydrophobicContact CE1-CE2 3.74Å; F282-Y286 AromaticContact CE1-CZ 3.7Å; F282-Y286 WeakPolarHBondContact CE1-OH 3.35Å; F282-Y286 WeakPolarHBondContact CE2-OH 3.29Å; F282-Y286 HydrophobicContact CG-CE2 4.33Å; F282-Y286 HydrophobicContact CZ-CE2 4.28Å; F282-Y286 AromaticContact CZ-CZ 3.78Å; F282-Y286 WeakPolarHBondContact CZ-OH 3.5Å; F282-Y286 WeakPolarHBondContact O-CE2 3.02Å; F282-F292 HydrophobicContact CD1-CZ 4.22Å
283T60.9Low72.3Confident9 Ų984 Ų846%0.05545%0.453CS..G310 helixtrans-80.92.2-166.4-34.10000114.9L280 E281 K289 F292 I293L280-T283 VanDerWaalsContact O-CB 3.25Å; L280-T283 WeakPolarHBondContact O-CB 3.42Å; L280-T283 PolarHBondContact O-N 3.21Å; L280-T283 PolarHBondContact O-OG1 3.38Å; E281-T283 PolarHBondContact O-N 3.1Å; T283-K289 HydrophobicContact CG2-CG 4.35Å; T283-K289 WeakPolarHBondContact O-CE 3.3Å; T283-F292 HydrophobicContact CG2-CD1 3.42Å; T283-F292 VanDerWaalsContact CG2-CD1 3.42Å; T283-F292 HydrophobicContact CG2-CE1 3.56Å; T283-F292 HydrophobicContact CG2-CG 4.5Å; T283-I293 HydrophobicContact CG2-CD1 4.25Å; T283-I293 HydrophobicContact CG2-CG1 3.85Å
284E59.3Low72.5Confident145 Ų14587.6 Ų87.668%0.67847%0.473SS*.G310 helixtrans-87.1-13.2-171.2-68.6-164.2153.300115.2F282F282-E284 VanDerWaalsContact C-N 3.3Å; F282-E284 PolarHBondContact O-N 3.01Å
285N57.6Low72.6Confident139 Ų13988 Ų8874%0.74347%0.473SS*.SBendtrans-116.829.6-168-65.2-42.1000115.9
286Y67.3Low72.6Confident44 Ų4483 Ų8317%0.17345%0.447CS..  trans-124140.1-173.9-57.3-58.9000115.4I232 F282 F288 K289I232-Y286 HydrophobicContact CB-CE1 4.4Å; I232-Y286 HydrophobicContact CG1-CE1 4.05Å; I232-Y286 HydrophobicContact CG2-CE1 4.05Å; F282-Y286 AromaticContact CD1-CE2 3.77Å; F282-Y286 HydrophobicContact CD1-CE2 3.77Å; F282-Y286 AromaticContact CE1-CE2 3.74Å; F282-Y286 HydrophobicContact CE1-CE2 3.74Å; F282-Y286 AromaticContact CE1-CZ 3.7Å; F282-Y286 WeakPolarHBondContact CE1-OH 3.35Å; F282-Y286 WeakPolarHBondContact CE2-OH 3.29Å; F282-Y286 HydrophobicContact CG-CE2 4.33Å; F282-Y286 HydrophobicContact CZ-CE2 4.28Å; F282-Y286 AromaticContact CZ-CZ 3.78Å; F282-Y286 WeakPolarHBondContact CZ-OH 3.5Å; F282-Y286 WeakPolarHBondContact O-CE2 3.02Å; Y286-F288 VanDerWaalsContact C-N 3.31Å; Y286-F288 PolarHBondContact O-N 3.3Å; Y286-K289 PolarHBondContact O-N 2.84Å
287D62.5Low73.1Confident119 Ų11984.4 Ų84.464%0.63644%0.438SS*.THydrogen-bonded Turntrans-61.5-35.7-177.1-62.2-41.2000112.9G235G235-D287 WeakPolarHBondContact CA-OD2 3.45Å
288F72Confident73.5Confident112 Ų11279.3 Ų79.349%0.49142%0.419SS..THydrogen-bonded Turntrans-111.852.6179.4-59-69.4000112.6L231 Y286 A290 V291 F292L231-F288 HydrophobicContact CD1-CB 3.92Å; L231-F288 HydrophobicContact CD1-CD2 4.01Å; L231-F288 HydrophobicContact CD1-CG 4.34Å; L231-F288 HydrophobicContact CG-CB 4.45Å; Y286-F288 VanDerWaalsContact C-N 3.31Å; Y286-F288 PolarHBondContact O-N 3.3Å; F288-A290 PolarHBondContact O-N 3.09Å; F288-A290 VanDerWaalsContact O-N 3.14Å; F288-V291 HydrophobicContact CB-CB 4.2Å; F288-V291 HydrophobicContact CB-CG2 4.25Å; F288-V291 PolarHBondContact O-N 2.79Å; F288-F292 PolarHBondContact O-N 3.48Å; F288-F292 VanDerWaalsContact O-N 3.09Å
289K73.7Confident74.3Confident96 Ų9678.4 Ų78.442%0.41741%0.408SS..Hα-helixtrans-49.5-40.2-179.5-172.4172.8-174.6172.60113.8T283 Y286 F292 I293T283-K289 HydrophobicContact CG2-CG 4.35Å; T283-K289 WeakPolarHBondContact O-CE 3.3Å; Y286-K289 PolarHBondContact O-N 2.84Å; K289-F292 PolarHBondContact O-N 2.96Å; K289-I293 HydrophobicContact CG-CD1 3.88Å; K289-I293 VanDerWaalsContact O-CG1 3.29Å; K289-I293 WeakPolarHBondContact O-CG1 3.19Å; K289-I293 PolarHBondContact O-N 2.76Å
290A79.1Confident75Confident68 Ų6875 Ų7556%0.56239%0.392SS*.Hα-helixtrans-65.5-43.9179.500000112.7F288 F292 I293 I294F288-A290 PolarHBondContact O-N 3.09Å; F288-A290 VanDerWaalsContact O-N 3.14Å; A290-F292 VanDerWaalsContact C-N 3.34Å; A290-I293 PolarHBondContact O-N 3.43Å; A290-I294 WeakPolarHBondContact O-CB 3.14Å; A290-I294 WeakPolarHBondContact O-CD1 3.19Å; A290-I294 VanDerWaalsContact O-CG1 3.23Å; A290-I294 WeakPolarHBondContact O-CG1 3.22Å; A290-I294 PolarHBondContact O-N 3.47Å
291V83.4Confident76Confident80 Ų8073.7 Ų73.749%0.48539%0.385SS..Hα-helixtrans-66.3-40.6179.3-179.60000110.3L231 F288 I294 L295L231-V291 HydrophobicContact CD1-CG1 4.5Å; L231-V291 HydrophobicContact CD2-CB 4.4Å; L231-V291 HydrophobicContact CD2-CG1 4.37Å; F288-V291 HydrophobicContact CB-CB 4.2Å; F288-V291 HydrophobicContact CB-CG2 4.25Å; F288-V291 PolarHBondContact O-N 2.79Å; V291-I294 PolarHBondContact O-N 2.99Å; V291-L295 VanDerWaalsContact O-CB 3.28Å; V291-L295 WeakPolarHBondContact O-CB 3.16Å; V291-L295 PolarHBondContact O-N 3.16Å
292F81.9Confident77Confident10 Ų1069.5 Ų69.54%0.04437%0.367CS..Hα-helixtrans-59.2-50.4174.9-178.9-89.2000112.1V228 L231 F282 T283 F288 K289 A290 I294 L295 L296V228-F292 HydrophobicContact CG1-CD2 4.18Å; V228-F292 HydrophobicContact CG1-CE2 3.59Å; L231-F292 HydrophobicContact CD2-CB 3.63Å; L231-F292 HydrophobicContact CD2-CD2 4.21Å; L231-F292 HydrophobicContact CD2-CG 4.43Å; F282-F292 HydrophobicContact CD1-CZ 4.22Å; T283-F292 HydrophobicContact CG2-CD1 3.42Å; T283-F292 VanDerWaalsContact CG2-CD1 3.42Å; T283-F292 HydrophobicContact CG2-CE1 3.56Å; T283-F292 HydrophobicContact CG2-CG 4.5Å; F288-F292 PolarHBondContact O-N 3.48Å; F288-F292 VanDerWaalsContact O-N 3.09Å; K289-F292 PolarHBondContact O-N 2.96Å; A290-F292 VanDerWaalsContact C-N 3.34Å; F292-I294 VanDerWaalsContact C-N 3.34Å; F292-I294 PolarHBondContact O-N 2.99Å; F292-L295 PolarHBondContact O-N 3.48Å; F292-L296 HydrophobicContact CE1-CD2 4.21Å; F292-L296 WeakPolarHBondContact O-CB 3.35Å; F292-L296 PolarHBondContact O-N 3.46Å
293I82.4Confident78.1Confident77 Ų7768 Ų6840%0.39536%0.362SS..Hα-helixtrans-63.1-41.6-179-68.7168.9000110.8T283 K289 A290 L296 L297T283-I293 HydrophobicContact CG2-CD1 4.25Å; T283-I293 HydrophobicContact CG2-CG1 3.85Å; K289-I293 HydrophobicContact CG-CD1 3.88Å; K289-I293 VanDerWaalsContact O-CG1 3.29Å; K289-I293 WeakPolarHBondContact O-CG1 3.19Å; K289-I293 PolarHBondContact O-N 2.76Å; A290-I293 PolarHBondContact O-N 3.43Å; I293-L296 PolarHBondContact O-N 3.31Å; I293-L297 VanDerWaalsContact O-CB 3.25Å; I293-L297 WeakPolarHBondContact O-CB 3.4Å; I293-L297 PolarHBondContact O-N 3.16Å
294I86.6Confident79.1Confident116 Ų11674.7 Ų74.760%0.59539%0.387SS*.Hα-helixtrans-64.2-43.5177.1-68.5164.9000110.7A290 V291 F292 L297 A298A290-I294 WeakPolarHBondContact O-CB 3.14Å; A290-I294 WeakPolarHBondContact O-CD1 3.19Å; A290-I294 VanDerWaalsContact O-CG1 3.23Å; A290-I294 WeakPolarHBondContact O-CG1 3.22Å; A290-I294 PolarHBondContact O-N 3.47Å; V291-I294 PolarHBondContact O-N 2.99Å; F292-I294 VanDerWaalsContact C-N 3.34Å; F292-I294 PolarHBondContact O-N 2.99Å; I294-L297 PolarHBondContact O-N 2.92Å; I294-A298 VanDerWaalsContact O-CB 3.25Å; I294-A298 WeakPolarHBondContact O-CB 3.05Å; I294-A298 PolarHBondContact O-N 3.12Å
295L86.4Confident80Confident43 Ų4371.7 Ų71.723%0.22537%0.374CS..Hα-helixtrans-65.4-41.6178.7-172.769.1000111.7F224 A227 V228 V291 F292 A298 Y299F224-L295 HydrophobicContact CD1-CD1 3.89Å; F224-L295 HydrophobicContact CD1-CG 4.17Å; F224-L295 HydrophobicContact CE1-CD1 3.83Å; F224-L295 HydrophobicContact CE1-CG 4.46Å; A227-L295 HydrophobicContact CB-CD2 3.88Å; V228-L295 HydrophobicContact CG2-CD2 3.69Å; V228-L295 HydrophobicContact CG2-CG 4.46Å; V291-L295 VanDerWaalsContact O-CB 3.28Å; V291-L295 WeakPolarHBondContact O-CB 3.16Å; V291-L295 PolarHBondContact O-N 3.16Å; F292-L295 PolarHBondContact O-N 3.48Å; L295-A298 PolarHBondContact O-N 3.41Å; L295-Y299 WeakPolarHBondContact O-CB 3.08Å; L295-Y299 PolarHBondContact O-N 2.6Å
296L83.9Confident80.8Confident13 Ų1367.8 Ų67.87%0.06835%0.353CS..Hα-helixtrans-65.4-44.3176-175.369.8000111.3L270 F273 L280 F292 I293 Y299 V300L270-L296 HydrophobicContact CD2-CD1 3.78Å; F273-L296 HydrophobicContact CD2-CD1 3.9Å; F273-L296 HydrophobicContact CE1-CD2 4.22Å; F273-L296 HydrophobicContact CE2-CD1 4.12Å; F273-L296 HydrophobicContact CE2-CD2 4.39Å; F273-L296 HydrophobicContact CG-CD1 4.17Å; F273-L296 HydrophobicContact CZ-CD2 4.08Å; L280-L296 HydrophobicContact CD2-CD2 3.65Å; F292-L296 HydrophobicContact CE1-CD2 4.21Å; F292-L296 WeakPolarHBondContact O-CB 3.35Å; F292-L296 PolarHBondContact O-N 3.46Å; I293-L296 PolarHBondContact O-N 3.31Å; L296-Y299 WeakPolarHBondContact O-CB 3.46Å; L296-Y299 PolarHBondContact O-N 3.25Å; L296-V300 WeakPolarHBondContact O-CG2 3.24Å; L296-V300 PolarHBondContact O-N 3.42Å
297L86.3Confident81Confident102 Ų10267.4 Ų67.453%0.53435%0.354SS..Hα-helixtrans-63.8-44.4176.8-175.468.4000111.1I293 I294 Y299 V300 I301I293-L297 VanDerWaalsContact O-CB 3.25Å; I293-L297 WeakPolarHBondContact O-CB 3.4Å; I293-L297 PolarHBondContact O-N 3.16Å; I294-L297 PolarHBondContact O-N 2.92Å; L297-Y299 VanDerWaalsContact C-N 3.32Å; L297-Y299 PolarHBondContact O-N 3.33Å; L297-V300 PolarHBondContact O-N 3.11Å; L297-I301 HydrophobicContact CD1-CD1 4.07Å; L297-I301 HydrophobicContact CD1-CG1 4.44Å; L297-I301 HydrophobicContact CD2-CD1 4.45Å; L297-I301 HydrophobicContact CG-CD1 3.84Å; L297-I301 WeakPolarHBondContact O-CB 3.37Å; L297-I301 VanDerWaalsContact O-CG1 3.3Å; L297-I301 WeakPolarHBondContact O-CG1 3.38Å; L297-I301 PolarHBondContact O-N 2.97Å
298A88.4Confident81.3Confident36 Ų3664.5 Ų64.530%0.29834%0.338SS..Hα-helixtrans-60.3-42.9174.800000111.1I294 L295 L302I294-A298 VanDerWaalsContact O-CB 3.25Å; I294-A298 WeakPolarHBondContact O-CB 3.05Å; I294-A298 PolarHBondContact O-N 3.12Å; L295-A298 PolarHBondContact O-N 3.41Å; A298-L302 WeakPolarHBondContact O-CB 3.37Å; A298-L302 WeakPolarHBondContact O-CD1 3.42Å; A298-L302 WeakPolarHBondContact O-CG 3.16Å; A298-L302 PolarHBondContact O-N 3.42Å
299Y88.6Confident81.2Confident1 Ų163.7 Ų63.70%0.00434%0.339CS..Hα-helixtrans-59.6-50.3174.1171.8-104.9000111.9L221 F224 L270 T274 L295 L296 L297 I301 L302 T303L221-Y299 VanDerWaalsContact CD1-OH 3.29Å; L221-Y299 WeakPolarHBondContact CD1-OH 3.25Å; F224-Y299 HydrophobicContact CB-CD2 3.67Å; F224-Y299 HydrophobicContact CB-CE2 4.16Å; F224-Y299 HydrophobicContact CB-CG 4.39Å; F224-Y299 AromaticContact CD1-CD2 4Å; F224-Y299 HydrophobicContact CD1-CD2 4Å; F224-Y299 HydrophobicContact CD1-CG 4.26Å; F224-Y299 AromaticContact CD2-CD2 3.89Å; F224-Y299 HydrophobicContact CD2-CD2 3.89Å; F224-Y299 AromaticContact CG-CD2 3.57Å; F224-Y299 HydrophobicContact CG-CD2 3.57Å; F224-Y299 HydrophobicContact CG-CE2 4.41Å; F224-Y299 HydrophobicContact CG-CG 4.27Å; L270-Y299 HydrophobicContact CB-CE1 3.94Å; L270-Y299 HydrophobicContact CD2-CD1 3.82Å; L270-Y299 HydrophobicContact CD2-CE1 3.87Å; L270-Y299 HydrophobicContact CD2-CG 4.36Å; L270-Y299 HydrophobicContact CG-CE1 4.46Å; L270-Y299 PolarHBondContact O-OH 3.1Å; T274-Y299 HydrophobicContact CG2-CE1 3.49Å; T274-Y299 VanDerWaalsContact CG2-CE1 3.49Å; T274-Y299 VanDerWaalsContact CG2-CZ 3.49Å; T274-Y299 WeakPolarHBondContact CG2-OH 3.18Å; L295-Y299 WeakPolarHBondContact O-CB 3.08Å; L295-Y299 PolarHBondContact O-N 2.6Å; L296-Y299 WeakPolarHBondContact O-CB 3.46Å; L296-Y299 PolarHBondContact O-N 3.25Å; L297-Y299 VanDerWaalsContact C-N 3.32Å; L297-Y299 PolarHBondContact O-N 3.33Å; Y299-I301 PolarHBondContact O-N 2.97Å; Y299-L302 PolarHBondContact O-N 3.25Å; Y299-T303 HydrophobicContact CD2-CG2 3.67Å; Y299-T303 HydrophobicContact CE1-CG2 4.36Å; Y299-T303 HydrophobicContact CE2-CG2 3.37Å; Y299-T303 HydrophobicContact CG-CG2 4.3Å; Y299-T303 VanDerWaalsContact O-CB 3.25Å; Y299-T303 WeakPolarHBondContact O-CB 3.48Å; Y299-T303 VanDerWaalsContact O-CG2 3.28Å; Y299-T303 WeakPolarHBondContact O-CG2 3.34Å; Y299-T303 PolarHBondContact O-N 3.14Å; Y299-T303 PolarHBondContact O-OG1 3.48Å
300V86.1Confident81.2Confident56 Ų5664.2 Ų64.234%0.33934%0.344SS..Hα-helixtrans-62.5-43.8-179.51720000111L296 L297 T303 Y304L296-V300 WeakPolarHBondContact O-CG2 3.24Å; L296-V300 PolarHBondContact O-N 3.42Å; L297-V300 PolarHBondContact O-N 3.11Å; V300-T303 PolarHBondContact O-OG1 3.09Å; V300-Y304 WeakPolarHBondContact O-CB 3.42Å; V300-Y304 PolarHBondContact O-N 3.39Å
301I86.8Confident80.9Confident84 Ų8463.1 Ų63.143%0.43133%0.328SS..Hα-helixtrans-67.1-49.6178.6-67.3171000110.9L297 Y299 Y304 I305L297-I301 HydrophobicContact CD1-CD1 4.07Å; L297-I301 HydrophobicContact CD1-CG1 4.44Å; L297-I301 HydrophobicContact CD2-CD1 4.45Å; L297-I301 HydrophobicContact CG-CD1 3.84Å; L297-I301 WeakPolarHBondContact O-CB 3.37Å; L297-I301 VanDerWaalsContact O-CG1 3.3Å; L297-I301 WeakPolarHBondContact O-CG1 3.38Å; L297-I301 PolarHBondContact O-N 2.97Å; Y299-I301 PolarHBondContact O-N 2.97Å; I301-Y304 PolarHBondContact O-N 3.09Å; I301-I305 HydrophobicContact CG2-CD1 3.56Å; I301-I305 HydrophobicContact CG2-CG1 4.3Å; I301-I305 WeakPolarHBondContact O-CB 3.33Å; I301-I305 WeakPolarHBondContact O-CG1 3.46Å; I301-I305 PolarHBondContact O-N 3.31Å
302L83.6Confident80.2Confident73 Ų7364.5 Ų64.538%0.38233%0.332SS..Hα-helixtrans-63.9-44.6-179.2-73.2170.8000111.3F224 A298 Y299 L306F224-L302 HydrophobicContact CZ-CD1 3.86Å; A298-L302 WeakPolarHBondContact O-CB 3.37Å; A298-L302 WeakPolarHBondContact O-CD1 3.42Å; A298-L302 WeakPolarHBondContact O-CG 3.16Å; A298-L302 PolarHBondContact O-N 3.42Å; Y299-L302 PolarHBondContact O-N 3.25Å; L302-L306 VanDerWaalsContact O-CB 3.27Å; L302-L306 WeakPolarHBondContact O-CB 3.29Å; L302-L306 WeakPolarHBondContact O-CD1 3.45Å; L302-L306 WeakPolarHBondContact O-CG 2.88Å; L302-L306 PolarHBondContact O-N 3.01Å
303T83.4Confident79.7Confident6 Ų666.7 Ų66.74%0.03735%0.352CS..Hα-helixtrans-62.5-50.1173.654.90000109.8T274 Y299 V300 I305 L306 L307T274-T303 HydrophobicContact CG2-CG2 4.31Å; Y299-T303 HydrophobicContact CD2-CG2 3.67Å; Y299-T303 HydrophobicContact CE1-CG2 4.36Å; Y299-T303 HydrophobicContact CE2-CG2 3.37Å; Y299-T303 HydrophobicContact CG-CG2 4.3Å; Y299-T303 VanDerWaalsContact O-CB 3.25Å; Y299-T303 WeakPolarHBondContact O-CB 3.48Å; Y299-T303 VanDerWaalsContact O-CG2 3.28Å; Y299-T303 WeakPolarHBondContact O-CG2 3.34Å; Y299-T303 PolarHBondContact O-N 3.14Å; Y299-T303 PolarHBondContact O-OG1 3.48Å; V300-T303 PolarHBondContact O-OG1 3.09Å; T303-I305 PolarHBondContact O-N 3.09Å; T303-L306 CarbonylContact O-C 3.51Å; T303-L306 PolarHBondContact O-N 3.42Å; T303-L306 VanDerWaalsContact O-N 3.16Å; T303-L307 WeakPolarHBondContact O-CA 3.38Å; T303-L307 WeakPolarHBondContact O-CB 3.41Å; T303-L307 WeakPolarHBondContact O-CD1 3.24Å; T303-L307 WeakPolarHBondContact O-CG 3.48Å; T303-L307 PolarHBondContact O-N 2.94Å
304Y81.8Confident79Confident149 Ų14965.4 Ų65.458%0.58435%0.346SS*.Hα-helixtrans-58.2-42.9179.5-170.9-105.9000113.7V300 I301 L307 L308V300-Y304 WeakPolarHBondContact O-CB 3.42Å; V300-Y304 PolarHBondContact O-N 3.39Å; I301-Y304 PolarHBondContact O-N 3.09Å; Y304-L307 PolarHBondContact O-N 2.84Å; Y304-L308 HydrophobicContact CD1-CD1 3.89Å; Y304-L308 HydrophobicContact CD2-CD1 4.14Å; Y304-L308 HydrophobicContact CD2-CG 4.31Å; Y304-L308 HydrophobicContact CE1-CD1 3.33Å; Y304-L308 HydrophobicContact CE1-CG 4.39Å; Y304-L308 HydrophobicContact CE2-CD1 3.6Å; Y304-L308 HydrophobicContact CE2-CG 4.08Å; Y304-L308 HydrophobicContact CG-CD1 4.28Å; Y304-L308 WeakPolarHBondContact O-CB 3.27Å; Y304-L308 WeakPolarHBondContact O-CG 3.48Å; Y304-L308 PolarHBondContact O-N 2.84Å; Y304-L308 WeakPolarHBondContact OH-CD1 3.49Å
305I78.9Confident78.2Confident82 Ų8262 Ų6242%0.42133%0.328SS..Hα-helixtrans-62.7-46.9175.9-69.5171.5000110.8I301 T303 N309I301-I305 HydrophobicContact CG2-CD1 3.56Å; I301-I305 HydrophobicContact CG2-CG1 4.3Å; I301-I305 WeakPolarHBondContact O-CB 3.33Å; I301-I305 WeakPolarHBondContact O-CG1 3.46Å; I301-I305 PolarHBondContact O-N 3.31Å; T303-I305 PolarHBondContact O-N 3.09Å; I305-N309 WeakPolarHBondContact CG2-ND2 3.35Å; I305-N309 WeakPolarHBondContact O-CB 3.07Å; I305-N309 PolarHBondContact O-N 3.26Å; I305-N309 PolarHBondContact O-ND2 2.68Å
306L72.7Confident77.5Confident57 Ų5761.7 Ų61.730%0.29834%0.335SS..Hα-helixtrans-69.5-41.6178.7-69.3169.7000111.8F220 L302 T303 M310F220-L306 HydrophobicContact CD1-CD1 4.02Å; F220-L306 HydrophobicContact CD2-CD1 4.18Å; F220-L306 HydrophobicContact CE1-CD1 3.52Å; F220-L306 HydrophobicContact CE2-CD1 3.68Å; F220-L306 HydrophobicContact CG-CD1 4.34Å; F220-L306 HydrophobicContact CZ-CD1 3.33Å; L302-L306 VanDerWaalsContact O-CB 3.27Å; L302-L306 WeakPolarHBondContact O-CB 3.29Å; L302-L306 WeakPolarHBondContact O-CD1 3.45Å; L302-L306 WeakPolarHBondContact O-CG 2.88Å; L302-L306 PolarHBondContact O-N 3.01Å; T303-L306 CarbonylContact O-C 3.51Å; T303-L306 PolarHBondContact O-N 3.42Å; T303-L306 VanDerWaalsContact O-N 3.16Å; L306-M310 WeakPolarHBondContact O-CB 3.23Å; L306-M310 PolarHBondContact O-N 3.35Å; L306-M310 VanDerWaalsContact O-N 3.14Å
307L72.3Confident77.1Confident35 Ų3567.8 Ų67.818%0.18336%0.363CS..Hα-helixtrans-63.6-47.3-177.2-71170.6000109.1F213 Y217 T303 Y304 L311F213-L307 HydrophobicContact CE1-CD2 4.02Å; F213-L307 HydrophobicContact CE2-CB 4.33Å; F213-L307 HydrophobicContact CE2-CD2 3.58Å; F213-L307 HydrophobicContact CE2-CG 4.49Å; F213-L307 HydrophobicContact CZ-CB 4.44Å; F213-L307 HydrophobicContact CZ-CD2 3.13Å; F213-L307 HydrophobicContact CZ-CG 4.32Å; Y217-L307 HydrophobicContact CD2-CD2 3.8Å; Y217-L307 HydrophobicContact CE2-CD2 4.25Å; T303-L307 WeakPolarHBondContact O-CA 3.38Å; T303-L307 WeakPolarHBondContact O-CB 3.41Å; T303-L307 WeakPolarHBondContact O-CD1 3.24Å; T303-L307 WeakPolarHBondContact O-CG 3.48Å; T303-L307 PolarHBondContact O-N 2.94Å; Y304-L307 PolarHBondContact O-N 2.84Å; L307-L311 WeakPolarHBondContact O-CB 3.22Å; L307-L311 PolarHBondContact O-N 3.42Å
308L69.5Low76.5Confident59 Ų5963.4 Ų63.431%0.30934%0.341SS..Hα-helixtrans-76.4-48.4178.6-70.4-176.6000112.8Y304 M310 L311 I312Y304-L308 HydrophobicContact CD1-CD1 3.89Å; Y304-L308 HydrophobicContact CD2-CD1 4.14Å; Y304-L308 HydrophobicContact CD2-CG 4.31Å; Y304-L308 HydrophobicContact CE1-CD1 3.33Å; Y304-L308 HydrophobicContact CE1-CG 4.39Å; Y304-L308 HydrophobicContact CE2-CD1 3.6Å; Y304-L308 HydrophobicContact CE2-CG 4.08Å; Y304-L308 HydrophobicContact CG-CD1 4.28Å; Y304-L308 WeakPolarHBondContact O-CB 3.27Å; Y304-L308 WeakPolarHBondContact O-CG 3.48Å; Y304-L308 PolarHBondContact O-N 2.84Å; Y304-L308 WeakPolarHBondContact OH-CD1 3.49Å; L308-M310 PolarHBondContact O-N 3Å; L308-L311 PolarHBondContact O-N 2.89Å; L308-I312 HydrophobicContact CB-CD1 4.07Å; L308-I312 HydrophobicContact CD2-CD1 4.26Å; L308-I312 WeakPolarHBondContact O-CB 3.45Å; L308-I312 WeakPolarHBondContact O-CD1 3.36Å; L308-I312 WeakPolarHBondContact O-CG1 3.34Å; L308-I312 PolarHBondContact O-N 3.48Å
309N69.9Low75.9Confident95 Ų9563.9 Ų63.951%0.50834%0.34SS..Hα-helixtrans-69.7-39.3-169.6-68.6-21.8000112.7I305 A313I305-N309 WeakPolarHBondContact CG2-ND2 3.35Å; I305-N309 WeakPolarHBondContact O-CB 3.07Å; I305-N309 PolarHBondContact O-N 3.26Å; I305-N309 PolarHBondContact O-ND2 2.68Å; N309-A313 WeakPolarHBondContact O-CB 3.41Å; N309-A313 PolarHBondContact O-N 3.15Å
310M73.8Confident75.1Confident107 Ų10769.5 Ų69.553%0.52737%0.37SS..Hα-helixtrans-77.7-38.4177.2-68.2-67.3121.300112L306 L308 L314L306-M310 WeakPolarHBondContact O-CB 3.23Å; L306-M310 PolarHBondContact O-N 3.35Å; L306-M310 VanDerWaalsContact O-N 3.14Å; L308-M310 PolarHBondContact O-N 3Å; M310-L314 VanDerWaalsContact O-CB 3.27Å; M310-L314 WeakPolarHBondContact O-CB 3.48Å; M310-L314 WeakPolarHBondContact O-CD1 3.36Å; M310-L314 VanDerWaalsContact O-CG 3.24Å; M310-L314 WeakPolarHBondContact O-CG 3.37Å; M310-L314 PolarHBondContact O-N 2.85Å
311L72.1Confident74.4Confident44 Ų4472.7 Ų72.723%0.2338%0.379CS..Hα-helixtrans-67.1-45.5179.5-167.976000111.4F213 L307 L308 M315F213-L311 HydrophobicContact CD2-CB 4.49Å; F213-L311 HydrophobicContact CD2-CD1 4.19Å; F213-L311 HydrophobicContact CE2-CB 4.16Å; F213-L311 HydrophobicContact CE2-CD1 4.1Å; F213-L311 HydrophobicContact CG-CD1 4.43Å; F213-L311 HydrophobicContact CZ-CD1 4.35Å; L307-L311 WeakPolarHBondContact O-CB 3.22Å; L307-L311 PolarHBondContact O-N 3.42Å; L308-L311 PolarHBondContact O-N 2.89Å; L311-M315 HydrophobicContact CD1-CE 3.33Å; L311-M315 HydrophobicContact CD1-CG 4.43Å; L311-M315 HydrophobicContact CD1-SD 4.06Å; L311-M315 HydrophobicContact CD2-CE 4.31Å; L311-M315 HydrophobicContact CD2-SD 4.4Å; L311-M315 HydrophobicContact CG-CE 3.77Å; L311-M315 HydrophobicContact CG-CG 4.34Å; L311-M315 HydrophobicContact CG-SD 3.83Å; L311-M315 WeakPolarHBondContact O-CB 3.42Å; L311-M315 WeakPolarHBondContact O-CG 3.46Å; L311-M315 PolarHBondContact O-N 2.93Å
312I69Low73.6Confident109 Ų10968.8 Ų68.856%0.55936%0.359SS*.Hα-helixtrans-66.8-42.9179.6-64.6167.6000110.6L308 G316L308-I312 HydrophobicContact CB-CD1 4.07Å; L308-I312 HydrophobicContact CD2-CD1 4.26Å; L308-I312 WeakPolarHBondContact O-CB 3.45Å; L308-I312 WeakPolarHBondContact O-CD1 3.36Å; L308-I312 WeakPolarHBondContact O-CG1 3.34Å; L308-I312 PolarHBondContact O-N 3.48Å; I312-G316 WeakPolarHBondContact O-CA 3.39Å; I312-G316 PolarHBondContact O-N 3.01Å
313A70.1Confident72.9Confident57 Ų5767.9 Ų67.947%0.47136%0.362SS..Hα-helixtrans-63.7-46.5178.600000112.1N309 E317N309-A313 WeakPolarHBondContact O-CB 3.41Å; N309-A313 PolarHBondContact O-N 3.15Å; A313-E317 PolarHBondContact O-N 3.22Å; A313-E317 VanDerWaalsContact O-N 3.15Å
314L69.7Low72.3Confident49 Ų4975.4 Ų75.426%0.25740%0.397SS..Hα-helixtrans-71.9-43.3-179.2-69.5169.9000112D209 M310 T318D209-L314 HydrophobicContact CB-CB 4.27Å; M310-L314 VanDerWaalsContact O-CB 3.27Å; M310-L314 WeakPolarHBondContact O-CB 3.48Å; M310-L314 WeakPolarHBondContact O-CD1 3.36Å; M310-L314 VanDerWaalsContact O-CG 3.24Å; M310-L314 WeakPolarHBondContact O-CG 3.37Å; M310-L314 PolarHBondContact O-N 2.85Å; L314-T318 WeakPolarHBondContact O-CB 3.2Å; L314-T318 PolarHBondContact O-N 3.49Å; L314-T318 PolarHBondContact O-OG1 2.92Å
315M69.4Low71.8Confident46 Ų4672.7 Ų72.723%0.22739%0.39CS..Hα-helixtrans-67.1-38.3176.5-69.3-171.6173.400111.7M205 L311 V319M205-M315 HydrophobicContact CE-CE 3.79Å; M205-M315 HydrophobicContact CE-CG 4.34Å; M205-M315 HydrophobicContact CE-SD 3.8Å; M205-M315 HydrophobicContact CG-CE 4.3Å; M205-M315 HydrophobicContact CG-CG 3.89Å; M205-M315 HydrophobicContact SD-CB 3.91Å; M205-M315 HydrophobicContact SD-CE 4.21Å; M205-M315 HydrophobicContact SD-CG 3.59Å; M205-M315 VanDerWaalsContact SD-CG 3.59Å; M205-M315 HydrophobicContact SD-SD 3.82Å; L311-M315 HydrophobicContact CD1-CE 3.33Å; L311-M315 HydrophobicContact CD1-CG 4.43Å; L311-M315 HydrophobicContact CD1-SD 4.06Å; L311-M315 HydrophobicContact CD2-CE 4.31Å; L311-M315 HydrophobicContact CD2-SD 4.4Å; L311-M315 HydrophobicContact CG-CE 3.77Å; L311-M315 HydrophobicContact CG-CG 4.34Å; L311-M315 HydrophobicContact CG-SD 3.83Å; L311-M315 WeakPolarHBondContact O-CB 3.42Å; L311-M315 WeakPolarHBondContact O-CG 3.46Å; L311-M315 PolarHBondContact O-N 2.93Å; M315-V319 WeakPolarHBondContact O-CB 3.42Å; M315-V319 WeakPolarHBondContact O-CG2 3.05Å; M315-V319 PolarHBondContact O-N 3.21Å
316G72.1Confident71.4Confident36 Ų3669 Ų6937%0.37137%0.371SS..Hα-helixtrans-64.8-48.417900000113.3I312 N320I312-G316 WeakPolarHBondContact O-CA 3.39Å; I312-G316 PolarHBondContact O-N 3.01Å; G316-N320 PolarHBondContact O-N 3.3Å; G316-N320 VanDerWaalsContact O-N 3.16Å
317E74.8Confident71.4Confident140 Ų14071.4 Ų71.465%0.65438%0.379SS*.Hα-helixtrans-67.7-41.7177.3-167.3-176.517100111.3A313 N320 K321A313-E317 PolarHBondContact O-N 3.22Å; A313-E317 VanDerWaalsContact O-N 3.15Å; E317-N320 PolarHBondContact O-N 2.94Å; E317-K321 WeakPolarHBondContact O-CB 3.47Å; E317-K321 PolarHBondContact O-N 2.95Å
318T74.1Confident71.6Confident10 Ų1071.9 Ų71.96%0.06138%0.382CS..Hα-helixtrans-64.1-44.9177.1-72.80000112.1M205 R208 D209 L314 K321 I322M205-T318 HydrophobicContact CB-CG2 4.47Å; R208-T318 PolarHBondContact NH2-OG1 3.36Å; D209-T318 WeakPolarHBondContact OD2-CB 3.12Å; D209-T318 WeakPolarHBondContact OD2-CG2 3.17Å; D209-T318 PolarHBondContact OD2-OG1 3.23Å; L314-T318 WeakPolarHBondContact O-CB 3.2Å; L314-T318 PolarHBondContact O-N 3.49Å; L314-T318 PolarHBondContact O-OG1 2.92Å; T318-K321 PolarHBondContact O-N 3.01Å; T318-I322 HydrophobicContact CG2-CD1 3.29Å; T318-I322 HydrophobicContact CG2-CG1 3.82Å; T318-I322 WeakPolarHBondContact O-CA 3.03Å; T318-I322 WeakPolarHBondContact O-CB 3.36Å; T318-I322 WeakPolarHBondContact O-CG1 3.37Å; T318-I322 PolarHBondContact O-N 2.79Å
319V74.3Confident71.8Confident46 Ų4669.4 Ų69.428%0.27937%0.369SS..Hα-helixtrans-64-42.6179.6166.60000110.3M201 M205 M315 A323M201-V319 HydrophobicContact CE-CG1 4.49Å; M201-V319 HydrophobicContact CE-CG2 4.37Å; M201-V319 HydrophobicContact CG-CG2 4.46Å; M201-V319 HydrophobicContact SD-CB 4.37Å; M201-V319 HydrophobicContact SD-CG1 3.89Å; M201-V319 HydrophobicContact SD-CG2 4.07Å; M205-V319 HydrophobicContact SD-CG2 3.98Å; M315-V319 WeakPolarHBondContact O-CB 3.42Å; M315-V319 WeakPolarHBondContact O-CG2 3.05Å; M315-V319 PolarHBondContact O-N 3.21Å; V319-A323 WeakPolarHBondContact O-CA 3.18Å; V319-A323 WeakPolarHBondContact O-CB 3.14Å; V319-A323 PolarHBondContact O-N 3.44Å
320N71.8Confident72.2Confident120 Ų12065.2 Ų65.264%0.64235%0.346SS*.Hα-helixtrans-65.1-46.7178.1-78.5-19.5000112.4G316 E317 Q324G316-N320 PolarHBondContact O-N 3.3Å; G316-N320 VanDerWaalsContact O-N 3.16Å; E317-N320 PolarHBondContact O-N 2.94Å; N320-Q324 PolarHBondContact O-N 3.13Å
321K72.3Confident72.3Confident123 Ų12362.3 Ų62.354%0.53533%0.33SS..Hα-helixtrans-68.6-44178.6-173.8174.3-177.7171.10112.3E317 T318 Q324 E325E317-K321 WeakPolarHBondContact O-CB 3.47Å; E317-K321 PolarHBondContact O-N 2.95Å; T318-K321 PolarHBondContact O-N 3.01Å; K321-Q324 PolarHBondContact O-N 3.12Å; K321-E325 WeakPolarHBondContact CE-OE1 2.94Å; K321-E325 PolarHBondContact O-N 2.88Å; K321-E325 VanDerWaalsContact O-N 3.15Å
322I70Confident72.4Confident2 Ų260.5 Ų60.51%0.0132%0.321CS..Hα-helixtrans-69.9-35.6178.2-67.1-173.1000110.3M201 K204 T318 Q324 E325 S326M201-I322 HydrophobicContact CB-CG2 4.18Å; M201-I322 HydrophobicContact CG-CG2 3.98Å; K204-I322 HydrophobicContact CB-CD1 3.65Å; K204-I322 HydrophobicContact CD-CD1 4.13Å; T318-I322 HydrophobicContact CG2-CD1 3.29Å; T318-I322 HydrophobicContact CG2-CG1 3.82Å; T318-I322 WeakPolarHBondContact O-CA 3.03Å; T318-I322 WeakPolarHBondContact O-CB 3.36Å; T318-I322 WeakPolarHBondContact O-CG1 3.37Å; T318-I322 PolarHBondContact O-N 2.79Å; I322-Q324 PolarHBondContact O-N 2.97Å; I322-E325 CarbonylContact O-C 3.59Å; I322-E325 PolarHBondContact O-N 3.39Å; I322-S326 WeakPolarHBondContact O-CA 2.8Å; I322-S326 WeakPolarHBondContact O-CB 2.99Å; I322-S326 PolarHBondContact O-N 3.01Å; I322-S326 PolarHBondContact O-OG 3.1Å; I322-S326 VanDerWaalsContact O-OG 3.1Å
323A69.2Low72.6Confident53 Ų5357 Ų5744%0.43830%0.302SS..Hα-helixtrans-55.6-40.5175.100000111.1V319 S326V319-A323 WeakPolarHBondContact O-CA 3.18Å; V319-A323 WeakPolarHBondContact O-CB 3.14Å; V319-A323 PolarHBondContact O-N 3.44Å; A323-S326 PolarHBondContact O-OG 3.37Å
324Q69.6Low73.1Confident165 Ų16555.4 Ų55.477%0.77128%0.284SS*.Hα-helixtrans-73-38.9178.8-158150.9-7.800113.2N320 K321 I322N320-Q324 PolarHBondContact O-N 3.13Å; K321-Q324 PolarHBondContact O-N 3.12Å; I322-Q324 PolarHBondContact O-N 2.97Å
325E72Confident73.4Confident92 Ų9253.2 Ų53.243%0.4327%0.273SS..Hα-helixtrans-84.3-20.9177.8-68.1177.8-171.500113.9K321 I322 K327 N328 I329K321-E325 WeakPolarHBondContact CE-OE1 2.94Å; K321-E325 PolarHBondContact O-N 2.88Å; K321-E325 VanDerWaalsContact O-N 3.15Å; I322-E325 CarbonylContact O-C 3.59Å; I322-E325 PolarHBondContact O-N 3.39Å; E325-K327 VanDerWaalsContact C-N 3.32Å; E325-K327 PolarHBondContact O-N 3.01Å; E325-N328 WeakPolarHBondContact O-CB 3.28Å; E325-N328 PolarHBondContact O-N 3.17Å; E325-I329 HydrophobicContact CB-CD1 3.93Å; E325-I329 WeakPolarHBondContact O-CD1 3.38Å; E325-I329 WeakPolarHBondContact O-CG1 3.17Å; E325-I329 PolarHBondContact O-N 3.33Å
326S71Confident73.7Confident4 Ų452.3 Ų52.33%0.02827%0.269CS..Hα-helixtrans-65.4-33.9-167.859.10000112.1I197 I322 A323 N328 I329 W330I197-S326 WeakPolarHBondContact CG2-OG 3.13Å; I322-S326 WeakPolarHBondContact O-CA 2.8Å; I322-S326 WeakPolarHBondContact O-CB 2.99Å; I322-S326 PolarHBondContact O-N 3.01Å; I322-S326 PolarHBondContact O-OG 3.1Å; I322-S326 VanDerWaalsContact O-OG 3.1Å; A323-S326 PolarHBondContact O-OG 3.37Å; S326-N328 VanDerWaalsContact C-N 3.27Å; S326-N328 PolarHBondContact O-N 2.89Å; S326-I329 PolarHBondContact O-N 3.46Å; S326-W330 WeakPolarHBondContact O-CB 3.27Å; S326-W330 PolarHBondContact O-N 2.83Å
327K73.3Confident73.9Confident108 Ų10851.4 Ų51.447%0.4726%0.256SS..Hα-helixtrans-61.8-39.9175.7-168.2175-175.5176.90111.1E325 K331E325-K327 VanDerWaalsContact C-N 3.32Å; E325-K327 PolarHBondContact O-N 3.01Å; K327-K331 WeakPolarHBondContact O-CB 3.42Å; K327-K331 VanDerWaalsContact O-CG 3.3Å; K327-K331 WeakPolarHBondContact O-CG 3.15Å; K327-K331 PolarHBondContact O-N 3.27Å
328N75.1Confident74Confident45 Ų4544.8 Ų44.824%0.24123%0.225CC..Hα-helixtrans-77.1-34.2-179.6-60.9-13.8000111.1H43 L47 E325 S326 L332H43-N328 HydrophobicContact CB-CB 3.99Å; H43-N328 PolarHBondContact ND1-O 3.43Å; H43-N328 VanDerWaalsContact ND1-O 3.1Å; L47-N328 HydrophobicContact CD1-CB 3.95Å; L47-N328 WeakPolarHBondContact CD1-ND2 3.34Å; L47-N328 VanDerWaalsContact CD1-OD1 3.3Å; L47-N328 WeakPolarHBondContact CD1-OD1 3.43Å; E325-N328 WeakPolarHBondContact O-CB 3.28Å; E325-N328 PolarHBondContact O-N 3.17Å; S326-N328 VanDerWaalsContact C-N 3.27Å; S326-N328 PolarHBondContact O-N 2.89Å; N328-L332 PolarHBondContact O-N 3.42Å
329I73.8Confident73.9Confident7 Ų745.3 Ų45.34%0.03623%0.227CC..Hα-helixtrans-67.9-45.5172.8-62.4154.7000111.2V200 K204 E325 S326 K331 L332 Q333V200-I329 HydrophobicContact CG1-CB 4.27Å; V200-I329 HydrophobicContact CG1-CG2 3.59Å; K204-I329 HydrophobicContact CD-CD1 4.43Å; E325-I329 HydrophobicContact CB-CD1 3.93Å; E325-I329 WeakPolarHBondContact O-CD1 3.38Å; E325-I329 WeakPolarHBondContact O-CG1 3.17Å; E325-I329 PolarHBondContact O-N 3.33Å; S326-I329 PolarHBondContact O-N 3.46Å; I329-K331 PolarHBondContact O-N 3.22Å; I329-L332 WeakPolarHBondContact O-CB 3.25Å; I329-L332 PolarHBondContact O-N 3.22Å; I329-L332 VanDerWaalsContact O-N 3.17Å; I329-Q333 WeakPolarHBondContact O-CG 3.47Å; I329-Q333 PolarHBondContact O-N 3.39Å
330W78.2Confident73.8Confident7 Ų745.5 Ų45.53%0.02723%0.227CC..Hα-helixtrans-61.2-44.3176.3171.177.1000110.9R190 Q193 I197 S326 L332 Q333 R334R190-W330 PolarHBondContact O-NE1 3.12Å; Q193-W330 VanDerWaalsContact CA-CZ2 3.48Å; Q193-W330 HydrophobicContact CB-CH2 3.75Å; Q193-W330 HydrophobicContact CB-CZ2 3.69Å; Q193-W330 HydrophobicContact CG-CH2 3.52Å; Q193-W330 HydrophobicContact CG-CZ2 3.86Å; Q193-W330 HydrophobicContact CG-CZ3 3.9Å; I197-W330 HydrophobicContact CG1-CB 4.08Å; I197-W330 HydrophobicContact CG1-CD2 4.41Å; I197-W330 HydrophobicContact CG1-CG 4.06Å; S326-W330 WeakPolarHBondContact O-CB 3.27Å; S326-W330 PolarHBondContact O-N 2.83Å; W330-L332 VanDerWaalsContact C-N 3.33Å; W330-L332 PolarHBondContact O-N 3.26Å; W330-Q333 PolarHBondContact O-N 2.86Å; W330-R334 WeakPolarHBondContact O-CB 3.47Å; W330-R334 PolarHBondContact O-N 3.47Å
331K75.6Confident73.9Confident46 Ų4640.9 Ų40.920%0.220%0.203CC..Hα-helixtrans-59-41.8173.1-78.9-179.7177.9-169.10112.4L47 N52 K327 I329 R334 A335L47-K331 HydrophobicContact CD2-CD 3.39Å; N52-K331 PolarHBondContact ND2-NZ 3.5Å; K327-K331 WeakPolarHBondContact O-CB 3.42Å; K327-K331 VanDerWaalsContact O-CG 3.3Å; K327-K331 WeakPolarHBondContact O-CG 3.15Å; K327-K331 PolarHBondContact O-N 3.27Å; I329-K331 PolarHBondContact O-N 3.22Å; K331-R334 PolarHBondContact O-N 2.85Å; K331-A335 WeakPolarHBondContact O-CB 3.03Å; K331-A335 PolarHBondContact O-N 3.35Å
332L75.6Confident73.9Confident6 Ų637 Ų373%0.03119%0.187CC..Hα-helixtrans-62.3-49173.8170.267.9000111.3R42 H43 L46 N328 I329 W330 R334 A335 I336R42-L332 HydrophobicContact CG-CD2 4.07Å; H43-L332 WeakPolarHBondContact CE1-CD2 3.32Å; H43-L332 WeakPolarHBondContact ND1-CB 3.4Å; L46-L332 HydrophobicContact CD1-CB 4.37Å; L46-L332 HydrophobicContact CD1-CD1 3.12Å; L46-L332 HydrophobicContact CD1-CG 4.31Å; N328-L332 PolarHBondContact O-N 3.42Å; I329-L332 WeakPolarHBondContact O-CB 3.25Å; I329-L332 PolarHBondContact O-N 3.22Å; I329-L332 VanDerWaalsContact O-N 3.17Å; W330-L332 VanDerWaalsContact C-N 3.33Å; W330-L332 PolarHBondContact O-N 3.26Å; L332-R334 VanDerWaalsContact C-N 3.26Å; L332-R334 PolarHBondContact O-N 3.28Å; L332-A335 WeakPolarHBondContact O-CA 3.25Å; L332-A335 WeakPolarHBondContact O-CB 3.43Å; L332-A335 PolarHBondContact O-N 2.9Å; L332-A335 VanDerWaalsContact O-N 3.08Å; L332-I336 HydrophobicContact CD1-CD1 3.89Å; L332-I336 HydrophobicContact CD1-CG1 4.05Å; L332-I336 HydrophobicContact CD2-CD1 4.3Å; L332-I336 HydrophobicContact CG-CD1 3.81Å; L332-I336 HydrophobicContact CG-CG1 4.36Å; L332-I336 WeakPolarHBondContact O-CG1 3.07Å; L332-I336 PolarHBondContact O-N 3.39Å
333Q73.6Confident73.9Confident34 Ų3441.3 Ų41.316%0.15921%0.205CC..Hα-helixtrans-61.7-37.5179.6-73.8-171.9-9.900111.7I329 W330 I336 T337I329-Q333 WeakPolarHBondContact O-CG 3.47Å; I329-Q333 PolarHBondContact O-N 3.39Å; W330-Q333 PolarHBondContact O-N 2.86Å; Q333-I336 PolarHBondContact O-N 3.5Å; Q333-T337 WeakPolarHBondContact O-CB 3.37Å; Q333-T337 PolarHBondContact O-N 3.35Å; Q333-T337 PolarHBondContact O-OG1 2.97Å
334R79.6Confident73.8Confident24 Ų2443.8 Ų43.89%0.09122%0.219CC..Hα-helixtrans-62.1-45.4172.1-165.917576.5167.83.7110.8W59 W330 K331 L332 I336 T337 I338W59-R334 HydrophobicContact CD2-CG 4.3Å; W59-R334 HydrophobicContact CE3-CG 3.89Å; W59-R334 HydrophobicContact CZ3-CG 4.07Å; W330-R334 WeakPolarHBondContact O-CB 3.47Å; W330-R334 PolarHBondContact O-N 3.47Å; K331-R334 PolarHBondContact O-N 2.85Å; L332-R334 VanDerWaalsContact C-N 3.26Å; L332-R334 PolarHBondContact O-N 3.28Å; R334-I336 PolarHBondContact O-N 3.13Å; R334-T337 PolarHBondContact O-N 3.2Å; R334-I338 HydrophobicContact CG-CD1 4.15Å; R334-I338 WeakPolarHBondContact O-CD1 3.38Å; R334-I338 WeakPolarHBondContact O-CG1 3.13Å; R334-I338 PolarHBondContact O-N 3.44Å
335A75.7Confident73.5Confident4 Ų438.1 Ų38.13%0.03319%0.192CC..Hα-helixtrans-60.4-44.7176.100000112.4L55 K331 L332 I338 L339L55-A335 HydrophobicContact CD1-CB 3.64Å; L55-A335 HydrophobicContact CD2-CB 4.3Å; K331-A335 WeakPolarHBondContact O-CB 3.03Å; K331-A335 PolarHBondContact O-N 3.35Å; L332-A335 WeakPolarHBondContact O-CA 3.25Å; L332-A335 WeakPolarHBondContact O-CB 3.43Å; L332-A335 PolarHBondContact O-N 2.9Å; L332-A335 VanDerWaalsContact O-N 3.08Å; A335-I338 PolarHBondContact O-N 3.07Å; A335-L339 WeakPolarHBondContact O-CB 3.37Å; A335-L339 PolarHBondContact O-N 3.16Å
336I75.1Confident72.8Confident27 Ų2740.5 Ų40.514%0.13821%0.207CC..Hα-helixtrans-60.4-47.2175.7-66.9167.1000110L332 Q333 R334 I338 L339 D340L332-I336 HydrophobicContact CD1-CD1 3.89Å; L332-I336 HydrophobicContact CD1-CG1 4.05Å; L332-I336 HydrophobicContact CD2-CD1 4.3Å; L332-I336 HydrophobicContact CG-CD1 3.81Å; L332-I336 HydrophobicContact CG-CG1 4.36Å; L332-I336 WeakPolarHBondContact O-CG1 3.07Å; L332-I336 PolarHBondContact O-N 3.39Å; Q333-I336 PolarHBondContact O-N 3.5Å; R334-I336 PolarHBondContact O-N 3.13Å; I336-I338 VanDerWaalsContact C-N 3.34Å; I336-I338 PolarHBondContact O-N 3.37Å; I336-L339 PolarHBondContact O-N 2.65Å; I336-L339 VanDerWaalsContact O-N 3.15Å; I336-D340 WeakPolarHBondContact CG2-OD2 3.36Å; I336-D340 WeakPolarHBondContact O-CB 3.49Å; I336-D340 PolarHBondContact O-N 2.84Å
337T77.3Confident72.2Confident16 Ų1649.1 Ų49.110%0.09824%0.244CC..Hα-helixtrans-60.3-43.9178.6-54.20000111.3F67 Q333 R334 L339 T341F67-T337 HydrophobicContact CD2-CG2 4.11Å; F67-T337 HydrophobicContact CE2-CG2 4.03Å; Q333-T337 WeakPolarHBondContact O-CB 3.37Å; Q333-T337 PolarHBondContact O-N 3.35Å; Q333-T337 PolarHBondContact O-OG1 2.97Å; R334-T337 PolarHBondContact O-N 3.2Å; T337-L339 VanDerWaalsContact C-N 3.34Å; T337-L339 PolarHBondContact O-N 3.31Å; T337-T341 VanDerWaalsContact O-CB 3.32Å; T337-T341 WeakPolarHBondContact O-CB 3.5Å; T337-T341 PolarHBondContact O-N 3.3Å; T337-T341 PolarHBondContact O-OG1 2.9Å
338I77.4Confident71.2Confident1 Ų149.1 Ų49.11%0.00526%0.257CS..Hα-helixtrans-57.7-48.9175-69.3160.5000110.1L55 K58 W59 V63 R334 A335 I336 T341 E342L55-I338 HydrophobicContact CB-CD1 4.16Å; L55-I338 HydrophobicContact CD2-CD1 4.04Å; L55-I338 HydrophobicContact CD2-CG2 4.2Å; L55-I338 WeakPolarHBondContact O-CD1 3.21Å; K58-I338 HydrophobicContact CB-CG2 4.39Å; K58-I338 HydrophobicContact CD-CG2 4.48Å; W59-I338 HydrophobicContact CB-CD1 4.25Å; W59-I338 HydrophobicContact CE3-CD1 4.11Å; W59-I338 HydrophobicContact CE3-CG1 3.77Å; W59-I338 HydrophobicContact CZ3-CG1 4.41Å; V63-I338 HydrophobicContact CB-CG1 4.46Å; V63-I338 HydrophobicContact CG1-CG1 4.2Å; V63-I338 HydrophobicContact CG2-CB 4.42Å; V63-I338 HydrophobicContact CG2-CG1 4.11Å; V63-I338 HydrophobicContact CG2-CG2 4.1Å; R334-I338 HydrophobicContact CG-CD1 4.15Å; R334-I338 WeakPolarHBondContact O-CD1 3.38Å; R334-I338 WeakPolarHBondContact O-CG1 3.13Å; R334-I338 PolarHBondContact O-N 3.44Å; A335-I338 PolarHBondContact O-N 3.07Å; I336-I338 VanDerWaalsContact C-N 3.34Å; I336-I338 PolarHBondContact O-N 3.37Å; I338-T341 PolarHBondContact O-N 3.16Å; I338-E342 WeakPolarHBondContact O-CB 3.16Å; I338-E342 WeakPolarHBondContact O-CG 3.16Å; I338-E342 PolarHBondContact O-N 3.48Å
339L72.3Confident70.4Confident21 Ų2151.2 Ų51.211%0.1127%0.266CS..Hα-helixtrans-70.2-37.2-174.3-141154.9000112L30 A31 A34 A335 I336 T337 E342 K343L30-L339 HydrophobicContact CG-CD1 4.2Å; A31-L339 HydrophobicContact CB-CD1 4.47Å; A31-L339 HydrophobicContact CB-CD2 4.09Å; A34-L339 HydrophobicContact CB-CD1 3.97Å; A335-L339 WeakPolarHBondContact O-CB 3.37Å; A335-L339 PolarHBondContact O-N 3.16Å; I336-L339 PolarHBondContact O-N 2.65Å; I336-L339 VanDerWaalsContact O-N 3.15Å; T337-L339 VanDerWaalsContact C-N 3.34Å; T337-L339 PolarHBondContact O-N 3.31Å; L339-E342 PolarHBondContact O-N 3.47Å; L339-K343 HydrophobicContact CD2-CD 4.25Å; L339-K343 VanDerWaalsContact CD2-CE 3.46Å; L339-K343 WeakPolarHBondContact O-CG 3.32Å; L339-K343 PolarHBondContact O-N 3.46Å
340D71Confident70Confident51 Ų5157.2 Ų57.227%0.27329%0.288SS..Hα-helixtrans-71.5-38.8175.3-73.6-16.9000111.3R132 I336 K343 S344R132-D340 IonicContact NH1-OD2 3.57Å; I336-D340 WeakPolarHBondContact CG2-OD2 3.36Å; I336-D340 WeakPolarHBondContact O-CB 3.49Å; I336-D340 PolarHBondContact O-N 2.84Å; D340-K343 PolarHBondContact O-N 3.19Å; D340-K343 IonicContact OD1-NZ 3.72Å; D340-S344 PolarHBondContact O-N 2.91Å; D340-S344 VanDerWaalsContact O-N 3.09Å
341T74.2Confident69.2Low23 Ų2365.7 Ų65.714%0.14133%0.325CS..Hα-helixtrans-60.3-48.1170.1-48.10000109.4I66 T337 I338 K343 S344 F345I66-T341 HydrophobicContact CG2-CG2 4.21Å; T337-T341 VanDerWaalsContact O-CB 3.32Å; T337-T341 WeakPolarHBondContact O-CB 3.5Å; T337-T341 PolarHBondContact O-N 3.3Å; T337-T341 PolarHBondContact O-OG1 2.9Å; I338-T341 PolarHBondContact O-N 3.16Å; T341-K343 PolarHBondContact O-N 2.65Å; T341-S344 WeakPolarHBondContact O-CB 3.49Å; T341-S344 PolarHBondContact O-N 3Å; T341-F345 HydrophobicContact CG2-CE2 3.52Å; T341-F345 HydrophobicContact CG2-CZ 3.67Å; T341-F345 WeakPolarHBondContact O-CD2 3.29Å; T341-F345 WeakPolarHBondContact O-CE2 3.46Å
342E73.2Confident68.5Low42 Ų4267.3 Ų67.320%0.19635%0.347CS..Hα-helixtrans-58.2-30.6177.4-82.3-173.9-177.700114.4K58 F62 I338 L339 R350K58-E342 VanDerWaalsContact CD-OE1 3.22Å; K58-E342 WeakPolarHBondContact CD-OE1 3.14Å; K58-E342 VanDerWaalsContact CE-OE1 3.22Å; K58-E342 WeakPolarHBondContact CE-OE1 3.46Å; K58-E342 VanDerWaalsContact NZ-CD 3.29Å; K58-E342 IonicContact NZ-OE1 3.55Å; K58-E342 PolarHBondContact NZ-OE1 2.95Å; K58-E342 IonicContact NZ-OE2 3.87Å; K58-E342 PolarHBondContact NZ-OE2 3.14Å; F62-E342 HydrophobicContact CE1-CG 4.38Å; I338-E342 WeakPolarHBondContact O-CB 3.16Å; I338-E342 WeakPolarHBondContact O-CG 3.16Å; I338-E342 PolarHBondContact O-N 3.48Å; L339-E342 PolarHBondContact O-N 3.47Å; E342-R350 PolarHBondContact O-NH2 3.33Å
343K69.1Low67.8Low92 Ų9270.1 Ų70.140%0.436%0.359SS..Hα-helixtrans-77.2-29.9174.5-76.8171-178.4165.40113L339 D340 T341 F345L339-K343 HydrophobicContact CD2-CD 4.25Å; L339-K343 VanDerWaalsContact CD2-CE 3.46Å; L339-K343 WeakPolarHBondContact O-CG 3.32Å; L339-K343 PolarHBondContact O-N 3.46Å; D340-K343 PolarHBondContact O-N 3.19Å; D340-K343 IonicContact OD1-NZ 3.72Å; T341-K343 PolarHBondContact O-N 2.65Å; K343-F345 PolarHBondContact O-N 3.36Å
344S66.3Low67.4Low104 Ų10474.3 Ų74.373%0.72737%0.374SS*.Hα-helixtrans-71.9-14.3178-167.70000113.5D340 T341D340-S344 PolarHBondContact O-N 2.91Å; D340-S344 VanDerWaalsContact O-N 3.09Å; T341-S344 WeakPolarHBondContact O-CB 3.49Å; T341-S344 PolarHBondContact O-N 3Å
345F64.8Low66.8Low46 Ų4674.1 Ų74.120%0.20238%0.376CS..SBendtrans-75142.7178.8-68.3-73.4000113.8F62 I66 T341 K343 M349F62-F345 HydrophobicContact CD2-CZ 4.33Å; F62-F345 HydrophobicContact CE1-CE2 4.26Å; F62-F345 HydrophobicContact CE2-CD1 4.4Å; F62-F345 HydrophobicContact CE2-CD2 4.12Å; F62-F345 AromaticContact CE2-CE1 3.69Å; F62-F345 HydrophobicContact CE2-CE1 3.69Å; F62-F345 AromaticContact CE2-CE2 3.38Å; F62-F345 HydrophobicContact CE2-CE2 3.38Å; F62-F345 AromaticContact CE2-CZ 3.14Å; F62-F345 HydrophobicContact CE2-CZ 3.14Å; F62-F345 AromaticContact CZ-CD2 3.78Å; F62-F345 HydrophobicContact CZ-CD2 3.78Å; F62-F345 HydrophobicContact CZ-CE1 4.26Å; F62-F345 AromaticContact CZ-CE2 3.05Å; F62-F345 HydrophobicContact CZ-CE2 3.05Å; F62-F345 AromaticContact CZ-CZ 3.37Å; F62-F345 HydrophobicContact CZ-CZ 3.37Å; I66-F345 HydrophobicContact CD1-CE1 3.49Å; I66-F345 VanDerWaalsContact CD1-CE1 3.49Å; I66-F345 HydrophobicContact CD1-CZ 3.34Å; I66-F345 HydrophobicContact CG2-CZ 4.25Å; T341-F345 HydrophobicContact CG2-CE2 3.52Å; T341-F345 HydrophobicContact CG2-CZ 3.67Å; T341-F345 WeakPolarHBondContact O-CD2 3.29Å; T341-F345 WeakPolarHBondContact O-CE2 3.46Å; K343-F345 PolarHBondContact O-N 3.36Å; F345-M349 HydrophobicContact CB-CB 4.35Å; F345-M349 HydrophobicContact CD1-CB 4.46Å
346L57.2Low66.5Low142 Ų14275 Ų7574%0.74339%0.385SS*.  trans-54.7139.7163.8-75.5141.8000110.4C348 M349L346-C348 PolarHBondContact O-N 3.47Å; L346-M349 PolarHBondContact O-N 2.93Å
347K57Low66.3Low185 Ų18581.2 Ų81.280%0.80441%0.412SS*.THydrogen-bonded Turntrans-52.8-29.4-173.7-70.9178.8179.8174.40114
348C52.4Low66.2Low109 Ų10984.6 Ų84.674%0.73643%0.429SS*.THydrogen-bonded Turntrans-70.1-39.4179.5-60.60000112.9L346 R350 K351L346-C348 PolarHBondContact O-N 3.47Å; C348-R350 VanDerWaalsContact C-N 3.25Å; C348-R350 PolarHBondContact O-N 2.92Å; C348-K351 PolarHBondContact O-N 3.34Å
349M59.3Low66Low88 Ų8887 Ų8743%0.43344%0.441SS..Hα-helixtrans-68.5-27.9179.5-64.4-61.5-72.600111.6F345 L346 K351 A352 F353F345-M349 HydrophobicContact CB-CB 4.35Å; F345-M349 HydrophobicContact CD1-CB 4.46Å; L346-M349 PolarHBondContact O-N 2.93Å; M349-K351 PolarHBondContact O-N 3.14Å; M349-A352 PolarHBondContact O-N 2.76Å; M349-A352 VanDerWaalsContact O-N 3.14Å; M349-F353 HydrophobicContact CB-CD2 4.05Å; M349-F353 HydrophobicContact CB-CE2 3.76Å; M349-F353 HydrophobicContact CE-CE2 3.46Å; M349-F353 VanDerWaalsContact CE-CE2 3.46Å; M349-F353 HydrophobicContact CE-CZ 3.5Å; M349-F353 VanDerWaalsContact CE-CZ 3.5Å; M349-F353 WeakPolarHBondContact O-CD2 3.44Å; M349-F353 WeakPolarHBondContact O-CG 3.49Å; M349-F353 PolarHBondContact O-N 2.93Å
350R64.6Low66.1Low134 Ų13489.1 Ų89.151%0.50645%0.45SS..Hα-helixtrans-61-28.5178.4-171.1175.6-86.2175.7-4.5113.1E342 C348E342-R350 PolarHBondContact O-NH2 3.33Å; C348-R350 VanDerWaalsContact C-N 3.25Å; C348-R350 PolarHBondContact O-N 2.92Å
351K61.4Low66.1Low184 Ų18490.3 Ų90.380%0.846%0.459SS*.Hα-helixtrans-75-35.9176.6-69.4-174179.5-178.20112.6C348 M349 F353C348-K351 PolarHBondContact O-N 3.34Å; M349-K351 PolarHBondContact O-N 3.14Å; K351-F353 VanDerWaalsContact C-N 3.26Å; K351-F353 PolarHBondContact O-N 3.02Å
352A60.6Low65.9Low80 Ų8090.5 Ų90.566%0.66147%0.466SS*.Hα-helixtrans-71-22.917700000112.7M349M349-A352 PolarHBondContact O-N 2.76Å; M349-A352 VanDerWaalsContact O-N 3.14Å
353F62.1Low65.9Low66 Ų6695.3 Ų95.329%0.28949%0.487SS..THydrogen-bonded Turntrans-10522.2-174.2-59.1-49.5000114.4F62 M349 K351 S355F62-F353 HydrophobicContact CB-CD1 4.48Å; F62-F353 HydrophobicContact CB-CE1 4.46Å; F62-F353 HydrophobicContact CD2-CD1 4.17Å; F62-F353 HydrophobicContact CD2-CD2 4.21Å; F62-F353 AromaticContact CD2-CE1 4Å; F62-F353 HydrophobicContact CD2-CE1 4Å; F62-F353 AromaticContact CD2-CE2 4Å; F62-F353 HydrophobicContact CD2-CE2 4Å; F62-F353 HydrophobicContact CD2-CG 4.3Å; F62-F353 AromaticContact CD2-CZ 3.91Å; F62-F353 HydrophobicContact CD2-CZ 3.91Å; F62-F353 AromaticContact CE2-CD2 3.87Å; F62-F353 HydrophobicContact CE2-CD2 3.87Å; F62-F353 AromaticContact CE2-CE2 3.81Å; F62-F353 HydrophobicContact CE2-CE2 3.81Å; F62-F353 HydrophobicContact CE2-CG 4.28Å; F62-F353 HydrophobicContact CE2-CZ 4.2Å; F62-F353 HydrophobicContact CG-CD1 4.37Å; F62-F353 HydrophobicContact CG-CE1 4.48Å; F62-F353 HydrophobicContact CZ-CD2 4.39Å; M349-F353 HydrophobicContact CB-CD2 4.05Å; M349-F353 HydrophobicContact CB-CE2 3.76Å; M349-F353 HydrophobicContact CE-CE2 3.46Å; M349-F353 VanDerWaalsContact CE-CE2 3.46Å; M349-F353 HydrophobicContact CE-CZ 3.5Å; M349-F353 VanDerWaalsContact CE-CZ 3.5Å; M349-F353 WeakPolarHBondContact O-CD2 3.44Å; M349-F353 WeakPolarHBondContact O-CG 3.49Å; M349-F353 PolarHBondContact O-N 2.93Å; K351-F353 VanDerWaalsContact C-N 3.26Å; K351-F353 PolarHBondContact O-N 3.02Å; F353-S355 PolarHBondContact O-N 2.98Å
354R65.9Low65.9Low121 Ų12192.8 Ų92.846%0.45748%0.479SS..  trans-77.3113175.1-165.9175.5-174.9164.55.2109.9E20E20-R354 IonicContact OE1-NH2 2.92Å; E20-R354 PolarHBondContact OE1-NH2 2.64Å
355S65.9Low66Low21 Ų2193.3 Ų93.315%0.14748%0.48CS..  trans-74.6144.4171.1-70.30000111.1D57 F353D57-S355 PolarHBondContact OD2-OG 3.14Å; F353-S355 PolarHBondContact O-N 2.98Å
356G69.6Low66.2Low22 Ų2297.7 Ų97.723%0.22751%0.506CS..SBendtrans116.2164.4-177.200000112.8W373 C374G356-W373 WeakPolarHBondContact O-CZ3 3.47Å; G356-C374 CarbonylContact C-O 3.29Å; G356-C374 VanDerWaalsContact CA-O 3.32Å; G356-C374 WeakPolarHBondContact CA-O 3.43Å
357K71.6Confident67Low158 Ų15893.6 Ų93.669%0.68750%0.497SS*.EExtended strand (participates in β ladder)trans-116.9145.5171-68.6-175.8-179.9-179.90109L359 W373 C374K357-L359 HydrophobicContact CB-CG 4.45Å; K357-L359 PolarHBondContact O-N 3.3Å; K357-W373 WeakPolarHBondContact O-CA 3.29Å; K357-C374 PolarHBondContact N-O 3.22Å; K357-C374 PolarHBondContact O-N 3.29Å
358L74.1Confident67.9Low87 Ų8792 Ų9246%0.45549%0.491SS..EExtended strand (participates in β ladder)trans-75.6117.5170.8-167.377.3000107.8F371 W373L358-F371 HydrophobicContact CD1-CB 4.02Å; L358-F371 HydrophobicContact CD2-CB 4.18Å; L358-F371 HydrophobicContact CD2-CD1 4.13Å; L358-F371 HydrophobicContact CD2-CG 4.34Å; L358-F371 HydrophobicContact CG-CB 4.04Å; L358-F371 HydrophobicContact CG-CD1 4.2Å; L358-F371 HydrophobicContact CG-CG 4.5Å; L358-W373 HydrophobicContact CB-CD2 4.45Å; L358-W373 HydrophobicContact CB-CE3 4.5Å; L358-W373 HydrophobicContact CB-CH2 4.34Å; L358-W373 HydrophobicContact CB-CZ2 4.28Å; L358-W373 HydrophobicContact CB-CZ3 4.45Å; L358-W373 HydrophobicContact CD1-CD2 4.14Å; L358-W373 HydrophobicContact CD1-CG 4.18Å; L358-W373 HydrophobicContact CD1-CZ2 4.28Å
359L72.8Confident68.9Low50 Ų5090.8 Ų90.826%0.26248%0.477SS..EExtended strand (participates in β ladder)trans-125.1145.5179.3-66.3178.1000110K357 V361 F371 R372 C374 P396K357-L359 HydrophobicContact CB-CG 4.45Å; K357-L359 PolarHBondContact O-N 3.3Å; L359-V361 PolarHBondContact O-N 2.89Å; L359-F371 WeakPolarHBondContact O-CA 3.28Å; L359-R372 PolarHBondContact N-O 3.36Å; L359-R372 PolarHBondContact O-N 3.47Å; L359-C374 HydrophobicContact CB-CB 4.43Å; L359-C374 HydrophobicContact CD1-CB 3.85Å; L359-C374 HydrophobicContact CG-CB 4.38Å; L359-P396 HydrophobicContact CD1-CB 4.22Å; L359-P396 HydrophobicContact CD1-CG 3.77Å
360Q75.6Confident69.7Low66 Ų6688 Ų8831%0.30846%0.463SS..EExtended strand (participates in β ladder)trans-81.1111.6170.2-172.9178.92.800108.2D369 F371 G397Q360-D369 VanDerWaalsContact NE2-CG 3.29Å; Q360-D369 PolarHBondContact NE2-OD1 2.8Å; Q360-F371 HydrophobicContact CB-CD1 4.15Å; Q360-F371 HydrophobicContact CB-CE1 3.92Å; Q360-G397 WeakPolarHBondContact O-CA 3.23Å
361V69.5Low70.2Confident76 Ų7686.6 Ų86.646%0.46146%0.461SS..EExtended strand (participates in β ladder)trans-93-21.5-175-175.80000111.2L359 D370 R372L359-V361 PolarHBondContact O-N 2.89Å; V361-D370 PolarHBondContact N-O 2.9Å; V361-R372 HydrophobicContact CB-CG 4.45Å; V361-R372 HydrophobicContact CG2-CB 3.78Å; V361-R372 HydrophobicContact CG2-CG 4.05Å
362G71.4Confident70.8Confident28 Ų2881.4 Ų81.429%0.28944%0.437SS..EExtended strand (participates in β ladder)trans166.5-153.717700000112.2D370G362-D370 WeakPolarHBondContact O-CB 3.45Å; G362-D370 PolarHBondContact O-N 3.47Å
363F71.9Confident71.3Confident143 Ų14383 Ų8363%0.62743%0.426SS*.EExtended strand (participates in β ladder)trans-108.7140.3175.1-59.9-82.8000109.9K368 D369F363-K368 CarbonylContact C-O 3.52Å; F363-K368 VanDerWaalsContact CA-O 3.31Å; F363-K368 WeakPolarHBondContact CA-O 3.25Å; F363-D369 WeakPolarHBondContact CE1-OD1 3.3Å
364T70.8Confident71.7Confident39 Ų3981.7 Ų81.724%0.23942%0.424CS..  trans-63.2162.516959.80000110.1D366 G367 K368 D370T364-D366 PolarHBondContact O-N 3.47Å; T364-G367 PolarHBondContact O-N 3.31Å; T364-K368 PolarHBondContact N-O 3.48Å; T364-K368 PolarHBondContact OG1-N 2.87Å; T364-K368 VanDerWaalsContact OG1-N 3.14Å; T364-K368 PolarHBondContact OG1-O 2.87Å; T364-D370 HydrophobicContact CG2-CB 3.94Å
365P66.5Low72Confident115 Ų11579.1 Ų79.175%0.74742%0.416SS*.THydrogen-bonded Turntrans-53.4-22.9172.3-24.333.8000113.3
366D69.9Low72.3Confident138 Ų13886.1 Ų86.174%0.73844%0.439SS*.THydrogen-bonded Turntrans-89.27177.9-51.5-44.7000113.9T364 K368T364-D366 PolarHBondContact O-N 3.47Å; D366-K368 PolarHBondContact O-N 3.22Å
367G73.9Confident72.4Confident55 Ų5587 Ų8757%0.56744%0.44SS*.SBendtrans75.814.4177.100000115.7T364T364-G367 PolarHBondContact O-N 3.31Å
368K75.4Confident72.3Confident153 Ų15384.4 Ų84.467%0.66543%0.434SS*.  trans-93.3150.4176.4-64.7-178-179.8175.80111.3F363 T364 D366 D370F363-K368 CarbonylContact C-O 3.52Å; F363-K368 VanDerWaalsContact CA-O 3.31Å; F363-K368 WeakPolarHBondContact CA-O 3.25Å; T364-K368 PolarHBondContact N-O 3.48Å; T364-K368 PolarHBondContact OG1-N 2.87Å; T364-K368 VanDerWaalsContact OG1-N 3.14Å; T364-K368 PolarHBondContact OG1-O 2.87Å; D366-K368 PolarHBondContact O-N 3.22Å; K368-D370 PolarHBondContact O-N 2.84Å
369D74.7Confident72Confident83 Ų8386.5 Ų86.544%0.44444%0.441SS..EExtended strand (participates in β ladder)trans-60.7120.8175.2-63-31.6000111.1Q360 F363 F371Q360-D369 VanDerWaalsContact NE2-CG 3.29Å; Q360-D369 PolarHBondContact NE2-OD1 2.8Å; F363-D369 WeakPolarHBondContact CE1-OD1 3.3Å; D369-F371 HydrophobicContact CB-CD2 4.13Å; D369-F371 HydrophobicContact CB-CE2 3.62Å; D369-F371 HydrophobicContact CB-CZ 4.32Å; D369-F371 PolarHBondContact O-N 3.27Å
370D75.6Confident71.9Confident29 Ų2989.3 Ų89.316%0.15546%0.46CS..EExtended strand (participates in β ladder)trans-94.894.4179.9-169.12.6000110.2V361 G362 T364 K368 R372V361-D370 PolarHBondContact N-O 2.9Å; G362-D370 WeakPolarHBondContact O-CB 3.45Å; G362-D370 PolarHBondContact O-N 3.47Å; T364-D370 HydrophobicContact CG2-CB 3.94Å; K368-D370 PolarHBondContact O-N 2.84Å; D370-R372 WeakPolarHBondContact OD1-CG 3.25Å; D370-R372 IonicContact OD1-NE 3.4Å; D370-R372 PolarHBondContact OD1-NE 3.25Å; D370-R372 IonicContact OD2-CZ 3.14Å; D370-R372 IonicContact OD2-NE 2.78Å; D370-R372 PolarHBondContact OD2-NE 3.26Å; D370-R372 IonicContact OD2-NH2 3.96Å; D370-R372 PolarHBondContact OD2-NH2 2.93Å
371F74.4Confident71.7Confident104 Ų10489.9 Ų89.946%0.45647%0.466SS..EExtended strand (participates in β ladder)trans-83.9119.1173.2-70-80.7000111L358 L359 Q360 D369L358-F371 HydrophobicContact CD1-CB 4.02Å; L358-F371 HydrophobicContact CD2-CB 4.18Å; L358-F371 HydrophobicContact CD2-CD1 4.13Å; L358-F371 HydrophobicContact CD2-CG 4.34Å; L358-F371 HydrophobicContact CG-CB 4.04Å; L358-F371 HydrophobicContact CG-CD1 4.2Å; L358-F371 HydrophobicContact CG-CG 4.5Å; L359-F371 WeakPolarHBondContact O-CA 3.28Å; Q360-F371 HydrophobicContact CB-CD1 4.15Å; Q360-F371 HydrophobicContact CB-CE1 3.92Å; D369-F371 HydrophobicContact CB-CD2 4.13Å; D369-F371 HydrophobicContact CB-CE2 3.62Å; D369-F371 HydrophobicContact CB-CZ 4.32Å; D369-F371 PolarHBondContact O-N 3.27Å
372R74.4Confident71.9Confident76 Ų7696.3 Ų96.329%0.28748%0.482SS..EExtended strand (participates in β ladder)trans-122.1146.7177.4-55.8-173.6179.8-159.8-0.7110.7P14 L359 V361 D370 C374P14-R372 PolarHBondContact O-NH2 3.15Å; L359-R372 PolarHBondContact N-O 3.36Å; L359-R372 PolarHBondContact O-N 3.47Å; V361-R372 HydrophobicContact CB-CG 4.45Å; V361-R372 HydrophobicContact CG2-CB 3.78Å; V361-R372 HydrophobicContact CG2-CG 4.05Å; D370-R372 WeakPolarHBondContact OD1-CG 3.25Å; D370-R372 IonicContact OD1-NE 3.4Å; D370-R372 PolarHBondContact OD1-NE 3.25Å; D370-R372 IonicContact OD2-CZ 3.14Å; D370-R372 IonicContact OD2-NE 2.78Å; D370-R372 PolarHBondContact OD2-NE 3.26Å; D370-R372 IonicContact OD2-NH2 3.96Å; D370-R372 PolarHBondContact OD2-NH2 2.93Å; R372-C374 PolarHBondContact O-N 3Å
373W70.9Confident72.1Confident114 Ų114100.9 Ų100.943%0.43250%0.504SS..EExtended strand (participates in β ladder)trans-78112.4170-75.191.8000108.2G356 K357 L358G356-W373 WeakPolarHBondContact O-CZ3 3.47Å; K357-W373 WeakPolarHBondContact O-CA 3.29Å; L358-W373 HydrophobicContact CB-CD2 4.45Å; L358-W373 HydrophobicContact CB-CE3 4.5Å; L358-W373 HydrophobicContact CB-CH2 4.34Å; L358-W373 HydrophobicContact CB-CZ2 4.28Å; L358-W373 HydrophobicContact CB-CZ3 4.45Å; L358-W373 HydrophobicContact CD1-CD2 4.14Å; L358-W373 HydrophobicContact CD1-CG 4.18Å; L358-W373 HydrophobicContact CD1-CZ2 4.28Å
374C71Confident71.9Confident37 Ų3796.5 Ų96.525%0.2549%0.489CS..EExtended strand (participates in β ladder)trans-111.6142.5-179.3-65.40000109.9G356 K357 L359 R372G356-C374 CarbonylContact C-O 3.29Å; G356-C374 VanDerWaalsContact CA-O 3.32Å; G356-C374 WeakPolarHBondContact CA-O 3.43Å; K357-C374 PolarHBondContact N-O 3.22Å; K357-C374 PolarHBondContact O-N 3.29Å; L359-C374 HydrophobicContact CB-CB 4.43Å; L359-C374 HydrophobicContact CD1-CB 3.85Å; L359-C374 HydrophobicContact CG-CB 4.38Å; R372-C374 PolarHBondContact O-N 3Å
375F73Confident71.7Confident68 Ų68102.3 Ų102.330%0.29851%0.507SS..  trans-111.9120.5170.8-175.3-100.5000107.5R53 L54 D57 V377R53-F375 HydrophobicContact CB-CE1 3.99Å; L54-F375 HydrophobicContact CB-CD1 4.33Å; L54-F375 HydrophobicContact CB-CE1 4.17Å; L54-F375 HydrophobicContact CB-CZ 4.41Å; L54-F375 HydrophobicContact CD1-CB 4.46Å; L54-F375 HydrophobicContact CD1-CD1 4.28Å; L54-F375 HydrophobicContact CD1-CD2 3.63Å; L54-F375 HydrophobicContact CD1-CE1 4.48Å; L54-F375 HydrophobicContact CD1-CE2 3.86Å; L54-F375 HydrophobicContact CD1-CG 3.87Å; L54-F375 HydrophobicContact CD1-CZ 4.29Å; D57-F375 HydrophobicContact CB-CE2 3.96Å; D57-F375 HydrophobicContact CB-CZ 3.9Å; F375-V377 HydrophobicContact CD1-CG2 3.63Å; F375-V377 HydrophobicContact CE1-CG2 3.98Å
376R71.6Confident71.9Confident168 Ų168103.5 Ų103.563%0.63451%0.507SS*.  trans-73.4130.1178.9-179.7174.4166.5164.2-3.7109D378R376-D378 IonicContact CZ-OD1 3.37Å; R376-D378 IonicContact NE-OD1 3.94Å; R376-D378 PolarHBondContact NE-OD1 3.39Å; R376-D378 IonicContact NH2-OD1 3.2Å; R376-D378 PolarHBondContact NH2-OD1 3.37Å; R376-D378 VanDerWaalsContact NH2-OD1 3.15Å
377V71.7Confident71.8Confident41 Ų41102 Ų10225%0.24850%0.503CS..  trans-127.4115.6176.6-175.90000106.7E49 P50 R53 F375 E379E49-V377 HydrophobicContact CG-CG1 4.45Å; P50-V377 HydrophobicContact CB-CG2 3.98Å; R53-V377 HydrophobicContact CG-CG1 4.22Å; F375-V377 HydrophobicContact CD1-CG2 3.63Å; F375-V377 HydrophobicContact CE1-CG2 3.98Å; V377-E379 HydrophobicContact CG1-CG 4.03Å; V377-E379 PolarHBondContact O-N 3.44Å
378D68.8Low71Confident103 Ų103103 Ų10355%0.55150%0.495SS*.  trans-86.1109.3175.5-55-50.2000108.2R376R376-D378 IonicContact CZ-OD1 3.37Å; R376-D378 IonicContact NE-OD1 3.94Å; R376-D378 PolarHBondContact NE-OD1 3.39Å; R376-D378 IonicContact NH2-OD1 3.2Å; R376-D378 PolarHBondContact NH2-OD1 3.37Å; R376-D378 VanDerWaalsContact NH2-OD1 3.15Å
379E68.9Low70.3Confident130 Ų13099.4 Ų99.461%0.60749%0.486SS*.  trans-107.9129.8174.3-70.9-174.1-172.400109.9E49 V377E49-E379 HydrophobicContact CG-CG 4.04Å; V377-E379 HydrophobicContact CG1-CG 4.03Å; V377-E379 PolarHBondContact O-N 3.44Å
380V69.9Low69.2Low109 Ų10999.5 Ų99.566%0.66151%0.507SS*.  trans-109.8105.9175.1-176.80000108.3W382V380-W382 HydrophobicContact CG1-CD2 4.18Å; V380-W382 HydrophobicContact CG1-CZ2 3.84Å
381N71.4Confident68.2Low79 Ų79104.8 Ų104.842%0.42253%0.533SS..  trans-111.898174.8-171.8-10.1000111T383 T384 W385N381-T383 PolarHBondContact O-N 3.48Å; N381-T383 PolarHBondContact OD1-N 3.29Å; N381-T383 PolarHBondContact OD1-OG1 3.47Å; N381-T384 WeakPolarHBondContact CB-OG1 3.46Å; N381-T384 PolarHBondContact ND2-OG1 3.06Å; N381-T384 PolarHBondContact O-N 2.93Å; N381-W385 PolarHBondContact O-N 2.78Å; N381-W385 VanDerWaalsContact O-N 3.15Å
382W74.1Confident67.1Low210 Ų210104.8 Ų104.880%0.79554%0.537SS*.THydrogen-bonded Turntrans-61.9-22.6179.8-62.6105.6000114V380V380-W382 HydrophobicContact CG1-CD2 4.18Å; V380-W382 HydrophobicContact CG1-CZ2 3.84Å
383T76.2Confident66.3Low125 Ų125105.5 Ų105.577%0.76755%0.547SS*.THydrogen-bonded Turntrans-82-26.9-177.564.80000113.7N381N381-T383 PolarHBondContact O-N 3.48Å; N381-T383 PolarHBondContact OD1-N 3.29Å; N381-T383 PolarHBondContact OD1-OG1 3.47Å
384T66.5Low65.6Low51 Ų51108 Ų10831%0.31356%0.563SS.*THydrogen-bonded Turntrans-111.62.9-178.853.30000112.9N381 N386 T387 N388N381-T384 WeakPolarHBondContact CB-OG1 3.46Å; N381-T384 PolarHBondContact ND2-OG1 3.06Å; N381-T384 PolarHBondContact O-N 2.93Å; T384-N386 VanDerWaalsContact C-N 3.26Å; T384-N386 PolarHBondContact O-N 3.02Å; T384-T387 PolarHBondContact O-N 3.35Å; T384-T387 VanDerWaalsContact O-N 3.17Å; T384-T387 PolarHBondContact O-OG1 3.2Å; T384-N388 PolarHBondContact O-N 2.87Å
385W67.6Low64.8Low161 Ų161110.5 Ų110.561%0.6157%0.574SS**Hα-helixtrans-56-40.9-177.7-173.877.2000111.9N381 T387 V389N381-W385 PolarHBondContact O-N 2.78Å; N381-W385 VanDerWaalsContact O-N 3.15Å; W385-T387 PolarHBondContact O-N 3.2Å; W385-V389 WeakPolarHBondContact O-CG2 3.43Å
386N70.4Confident63.6Low139 Ų139110.5 Ų110.574%0.74358%0.581SS**Hα-helixtrans-74.2-22.2-177.1-160.228.1000114.2T384T384-N386 VanDerWaalsContact C-N 3.26Å; T384-N386 PolarHBondContact O-N 3.02Å
387T66.6Low62.4Low108 Ų108104.4 Ų104.466%0.66357%0.571SS**Hα-helixtrans-91.5-25-17742.70000113.7T384 W385T384-T387 PolarHBondContact O-N 3.35Å; T384-T387 VanDerWaalsContact O-N 3.17Å; T384-T387 PolarHBondContact O-OG1 3.2Å; W385-T387 PolarHBondContact O-N 3.2Å
388N58Low61.1Low74 Ų74108 Ų10840%0.39659%0.588SS.*Hα-helixtrans-110.97.6-168.7-67.4-23.9000114.7T384 G390 I391T384-N388 PolarHBondContact O-N 2.87Å; N388-G390 PolarHBondContact O-N 3.43Å; N388-G390 VanDerWaalsContact O-N 3.07Å; N388-I391 PolarHBondContact O-N 3.46Å
389V59.8Low60Low79 Ų79107.2 Ų107.248%0.47959%0.59SS.*G310 helixtrans-54.1-32.6-177.2-163.30000112.5W385 I391W385-V389 WeakPolarHBondContact O-CG2 3.43Å; V389-I391 PolarHBondContact O-N 3.45Å
390G52.6Low58.7Low85 Ų85110 Ų11088%0.87660%0.603SS**G310 helixtrans-80.3-3.4179.300000116.3N388N388-G390 PolarHBondContact O-N 3.43Å; N388-G390 VanDerWaalsContact O-N 3.07Å
391I54.1Low57.2Low139 Ų139108 Ų10871%0.71361%0.605SS**G310 helixtrans-107.1-5.3-178.5-57.2172.8000111.2N388 V389 N393N388-I391 PolarHBondContact O-N 3.46Å; V389-I391 PolarHBondContact O-N 3.45Å; I391-N393 PolarHBondContact O-N 3.43Å
392I50.9Low55.6Low105 Ų105109.6 Ų109.654%0.53862%0.618SS.*  trans-78.895.6-176.5-52.8174.9000109.3
393N57.7Low53.5Low91 Ų91109.2 Ų109.249%0.48762%0.621SS.*  trans-86.6117.9158.7-103.55.8000107.7I391 D395I391-N393 PolarHBondContact O-N 3.43Å; N393-D395 PolarHBondContact O-N 3.33Å
394E57.1Low51.6Low165 Ų165113.8 Ų113.877%0.77162%0.624SS**SBendtrans-65.7-25.6-177.7-64.8-166.1159.400113.2
395D53.3Low49.6Very low91 Ų91117.9 Ų117.949%0.48765%0.65SS.*SBendtrans-134.7122.8174.1-77.2-42.6000111.7N393 G397N393-D395 PolarHBondContact O-N 3.33Å; D395-G397 PolarHBondContact O-N 3.06Å; D395-G397 VanDerWaalsContact O-N 3.14Å
396P49.2Very low48Very low67 Ų67117.7 Ų117.744%0.43566%0.66SS.*THydrogen-bonded Turntrans-69.6110.4170.34.96.3000109.2L359L359-P396 HydrophobicContact CD1-CB 4.22Å; L359-P396 HydrophobicContact CD1-CG 3.77Å
397G46.2Very low46Very low41 Ų41115.6 Ų115.642%0.42366%0.656SS.*THydrogen-bonded Turntrans125.1-19.517300000114.9Q360 D395 C399Q360-G397 WeakPolarHBondContact O-CA 3.23Å; D395-G397 PolarHBondContact O-N 3.06Å; D395-G397 VanDerWaalsContact O-N 3.14Å; G397-C399 VanDerWaalsContact C-N 3.33Å; G397-C399 PolarHBondContact O-N 3.14Å
398N43.9Very low44.1Very low115 Ų115120.1 Ų120.162%0.61567%0.667SS**  trans-92.865.2175.5-159.115.7000110.9E400N398-E400 VanDerWaalsContact C-N 3.26Å; N398-E400 PolarHBondContact O-N 3.09Å
399C45.2Very low42.6Very low88 Ų88122 Ų12260%0.59569%0.685SS**  trans-87.616.1178.4-71.50000113.2G397 G401G397-C399 VanDerWaalsContact C-N 3.33Å; G397-C399 PolarHBondContact O-N 3.14Å; C399-G401 VanDerWaalsContact C-N 3.25Å; C399-G401 PolarHBondContact O-N 3.04Å
400E41.3Very low41.2Very low187 Ų187126 Ų12687%0.87470%0.704SS**SBendtrans-76.8-8.5-177-68.9-163.7156.500114N398N398-E400 VanDerWaalsContact C-N 3.26Å; N398-E400 PolarHBondContact O-N 3.09Å
401G39.2Very low39.9Very low69 Ų69133.3 Ų133.371%0.71171%0.705SS**SBendtrans-109.3-23.9-174.600000117.6C399C399-G401 VanDerWaalsContact C-N 3.25Å; C399-G401 PolarHBondContact O-N 3.04Å
402V36.8Very low38.8Very low112 Ų112132.7 Ų132.768%0.67971%0.713SS**  trans-110.978.1-169.6-1700000110.6R404V402-R404 PolarHBondContact O-N 3.4Å
403K31.8Very low37.7Very low201 Ų201130.7 Ų130.787%0.87472%0.718SS**  trans-61.8107.8160.3-78-176.8-179.9176.50108T405K403-T405 PolarHBondContact O-N 2.86Å
404R34.5Very low36.6Very low221 Ų221138.4 Ų138.483%0.83474%0.74SS**  trans-46.2102.4171.6-68.1173.9172.5135.2-1.7111.3V402 L406V402-R404 PolarHBondContact O-N 3.4Å; R404-L406 VanDerWaalsContact C-N 3.31Å; R404-L406 PolarHBondContact O-N 3.25Å
405T25.2Very low35.3Very low137 Ų137137.2 Ų137.284%0.8474%0.744SS**  trans-79.587.8155.917.60000108.2K403 S407K403-T405 PolarHBondContact O-N 2.86Å; T405-S407 VanDerWaalsContact C-N 3.35Å; T405-S407 PolarHBondContact O-N 3.44Å
406L33.8Very low34.2Very low158 Ų158138.4 Ų138.483%0.82776%0.76SS**  trans-69.387167.5-111.7150.9000109R404R404-L406 VanDerWaalsContact C-N 3.31Å; R404-L406 PolarHBondContact O-N 3.25Å
407S29.3Very low33.4Very low94 Ų94138.3 Ų138.366%0.65777%0.771SS**  trans-178.978.4156.148.20000112.8T405T405-S407 VanDerWaalsContact C-N 3.35Å; T405-S407 PolarHBondContact O-N 3.44Å
408F27.3Very low32.9Very low203 Ų203148 Ų14889%0.8980%0.795SS**  trans-129.884.1149.5-98.5-82.3000109L410F408-L410 PolarHBondContact O-N 2.91Å; F408-L410 VanDerWaalsContact O-N 3.16Å
409S26.4Very low32.2Very low113 Ų113150 Ų15079%0.7981%0.805SS**  trans-72.493.2161.147.80000108.3R411S409-R411 VanDerWaalsContact C-N 3.29Å; S409-R411 PolarHBondContact O-N 3.49Å
410L29Very low31.8Very low165 Ų165158 Ų15886%0.86482%0.823SS**  trans-72.591.9166.4-88.6160.7000108.6F408 S412F408-L410 PolarHBondContact O-N 2.91Å; F408-L410 VanDerWaalsContact O-N 3.16Å; L410-S412 PolarHBondContact O-N 3.44Å
411R26.1Very low31.4Very low238 Ų238158.1 Ų158.190%0.89882%0.821SS**  trans-59122166-155.6179.7-154.4-164.25.6107.9S409 G413S409-R411 VanDerWaalsContact C-N 3.29Å; S409-R411 PolarHBondContact O-N 3.49Å; R411-G413 PolarHBondContact O-N 2.85Å
412S30.9Very low31.1Very low126 Ų126162.3 Ų162.388%0.88183%0.827SS**  trans-60.3107.4171.9-179.50000109.6L410L410-S412 PolarHBondContact O-N 3.44Å
413G27.3Very low30.7Very low63 Ų63167.7 Ų167.765%0.64984%0.842SS**  trans-121114.2173.200000109.4R411 V415R411-G413 PolarHBondContact O-N 2.85Å; G413-V415 PolarHBondContact O-N 3.02Å
414R35.4Very low30.6Very low252 Ų252162.5 Ų162.595%0.95184%0.836SS**  trans-56.5121.7170.1-70.2176.1-177.4171.60.3109.4
415V29.6Very low30.4Very low141 Ų141159.5 Ų159.586%0.85584%0.836SS**  trans-133.9118.8158.8-1770000109.3G413G413-V415 PolarHBondContact O-N 3.02Å
416S29.8Very low30.4Very low116 Ų116159.1 Ų159.181%0.81183%0.833SS**  trans-66.9142174.5-178.40000111.4
417G33.6Very low30.3Very low65 Ų65156.9 Ų156.967%0.6783%0.828SS**  trans39.8122.7144.900000121.3
418R35.4Very low30.3Very low245 Ų245160.1 Ų160.193%0.92584%0.837SS**  trans102.7123.4149.8-66177.5169171.5-3.6118.1
419N28.4Very low30.4Very low155 Ų155158.7 Ų158.783%0.82984%0.838SS**  trans109.475.6156.6-67.3-5.6000116.8K421N419-K421 PolarHBondContact O-N 3.46Å
420W36.3Very low30.4Very low257 Ų257164.4 Ų164.497%0.97384%0.842SS**  trans-71108.8147.2-93.25.7000109.5
421K32.8Very low30.3Very low190 Ų190164.5 Ų164.583%0.82684%0.843SS**  trans168.592.5154.5-94.5163.7-169.4-169.30104.8N419N419-K421 PolarHBondContact O-N 3.46Å
422N32.6Very low30.3Very low157 Ų157157.9 Ų157.984%0.8484%0.839SS**  trans156.471.6160-76.6-11.2000109.4
423F29.3Very low30Very low225 Ų225157.5 Ų157.599%0.98784%0.837SS**  trans-133.477155.8-99.7-82000107.4
424A29.8Very low29.9Very low92 Ų92161.6 Ų161.676%0.7685%0.849SS**  trans-107.6106.8159.500000106.3
425L29.9Very low29.6Very low158 Ų158160.5 Ų160.583%0.82785%0.845SS**  trans173.8108.7132.9-121.675.9000109.1P427L425-P427 WeakPolarHBondContact O-CD 3.49Å
426V26.8Very low29.3Very low129 Ų129160.1 Ų160.178%0.78284%0.839SS**  trans-75.5123.2155.2171.20000106.7L428V426-L428 PolarHBondContact O-N 3.41Å
427P31.4Very low29Very low110 Ų110166 Ų16671%0.71484%0.843SS**  trans-84.5103.4166.4-5.924.7000109L425 L429L425-P427 WeakPolarHBondContact O-CD 3.49Å; P427-L429 PolarHBondContact O-N 2.97Å
428L29Very low28.6Very low163 Ų163171.4 Ų171.485%0.85385%0.85SS**  trans-60.4108.6155.5-87.2159.1000108V426 R430V426-L428 PolarHBondContact O-N 3.41Å; L428-R430 PolarHBondContact O-N 3.28Å
429L28.1Very low28.1Very low173 Ų173164.6 Ų164.691%0.90684%0.84SS**  trans-80.1111.1169.9-106.5163000108.9P427P427-L429 PolarHBondContact O-N 2.97Å
430R27.5Very low28Very low233 Ų233164.1 Ų164.188%0.87984%0.843SS**  trans-81.5124.2178.9-175.6178.9-169.4164.52.4109L428L428-R430 PolarHBondContact O-N 3.28Å
431D27.2Very low27.5Very low167 Ų167161 Ų16189%0.89384%0.839SS**  trans-58.3130.3169.5-81.4-41.6000111.4
432A25Very low27.3Very low98 Ų98157.8 Ų157.881%0.8184%0.838SS**  trans-153.598.8163.100000109.8
433S25.3Very low27Very low119 Ų119159.6 Ų159.683%0.83284%0.841SS**  trans163.193.5134.3-178.50000110.8
434T25.2Very low26.8Very low149 Ų149157 Ų15791%0.91483%0.832SS**  trans-131.4116.6150.940.10000108.9
435R28Very low26.7Very low228 Ų228159.2 Ų159.286%0.8684%0.836SS**  trans-125.3136.3155.3-103-170.4167162-4.6103.3
436D24.5Very low26.4Very low134 Ų134159.4 Ų159.472%0.71783%0.833SS**  cis-155.3147.521.2-78.8-53.9000108.4
437R24.1Very low26.5Very low240 Ų240161.4 Ų161.491%0.90684%0.838SS**  179.7127.8127.3-106.1177171.5179.7-2.6114.2
438H24.8Very low26.3Very low177 Ų177165.3 Ų165.382%0.81984%0.844SS**  trans11.7125.2157.8-82.1-70.8000123.6
439S25.3Very low26.1Very low103 Ų103165.7 Ų165.772%0.7284%0.841SS**  trans-18.6128149.455.10000120.3
440T25Very low26Very low144 Ų144168.4 Ų168.488%0.88384%0.841SS**  trans-146.4136.41410.40000108.9
441Q26.1Very low25.9Very low192 Ų192163.4 Ų163.490%0.89784%0.836SS**PPolyproline II helixtrans-61.9151.4-173.9-69.9-179.3-25.800113.7
442P28.4Very low25.9Very low122 Ų122159.4 Ų159.479%0.79283%0.834SS**PPolyproline II helixtrans-96.4129.3159.125.6-11.9000111.8
443E27.2Very low26.1Very low195 Ų195160 Ų16091%0.91183%0.832SS**PPolyproline II helixtrans-60.1133.8166.3-87.4176.4137.500111.5
444E25.1Very low26.3Very low172 Ų172162.9 Ų162.980%0.80484%0.837SS**PPolyproline II helixtrans-68.6130.5167.1-75.9180136.700111.1
445V26.8Very low26.6Very low138 Ų138164.8 Ų164.884%0.83683%0.833SS**  trans-127.8112152.4-179.40000108.2
446Q24.2Very low26.9Very low161 Ų161159.8 Ų159.875%0.75283%0.83SS**  trans-66.1131.8-178.8-64.3175.1-10.700111.8
447L28.1Very low27.1Very low171 Ų171161.9 Ų161.990%0.89584%0.836SS**  trans-108.4119159.7-122.7102.1000109.2
448K28.3Very low27.3Very low193 Ų193157.6 Ų157.684%0.83983%0.831SS**  trans-65.2133.9-179.9-84.1177.4173.9175.90112.1
449H23.4Very low27.7Very low171 Ų171154 Ų15479%0.79283%0.832SS**  trans-59.4135.9162.6-106.3-83.9000111.5
450Y25.8Very low27.9Very low230 Ų230157.7 Ų157.790%0.90284%0.838SS**  trans-126.6117155.3-121.9-90.3000109
451T25.8Very low28.2Very low128 Ų128156.6 Ų156.679%0.78583%0.831SS**  trans-89.2130.7174.520.60000109.2
452G27.8Very low28.3Very low82 Ų82157.2 Ų157.285%0.84583%0.83SS**  trans-167.693.8174.200000111.2
453S27.9Very low28.4Very low111 Ų111159.9 Ų159.978%0.77683%0.83SS**  trans-70.4143.9175.81740000111.8
454L29.9Very low28.6Very low179 Ų179158.3 Ų158.394%0.93783%0.827SS**  trans-166.7138142.9-99.5144.2000111.5
455K32.1Very low28.8Very low190 Ų190155.9 Ų155.983%0.82683%0.829SS**  trans-76.7165.6-171.3-82.3177.5174.3178.40113.9
456P33.8Very low29.1Very low123 Ų123158.4 Ų158.480%0.79984%0.835SS**  trans-93.9123.1177.535-25.9000111.4
457E29Very low29.7Very low178 Ų178155.5 Ų155.583%0.83284%0.838SS**  trans-130.7148.9159.1-71.1-171.7165.300108.2
458D29.1Very low30.4Very low149 Ų149153.6 Ų153.680%0.79784%0.836SS**  trans89.574169.8-47.7-26.9000118.1
459A31.7Very low30.6Very low102 Ų102148.2 Ų148.284%0.84384%0.835SS**  trans-83.2110.3144.600000108.7
460E31Very low31.2Very low181 Ų181149.3 Ų149.385%0.84684%0.84SS**  trans-103118.4166.9-78.4-162.6153.900111.6
461V31.4Very low31.7Very low121 Ų121151.9 Ų151.973%0.73386%0.856SS**  trans-91.2134.5166.3167.80000107.2
462F27.7Very low32Very low204 Ų204153.1 Ų153.190%0.89586%0.86SS**  trans-135.4136.3158.5-117.9-87.9000112.4
463K30.5Very low32.2Very low179 Ų179156.8 Ų156.878%0.77886%0.861SS**  trans-86.6153.6-162.6-89.2168.6162.1171.40114
464D30.1Very low32.4Very low161 Ų161159.4 Ų159.486%0.86187%0.865SS**  trans-58.4147.4153.9-77.3-45.2000112.4
465S31Very low32.6Very low121 Ų121158.2 Ų158.285%0.84686%0.861SS**  trans-143.8109.3160.6-69.80000111.2
466M32.1Very low32.6Very low192 Ų192156.3 Ų156.395%0.94686%0.863SS**  trans-67141.1162-126.3173176.300109.5
467A37.6Very low32.5Very low100 Ų100158.5 Ų158.583%0.82687%0.868SS**  trans-116.6132.2168.100000110.3
468P43.2Very low32.8Very low131 Ų131157.1 Ų157.185%0.85187%0.87SS**  trans-112.7150.9154.835.5-24.4000110.6
469G32.5Very low33.1Very low79 Ų79157.7 Ų157.781%0.81488%0.876SS**  trans163.9113.6168.900000115.1
470E34.8Very low33.2Very low195 Ų195162.3 Ų162.391%0.91188%0.879SS**  trans-56.4142.8174-63.3162.3129.500114.5
471K36.2Very low33.4Very low284 Ų284160.6 Ų160.6100%1.23588%0.882SS**  -167.70119.6-107.3-179.2-176.1-179.60111.3

Retrieved 471 of 471 residues in 88.8 ms (Link to these results)