A0A077Z2B9_TRITR Loading...

Tmemb 161AB domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2B9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 215 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
1M50.2Low60.4Low182 Ų18280.3 Ų80.390%0.89741%0.41SS*.  0-44.80-77.2-167.5160.100113.6W3 M4 L5M1-W3 VanDerWaalsContact C-N 3.28Å; M1-W3 PolarHBondContact O-N 2.75Å; M1-W3 VanDerWaalsContact O-N 3.17Å; M1-M4 PolarHBondContact O-N 2.84Å; M1-L5 PolarHBondContact O-N 3.48Å
2S56.8Low60.5Low58 Ų5880 Ų8041%0.40641%0.41SS..Hα-helixtrans-57.4-30.8-177.1-54.60000116.2A6 R56S2-A6 WeakPolarHBondContact O-CB 3.46Å; S2-A6 PolarHBondContact O-N 2.83Å; S2-A6 VanDerWaalsContact O-N 3.13Å; S2-R56 PolarHBondContact O-NH2 3.48Å
3W59.3Low60.5Low100 Ų10075.5 Ų75.538%0.37939%0.388SS..Hα-helixtrans-77-36.3179.965.3-95.7000112.7M1 L5 A6 L7 I202M1-W3 VanDerWaalsContact C-N 3.28Å; M1-W3 PolarHBondContact O-N 2.75Å; M1-W3 VanDerWaalsContact O-N 3.17Å; W3-L5 VanDerWaalsContact C-N 3.32Å; W3-L5 PolarHBondContact O-N 3.35Å; W3-A6 PolarHBondContact O-N 2.89Å; W3-L7 HydrophobicContact CE3-CD1 3.67Å; W3-L7 HydrophobicContact CZ3-CD1 3.76Å; W3-L7 PolarHBondContact O-N 3.13Å; W3-I202 HydrophobicContact CG-CD1 4.2Å
4M63.7Low60.3Low112 Ų11277.6 Ų77.655%0.55239%0.393SS*.Hα-helixtrans-63.5-41175.1-70.7178.316200110.8M1 L7 L8M1-M4 PolarHBondContact O-N 2.84Å; M4-L7 PolarHBondContact O-N 2.76Å; M4-L8 VanDerWaalsContact O-CB 3.24Å; M4-L8 WeakPolarHBondContact O-CB 3.32Å; M4-L8 PolarHBondContact O-N 3.3Å
5L61.2Low60.1Low64 Ų6476 Ų7634%0.33539%0.39SS..Hα-helixtrans-66.2-36.1174.4-84.3150.5000112.5M1 W3 S9 F52 F55M1-L5 PolarHBondContact O-N 3.48Å; W3-L5 VanDerWaalsContact C-N 3.32Å; W3-L5 PolarHBondContact O-N 3.35Å; L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 3.46Å; L5-S9 PolarHBondContact O-OG 3.24Å; L5-S9 VanDerWaalsContact O-OG 3.11Å; L5-F52 HydrophobicContact CB-CE2 3.89Å; L5-F52 HydrophobicContact CB-CZ 4.12Å; L5-F52 HydrophobicContact CD2-CE2 4.04Å; L5-F55 HydrophobicContact CD1-CE1 4.42Å
6A60.5Low59.7Low1 Ų174.8 Ų74.81%0.00839%0.39CS..Hα-helixtrans-70.9-39.8175.200000112.3S2 W3 S9 M10 C191 F195S2-A6 WeakPolarHBondContact O-CB 3.46Å; S2-A6 PolarHBondContact O-N 2.83Å; S2-A6 VanDerWaalsContact O-N 3.13Å; W3-A6 PolarHBondContact O-N 2.89Å; A6-S9 VanDerWaalsContact CA-OG 3.3Å; A6-S9 WeakPolarHBondContact CA-OG 3.21Å; A6-S9 PolarHBondContact O-N 3.42Å; A6-S9 PolarHBondContact O-OG 3.27Å; A6-M10 WeakPolarHBondContact O-CB 3.24Å; A6-M10 PolarHBondContact O-N 3.23Å; A6-C191 PolarHBondContact O-SG 3.49Å; A6-F195 HydrophobicContact CB-CB 4.33Å
7L64Low59.4Low66 Ų6673.9 Ų73.935%0.34638%0.382SS..Hα-helixtrans-64.4-44.4171.9-79.2176.7000110.9W3 M4 S9 M10 L11 F195W3-L7 HydrophobicContact CE3-CD1 3.67Å; W3-L7 HydrophobicContact CZ3-CD1 3.76Å; W3-L7 PolarHBondContact O-N 3.13Å; M4-L7 PolarHBondContact O-N 2.76Å; L7-S9 VanDerWaalsContact C-N 3.31Å; L7-S9 PolarHBondContact O-N 2.91Å; L7-M10 PolarHBondContact O-N 3.25Å; L7-M10 VanDerWaalsContact O-N 3.17Å; L7-L11 VanDerWaalsContact O-CB 3.23Å; L7-L11 WeakPolarHBondContact O-CB 3.41Å; L7-L11 PolarHBondContact O-N 3.13Å; L7-F195 HydrophobicContact CD1-CE2 3.94Å; L7-F195 HydrophobicContact CD2-CD2 3.82Å; L7-F195 HydrophobicContact CD2-CE2 3.42Å; L7-F195 VanDerWaalsContact CD2-CE2 3.42Å; L7-F195 HydrophobicContact CD2-CZ 3.85Å; L7-F195 HydrophobicContact CG-CD2 3.85Å; L7-F195 HydrophobicContact CG-CE2 3.48Å; L7-F195 VanDerWaalsContact CG-CE2 3.48Å; L7-F195 HydrophobicContact CG-CZ 4.33Å
8L64.2Low59.4Low102 Ų10281.1 Ų81.153%0.53440%0.404SS..Hα-helixtrans-62.3-39.6177.2-167.970.9000111.1M4 L12M4-L8 VanDerWaalsContact O-CB 3.24Å; M4-L8 WeakPolarHBondContact O-CB 3.32Å; M4-L8 PolarHBondContact O-N 3.3Å; L8-L12 HydrophobicContact CD1-CD1 4.27Å; L8-L12 HydrophobicContact CG-CD1 4.31Å; L8-L12 WeakPolarHBondContact O-CB 3.41Å; L8-L12 PolarHBondContact O-N 3.45Å
9S59.9Low59.2Low24 Ų2481.9 Ų81.917%0.16841%0.409CS..Hα-helixtrans-68.7-37.5173.657.70000112.5L5 A6 L7 L12 T13 C191L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 3.46Å; L5-S9 PolarHBondContact O-OG 3.24Å; L5-S9 VanDerWaalsContact O-OG 3.11Å; A6-S9 VanDerWaalsContact CA-OG 3.3Å; A6-S9 WeakPolarHBondContact CA-OG 3.21Å; A6-S9 PolarHBondContact O-N 3.42Å; A6-S9 PolarHBondContact O-OG 3.27Å; L7-S9 VanDerWaalsContact C-N 3.31Å; L7-S9 PolarHBondContact O-N 2.91Å; S9-L12 PolarHBondContact O-N 2.64Å; S9-T13 WeakPolarHBondContact O-CB 2.99Å; S9-T13 PolarHBondContact O-N 3.35Å; S9-T13 PolarHBondContact O-OG1 3.06Å; S9-C191 PolarHBondContact OG-SG 3.13Å
10M61.3Low59.1Low65 Ų6579.4 Ų79.432%0.3240%0.402SS..Hα-helixtrans-66.1-42.8175.9-164.5-176.5-173.200111.1A6 L7 T13 F14 C191A6-M10 WeakPolarHBondContact O-CB 3.24Å; A6-M10 PolarHBondContact O-N 3.23Å; L7-M10 PolarHBondContact O-N 3.25Å; L7-M10 VanDerWaalsContact O-N 3.17Å; M10-T13 PolarHBondContact O-N 2.81Å; M10-F14 HydrophobicContact CG-CD2 4.43Å; M10-F14 PolarHBondContact O-N 3.26Å; M10-F14 VanDerWaalsContact O-N 3.12Å; M10-C191 PolarHBondContact N-SG 3.02Å
11L63.6Low59.1Low109 Ų10982.2 Ų82.257%0.57141%0.408SS*.Hα-helixtrans-69.9-35.2177.8-151.791.1000111.8L7 P15 C16L7-L11 VanDerWaalsContact O-CB 3.23Å; L7-L11 WeakPolarHBondContact O-CB 3.41Å; L7-L11 PolarHBondContact O-N 3.13Å; L11-P15 HydrophobicContact CG-CG 4.39Å; L11-P15 WeakPolarHBondContact O-CD 3.07Å; L11-P15 WeakPolarHBondContact O-CG 3.34Å; L11-C16 PolarHBondContact O-SG 2.81Å
12L61.6Low59.6Low77 Ų7777 Ų7740%0.40339%0.387SS..Iπ-helixtrans-72.1-37.9172-10876.5000111.8L8 S9 C16 F17L8-L12 HydrophobicContact CD1-CD1 4.27Å; L8-L12 HydrophobicContact CG-CD1 4.31Å; L8-L12 WeakPolarHBondContact O-CB 3.41Å; L8-L12 PolarHBondContact O-N 3.45Å; S9-L12 PolarHBondContact O-N 2.64Å; L12-C16 WeakPolarHBondContact O-CB 3.05Å; L12-F17 VanDerWaalsContact O-CD2 3.28Å; L12-F17 WeakPolarHBondContact O-CD2 3.12Å
13T60Low59.7Low21 Ų2182.1 Ų82.113%0.12940%0.398CS..Iπ-helixtrans-74.2-38.5-171.4-570000112.3S9 M10 V187S9-T13 WeakPolarHBondContact O-CB 2.99Å; S9-T13 PolarHBondContact O-N 3.35Å; S9-T13 PolarHBondContact O-OG1 3.06Å; M10-T13 PolarHBondContact O-N 2.81Å; T13-V187 HydrophobicContact CG2-CG1 3.95Å
14F57.6Low59.6Low105 Ų10582.1 Ų82.146%0.46140%0.401SS..Iπ-helixtrans-93.2-60.2-171.5-90.8-76.9000114.9M10 S188M10-F14 HydrophobicContact CG-CD2 4.43Å; M10-F14 PolarHBondContact O-N 3.26Å; M10-F14 VanDerWaalsContact O-N 3.12Å; F14-S188 WeakPolarHBondContact CE2-OG 3.2Å; F14-S188 WeakPolarHBondContact CZ-OG 3.37Å
15P57.7Low59.5Low54 Ų5480.9 Ų80.935%0.35140%0.396SS..Iπ-helixtrans-82.4-42-179.627-32.2000112.9L11 F17 R18 L19L11-P15 HydrophobicContact CG-CG 4.39Å; L11-P15 WeakPolarHBondContact O-CD 3.07Å; L11-P15 WeakPolarHBondContact O-CG 3.34Å; P15-F17 PolarHBondContact O-N 2.85Å; P15-R18 PolarHBondContact O-N 2.87Å; P15-L19 HydrophobicContact CB-CD1 4.36Å; P15-L19 VanDerWaalsContact O-CB 3.29Å; P15-L19 WeakPolarHBondContact O-CB 3.15Å; P15-L19 PolarHBondContact O-N 2.69Å
16C54.5Low59.3Low57 Ų5779.9 Ų79.939%0.38540%0.397SS..Iπ-helixtrans-66.9-33.8-171.9-64.50000113.6L11 L12 A20L11-C16 PolarHBondContact O-SG 2.81Å; L12-C16 WeakPolarHBondContact O-CB 3.05Å; C16-A20 WeakPolarHBondContact O-CB 3.39Å; C16-A20 PolarHBondContact O-N 2.7Å
17F53.4Low59.2Low59 Ų5982.7 Ų82.726%0.25941%0.412SS..Hα-helixtrans-78.2-32.9177.3-87.1-76.9000113.7L12 P15 R21 L41 R45L12-F17 VanDerWaalsContact O-CD2 3.28Å; L12-F17 WeakPolarHBondContact O-CD2 3.12Å; P15-F17 PolarHBondContact O-N 2.85Å; F17-R21 WeakPolarHBondContact O-CB 3.19Å; F17-R21 PolarHBondContact O-N 2.85Å; F17-L41 HydrophobicContact CE1-CB 4.38Å; F17-R45 HydrophobicContact CE1-CB 4.05Å; F17-R45 HydrophobicContact CE1-CG 4.46Å; F17-R45 HydrophobicContact CE2-CB 4.25Å; F17-R45 HydrophobicContact CE2-CG 3.99Å; F17-R45 HydrophobicContact CZ-CB 3.63Å; F17-R45 HydrophobicContact CZ-CG 3.89Å
18R59Low59.1Low203 Ų20384.3 Ų84.377%0.76642%0.418SS*.Hα-helixtrans-65.9-45.1170-100.6-110.3-173.6177.91.2110P15 R21 T22P15-R18 PolarHBondContact O-N 2.87Å; R18-R21 PolarHBondContact O-N 2.85Å; R18-T22 WeakPolarHBondContact O-CG2 3.27Å; R18-T22 PolarHBondContact O-N 3.3Å; R18-T22 PolarHBondContact O-OG1 3.47Å; R18-T22 VanDerWaalsContact O-OG1 3.06Å
19L55.5Low58.9Low97 Ų9783.9 Ų83.951%0.50842%0.423SS..Hα-helixtrans-63.4-43175.7-86.4154.5000112.4P15 T22 Y23P15-L19 HydrophobicContact CB-CD1 4.36Å; P15-L19 VanDerWaalsContact O-CB 3.29Å; P15-L19 WeakPolarHBondContact O-CB 3.15Å; P15-L19 PolarHBondContact O-N 2.69Å; L19-T22 VanDerWaalsContact CA-OG1 3.27Å; L19-T22 WeakPolarHBondContact CA-OG1 3.43Å; L19-T22 PolarHBondContact O-N 2.77Å; L19-T22 PolarHBondContact O-OG1 3.38Å; L19-Y23 VanDerWaalsContact O-CB 3.26Å; L19-Y23 WeakPolarHBondContact O-CB 3.15Å; L19-Y23 PolarHBondContact O-N 3.12Å
20A58.1Low58.9Low32 Ų3288.3 Ų88.326%0.26445%0.445SS..Hα-helixtrans-67-35.8178.200000112.3C16 K24 L41C16-A20 WeakPolarHBondContact O-CB 3.39Å; C16-A20 PolarHBondContact O-N 2.7Å; A20-K24 VanDerWaalsContact O-CB 3.3Å; A20-K24 WeakPolarHBondContact O-CB 3.26Å; A20-K24 PolarHBondContact O-N 3.02Å; A20-L41 HydrophobicContact CB-CD1 4.42Å
21R58.4Low58.7Low138 Ų13888 Ų8852%0.52146%0.458SS..Hα-helixtrans-70.6-44.2173.7-170.4175.7-80.5173.2-6111.1F17 R18 Y23 K24 D25F17-R21 WeakPolarHBondContact O-CB 3.19Å; F17-R21 PolarHBondContact O-N 2.85Å; R18-R21 PolarHBondContact O-N 2.85Å; R21-Y23 VanDerWaalsContact C-N 3.28Å; R21-Y23 PolarHBondContact O-N 3.28Å; R21-K24 PolarHBondContact O-N 3.08Å; R21-D25 WeakPolarHBondContact O-CB 3.09Å; R21-D25 PolarHBondContact O-N 3.3Å
22T60.7Low58.3Low74 Ų7488 Ų8845%0.45446%0.458SS..Hα-helixtrans-64.6-32.9173.852.70000112.4R18 L19 A26R18-T22 WeakPolarHBondContact O-CG2 3.27Å; R18-T22 PolarHBondContact O-N 3.3Å; R18-T22 PolarHBondContact O-OG1 3.47Å; R18-T22 VanDerWaalsContact O-OG1 3.06Å; L19-T22 VanDerWaalsContact CA-OG1 3.27Å; L19-T22 WeakPolarHBondContact CA-OG1 3.43Å; L19-T22 PolarHBondContact O-N 2.77Å; L19-T22 PolarHBondContact O-OG1 3.38Å; T22-A26 WeakPolarHBondContact O-CB 3.33Å; T22-A26 PolarHBondContact O-N 2.89Å
23Y58.6Low57.9Low164 Ų16490.2 Ų90.264%0.64347%0.471SS*.Hα-helixtrans-68.9-41.2173.7-114.8-93.4000111.4L19 R21 A26 L27L19-Y23 VanDerWaalsContact O-CB 3.26Å; L19-Y23 WeakPolarHBondContact O-CB 3.15Å; L19-Y23 PolarHBondContact O-N 3.12Å; R21-Y23 VanDerWaalsContact C-N 3.28Å; R21-Y23 PolarHBondContact O-N 3.28Å; Y23-A26 PolarHBondContact O-N 3.39Å; Y23-L27 WeakPolarHBondContact O-CB 3.01Å; Y23-L27 PolarHBondContact O-N 2.96Å
24K58.4Low57.6Low100 Ų10093.9 Ų93.944%0.43550%0.503SS..Hα-helixtrans-65-47.7175.5-173.4-174.9174-1660110.9A20 R21 A26 L27 E28A20-K24 VanDerWaalsContact O-CB 3.3Å; A20-K24 WeakPolarHBondContact O-CB 3.26Å; A20-K24 PolarHBondContact O-N 3.02Å; R21-K24 PolarHBondContact O-N 3.08Å; K24-A26 VanDerWaalsContact C-N 3.27Å; K24-A26 PolarHBondContact O-N 2.75Å; K24-L27 PolarHBondContact O-N 3.26Å; K24-E28 WeakPolarHBondContact CE-OE1 3.48Å; K24-E28 IonicContact NZ-OE1 3.58Å; K24-E28 PolarHBondContact O-N 3.2Å
25D61Low57.3Low86 Ų8695.6 Ų95.646%0.4652%0.516SS..Hα-helixtrans-62.9-35.5177.8-61.8-14.2000110.8R21 S29R21-D25 WeakPolarHBondContact O-CB 3.09Å; R21-D25 PolarHBondContact O-N 3.3Å; D25-S29 PolarHBondContact O-N 3.4Å; D25-S29 VanDerWaalsContact O-N 3.12Å
26A57.6Low57.2Low43 Ų4399.7 Ų99.736%0.35553%0.534SS..Hα-helixtrans-75.6-23173.400000114.1T22 Y23 K24 S29 N30T22-A26 WeakPolarHBondContact O-CB 3.33Å; T22-A26 PolarHBondContact O-N 2.89Å; Y23-A26 PolarHBondContact O-N 3.39Å; K24-A26 VanDerWaalsContact C-N 3.27Å; K24-A26 PolarHBondContact O-N 2.75Å; A26-S29 WeakPolarHBondContact CA-OG 3.17Å; A26-S29 PolarHBondContact O-OG 3.03Å; A26-N30 PolarHBondContact O-ND2 3.29Å
27L57.9Low57.1Low61 Ų61102.2 Ų102.232%0.31955%0.55SS.*Hα-helixtrans-80.3-40.3173.2-123.374000111Y23 K24 S29 N30 G31 L36Y23-L27 WeakPolarHBondContact O-CB 3.01Å; Y23-L27 PolarHBondContact O-N 2.96Å; K24-L27 PolarHBondContact O-N 3.26Å; L27-S29 VanDerWaalsContact C-N 3.31Å; L27-S29 PolarHBondContact O-N 3.47Å; L27-N30 PolarHBondContact O-N 3.17Å; L27-N30 VanDerWaalsContact O-N 3.13Å; L27-G31 PolarHBondContact O-N 3.21Å; L27-L36 HydrophobicContact CD2-CD1 4.1Å
28E61.3Low57.1Low99 Ų99108.8 Ų108.846%0.46358%0.581SS.*Hα-helixtrans-63.5-36.6174.9-76.2-178.4175.200110.8K24 N30 G31K24-E28 WeakPolarHBondContact CE-OE1 3.48Å; K24-E28 IonicContact NZ-OE1 3.58Å; K24-E28 PolarHBondContact O-N 3.2Å; E28-N30 VanDerWaalsContact C-N 3.27Å; E28-N30 PolarHBondContact O-N 2.97Å; E28-G31 PolarHBondContact O-N 3.3Å
29S60.4Low56.8Low93 Ų93106 Ų10665%0.6558%0.581SS**THydrogen-bonded Turntrans-68.9-22.6173.670.10000114.1D25 A26 L27D25-S29 PolarHBondContact O-N 3.4Å; D25-S29 VanDerWaalsContact O-N 3.12Å; A26-S29 WeakPolarHBondContact CA-OG 3.17Å; A26-S29 PolarHBondContact O-OG 3.03Å; L27-S29 VanDerWaalsContact C-N 3.31Å; L27-S29 PolarHBondContact O-N 3.47Å
30N60.5Low56.8Low118 Ų118105.1 Ų105.163%0.63158%0.577SS**THydrogen-bonded Turntrans-9511.4-179.3-80.5-39.1000113.5A26 L27 E28 L32A26-N30 PolarHBondContact O-ND2 3.29Å; L27-N30 PolarHBondContact O-N 3.17Å; L27-N30 VanDerWaalsContact O-N 3.13Å; E28-N30 VanDerWaalsContact C-N 3.27Å; E28-N30 PolarHBondContact O-N 2.97Å; N30-L32 PolarHBondContact O-N 3.41Å; N30-L32 VanDerWaalsContact O-N 3.07Å
31G56.2Low56.7Low58 Ų58107.2 Ų107.260%0.59858%0.583SS**THydrogen-bonded Turntrans66.411172.900000115.1L27 E28 N33L27-G31 PolarHBondContact O-N 3.21Å; E28-G31 PolarHBondContact O-N 3.3Å; G31-N33 PolarHBondContact O-N 3.3Å
32L55.1Low56.5Low109 Ų109101.9 Ų101.957%0.57157%0.571SS**  trans-8542.6-177.7-118.2106.8000112.4N30 A34N30-L32 PolarHBondContact O-N 3.41Å; N30-L32 VanDerWaalsContact O-N 3.07Å; L32-A34 PolarHBondContact O-N 3.29Å
33N54.8Low56.3Low124 Ų124101.3 Ų101.366%0.66357%0.57SS**THydrogen-bonded Turntrans-72.67.9-172-71.1-26.4000115.1G31G31-N33 PolarHBondContact O-N 3.3Å
34A53Low56.3Low98 Ų9895.1 Ų95.181%0.8155%0.553SS**THydrogen-bonded Turntrans-108.6-7.1-167.300000115.9L32L32-A34 PolarHBondContact O-N 3.29Å
35L51.9Low56.4Low140 Ų14091.3 Ų91.373%0.73354%0.536SS*.SBendtrans-128.7-0.3-164.7-97151.8000117.1
36L54.6Low56.4Low140 Ų14089 Ų8973%0.73353%0.525SS*.SBendtrans-108.2109.2169.2-95.885.9000110.9L27L27-L36 HydrophobicContact CD2-CD1 4.1Å
37P53.2Low56.7Low111 Ų11192 Ų9272%0.72153%0.534SS*.  trans-61.1150.2175.326.2-32000110.1L39P37-L39 PolarHBondContact O-N 3.16Å
38H53Low56.9Low196 Ų19693 Ų9391%0.90754%0.542SS*.  trans-5644.6-171.2-54.8-73000117.2D40H38-D40 VanDerWaalsContact C-N 3.3Å; H38-D40 PolarHBondContact O-N 3.28Å
39L51.6Low57Low146 Ų14690.1 Ų90.176%0.76453%0.532SS*.  trans-75.788.7171.4-138.881.4000108.2P37 L41P37-L39 PolarHBondContact O-N 3.16Å; L39-L41 PolarHBondContact O-N 2.93Å
40D56.5Low57.2Low77 Ų7792 Ų9241%0.41253%0.532SS..  trans-65.796.5-179.5-150.4-2.8000108.8H38 G42 S43H38-D40 VanDerWaalsContact C-N 3.3Å; H38-D40 PolarHBondContact O-N 3.28Å; D40-G42 PolarHBondContact O-N 3.23Å; D40-S43 PolarHBondContact O-N 2.81Å; D40-S43 PolarHBondContact O-OG 3.49Å
41L56Low57.6Low77 Ų7791.8 Ų91.840%0.40353%0.529SS..Hα-helixtrans-49.1-21.1-176.1-72.8158.1000113.2F17 A20 L39 R45F17-L41 HydrophobicContact CE1-CB 4.38Å; A20-L41 HydrophobicContact CB-CD1 4.42Å; L39-L41 PolarHBondContact O-N 2.93Å; L41-R45 PolarHBondContact O-N 3.27Å
42G54.7Low57.9Low26 Ų2691.3 Ų91.327%0.26851%0.511SS..Hα-helixtrans-64.1-39.6174.700000114.7D40D40-G42 PolarHBondContact O-N 3.23Å
43S55.3Low58.2Low62 Ų6289.2 Ų89.243%0.43450%0.503SS..Hα-helixtrans-80.6-37.5-179.364.40000111.6D40 R45 V46 L47D40-S43 PolarHBondContact O-N 2.81Å; D40-S43 PolarHBondContact O-OG 3.49Å; S43-R45 VanDerWaalsContact C-N 3.27Å; S43-R45 PolarHBondContact O-N 2.9Å; S43-V46 PolarHBondContact O-N 3.46Å; S43-V46 VanDerWaalsContact O-N 3.13Å; S43-L47 PolarHBondContact O-N 3.29Å; S43-L47 VanDerWaalsContact O-N 3.08Å
44A58.7Low58.9Low34 Ų3485.1 Ų85.128%0.28149%0.489SS..Hα-helixtrans-57.1-40175.400000112V46 L47 V48A44-V46 PolarHBondContact O-N 3.43Å; A44-L47 PolarHBondContact O-N 3.31Å; A44-V48 WeakPolarHBondContact O-CB 3.43Å; A44-V48 VanDerWaalsContact O-CG2 3.26Å; A44-V48 WeakPolarHBondContact O-CG2 3.45Å; A44-V48 PolarHBondContact O-N 3.49Å
45R61.2Low59.6Low19 Ų1985.7 Ų85.77%0.07247%0.474CS..Hα-helixtrans-59.1-44.8176.2-173.5-17361.5-176.7-2.4112.4F17 L41 S43 V49 N184F17-R45 HydrophobicContact CE1-CB 4.05Å; F17-R45 HydrophobicContact CE1-CG 4.46Å; F17-R45 HydrophobicContact CE2-CB 4.25Å; F17-R45 HydrophobicContact CE2-CG 3.99Å; F17-R45 HydrophobicContact CZ-CB 3.63Å; F17-R45 HydrophobicContact CZ-CG 3.89Å; L41-R45 PolarHBondContact O-N 3.27Å; S43-R45 VanDerWaalsContact C-N 3.27Å; S43-R45 PolarHBondContact O-N 2.9Å; R45-V49 VanDerWaalsContact O-CG2 3.27Å; R45-V49 WeakPolarHBondContact O-CG2 3.42Å; R45-V49 PolarHBondContact O-N 2.83Å; R45-N184 VanDerWaalsContact NH1-CG 3.27Å; R45-N184 PolarHBondContact NH1-ND2 2.92Å; R45-N184 PolarHBondContact NH1-OD1 3.4Å
46V61.1Low60Low39 Ų3980.9 Ų80.924%0.23645%0.446CS..Hα-helixtrans-68.5-40.6-178.9-1800000110.3S43 A44 V49 M50 W143S43-V46 PolarHBondContact O-N 3.46Å; S43-V46 VanDerWaalsContact O-N 3.13Å; A44-V46 PolarHBondContact O-N 3.43Å; V46-V49 PolarHBondContact O-N 3.18Å; V46-M50 VanDerWaalsContact O-CB 3.31Å; V46-M50 WeakPolarHBondContact O-CB 3.48Å; V46-M50 PolarHBondContact O-N 2.92Å; V46-W143 HydrophobicContact CG2-CE3 4.39Å; V46-W143 HydrophobicContact CG2-CZ3 4.07Å
47L63.8Low60.5Low106 Ų10680.1 Ų80.156%0.55544%0.442SS*.Hα-helixtrans-64.6-43.5177.5-172.3134000111.9S43 A44 V49 M50 I51S43-L47 PolarHBondContact O-N 3.29Å; S43-L47 VanDerWaalsContact O-N 3.08Å; A44-L47 PolarHBondContact O-N 3.31Å; L47-V49 PolarHBondContact O-N 3.38Å; L47-M50 PolarHBondContact O-N 2.96Å; L47-I51 HydrophobicContact CD2-CD1 3.49Å; L47-I51 VanDerWaalsContact CD2-CD1 3.49Å; L47-I51 HydrophobicContact CD2-CG1 4.47Å; L47-I51 HydrophobicContact CG-CD1 4.13Å; L47-I51 VanDerWaalsContact O-CG1 3.28Å; L47-I51 WeakPolarHBondContact O-CG1 3.18Å; L47-I51 PolarHBondContact O-N 3.16Å
48V62.8Low61.1Low80 Ų8079 Ų7949%0.48544%0.437SS..Hα-helixtrans-61.1-45.1174.9171.20000111.3A44 F52A44-V48 WeakPolarHBondContact O-CB 3.43Å; A44-V48 VanDerWaalsContact O-CG2 3.26Å; A44-V48 WeakPolarHBondContact O-CG2 3.45Å; A44-V48 PolarHBondContact O-N 3.49Å; V48-F52 WeakPolarHBondContact O-CB 2.95Å; V48-F52 PolarHBondContact O-N 3.27Å
49V62.1Low61.5Low40 Ų4072 Ų7224%0.24241%0.408CS..Hα-helixtrans-63.6-42176.6172.80000110.9R45 V46 L47 F52 V53 V187R45-V49 VanDerWaalsContact O-CG2 3.27Å; R45-V49 WeakPolarHBondContact O-CG2 3.42Å; R45-V49 PolarHBondContact O-N 2.83Å; V46-V49 PolarHBondContact O-N 3.18Å; L47-V49 PolarHBondContact O-N 3.38Å; V49-F52 PolarHBondContact O-N 2.67Å; V49-V53 HydrophobicContact CG1-CG2 4.27Å; V49-V53 WeakPolarHBondContact O-CB 3.47Å; V49-V53 VanDerWaalsContact O-CG2 3.28Å; V49-V53 WeakPolarHBondContact O-CG2 3.34Å; V49-V53 PolarHBondContact O-N 3.12Å; V49-V187 HydrophobicContact CG1-CG2 4.41Å; V49-V187 HydrophobicContact CG2-CG1 3.86Å; V49-V187 HydrophobicContact CG2-CG2 4.26Å
50M64.4Low61.8Low133 Ų13367.5 Ų67.566%0.65539%0.392SS*.Hα-helixtrans-64.3-45.2179.6-167.9-171.9-66.800111.9V46 L47 F52 V53 G54V46-M50 VanDerWaalsContact O-CB 3.31Å; V46-M50 WeakPolarHBondContact O-CB 3.48Å; V46-M50 PolarHBondContact O-N 2.92Å; L47-M50 PolarHBondContact O-N 2.96Å; M50-F52 VanDerWaalsContact C-N 3.3Å; M50-F52 PolarHBondContact O-N 3Å; M50-V53 PolarHBondContact O-N 2.98Å; M50-G54 PolarHBondContact O-N 2.96Å
51I69.4Low62.2Low112 Ų11265.8 Ų65.857%0.57439%0.392SS*.Hα-helixtrans-60.2-43.2174.3-68.5169.7000110.1L47 G54 F55L47-I51 HydrophobicContact CD2-CD1 3.49Å; L47-I51 VanDerWaalsContact CD2-CD1 3.49Å; L47-I51 HydrophobicContact CD2-CG1 4.47Å; L47-I51 HydrophobicContact CG-CD1 4.13Å; L47-I51 VanDerWaalsContact O-CG1 3.28Å; L47-I51 WeakPolarHBondContact O-CG1 3.18Å; L47-I51 PolarHBondContact O-N 3.16Å; I51-G54 PolarHBondContact O-N 2.94Å; I51-F55 WeakPolarHBondContact O-CB 3.46Å; I51-F55 PolarHBondContact O-N 3.36Å
52F61.8Low62.5Low48 Ų4865.9 Ų65.921%0.21140%0.397CS..Hα-helixtrans-65.9-42.7-179.7-164.1-97.5000112.6L5 V48 V49 M50 F55 R56L5-F52 HydrophobicContact CB-CE2 3.89Å; L5-F52 HydrophobicContact CB-CZ 4.12Å; L5-F52 HydrophobicContact CD2-CE2 4.04Å; V48-F52 WeakPolarHBondContact O-CB 2.95Å; V48-F52 PolarHBondContact O-N 3.27Å; V49-F52 PolarHBondContact O-N 2.67Å; M50-F52 VanDerWaalsContact C-N 3.3Å; M50-F52 PolarHBondContact O-N 3Å; F52-F55 PolarHBondContact O-N 2.88Å; F52-R56 HydrophobicContact CD1-CG 4.15Å; F52-R56 HydrophobicContact CE1-CG 4.11Å; F52-R56 WeakPolarHBondContact O-CB 3.46Å; F52-R56 VanDerWaalsContact O-CG 3.24Å; F52-R56 WeakPolarHBondContact O-CG 2.9Å; F52-R56 PolarHBondContact O-N 3.43Å
53V63.2Low62.6Low66 Ų6667.6 Ų67.640%0.441%0.405SS..Hα-helixtrans-63.5-43.4174.3172.20000110.3V49 M50 F55 R56 L57V49-V53 HydrophobicContact CG1-CG2 4.27Å; V49-V53 WeakPolarHBondContact O-CB 3.47Å; V49-V53 VanDerWaalsContact O-CG2 3.28Å; V49-V53 WeakPolarHBondContact O-CG2 3.34Å; V49-V53 PolarHBondContact O-N 3.12Å; M50-V53 PolarHBondContact O-N 2.98Å; V53-F55 PolarHBondContact O-N 2.93Å; V53-R56 PolarHBondContact O-N 2.74Å; V53-L57 HydrophobicContact CG1-CD1 4.01Å; V53-L57 HydrophobicContact CG1-CG 4.41Å; V53-L57 WeakPolarHBondContact O-CG 2.92Å; V53-L57 PolarHBondContact O-N 3.44Å
54G67.6Low62.8Low37 Ų3769.6 Ų69.638%0.38141%0.41SS..Hα-helixtrans-58.9-45.6175.200000112.6M50 I51 R56 L57 S58M50-G54 PolarHBondContact O-N 2.96Å; I51-G54 PolarHBondContact O-N 2.94Å; G54-R56 VanDerWaalsContact C-N 3.34Å; G54-R56 PolarHBondContact O-N 3.41Å; G54-L57 PolarHBondContact O-N 2.91Å; G54-S58 WeakPolarHBondContact O-CB 3.47Å; G54-S58 PolarHBondContact O-N 2.84Å
55F68.3Low63.3Low110 Ų11074 Ų7448%0.48243%0.425SS..Hα-helixtrans-62.7-39.1175.7-178.1-100.3000112.5L5 I51 F52 V53 S58 T59L5-F55 HydrophobicContact CD1-CE1 4.42Å; I51-F55 WeakPolarHBondContact O-CB 3.46Å; I51-F55 PolarHBondContact O-N 3.36Å; F52-F55 PolarHBondContact O-N 2.88Å; V53-F55 PolarHBondContact O-N 2.93Å; F55-S58 PolarHBondContact O-N 2.93Å; F55-T59 HydrophobicContact CD1-CG2 4.49Å; F55-T59 HydrophobicContact CE1-CG2 4.05Å; F55-T59 HydrophobicContact CE2-CG2 4.24Å; F55-T59 HydrophobicContact CZ-CG2 3.92Å; F55-T59 WeakPolarHBondContact O-CG2 3.45Å; F55-T59 PolarHBondContact O-N 3.26Å; F55-T59 PolarHBondContact O-OG1 3.46Å
56R60.8Low63.5Low40 Ų4076 Ų7615%0.15145%0.445CS..Hα-helixtrans-66.8-41.2176-73-72.2-176.21600.9112.5S2 F52 V53 G54 S58 T59 A60S2-R56 PolarHBondContact O-NH2 3.48Å; F52-R56 HydrophobicContact CD1-CG 4.15Å; F52-R56 HydrophobicContact CE1-CG 4.11Å; F52-R56 WeakPolarHBondContact O-CB 3.46Å; F52-R56 VanDerWaalsContact O-CG 3.24Å; F52-R56 WeakPolarHBondContact O-CG 2.9Å; F52-R56 PolarHBondContact O-N 3.43Å; V53-R56 PolarHBondContact O-N 2.74Å; G54-R56 VanDerWaalsContact C-N 3.34Å; G54-R56 PolarHBondContact O-N 3.41Å; R56-S58 VanDerWaalsContact C-N 3.35Å; R56-T59 WeakPolarHBondContact CA-OG1 3.42Å; R56-T59 PolarHBondContact O-N 3.43Å; R56-T59 PolarHBondContact O-OG1 2.94Å; R56-A60 WeakPolarHBondContact O-CB 3.34Å; R56-A60 PolarHBondContact O-N 3.01Å
57L64.1Low63.5Low123 Ų12380.6 Ų80.664%0.64446%0.459SS*.Hα-helixtrans-66.4-39.7175.7-70.7172.1000111.3V53 G54 T59 A60V53-L57 HydrophobicContact CG1-CD1 4.01Å; V53-L57 HydrophobicContact CG1-CG 4.41Å; V53-L57 WeakPolarHBondContact O-CG 2.92Å; V53-L57 PolarHBondContact O-N 3.44Å; G54-L57 PolarHBondContact O-N 2.91Å; L57-T59 PolarHBondContact O-N 3.46Å; L57-A60 PolarHBondContact O-N 3.45Å
58S67.7Low63.8Low87 Ų8780.8 Ų80.861%0.60846%0.46SS*.Hα-helixtrans-64-39.3175.9-178.50000112.3G54 F55 R56 P62G54-S58 WeakPolarHBondContact O-CB 3.47Å; G54-S58 PolarHBondContact O-N 2.84Å; F55-S58 PolarHBondContact O-N 2.93Å; R56-S58 VanDerWaalsContact C-N 3.35Å; S58-P62 WeakPolarHBondContact O-CD 3.47Å
59T60.5Low64.5Low51 Ų5180.9 Ų80.931%0.31346%0.458SS..Hα-helixtrans-80.3-20.2178.748.70000113.9F55 R56 L57 P62 C63F55-T59 HydrophobicContact CD1-CG2 4.49Å; F55-T59 HydrophobicContact CE1-CG2 4.05Å; F55-T59 HydrophobicContact CE2-CG2 4.24Å; F55-T59 HydrophobicContact CZ-CG2 3.92Å; F55-T59 WeakPolarHBondContact O-CG2 3.45Å; F55-T59 PolarHBondContact O-N 3.26Å; F55-T59 PolarHBondContact O-OG1 3.46Å; R56-T59 WeakPolarHBondContact CA-OG1 3.42Å; R56-T59 PolarHBondContact O-N 3.43Å; R56-T59 PolarHBondContact O-OG1 2.94Å; L57-T59 PolarHBondContact O-N 3.46Å; T59-P62 WeakPolarHBondContact O-CD 2.94Å; T59-P62 WeakPolarHBondContact O-CG 3.41Å; T59-C63 WeakPolarHBondContact O-CB 3.33Å; T59-C63 PolarHBondContact O-N 3.21Å
60A58.3Low64.8Low51 Ų5183.2 Ų83.242%0.42147%0.469SS..Hα-helixtrans-66-37.5177.500000112.9R56 L57 C63 L64R56-A60 WeakPolarHBondContact O-CB 3.34Å; R56-A60 PolarHBondContact O-N 3.01Å; L57-A60 PolarHBondContact O-N 3.45Å; A60-C63 PolarHBondContact O-N 2.97Å; A60-L64 WeakPolarHBondContact O-CB 3.46Å; A60-L64 PolarHBondContact O-N 3.36Å
61G63.8Low64.9Low41 Ų4179 Ų7942%0.42346%0.455SS..Hα-helixtrans-55.2-61.5177.500000113.9C63 L64 Q65G61-C63 VanDerWaalsContact C-N 3.25Å; G61-C63 PolarHBondContact O-N 3.16Å; G61-L64 PolarHBondContact O-N 3.04Å; G61-Q65 PolarHBondContact O-N 2.91Å
62P61.9Low64.9Low78 Ų7878.2 Ų78.251%0.50645%0.451SS..Hα-helixtrans-64.7-30.7-179.523.6-32.6000112.4S58 T59 Q65 A66S58-P62 WeakPolarHBondContact O-CD 3.47Å; T59-P62 WeakPolarHBondContact O-CD 2.94Å; T59-P62 WeakPolarHBondContact O-CG 3.41Å; P62-Q65 PolarHBondContact O-N 2.77Å; P62-A66 WeakPolarHBondContact O-CB 3.41Å; P62-A66 PolarHBondContact O-N 2.92Å
63C58Low65.5Low62 Ų6283.1 Ų83.142%0.41947%0.472SS..Hα-helixtrans-63.6-47.3174.8-165.90000111.2T59 A60 G61 Q65 A66 Y67T59-C63 WeakPolarHBondContact O-CB 3.33Å; T59-C63 PolarHBondContact O-N 3.21Å; A60-C63 PolarHBondContact O-N 2.97Å; G61-C63 VanDerWaalsContact C-N 3.25Å; G61-C63 PolarHBondContact O-N 3.16Å; C63-Q65 VanDerWaalsContact C-N 3.32Å; C63-Q65 PolarHBondContact O-N 3.27Å; C63-A66 PolarHBondContact O-N 2.97Å; C63-Y67 WeakPolarHBondContact O-CD2 3.33Å; C63-Y67 PolarHBondContact O-N 3.38Å; C63-Y67 WeakPolarHBondContact SG-CE2 3.48Å
64L59.9Low65.8Low105 Ų10585.1 Ų85.155%0.5548%0.475SS..Hα-helixtrans-61.7-41.2177-171.968.3000111.6A60 G61 Y67 L68A60-L64 WeakPolarHBondContact O-CB 3.46Å; A60-L64 PolarHBondContact O-N 3.36Å; G61-L64 PolarHBondContact O-N 3.04Å; L64-Y67 PolarHBondContact O-N 2.77Å; L64-L68 WeakPolarHBondContact O-CB 3.3Å; L64-L68 PolarHBondContact O-N 3.43Å
65Q67.6Low65.9Low127 Ų12788.8 Ų88.859%0.59349%0.485SS*.Hα-helixtrans-65.7-39177.5-167.4174.14.200112.1G61 P62 C63 L68 N69G61-Q65 PolarHBondContact O-N 2.91Å; P62-Q65 PolarHBondContact O-N 2.77Å; C63-Q65 VanDerWaalsContact C-N 3.32Å; C63-Q65 PolarHBondContact O-N 3.27Å; Q65-L68 PolarHBondContact O-N 3.47Å; Q65-N69 WeakPolarHBondContact O-CB 3.43Å; Q65-N69 PolarHBondContact O-N 2.74Å
66A66.7Low66.2Low60 Ų6085.9 Ų85.950%0.49648%0.481SS..Hα-helixtrans-63.5-41.5173.900000112P62 C63 N69 L70P62-A66 WeakPolarHBondContact O-CB 3.41Å; P62-A66 PolarHBondContact O-N 2.92Å; C63-A66 PolarHBondContact O-N 2.97Å; A66-N69 PolarHBondContact O-N 3.26Å; A66-L70 WeakPolarHBondContact O-CB 3.08Å; A66-L70 PolarHBondContact O-N 2.88Å
67Y61.4Low66.8Low136 Ų13690.2 Ų90.253%0.53350%0.501SS..Hα-helixtrans-63.5-42.2174.3-82.4-68.1000112.3C63 L64 L70 A71C63-Y67 WeakPolarHBondContact O-CD2 3.33Å; C63-Y67 PolarHBondContact O-N 3.38Å; C63-Y67 WeakPolarHBondContact SG-CE2 3.48Å; L64-Y67 PolarHBondContact O-N 2.77Å; Y67-L70 PolarHBondContact O-N 2.89Å; Y67-A71 PolarHBondContact O-N 2.9Å
68L70.1Confident66.9Low109 Ų10988.5 Ų88.557%0.57149%0.492SS*.Hα-helixtrans-65-43.6177.8-15778.7000111.1L64 Q65 L70 A71 I72L64-L68 WeakPolarHBondContact O-CB 3.3Å; L64-L68 PolarHBondContact O-N 3.43Å; Q65-L68 PolarHBondContact O-N 3.47Å; L68-L70 VanDerWaalsContact C-N 3.29Å; L68-L70 PolarHBondContact O-N 3.36Å; L68-A71 WeakPolarHBondContact O-CB 3.19Å; L68-A71 PolarHBondContact O-N 3.31Å; L68-A71 VanDerWaalsContact O-N 3.16Å; L68-I72 HydrophobicContact CG-CD1 4.42Å; L68-I72 VanDerWaalsContact O-CG1 3.31Å; L68-I72 WeakPolarHBondContact O-CG1 3.29Å; L68-I72 PolarHBondContact O-N 2.86Å
69N76Confident67Low82 Ų8294.3 Ų94.344%0.43950%0.501SS..Hα-helixtrans-61.3-37.9175-77.2-16.1000112Q65 A66 K73Q65-N69 WeakPolarHBondContact O-CB 3.43Å; Q65-N69 PolarHBondContact O-N 2.74Å; A66-N69 PolarHBondContact O-N 3.26Å; N69-K73 VanDerWaalsContact O-CG 3.3Å; N69-K73 WeakPolarHBondContact O-CG 3.37Å; N69-K73 PolarHBondContact O-N 2.88Å
70L70.2Confident67.5Low90 Ų9097.1 Ų97.147%0.47152%0.518SS..Hα-helixtrans-67.4-40.4174.8-167.472.1000111.7A66 Y67 L68 K73 K74A66-L70 WeakPolarHBondContact O-CB 3.08Å; A66-L70 PolarHBondContact O-N 2.88Å; Y67-L70 PolarHBondContact O-N 2.89Å; L68-L70 VanDerWaalsContact C-N 3.29Å; L68-L70 PolarHBondContact O-N 3.36Å; L70-K73 PolarHBondContact O-N 3.13Å; L70-K74 WeakPolarHBondContact O-CG 3.43Å; L70-K74 PolarHBondContact O-N 3.01Å
71A66.3Low67.9Low44 Ų4498.6 Ų98.636%0.36452%0.517SS..Hα-helixtrans-62.4-44.7175.800000111.5Y67 L68 K73 K74 I75Y67-A71 PolarHBondContact O-N 2.9Å; L68-A71 WeakPolarHBondContact O-CB 3.19Å; L68-A71 PolarHBondContact O-N 3.31Å; L68-A71 VanDerWaalsContact O-N 3.16Å; A71-K73 PolarHBondContact O-N 3.32Å; A71-K74 PolarHBondContact O-N 3.44Å; A71-I75 WeakPolarHBondContact O-CG1 3.26Å; A71-I75 PolarHBondContact O-N 3.35Å
72I69Low67.6Low96 Ų9699.1 Ų99.149%0.49252%0.517SS..Hα-helixtrans-60.9-44.7176.1-66.2164.3000110.6L68 K74 I75 A76L68-I72 HydrophobicContact CG-CD1 4.42Å; L68-I72 VanDerWaalsContact O-CG1 3.31Å; L68-I72 WeakPolarHBondContact O-CG1 3.29Å; L68-I72 PolarHBondContact O-N 2.86Å; I72-K74 VanDerWaalsContact C-N 3.34Å; I72-K74 PolarHBondContact O-N 2.91Å; I72-I75 PolarHBondContact O-N 3.3Å; I72-A76 WeakPolarHBondContact O-CB 3.29Å; I72-A76 PolarHBondContact O-N 2.83Å
73K73.7Confident67.7Low150 Ų15099.2 Ų99.265%0.65253%0.532SS*.Hα-helixtrans-60.8-40.9175.8-74.6176.5-178.4-174.10112.5N69 L70 A71 A76 K77N69-K73 VanDerWaalsContact O-CG 3.3Å; N69-K73 WeakPolarHBondContact O-CG 3.37Å; N69-K73 PolarHBondContact O-N 2.88Å; L70-K73 PolarHBondContact O-N 3.13Å; A71-K73 PolarHBondContact O-N 3.32Å; K73-A76 PolarHBondContact O-N 3.43Å; K73-K77 PolarHBondContact O-N 3.25Å
74K70.3Confident67.9Low109 Ų109105.8 Ų105.847%0.47455%0.553SS.*Hα-helixtrans-65.5-42.2176.1-75.2-171.5177.6-169.50112L70 A71 I72 A76 K77 L78L70-K74 WeakPolarHBondContact O-CG 3.43Å; L70-K74 PolarHBondContact O-N 3.01Å; A71-K74 PolarHBondContact O-N 3.44Å; I72-K74 VanDerWaalsContact C-N 3.34Å; I72-K74 PolarHBondContact O-N 2.91Å; K74-A76 VanDerWaalsContact C-N 3.32Å; K74-A76 PolarHBondContact O-N 3.45Å; K74-K77 PolarHBondContact O-N 2.91Å; K74-L78 WeakPolarHBondContact O-CB 3Å; K74-L78 WeakPolarHBondContact O-CG 3.38Å; K74-L78 PolarHBondContact O-N 3.44Å
75I70.2Confident67.9Low113 Ų113104.5 Ų104.558%0.57955%0.546SS*.Hα-helixtrans-63.1-40.7175.1-67.2165.2000110.5A71 I72 L78 R79A71-I75 WeakPolarHBondContact O-CG1 3.26Å; A71-I75 PolarHBondContact O-N 3.35Å; I72-I75 PolarHBondContact O-N 3.3Å; I75-L78 PolarHBondContact O-N 2.84Å; I75-R79 WeakPolarHBondContact O-CB 3.16Å; I75-R79 PolarHBondContact O-N 3.21Å
76A73.6Confident67.7Low49 Ų49101.9 Ų101.941%0.40554%0.542SS..Hα-helixtrans-63.1-43.5175.800000112I72 K73 K74 R79 T80I72-A76 WeakPolarHBondContact O-CB 3.29Å; I72-A76 PolarHBondContact O-N 2.83Å; K73-A76 PolarHBondContact O-N 3.43Å; K74-A76 VanDerWaalsContact C-N 3.32Å; K74-A76 PolarHBondContact O-N 3.45Å; A76-R79 WeakPolarHBondContact O-CB 3.48Å; A76-R79 PolarHBondContact O-N 3.13Å; A76-T80 PolarHBondContact O-N 3.23Å; A76-T80 PolarHBondContact O-OG1 3.48Å
77K73.1Confident67.4Low131 Ų131105.1 Ų105.157%0.5755%0.551SS**Hα-helixtrans-62.2-45.2175.2-173.4176176.3179.40111.8K73 K74 R79 T80 E81K73-K77 PolarHBondContact O-N 3.25Å; K74-K77 PolarHBondContact O-N 2.91Å; K77-R79 VanDerWaalsContact C-N 3.28Å; K77-R79 PolarHBondContact O-N 3.17Å; K77-T80 WeakPolarHBondContact CA-OG1 3.27Å; K77-T80 PolarHBondContact O-N 3.42Å; K77-T80 PolarHBondContact O-OG1 2.78Å; K77-E81 WeakPolarHBondContact CE-OE1 3.44Å; K77-E81 WeakPolarHBondContact O-CG 3.44Å; K77-E81 PolarHBondContact O-N 3.17Å
78L66.6Low67.4Low88 Ų88106.8 Ų106.846%0.46156%0.561SS.*Hα-helixtrans-61.7-36.8174-72.9169000111.6K74 I75 E81 A82K74-L78 WeakPolarHBondContact O-CB 3Å; K74-L78 WeakPolarHBondContact O-CG 3.38Å; K74-L78 PolarHBondContact O-N 3.44Å; I75-L78 PolarHBondContact O-N 2.84Å; L78-E81 PolarHBondContact O-N 2.77Å; L78-A82 WeakPolarHBondContact O-CB 3.47Å; L78-A82 PolarHBondContact O-N 3.34Å
79R69.5Low67.1Low208 Ų208106 Ų10679%0.78556%0.557SS**Hα-helixtrans-68.2-38.6177.3-170.4175.7-175.5167.81.8112.5I75 A76 K77 E81 A82I75-R79 WeakPolarHBondContact O-CB 3.16Å; I75-R79 PolarHBondContact O-N 3.21Å; A76-R79 WeakPolarHBondContact O-CB 3.48Å; A76-R79 PolarHBondContact O-N 3.13Å; K77-R79 VanDerWaalsContact C-N 3.28Å; K77-R79 PolarHBondContact O-N 3.17Å; R79-E81 VanDerWaalsContact C-N 3.33Å; R79-A82 PolarHBondContact O-N 3.44Å
80T70.7Confident66.4Low111 Ų111106.2 Ų106.268%0.68156%0.558SS**Hα-helixtrans-68.8-33.6174.948.70000112.2A76 K77A76-T80 PolarHBondContact O-N 3.23Å; A76-T80 PolarHBondContact O-OG1 3.48Å; K77-T80 WeakPolarHBondContact CA-OG1 3.27Å; K77-T80 PolarHBondContact O-N 3.42Å; K77-T80 PolarHBondContact O-OG1 2.78Å
81E67.5Low65.8Low82 Ų82107.3 Ų107.338%0.38356%0.564SS.*Hα-helixtrans-79.5-28.7176-69173.9-167.700112.1K77 L78 R79 G83 K84 I85K77-E81 WeakPolarHBondContact CE-OE1 3.44Å; K77-E81 WeakPolarHBondContact O-CG 3.44Å; K77-E81 PolarHBondContact O-N 3.17Å; L78-E81 PolarHBondContact O-N 2.77Å; R79-E81 VanDerWaalsContact C-N 3.33Å; E81-G83 PolarHBondContact O-N 2.95Å; E81-K84 CarbonylContact O-C 3.57Å; E81-K84 WeakPolarHBondContact O-CA 3.13Å; E81-K84 PolarHBondContact O-N 2.7Å; E81-I85 HydrophobicContact CB-CD1 4.13Å; E81-I85 WeakPolarHBondContact O-CB 3.5Å; E81-I85 PolarHBondContact O-N 3.41Å; E81-I85 VanDerWaalsContact O-N 3.13Å
82A58.3Low65.6Low52 Ų52107.5 Ų107.543%0.4357%0.566SS.*Hα-helixtrans-64.7-21.7177.700000113.8L78 R79 K84L78-A82 WeakPolarHBondContact O-CB 3.47Å; L78-A82 PolarHBondContact O-N 3.34Å; R79-A82 PolarHBondContact O-N 3.44Å; A82-K84 PolarHBondContact O-N 3.38Å
83G62.9Low65.1Low79 Ų79109 Ų10981%0.81457%0.566SS**THydrogen-bonded Turntrans-67.8-15169.600000113.5E81E81-G83 PolarHBondContact O-N 2.95Å
84K62.4Low64.4Low201 Ų201105 Ų10587%0.87455%0.554SS**THydrogen-bonded Turntrans-118.6-5.2-177.4-140.7175.7-178.2179.80113.1E81 A82E81-K84 CarbonylContact O-C 3.57Å; E81-K84 WeakPolarHBondContact O-CA 3.13Å; E81-K84 PolarHBondContact O-N 2.7Å; A82-K84 PolarHBondContact O-N 3.38Å
85I60.2Low63.5Low77 Ų77102.9 Ų102.940%0.39555%0.553SS.*SBendtrans-113.2123.9-173.1-90.8162.5000109.6E81 D89E81-I85 HydrophobicContact CB-CD1 4.13Å; E81-I85 WeakPolarHBondContact O-CB 3.5Å; E81-I85 PolarHBondContact O-N 3.41Å; E81-I85 VanDerWaalsContact O-N 3.13Å; I85-D89 HydrophobicContact CG2-CB 3.91Å
86S62.4Low62.8Low73 Ų7399.6 Ų99.651%0.5154%0.54SS..  trans-62.8145.4179.2-178.20000110.6K88 D89S86-K88 PolarHBondContact O-N 2.8Å; S86-D89 PolarHBondContact O-N 3.5Å
87N61.5Low61.8Low128 Ų12899.3 Ų99.368%0.68453%0.534SS*.Hα-helixtrans-51.3-21.4174.4-78.5-67.4000113.4N91N87-N91 PolarHBondContact O-N 2.69Å; N87-N91 VanDerWaalsContact O-N 3.08Å
88K62Low60.4Low170 Ų170100 Ų10074%0.73954%0.543SS*.Hα-helixtrans-63-40.5171.7-84.6-175.5174.2179.10113.3S86 N91 A92S86-K88 PolarHBondContact O-N 2.8Å; K88-N91 PolarHBondContact O-N 3.32Å; K88-A92 VanDerWaalsContact O-CB 3.32Å; K88-A92 WeakPolarHBondContact O-CB 3.3Å; K88-A92 PolarHBondContact O-N 2.87Å
89D63.3Low59.5Low92 Ų92104.6 Ų104.649%0.49256%0.559SS.*Hα-helixtrans-78.9-29.2-178.8-57.9-38.3000111.4I85 S86 A92 Y93I85-D89 HydrophobicContact CG2-CB 3.91Å; S86-D89 PolarHBondContact O-N 3.5Å; D89-A92 CarbonylContact O-C 3.59Å; D89-A92 PolarHBondContact O-N 2.93Å; D89-Y93 WeakPolarHBondContact O-CB 3.31Å; D89-Y93 PolarHBondContact O-N 3.5Å
90L61.3Low58.3Low88 Ų88102.2 Ų102.246%0.46155%0.55SS.*Hα-helixtrans-65.2-44.1171-169.268.8000110.7Y93 V94L90-Y93 PolarHBondContact O-N 3.23Å; L90-V94 WeakPolarHBondContact O-CB 3.23Å; L90-V94 VanDerWaalsContact O-CG2 3.27Å; L90-V94 WeakPolarHBondContact O-CG2 3.49Å; L90-V94 PolarHBondContact O-N 3.43Å
91N56.5Low57.2Low112 Ų112101.6 Ų101.660%0.59955%0.548SS*.Hα-helixtrans-68.9-33.1173.6-81.5-11.9000112.4N87 K88 S95N87-N91 PolarHBondContact O-N 2.69Å; N87-N91 VanDerWaalsContact O-N 3.08Å; K88-N91 PolarHBondContact O-N 3.32Å; N91-S95 WeakPolarHBondContact O-CB 3.37Å; N91-S95 PolarHBondContact O-N 2.92Å; N91-S95 PolarHBondContact O-OG 3.49Å
92A62.2Low56.2Low48 Ų48107.9 Ų107.940%0.39757%0.57SS.*Hα-helixtrans-68.3-34.2171.700000111.9K88 D89 S95 S96K88-A92 VanDerWaalsContact O-CB 3.32Å; K88-A92 WeakPolarHBondContact O-CB 3.3Å; K88-A92 PolarHBondContact O-N 2.87Å; D89-A92 CarbonylContact O-C 3.59Å; D89-A92 PolarHBondContact O-N 2.93Å; A92-S95 WeakPolarHBondContact CA-OG 3.39Å; A92-S95 PolarHBondContact O-OG 2.9Å; A92-S96 WeakPolarHBondContact O-CB 3.24Å; A92-S96 PolarHBondContact O-N 2.87Å; A92-S96 PolarHBondContact O-OG 3.23Å
93Y59.5Low55.7Low127 Ų127109 Ų10950%0.49857%0.574SS.*Hα-helixtrans-74.1-43177-171.6-95000111.5D89 L90 S96 T97D89-Y93 WeakPolarHBondContact O-CB 3.31Å; D89-Y93 PolarHBondContact O-N 3.5Å; L90-Y93 PolarHBondContact O-N 3.23Å; Y93-S96 WeakPolarHBondContact CA-OG 3.24Å; Y93-S96 PolarHBondContact O-OG 2.98Å; Y93-S96 VanDerWaalsContact O-OG 3.12Å; Y93-T97 WeakPolarHBondContact O-CB 3.43Å; Y93-T97 PolarHBondContact O-N 3.32Å; Y93-T97 PolarHBondContact O-OG1 2.78Å
94V58.1Low55Low67 Ų67106.6 Ų106.641%0.40655%0.545SS..Hα-helixtrans-67.6-42.9175.5173.70000110.5L90 T97 L98L90-V94 WeakPolarHBondContact O-CB 3.23Å; L90-V94 VanDerWaalsContact O-CG2 3.27Å; L90-V94 WeakPolarHBondContact O-CG2 3.49Å; L90-V94 PolarHBondContact O-N 3.43Å; V94-T97 PolarHBondContact O-N 3.42Å; V94-L98 HydrophobicContact CG1-CD1 3.96Å; V94-L98 WeakPolarHBondContact O-CB 3.18Å; V94-L98 PolarHBondContact O-N 2.86Å
95S51.9Low54.4Low64 Ų6499.8 Ų99.845%0.44852%0.52SS..Hα-helixtrans-70.3-35.3175.661.10000113N91 A92 T97 L98 F99N91-S95 WeakPolarHBondContact O-CB 3.37Å; N91-S95 PolarHBondContact O-N 2.92Å; N91-S95 PolarHBondContact O-OG 3.49Å; A92-S95 WeakPolarHBondContact CA-OG 3.39Å; A92-S95 PolarHBondContact O-OG 2.9Å; S95-T97 VanDerWaalsContact C-N 3.33Å; S95-L98 PolarHBondContact O-N 3.28Å; S95-F99 WeakPolarHBondContact O-CA 3.48Å; S95-F99 WeakPolarHBondContact O-CB 3.27Å; S95-F99 PolarHBondContact O-N 3.48Å
96S55.7Low54.1Low44 Ų4498.9 Ų98.931%0.30852%0.521SS..Hα-helixtrans-72-27.5171.860.60000112.6A92 Y93 R100A92-S96 WeakPolarHBondContact O-CB 3.24Å; A92-S96 PolarHBondContact O-N 2.87Å; A92-S96 PolarHBondContact O-OG 3.23Å; Y93-S96 WeakPolarHBondContact CA-OG 3.24Å; Y93-S96 PolarHBondContact O-OG 2.98Å; Y93-S96 VanDerWaalsContact O-OG 3.12Å; S96-R100 WeakPolarHBondContact O-CB 2.86Å; S96-R100 PolarHBondContact O-N 3.09Å
97T52.8Low53.6Low44 Ų4498.9 Ų98.927%0.2751%0.514SS..Hα-helixtrans-74-34173.6-60.80000112.2Y93 V94 S95Y93-T97 WeakPolarHBondContact O-CB 3.43Å; Y93-T97 PolarHBondContact O-N 3.32Å; Y93-T97 PolarHBondContact O-OG1 2.78Å; V94-T97 PolarHBondContact O-N 3.42Å; S95-T97 VanDerWaalsContact C-N 3.33Å
98L44.1Very low53.2Low146 Ų14696.3 Ų96.376%0.76450%0.503SS*.Hα-helixtrans-89.5-23.2178.2-92.6144.7000114.4V94 S95V94-L98 HydrophobicContact CG1-CD1 3.96Å; V94-L98 WeakPolarHBondContact O-CB 3.18Å; V94-L98 PolarHBondContact O-N 2.86Å; S95-L98 PolarHBondContact O-N 3.28Å
99F47Very low52.8Low184 Ų18493.2 Ų93.281%0.80749%0.494SS*.Hα-helixtrans-122.40.8-168.8-143.8-96.1000115.1S95 P101S95-F99 WeakPolarHBondContact O-CA 3.48Å; S95-F99 WeakPolarHBondContact O-CB 3.27Å; S95-F99 PolarHBondContact O-N 3.48Å; F99-P101 VanDerWaalsContact O-CD 3.24Å; F99-P101 WeakPolarHBondContact O-CD 2.95Å
100R43.7Very low52.5Low158 Ų15890.9 Ų90.960%0.59648%0.481SS*.  trans-102.2101175.6-164.4166.7157.5172.3-8.2110.6S96 Y102S96-R100 WeakPolarHBondContact O-CB 2.86Å; S96-R100 PolarHBondContact O-N 3.09Å; R100-Y102 PolarHBondContact O-N 3.24Å
101P47.6Very low52.3Low97 Ų9791.5 Ų91.563%0.6349%0.485SS*.THydrogen-bonded Turntrans-67.78.4-169.922-30.5000116.7F99F99-P101 VanDerWaalsContact O-CD 3.24Å; F99-P101 WeakPolarHBondContact O-CD 2.95Å
102Y47.7Very low52.3Low215 Ų21594.5 Ų94.584%0.84349%0.489SS*.THydrogen-bonded Turntrans-135.9-2.2-171.1-78-80.7000117.5R100R100-Y102 PolarHBondContact O-N 3.24Å
103S46.2Very low52.2Low74 Ų7497 Ų9752%0.51749%0.491SS..THydrogen-bonded Turntrans-136.9-22.7-172.6-166.30000117.4
104S49.8Very low52.1Low29 Ų2993.5 Ų93.520%0.20349%0.485CS..SBendtrans-120.2-9-178.4-59.10000113.6S106S104-S106 PolarHBondContact O-N 3.42Å
105T49.3Very low52.1Low59 Ų5995.1 Ų95.136%0.36249%0.49SS..Hα-helixtrans-58-31.3173.3-0.60000111.3I107 T108 L109T105-I107 PolarHBondContact O-N 2.92Å; T105-T108 PolarHBondContact O-N 2.94Å; T105-L109 HydrophobicContact CG2-CD1 4.09Å; T105-L109 WeakPolarHBondContact O-CA 3.28Å; T105-L109 WeakPolarHBondContact O-CB 3.26Å; T105-L109 PolarHBondContact O-N 3.2Å
106S52.6Low52.4Low58 Ų5894 Ų9441%0.40649%0.485SS..Hα-helixtrans-63.3-34.4-172.5-450000114.1S104 L110S104-S106 PolarHBondContact O-N 3.42Å; S106-L110 WeakPolarHBondContact O-CB 3.3Å; S106-L110 PolarHBondContact O-N 3.32Å
107I53.2Low52.5Low73 Ų7393.9 Ų93.937%0.37448%0.481SS..Hα-helixtrans-76.2-49.5-179-63.3165.4000110.8T105 L110 L111 Y204T105-I107 PolarHBondContact O-N 2.92Å; I107-L110 PolarHBondContact O-N 3.34Å; I107-L111 HydrophobicContact CG2-CD1 4.3Å; I107-L111 WeakPolarHBondContact O-CB 3.48Å; I107-L111 PolarHBondContact O-N 3.12Å; I107-Y204 WeakPolarHBondContact CG1-OH 2.85Å
108T52.3Low52.8Low73 Ų7395.1 Ų95.145%0.44849%0.485SS..Hα-helixtrans-69-38.7-178.9-52.80000111T105 L111 Y112T105-T108 PolarHBondContact O-N 2.94Å; T108-L111 PolarHBondContact O-N 2.82Å; T108-Y112 HydrophobicContact CG2-CD2 4.04Å; T108-Y112 HydrophobicContact CG2-CE2 4.4Å; T108-Y112 WeakPolarHBondContact O-CB 3.35Å; T108-Y112 PolarHBondContact O-N 3.06Å
109L54.7Low53.5Low105 Ų10590.5 Ų90.555%0.5547%0.468SS..Hα-helixtrans-73.8-33.9177.6-153.1149000110.7T105 F113T105-L109 HydrophobicContact CG2-CD1 4.09Å; T105-L109 WeakPolarHBondContact O-CA 3.28Å; T105-L109 WeakPolarHBondContact O-CB 3.26Å; T105-L109 PolarHBondContact O-N 3.2Å; L109-F113 WeakPolarHBondContact O-CA 3.46Å; L109-F113 WeakPolarHBondContact O-CB 3.2Å; L109-F113 PolarHBondContact O-N 3.44Å
110L56.5Low54.2Low43 Ų4388.6 Ų88.623%0.22546%0.456CS..Hα-helixtrans-68.2-38.3169.9-17188.7000112S106 I107 F113 C114 Y204S106-L110 WeakPolarHBondContact O-CB 3.3Å; S106-L110 PolarHBondContact O-N 3.32Å; I107-L110 PolarHBondContact O-N 3.34Å; L110-F113 PolarHBondContact O-N 3.36Å; L110-C114 WeakPolarHBondContact O-CB 3.46Å; L110-C114 PolarHBondContact O-N 3.11Å; L110-C114 PolarHBondContact O-SG 2.85Å; L110-Y204 HydrophobicContact CD2-CE1 4.44Å
111L56.3Low54.9Low102 Ų10283.7 Ų83.753%0.53445%0.446SS..Hα-helixtrans-67.4-46.5175.2-106148.8000111.6I107 T108 F113 L115I107-L111 HydrophobicContact CG2-CD1 4.3Å; I107-L111 WeakPolarHBondContact O-CB 3.48Å; I107-L111 PolarHBondContact O-N 3.12Å; T108-L111 PolarHBondContact O-N 2.82Å; L111-F113 VanDerWaalsContact C-N 3.34Å; L111-L115 HydrophobicContact CD2-CD1 4.49Å; L111-L115 VanDerWaalsContact O-CB 3.29Å; L111-L115 WeakPolarHBondContact O-CB 3.19Å; L111-L115 VanDerWaalsContact O-CG 3.26Å; L111-L115 WeakPolarHBondContact O-CG 3.45Å; L111-L115 PolarHBondContact O-N 3.48Å
112Y57.8Low55.3Low175 Ų17588 Ų8869%0.68645%0.45SS*.Hα-helixtrans-64.8-37.3173.3-98.9-84.4000111.9T108 A116T108-Y112 HydrophobicContact CG2-CD2 4.04Å; T108-Y112 HydrophobicContact CG2-CE2 4.4Å; T108-Y112 WeakPolarHBondContact O-CB 3.35Å; T108-Y112 PolarHBondContact O-N 3.06Å; Y112-A116 WeakPolarHBondContact O-CA 3.3Å; Y112-A116 WeakPolarHBondContact O-CB 3.36Å; Y112-A116 PolarHBondContact O-N 3.47Å
113F58.8Low55.8Low100 Ų10082.8 Ų82.844%0.43944%0.436SS..Hα-helixtrans-71.1-42.6177.7-171.9-117.3000111.2L109 L110 L111 A116 L117 L197L109-F113 WeakPolarHBondContact O-CA 3.46Å; L109-F113 WeakPolarHBondContact O-CB 3.2Å; L109-F113 PolarHBondContact O-N 3.44Å; L110-F113 PolarHBondContact O-N 3.36Å; L111-F113 VanDerWaalsContact C-N 3.34Å; F113-A116 PolarHBondContact O-N 2.87Å; F113-L117 HydrophobicContact CD1-CD1 3.47Å; F113-L117 VanDerWaalsContact CD1-CD1 3.47Å; F113-L117 HydrophobicContact CD2-CD1 4.2Å; F113-L117 HydrophobicContact CD2-CG 4.49Å; F113-L117 HydrophobicContact CE1-CD1 3.41Å; F113-L117 VanDerWaalsContact CE1-CD1 3.41Å; F113-L117 HydrophobicContact CE2-CD1 4.11Å; F113-L117 HydrophobicContact CE2-CG 4.43Å; F113-L117 HydrophobicContact CG-CD1 3.89Å; F113-L117 HydrophobicContact CZ-CD1 3.72Å; F113-L117 HydrophobicContact CZ-CG 4.44Å; F113-L117 WeakPolarHBondContact O-CB 3.39Å; F113-L117 VanDerWaalsContact O-CD1 3.29Å; F113-L117 WeakPolarHBondContact O-CD1 3.06Å; F113-L117 WeakPolarHBondContact O-CG 3.42Å; F113-L117 PolarHBondContact O-N 2.86Å; F113-L197 HydrophobicContact CD1-CD2 4Å; F113-L197 HydrophobicContact CE1-CD2 3.5Å; F113-L197 VanDerWaalsContact CE1-CD2 3.5Å; F113-L197 HydrophobicContact CZ-CD2 4.46Å
114C57.6Low56.6Low54 Ų5486.1 Ų86.137%0.36544%0.437SS..Hα-helixtrans-64.2-42.7173.6-77.90000111.9L110 L117 I118L110-C114 WeakPolarHBondContact O-CB 3.46Å; L110-C114 PolarHBondContact O-N 3.11Å; L110-C114 PolarHBondContact O-SG 2.85Å; C114-L117 PolarHBondContact O-N 3.39Å; C114-I118 WeakPolarHBondContact O-CB 3.44Å; C114-I118 WeakPolarHBondContact O-CD1 3.36Å; C114-I118 WeakPolarHBondContact O-CG1 3.15Å; C114-I118 PolarHBondContact O-N 2.82Å
115L58.9Low57.1Low100 Ų10089 Ų8952%0.52445%0.454SS..Hα-helixtrans-68.4-41.8175.3-73.8170.6000111.8L111 L117 I118 A119L111-L115 HydrophobicContact CD2-CD1 4.49Å; L111-L115 VanDerWaalsContact O-CB 3.29Å; L111-L115 WeakPolarHBondContact O-CB 3.19Å; L111-L115 VanDerWaalsContact O-CG 3.26Å; L111-L115 WeakPolarHBondContact O-CG 3.45Å; L111-L115 PolarHBondContact O-N 3.48Å; L115-L117 VanDerWaalsContact C-N 3.29Å; L115-L117 PolarHBondContact O-N 2.97Å; L115-I118 PolarHBondContact O-N 2.61Å; L115-A119 VanDerWaalsContact O-CB 3.27Å; L115-A119 WeakPolarHBondContact O-CB 3.08Å; L115-A119 PolarHBondContact O-N 2.89Å
116A58Low57.4Low41 Ų4188.5 Ų88.534%0.33946%0.456SS..Hα-helixtrans-62.3-38.3173.800000110.5Y112 F113 A119 Y120Y112-A116 WeakPolarHBondContact O-CA 3.3Å; Y112-A116 WeakPolarHBondContact O-CB 3.36Å; Y112-A116 PolarHBondContact O-N 3.47Å; F113-A116 PolarHBondContact O-N 2.87Å; A116-A119 PolarHBondContact O-N 3.43Å; A116-Y120 WeakPolarHBondContact O-CA 3.29Å; A116-Y120 WeakPolarHBondContact O-CB 3.2Å; A116-Y120 VanDerWaalsContact O-CD2 3.24Å; A116-Y120 WeakPolarHBondContact O-CD2 3.4Å; A116-Y120 PolarHBondContact O-N 2.91Å
117L58Low57.8Low42 Ų4291 Ų9122%0.2246%0.464CS..Hα-helixtrans-74.7-31.6177.1-74.3164.8000113.3F113 C114 L115 S121 I193 L197F113-L117 HydrophobicContact CD1-CD1 3.47Å; F113-L117 VanDerWaalsContact CD1-CD1 3.47Å; F113-L117 HydrophobicContact CD2-CD1 4.2Å; F113-L117 HydrophobicContact CD2-CG 4.49Å; F113-L117 HydrophobicContact CE1-CD1 3.41Å; F113-L117 VanDerWaalsContact CE1-CD1 3.41Å; F113-L117 HydrophobicContact CE2-CD1 4.11Å; F113-L117 HydrophobicContact CE2-CG 4.43Å; F113-L117 HydrophobicContact CG-CD1 3.89Å; F113-L117 HydrophobicContact CZ-CD1 3.72Å; F113-L117 HydrophobicContact CZ-CG 4.44Å; F113-L117 WeakPolarHBondContact O-CB 3.39Å; F113-L117 VanDerWaalsContact O-CD1 3.29Å; F113-L117 WeakPolarHBondContact O-CD1 3.06Å; F113-L117 WeakPolarHBondContact O-CG 3.42Å; F113-L117 PolarHBondContact O-N 2.86Å; C114-L117 PolarHBondContact O-N 3.39Å; L115-L117 VanDerWaalsContact C-N 3.29Å; L115-L117 PolarHBondContact O-N 2.97Å; L117-S121 WeakPolarHBondContact O-CB 3.46Å; L117-S121 PolarHBondContact O-N 3.28Å; L117-S121 PolarHBondContact O-OG 3.15Å; L117-I193 HydrophobicContact CD2-CG2 4.39Å; L117-L197 HydrophobicContact CD1-CD1 3.76Å; L117-L197 HydrophobicContact CD1-CD2 3.41Å; L117-L197 VanDerWaalsContact CD1-CD2 3.41Å; L117-L197 HydrophobicContact CD1-CG 4.12Å
118I59.3Low58.2Low70 Ų7089.7 Ų89.736%0.35946%0.457SS..Hα-helixtrans-69.7-40.6169.9-68.6163.8000110C114 L115 S121 R122C114-I118 WeakPolarHBondContact O-CB 3.44Å; C114-I118 WeakPolarHBondContact O-CD1 3.36Å; C114-I118 WeakPolarHBondContact O-CG1 3.15Å; C114-I118 PolarHBondContact O-N 2.82Å; L115-I118 PolarHBondContact O-N 2.61Å; I118-S121 WeakPolarHBondContact CA-OG 3.24Å; I118-S121 PolarHBondContact O-OG 3.33Å; I118-R122 WeakPolarHBondContact O-CB 3.37Å; I118-R122 VanDerWaalsContact O-CG 3.29Å; I118-R122 WeakPolarHBondContact O-CG 3.42Å; I118-R122 PolarHBondContact O-N 2.87Å
119A58.8Low58.5Low49 Ų4988.8 Ų88.841%0.40545%0.454SS..Hα-helixtrans-67.6-44.5175.300000111.5L115 A116 R122 L123L115-A119 VanDerWaalsContact O-CB 3.27Å; L115-A119 WeakPolarHBondContact O-CB 3.08Å; L115-A119 PolarHBondContact O-N 2.89Å; A116-A119 PolarHBondContact O-N 3.43Å; A119-R122 PolarHBondContact O-N 3.36Å; A119-L123 WeakPolarHBondContact O-CB 3.34Å; A119-L123 PolarHBondContact O-N 3.31Å
120Y60.7Low58.7Low143 Ų14387.4 Ų87.456%0.56145%0.45SS*.Hα-helixtrans-62.3-50.1174.2-96.8-75.5000109.7A116 R122 L123 W124A116-Y120 WeakPolarHBondContact O-CA 3.29Å; A116-Y120 WeakPolarHBondContact O-CB 3.2Å; A116-Y120 VanDerWaalsContact O-CD2 3.24Å; A116-Y120 WeakPolarHBondContact O-CD2 3.4Å; A116-Y120 PolarHBondContact O-N 2.91Å; Y120-R122 VanDerWaalsContact C-N 3.27Å; Y120-R122 PolarHBondContact O-N 2.79Å; Y120-L123 CarbonylContact O-C 3.58Å; Y120-L123 PolarHBondContact O-N 2.74Å; Y120-L123 VanDerWaalsContact O-N 3.11Å; Y120-W124 AromaticContact CD1-CD1 3.75Å; Y120-W124 AromaticContact CD1-NE1 3.47Å; Y120-W124 WeakPolarHBondContact O-CB 3.4Å; Y120-W124 PolarHBondContact O-N 3.11Å
121S58.8Low58.9Low55 Ų5589 Ų8939%0.38546%0.455SS..Hα-helixtrans-60.7-35177.957.20000112.8L117 I118 V125L117-S121 WeakPolarHBondContact O-CB 3.46Å; L117-S121 PolarHBondContact O-N 3.28Å; L117-S121 PolarHBondContact O-OG 3.15Å; I118-S121 WeakPolarHBondContact CA-OG 3.24Å; I118-S121 PolarHBondContact O-OG 3.33Å; S121-V125 VanDerWaalsContact O-CB 3.3Å; S121-V125 WeakPolarHBondContact O-CB 3.28Å; S121-V125 WeakPolarHBondContact O-CG2 3.37Å; S121-V125 PolarHBondContact O-N 2.77Å
122R55.3Low59Low188 Ų18886.2 Ų86.271%0.70944%0.442SS*.Hα-helixtrans-67.4-42.2171.9-75.7-177.1179.6173.61112.9I118 A119 Y120 A126I118-R122 WeakPolarHBondContact O-CB 3.37Å; I118-R122 VanDerWaalsContact O-CG 3.29Å; I118-R122 WeakPolarHBondContact O-CG 3.42Å; I118-R122 PolarHBondContact O-N 2.87Å; A119-R122 PolarHBondContact O-N 3.36Å; Y120-R122 VanDerWaalsContact C-N 3.27Å; Y120-R122 PolarHBondContact O-N 2.79Å; R122-A126 VanDerWaalsContact O-CB 3.25Å; R122-A126 WeakPolarHBondContact O-CB 3.07Å; R122-A126 PolarHBondContact O-N 3.15Å
123L58.5Low58.9Low105 Ų10583.5 Ų83.555%0.5544%0.439SS..Hα-helixtrans-65.4-40.6174.8-88.6153.9000112.2A119 Y120 A126 L127A119-L123 WeakPolarHBondContact O-CB 3.34Å; A119-L123 PolarHBondContact O-N 3.31Å; Y120-L123 CarbonylContact O-C 3.58Å; Y120-L123 PolarHBondContact O-N 2.74Å; Y120-L123 VanDerWaalsContact O-N 3.11Å; L123-A126 PolarHBondContact O-N 3.04Å; L123-L127 VanDerWaalsContact O-CB 3.31Å; L123-L127 WeakPolarHBondContact O-CB 3.46Å; L123-L127 WeakPolarHBondContact O-CG 3.28Å; L123-L127 PolarHBondContact O-N 2.9Å
124W62.4Low58.6Low144 Ų14483.9 Ų83.955%0.54545%0.445SS..Hα-helixtrans-68.4-42.7176.7-82.4100.1000111.1Y120 A126 L127 I128Y120-W124 AromaticContact CD1-CD1 3.75Å; Y120-W124 AromaticContact CD1-NE1 3.47Å; Y120-W124 WeakPolarHBondContact O-CB 3.4Å; Y120-W124 PolarHBondContact O-N 3.11Å; W124-A126 VanDerWaalsContact C-N 3.35Å; W124-L127 PolarHBondContact O-N 2.95Å; W124-I128 WeakPolarHBondContact O-CB 3.37Å; W124-I128 WeakPolarHBondContact O-CD1 3.4Å; W124-I128 WeakPolarHBondContact O-CG1 3.29Å; W124-I128 PolarHBondContact O-N 3.47Å
125V61.1Low58.5Low90 Ų9083.7 Ų83.755%0.54544%0.44SS..Hα-helixtrans-66.7-36.4174.9171.20000111.4S121 S129S121-V125 VanDerWaalsContact O-CB 3.3Å; S121-V125 WeakPolarHBondContact O-CB 3.28Å; S121-V125 WeakPolarHBondContact O-CG2 3.37Å; S121-V125 PolarHBondContact O-N 2.77Å; V125-S129 WeakPolarHBondContact O-CB 3.34Å; V125-S129 PolarHBondContact O-N 3.4Å
126A56.5Low58.1Low49 Ų4984.2 Ų84.241%0.40544%0.438SS..Hα-helixtrans-69.6-43.3174.500000112.3R122 L123 W124 I128 S129 V130R122-A126 VanDerWaalsContact O-CB 3.25Å; R122-A126 WeakPolarHBondContact O-CB 3.07Å; R122-A126 PolarHBondContact O-N 3.15Å; L123-A126 PolarHBondContact O-N 3.04Å; W124-A126 VanDerWaalsContact C-N 3.35Å; A126-I128 VanDerWaalsContact C-N 3.29Å; A126-I128 PolarHBondContact O-N 3.06Å; A126-S129 PolarHBondContact O-N 3.39Å; A126-S129 PolarHBondContact O-OG 2.9Å; A126-S129 VanDerWaalsContact O-OG 3.1Å; A126-V130 WeakPolarHBondContact O-CB 3.27Å; A126-V130 VanDerWaalsContact O-CG2 3.23Å; A126-V130 WeakPolarHBondContact O-CG2 3.39Å; A126-V130 PolarHBondContact O-N 3.03Å
127L60Low57.7Low111 Ų11186.7 Ų86.758%0.58145%0.451SS*.Hα-helixtrans-63-38.6173.7-84.1167.4000111.5L123 W124 V130 F131L123-L127 VanDerWaalsContact O-CB 3.31Å; L123-L127 WeakPolarHBondContact O-CB 3.46Å; L123-L127 WeakPolarHBondContact O-CG 3.28Å; L123-L127 PolarHBondContact O-N 2.9Å; W124-L127 PolarHBondContact O-N 2.95Å; L127-V130 PolarHBondContact O-N 2.96Å; L127-F131 VanDerWaalsContact O-CB 3.32Å; L127-F131 WeakPolarHBondContact O-CB 3.4Å; L127-F131 PolarHBondContact O-N 2.86Å
128I62.7Low57.1Low44 Ų4491.4 Ų91.423%0.22648%0.477CS..Hα-helixtrans-66.2-42.8174.5-75.7166.3000111.1W124 A126 V130 F131 V132 W183 I186W124-I128 WeakPolarHBondContact O-CB 3.37Å; W124-I128 WeakPolarHBondContact O-CD1 3.4Å; W124-I128 WeakPolarHBondContact O-CG1 3.29Å; W124-I128 PolarHBondContact O-N 3.47Å; A126-I128 VanDerWaalsContact C-N 3.29Å; A126-I128 PolarHBondContact O-N 3.06Å; I128-V130 VanDerWaalsContact C-N 3.33Å; I128-V130 PolarHBondContact O-N 2.86Å; I128-F131 PolarHBondContact O-N 3.25Å; I128-V132 HydrophobicContact CG2-CG2 4.38Å; I128-V132 WeakPolarHBondContact O-CB 3.42Å; I128-V132 WeakPolarHBondContact O-CG2 3.42Å; I128-V132 PolarHBondContact O-N 2.9Å; I128-W183 HydrophobicContact CG2-CH2 3.41Å; I128-W183 VanDerWaalsContact CG2-CH2 3.41Å; I128-W183 HydrophobicContact CG2-CZ2 4.48Å; I128-W183 HydrophobicContact CG2-CZ3 3.98Å; I128-I186 HydrophobicContact CD1-CG2 4.25Å
129S58.4Low56.3Low55 Ų5589.5 Ų89.539%0.38547%0.469SS..Hα-helixtrans-66.2-38.3177.885.10000111.5V125 A126 V132 L133V125-S129 WeakPolarHBondContact O-CB 3.34Å; V125-S129 PolarHBondContact O-N 3.4Å; A126-S129 PolarHBondContact O-N 3.39Å; A126-S129 PolarHBondContact O-OG 2.9Å; A126-S129 VanDerWaalsContact O-OG 3.1Å; S129-V132 PolarHBondContact O-N 3.44Å; S129-L133 VanDerWaalsContact O-CB 3.24Å; S129-L133 WeakPolarHBondContact O-CB 3.41Å; S129-L133 WeakPolarHBondContact O-CD1 3.45Å; S129-L133 VanDerWaalsContact O-CG 3.28Å; S129-L133 WeakPolarHBondContact O-CG 3.48Å; S129-L133 PolarHBondContact O-N 2.96Å
130V59Low55.5Low76 Ų7695.4 Ų95.446%0.46149%0.494SS..Hα-helixtrans-65.6-41.8173.9171.90000110.8A126 L127 I128 L133 L134A126-V130 WeakPolarHBondContact O-CB 3.27Å; A126-V130 VanDerWaalsContact O-CG2 3.23Å; A126-V130 WeakPolarHBondContact O-CG2 3.39Å; A126-V130 PolarHBondContact O-N 3.03Å; L127-V130 PolarHBondContact O-N 2.96Å; I128-V130 VanDerWaalsContact C-N 3.33Å; I128-V130 PolarHBondContact O-N 2.86Å; V130-L133 PolarHBondContact O-N 3.39Å; V130-L134 HydrophobicContact CG1-CD1 3.67Å; V130-L134 HydrophobicContact CG1-CG 4.28Å; V130-L134 VanDerWaalsContact O-CB 3.3Å; V130-L134 WeakPolarHBondContact O-CB 3.4Å; V130-L134 WeakPolarHBondContact O-CG 3.19Å; V130-L134 PolarHBondContact O-N 3.44Å
131F59.2Low54.8Low75 Ų7594 Ų9433%0.32949%0.489SS..Hα-helixtrans-66.5-39.9177.4-161.1-103.9000112.1L127 I128 L134 L135 F174L127-F131 VanDerWaalsContact O-CB 3.32Å; L127-F131 WeakPolarHBondContact O-CB 3.4Å; L127-F131 PolarHBondContact O-N 2.86Å; I128-F131 PolarHBondContact O-N 3.25Å; F131-L134 PolarHBondContact O-N 3.47Å; F131-L135 HydrophobicContact CD1-CD1 3.58Å; F131-L135 HydrophobicContact CE1-CD1 3.5Å; F131-L135 HydrophobicContact CE1-CG 4.46Å; F131-L135 HydrophobicContact CG-CD1 4.46Å; F131-L135 HydrophobicContact CZ-CD1 4.31Å; F131-L135 WeakPolarHBondContact O-CB 3.26Å; F131-L135 WeakPolarHBondContact O-CD1 3.09Å; F131-L135 VanDerWaalsContact O-CG 3.32Å; F131-L135 WeakPolarHBondContact O-CG 3.33Å; F131-L135 PolarHBondContact O-N 2.97Å; F131-L135 VanDerWaalsContact O-N 3.12Å; F131-F174 HydrophobicContact CZ-CD1 4.45Å; F131-F174 AromaticContact CZ-CE1 3.93Å; F131-F174 HydrophobicContact CZ-CE1 3.93Å; F131-F174 HydrophobicContact CZ-CE2 4.44Å; F131-F174 AromaticContact CZ-CZ 3.93Å; F131-F174 HydrophobicContact CZ-CZ 3.93Å
132V59.3Low53.9Low45 Ų4594.8 Ų94.827%0.27349%0.494SS..Hα-helixtrans-64.7-46.9173.7170.70000110.4I128 S129 L134 L135 F136I128-V132 HydrophobicContact CG2-CG2 4.38Å; I128-V132 WeakPolarHBondContact O-CB 3.42Å; I128-V132 WeakPolarHBondContact O-CG2 3.42Å; I128-V132 PolarHBondContact O-N 2.9Å; S129-V132 PolarHBondContact O-N 3.44Å; V132-L134 VanDerWaalsContact C-N 3.32Å; V132-L134 PolarHBondContact O-N 3.4Å; V132-L135 PolarHBondContact O-N 2.87Å; V132-F136 HydrophobicContact CG1-CD2 3.58Å; V132-F136 HydrophobicContact CG1-CE2 3.36Å; V132-F136 WeakPolarHBondContact O-CD2 3.13Å; V132-F136 PolarHBondContact O-N 3.21Å
133L54.7Low53.3Low117 Ų11791 Ų9161%0.61348%0.48SS*.Hα-helixtrans-66.8-27177.1-78.3163.2000113.7S129 V130 P137S129-L133 VanDerWaalsContact O-CB 3.24Å; S129-L133 WeakPolarHBondContact O-CB 3.41Å; S129-L133 WeakPolarHBondContact O-CD1 3.45Å; S129-L133 VanDerWaalsContact O-CG 3.28Å; S129-L133 WeakPolarHBondContact O-CG 3.48Å; S129-L133 PolarHBondContact O-N 2.96Å; V130-L133 PolarHBondContact O-N 3.39Å; L133-P137 WeakPolarHBondContact O-CD 3.25Å; L133-P137 WeakPolarHBondContact O-CG 3.31Å
134L53.8Low52.3Low109 Ų10991.6 Ų91.657%0.57148%0.483SS*.Hα-helixtrans-78.6-26.4174.1-76.7167.2000112.5V130 F131 V132V130-L134 HydrophobicContact CG1-CD1 3.67Å; V130-L134 HydrophobicContact CG1-CG 4.28Å; V130-L134 VanDerWaalsContact O-CB 3.3Å; V130-L134 WeakPolarHBondContact O-CB 3.4Å; V130-L134 WeakPolarHBondContact O-CG 3.19Å; V130-L134 PolarHBondContact O-N 3.44Å; F131-L134 PolarHBondContact O-N 3.47Å; V132-L134 VanDerWaalsContact C-N 3.32Å; V132-L134 PolarHBondContact O-N 3.4Å
135L54.4Low51.2Low49 Ų4989.4 Ų89.426%0.25749%0.487SS..Hα-helixtrans-81.8-29.8175.7-76.1163.8000113.1F131 V132 S139F131-L135 HydrophobicContact CD1-CD1 3.58Å; F131-L135 HydrophobicContact CE1-CD1 3.5Å; F131-L135 HydrophobicContact CE1-CG 4.46Å; F131-L135 HydrophobicContact CG-CD1 4.46Å; F131-L135 HydrophobicContact CZ-CD1 4.31Å; F131-L135 WeakPolarHBondContact O-CB 3.26Å; F131-L135 WeakPolarHBondContact O-CD1 3.09Å; F131-L135 VanDerWaalsContact O-CG 3.32Å; F131-L135 WeakPolarHBondContact O-CG 3.33Å; F131-L135 PolarHBondContact O-N 2.97Å; F131-L135 VanDerWaalsContact O-N 3.12Å; V132-L135 PolarHBondContact O-N 2.87Å; L135-S139 PolarHBondContact O-OG 2.9Å
136F51.6Low50.2Low112 Ų11291.5 Ų91.549%0.49149%0.494SS..SBendtrans-64.1-37.6-179.2-95.3-71.7000116.1V132 W143V132-F136 HydrophobicContact CG1-CD2 3.58Å; V132-F136 HydrophobicContact CG1-CE2 3.36Å; V132-F136 WeakPolarHBondContact O-CD2 3.13Å; V132-F136 PolarHBondContact O-N 3.21Å; F136-W143 AromaticContact CZ-CD1 3.88Å
137P49.5Very low49.3Very low93 Ų9397 Ų9760%0.60452%0.517SS*.SBendtrans-87.3-12.6-17828.6-32.7000114.5L133L133-P137 WeakPolarHBondContact O-CD 3.25Å; L133-P137 WeakPolarHBondContact O-CG 3.31Å
138N44.2Very low48.4Very low141 Ų14196.8 Ų96.875%0.75453%0.525SS*.SBendtrans-111.98.8-174.3-73.6-56.3000114.6
139S42.6Very low47.3Very low29 Ų29103 Ų10320%0.20355%0.553CS.*SBendtrans-157.1138.2178.364.10000112L135 Y141L135-S139 PolarHBondContact O-OG 2.9Å; S139-Y141 PolarHBondContact O-N 3.5Å; S139-Y141 WeakPolarHBondContact OG-CD2 3.26Å; S139-Y141 WeakPolarHBondContact OG-CE2 3.47Å
140N43.7Very low46.4Very low174 Ų174106.1 Ų106.193%0.9357%0.572SS**  trans-67.337.8170.8-71-43.2000112.5S142N140-S142 PolarHBondContact O-N 3.41Å
141Y44.7Very low45.5Very low114 Ų114107 Ų10745%0.44759%0.588SS.*  trans-9177.3179.1-59.5-40.8000109.6S139 W143 V176S139-Y141 PolarHBondContact O-N 3.5Å; S139-Y141 WeakPolarHBondContact OG-CD2 3.26Å; S139-Y141 WeakPolarHBondContact OG-CE2 3.47Å; Y141-W143 PolarHBondContact O-N 3.44Å; Y141-V176 HydrophobicContact CD1-CG2 4.22Å; Y141-V176 HydrophobicContact CE1-CG2 4.19Å
142S39.9Very low44.3Very low70 Ų70107.7 Ų107.749%0.4961%0.607SS.*  trans-69.8124.7165.7178.10000109.5N140 L144N140-S142 PolarHBondContact O-N 3.41Å; S142-L144 WeakPolarHBondContact CB-O 3.4Å; S142-L144 PolarHBondContact O-N 2.97Å; S142-L144 PolarHBondContact OG-N 2.92Å; S142-L144 VanDerWaalsContact OG-N 3.17Å; S142-L144 PolarHBondContact OG-O 3.33Å
143W43.3Very low43.5Very low110 Ų110112.2 Ų112.242%0.41763%0.634SS.*SBendtrans-70.8-7.5169.8-71.281.2000112.7V46 F136 Y141V46-W143 HydrophobicContact CG2-CE3 4.39Å; V46-W143 HydrophobicContact CG2-CZ3 4.07Å; F136-W143 AromaticContact CZ-CD1 3.88Å; Y141-W143 PolarHBondContact O-N 3.44Å
144L37.9Very low42.7Very low117 Ų117112.5 Ų112.561%0.61364%0.641SS**SBendtrans-101.6131.8170.6-72.493.7000109.5S142 L146S142-L144 WeakPolarHBondContact CB-O 3.4Å; S142-L144 PolarHBondContact O-N 2.97Å; S142-L144 PolarHBondContact OG-N 2.92Å; S142-L144 VanDerWaalsContact OG-N 3.17Å; S142-L144 PolarHBondContact OG-O 3.33Å; L144-L146 HydrophobicContact CB-CD1 4.16Å; L144-L146 PolarHBondContact O-N 2.75Å
145P39.2Very low42.3Very low97 Ų97112 Ų11263%0.6365%0.645SS**  trans-75.977.8175.633-31.5000108.6N147P145-N147 PolarHBondContact O-N 2.8Å
146L39Very low42.1Very low135 Ų135114.5 Ų114.571%0.70766%0.664SS**  trans-75.688.1157.1-87.2101.6000106.9L144 S148L144-L146 HydrophobicContact CB-CD1 4.16Å; L144-L146 PolarHBondContact O-N 2.75Å; L146-S148 VanDerWaalsContact C-N 3.28Å; L146-S148 PolarHBondContact O-N 2.85Å; L146-S148 PolarHBondContact O-OG 3.45Å
147N38.4Very low41.5Very low163 Ų163115.3 Ų115.387%0.87268%0.678SS**  trans40.944.9151.4-139.724.8000116.5P145 Q149P145-N147 PolarHBondContact O-N 2.8Å; N147-Q149 PolarHBondContact O-N 2.81Å; N147-Q149 VanDerWaalsContact O-N 3.12Å
148S41.8Very low41.3Very low108 Ų108116.2 Ų116.276%0.75569%0.686SS**  trans-84.989.9176.6-3.70000108.5L146L146-S148 VanDerWaalsContact C-N 3.28Å; L146-S148 PolarHBondContact O-N 2.85Å; L146-S148 PolarHBondContact O-OG 3.45Å
149Q38Very low41.5Very low173 Ų173111.1 Ų111.181%0.80867%0.667SS**  trans-41.7138166.6-167164.8-54.200110.7N147 A151N147-Q149 PolarHBondContact O-N 2.81Å; N147-Q149 VanDerWaalsContact O-N 3.12Å; Q149-A151 PolarHBondContact O-N 3.44Å
150P41.1Very low42Very low121 Ų121114.3 Ų114.379%0.78670%0.695SS**  trans-61.8107.4177.925.1-32000108.4A152P150-A152 PolarHBondContact O-N 2.9Å
151A39.2Very low42.5Very low96 Ų96114 Ų11479%0.79369%0.685SS**  trans-63.1110.8169.700000107.1Q149 V153Q149-A151 PolarHBondContact O-N 3.44Å; A151-V153 PolarHBondContact O-N 3.14Å
152A34.6Very low43.1Very low88 Ų88113.1 Ų113.173%0.72769%0.688SS**  trans-50.2129.3176.400000110P150 T154P150-A152 PolarHBondContact O-N 2.9Å; A152-T154 PolarHBondContact O-N 2.95Å
153V41.3Very low43.7Very low141 Ų141113.2 Ų113.286%0.85568%0.683SS**  trans-69.294174.7177.80000107.7A151A151-V153 PolarHBondContact O-N 3.14Å
154T38.4Very low44.4Very low123 Ų123113.8 Ų113.876%0.75569%0.694SS**  trans-75.4125164.4-18.80000107.7A152A152-T154 PolarHBondContact O-N 2.95Å
155P46.6Very low45.1Very low99 Ų99117.2 Ų117.264%0.64370%0.699SS**  trans-64.5137.5-178.625.5-32.9000110.5T157P155-T157 PolarHBondContact O-N 3.5Å
156P48.5Very low45.6Very low101 Ų101120.6 Ų120.666%0.65670%0.699SS**  trans-7597.3179.929.4-31.7000110
157T40.5Very low46Very low129 Ų129120.3 Ų120.379%0.79170%0.696SS**  trans-74.5126.315632.70000108.7P155P155-T157 PolarHBondContact O-N 3.5Å
158S45.5Very low46.7Very low112 Ų112116.9 Ų116.978%0.78368%0.681SS**SBendtrans92.2122.7175.281.70000116.8
159G47Very low47.4Very low33 Ų33115 Ų11534%0.3467%0.665SS.*  trans98.271.1155.800000117.5K161 D162 D163G159-K161 PolarHBondContact O-N 3.41Å; G159-D162 PolarHBondContact O-N 3.13Å; G159-D163 PolarHBondContact O-N 3.17Å
160A54.6Low48.1Very low96 Ų96113.9 Ų113.979%0.79366%0.658SS**Hα-helixtrans-55.3-14.9167.500000114.2
161K54.3Low48.7Very low168 Ų168111 Ų11173%0.7364%0.64SS**Hα-helixtrans-83.4-28.8173.6-64.6-179.1179.5176.70112.6G159 L164 W165G159-K161 PolarHBondContact O-N 3.41Å; K161-L164 PolarHBondContact O-N 3.46Å; K161-W165 PolarHBondContact O-N 2.65Å
162D56Low49.3Very low95 Ų95109.8 Ų109.851%0.50862%0.623SS.*Hα-helixtrans-78.9-31.3-178.4-57.5-31.7000111G159 W165 R166G159-D162 PolarHBondContact O-N 3.13Å; D162-W165 PolarHBondContact O-N 3.38Å; D162-R166 WeakPolarHBondContact O-CB 3.32Å; D162-R166 WeakPolarHBondContact O-CG 3.44Å; D162-R166 PolarHBondContact O-N 2.82Å
163D53Low50.5Low72 Ų72110.1 Ų110.139%0.38561%0.611SS.*Hα-helixtrans-67.6-34.4171.3-85-16.3000112.6G159 R166 M167G159-D163 PolarHBondContact O-N 3.17Å; D163-R166 PolarHBondContact O-N 3.36Å; D163-M167 WeakPolarHBondContact O-CG 3.14Å; D163-M167 PolarHBondContact O-N 2.94Å
164L57.1Low51.4Low123 Ų123106.3 Ų106.364%0.64458%0.583SS**Hα-helixtrans-66.1-42.9175.9-160.482.7000111.2K161 R166 M167 T168K161-L164 PolarHBondContact O-N 3.46Å; L164-R166 VanDerWaalsContact C-N 3.35Å; L164-M167 PolarHBondContact O-N 2.82Å; L164-T168 PolarHBondContact O-N 2.89Å; L164-T168 PolarHBondContact O-OG1 3.4Å
165W53.4Low52.5Low189 Ų189104.5 Ų104.572%0.71657%0.569SS**Hα-helixtrans-67.4-34.4176.1-77.1112.8000112.7K161 D162 T168 T169K161-W165 PolarHBondContact O-N 2.65Å; D162-W165 PolarHBondContact O-N 3.38Å; W165-T168 VanDerWaalsContact C-OG1 3.28Å; W165-T168 VanDerWaalsContact CA-OG1 3.27Å; W165-T168 WeakPolarHBondContact CA-OG1 3.5Å; W165-T168 PolarHBondContact O-N 3.03Å; W165-T168 PolarHBondContact O-OG1 3.3Å; W165-T169 PolarHBondContact O-OG1 3.21Å
166R49.2Very low53.1Low168 Ų168102.5 Ų102.563%0.63456%0.555SS**Hα-helixtrans-72.5-26.4174.1-69.5175.492.4-178.18.1112.7D162 D163 L164 T168 T172D162-R166 WeakPolarHBondContact O-CB 3.32Å; D162-R166 WeakPolarHBondContact O-CG 3.44Å; D162-R166 PolarHBondContact O-N 2.82Å; D163-R166 PolarHBondContact O-N 3.36Å; L164-R166 VanDerWaalsContact C-N 3.35Å; R166-T168 VanDerWaalsContact C-N 3.34Å; R166-T172 VanDerWaalsContact O-CB 3.26Å; R166-T172 WeakPolarHBondContact O-CB 3.3Å; R166-T172 PolarHBondContact O-OG1 3.38Å
167M48.5Very low53.7Low129 Ų129102.8 Ų102.864%0.63556%0.555SS**Hα-helixtrans-71.2-27.1170.3-75.3-178.2-178.400113D163 L164D163-M167 WeakPolarHBondContact O-CG 3.14Å; D163-M167 PolarHBondContact O-N 2.94Å; L164-M167 PolarHBondContact O-N 2.82Å
168T53.1Low54.8Low90 Ų90100.3 Ų100.355%0.55254%0.54SS*.SBendtrans-78.6-13.4174.924.50000114.9L164 W165 R166 F170L164-T168 PolarHBondContact O-N 2.89Å; L164-T168 PolarHBondContact O-OG1 3.4Å; W165-T168 VanDerWaalsContact C-OG1 3.28Å; W165-T168 VanDerWaalsContact CA-OG1 3.27Å; W165-T168 WeakPolarHBondContact CA-OG1 3.5Å; W165-T168 PolarHBondContact O-N 3.03Å; W165-T168 PolarHBondContact O-OG1 3.3Å; R166-T168 VanDerWaalsContact C-N 3.34Å; T168-F170 PolarHBondContact O-N 3.36Å
169T54.9Low55.6Low69 Ų6996.3 Ų96.342%0.42351%0.509SS..SBendtrans-72.3122.2175.8-46.20000109.3W165 S171 T172W165-T169 PolarHBondContact O-OG1 3.21Å; T169-S171 VanDerWaalsContact CG2-OG 3.27Å; T169-S171 WeakPolarHBondContact CG2-OG 3.39Å; T169-S171 PolarHBondContact O-N 3.36Å; T169-T172 WeakPolarHBondContact O-CB 3.39Å; T169-T172 PolarHBondContact O-N 2.84Å
170F53.7Low56.3Low150 Ų15099.5 Ų99.566%0.65851%0.511SS*.Hα-helixtrans-49-26.1178-100.4-82.2000113.7T168 T172 I173 F174T168-F170 PolarHBondContact O-N 3.36Å; F170-T172 VanDerWaalsContact C-N 3.33Å; F170-T172 PolarHBondContact O-N 3.06Å; F170-I173 PolarHBondContact O-N 2.9Å; F170-F174 HydrophobicContact CD1-CD2 4.07Å; F170-F174 AromaticContact CD1-CE2 3.75Å; F170-F174 HydrophobicContact CD1-CE2 3.75Å; F170-F174 HydrophobicContact CE1-CE2 4.18Å; F170-F174 WeakPolarHBondContact O-CD2 3.27Å; F170-F174 PolarHBondContact O-N 3.48Å
171S53.6Low56.7Low60 Ų6096.5 Ų96.542%0.4249%0.49SS..Hα-helixtrans-66.2-29.8175.264.80000113.9T169 F174T169-S171 VanDerWaalsContact CG2-OG 3.27Å; T169-S171 WeakPolarHBondContact CG2-OG 3.39Å; T169-S171 PolarHBondContact O-N 3.36Å; S171-F174 CarbonylContact O-C 3.54Å
172T52.6Low57.3Low71 Ų7192 Ų9244%0.43647%0.473SS..Hα-helixtrans-78.8-33.4177.7-48.60000111R166 T169 F170R166-T172 VanDerWaalsContact O-CB 3.26Å; R166-T172 WeakPolarHBondContact O-CB 3.3Å; R166-T172 PolarHBondContact O-OG1 3.38Å; T169-T172 WeakPolarHBondContact O-CB 3.39Å; T169-T172 PolarHBondContact O-N 2.84Å; F170-T172 VanDerWaalsContact C-N 3.33Å; F170-T172 PolarHBondContact O-N 3.06Å
173I58.5Low57.6Low94 Ų9489.7 Ų89.748%0.48246%0.458SS..Hα-helixtrans-69.8-41.3174.8-58.3173.8000110.3F170 N175F170-I173 PolarHBondContact O-N 2.9Å; I173-N175 PolarHBondContact O-N 3.26Å; I173-N175 VanDerWaalsContact O-N 3.12Å
174F59.7Low58.1Low61 Ų6188.7 Ų88.727%0.26845%0.452SS..THydrogen-bonded Turntrans-8757173.4-73.5-67.7000112.7F131 F170 S171F131-F174 HydrophobicContact CZ-CD1 4.45Å; F131-F174 AromaticContact CZ-CE1 3.93Å; F131-F174 HydrophobicContact CZ-CE1 3.93Å; F131-F174 HydrophobicContact CZ-CE2 4.44Å; F131-F174 AromaticContact CZ-CZ 3.93Å; F131-F174 HydrophobicContact CZ-CZ 3.93Å; F170-F174 HydrophobicContact CD1-CD2 4.07Å; F170-F174 AromaticContact CD1-CE2 3.75Å; F170-F174 HydrophobicContact CD1-CE2 3.75Å; F170-F174 HydrophobicContact CE1-CE2 4.18Å; F170-F174 WeakPolarHBondContact O-CD2 3.27Å; F170-F174 PolarHBondContact O-N 3.48Å; S171-F174 CarbonylContact O-C 3.54Å
175N62.1Low58.5Low86 Ų8687 Ų8746%0.4645%0.447SS..  trans-62.2149.2171.2-165.7-37.9000110.5I173 T177 V178 N179I173-N175 PolarHBondContact O-N 3.26Å; I173-N175 VanDerWaalsContact O-N 3.12Å; N175-T177 PolarHBondContact O-N 3.32Å; N175-T177 PolarHBondContact OD1-N 3.01Å; N175-V178 HydrophobicContact CB-CG2 4.42Å; N175-V178 WeakPolarHBondContact O-CA 3.37Å; N175-V178 PolarHBondContact O-N 2.86Å; N175-N179 PolarHBondContact O-N 3.45Å
176V60.4Low59.1Low56 Ų5679.9 Ų79.934%0.33942%0.422SS..Hα-helixtrans-47.8-37176.1177.70000111.7Y141 R180Y141-V176 HydrophobicContact CD1-CG2 4.22Å; Y141-V176 HydrophobicContact CE1-CG2 4.19Å; V176-R180 HydrophobicContact CG1-CG 4.34Å; V176-R180 VanDerWaalsContact O-CB 3.25Å; V176-R180 WeakPolarHBondContact O-CB 3.31Å; V176-R180 WeakPolarHBondContact O-CD 3.1Å; V176-R180 WeakPolarHBondContact O-CG 3.48Å; V176-R180 PolarHBondContact O-N 2.88Å
177T60.5Low59.9Low107 Ų10772.7 Ų72.766%0.65640%0.397SS*.Hα-helixtrans-65.6-44.3176.6-56.30000112.6N175 R180 G181N175-T177 PolarHBondContact O-N 3.32Å; N175-T177 PolarHBondContact OD1-N 3.01Å; T177-R180 PolarHBondContact O-N 2.93Å; T177-G181 PolarHBondContact O-N 2.91Å
178V62.8Low60.7Low77 Ų7767.2 Ų67.247%0.46737%0.372SS..Hα-helixtrans-67.6-45.6178.3178.50000110N175 R180 G181 L182N175-V178 HydrophobicContact CB-CG2 4.42Å; N175-V178 WeakPolarHBondContact O-CA 3.37Å; N175-V178 PolarHBondContact O-N 2.86Å; V178-R180 VanDerWaalsContact C-N 3.32Å; V178-R180 PolarHBondContact O-N 3.06Å; V178-G181 PolarHBondContact O-N 3.38Å; V178-G181 VanDerWaalsContact O-N 3.14Å; V178-L182 WeakPolarHBondContact O-CB 3.26Å; V178-L182 PolarHBondContact O-N 2.88Å
179N63.4Low61.3Low28 Ų2866.1 Ų66.115%0.1537%0.365CS..Hα-helixtrans-61-41.3177-168.631.9000111.6N175 G181 L182 W183N175-N179 PolarHBondContact O-N 3.45Å; N179-G181 PolarHBondContact O-N 3.12Å; N179-L182 PolarHBondContact O-N 2.91Å; N179-W183 WeakPolarHBondContact O-CB 3.28Å; N179-W183 PolarHBondContact O-N 3.44Å
180R61.9Low61.8Low100 Ų10066.4 Ų66.438%0.37737%0.366SS..Hα-helixtrans-64.8-38.4174.5-76.6172.6178.8-163.3-2.2112.5V176 T177 V178 N184V176-R180 HydrophobicContact CG1-CG 4.34Å; V176-R180 VanDerWaalsContact O-CB 3.25Å; V176-R180 WeakPolarHBondContact O-CB 3.31Å; V176-R180 WeakPolarHBondContact O-CD 3.1Å; V176-R180 WeakPolarHBondContact O-CG 3.48Å; V176-R180 PolarHBondContact O-N 2.88Å; T177-R180 PolarHBondContact O-N 2.93Å; V178-R180 VanDerWaalsContact C-N 3.32Å; V178-R180 PolarHBondContact O-N 3.06Å; R180-N184 PolarHBondContact O-N 3.49Å
181G62.2Low62.3Low34 Ų3459.8 Ų59.835%0.35134%0.339SS..Hα-helixtrans-65.1-49.2175.200000111.8T177 V178 N179 W183 N184 V185T177-G181 PolarHBondContact O-N 2.91Å; V178-G181 PolarHBondContact O-N 3.38Å; V178-G181 VanDerWaalsContact O-N 3.14Å; N179-G181 PolarHBondContact O-N 3.12Å; G181-W183 VanDerWaalsContact C-N 3.29Å; G181-W183 PolarHBondContact O-N 2.86Å; G181-N184 WeakPolarHBondContact O-CB 3.3Å; G181-N184 PolarHBondContact O-N 2.91Å; G181-N184 VanDerWaalsContact O-N 3.13Å; G181-V185 WeakPolarHBondContact O-CG2 3.23Å; G181-V185 PolarHBondContact O-N 2.88Å
182L65.9Low62.9Low72 Ų7258.9 Ų58.938%0.37733%0.333SS..Hα-helixtrans-57.1-43.9176-173.867.2000111.1V178 N179 N184 V185 I186V178-L182 WeakPolarHBondContact O-CB 3.26Å; V178-L182 PolarHBondContact O-N 2.88Å; N179-L182 PolarHBondContact O-N 2.91Å; L182-N184 VanDerWaalsContact C-N 3.33Å; L182-N184 PolarHBondContact O-N 3.1Å; L182-V185 PolarHBondContact O-N 3.44Å; L182-V185 VanDerWaalsContact O-N 3.15Å; L182-I186 HydrophobicContact CG-CD1 3.96Å; L182-I186 VanDerWaalsContact O-CG1 3.32Å; L182-I186 WeakPolarHBondContact O-CG1 3.5Å; L182-I186 PolarHBondContact O-N 3.45Å
183W63.6Low63.5Low48 Ų4859.3 Ų59.318%0.18233%0.331CS..Hα-helixtrans-62-40177.6-151.2-113.7000113I128 N179 G181 V185 I186 V187I128-W183 HydrophobicContact CG2-CH2 3.41Å; I128-W183 VanDerWaalsContact CG2-CH2 3.41Å; I128-W183 HydrophobicContact CG2-CZ2 4.48Å; I128-W183 HydrophobicContact CG2-CZ3 3.98Å; N179-W183 WeakPolarHBondContact O-CB 3.28Å; N179-W183 PolarHBondContact O-N 3.44Å; G181-W183 VanDerWaalsContact C-N 3.29Å; G181-W183 PolarHBondContact O-N 2.86Å; W183-V185 VanDerWaalsContact C-N 3.35Å; W183-I186 HydrophobicContact CE3-CD1 4.09Å; W183-I186 HydrophobicContact CZ3-CD1 4.37Å; W183-I186 PolarHBondContact O-N 3.05Å; W183-V187 WeakPolarHBondContact O-CB 3.48Å; W183-V187 VanDerWaalsContact O-CG2 3.26Å; W183-V187 WeakPolarHBondContact O-CG2 3.32Å; W183-V187 PolarHBondContact O-N 2.88Å
184N63.8Low63.8Low51 Ų5158 Ų5827%0.27332%0.323SS..Hα-helixtrans-63.1-42174.2-83.1-23000111.7R45 R180 G181 L182 S188R45-N184 VanDerWaalsContact NH1-CG 3.27Å; R45-N184 PolarHBondContact NH1-ND2 2.92Å; R45-N184 PolarHBondContact NH1-OD1 3.4Å; R180-N184 PolarHBondContact O-N 3.49Å; G181-N184 WeakPolarHBondContact O-CB 3.3Å; G181-N184 PolarHBondContact O-N 2.91Å; G181-N184 VanDerWaalsContact O-N 3.13Å; L182-N184 VanDerWaalsContact C-N 3.33Å; L182-N184 PolarHBondContact O-N 3.1Å; N184-S188 WeakPolarHBondContact O-CB 3.5Å; N184-S188 PolarHBondContact O-N 3.26Å
185V64.1Low64Low87 Ų8758 Ų5853%0.52732%0.323SS..Hα-helixtrans-64.2-42.3177.5175.70000111G181 L182 W183 S188 T189G181-V185 WeakPolarHBondContact O-CG2 3.23Å; G181-V185 PolarHBondContact O-N 2.88Å; L182-V185 PolarHBondContact O-N 3.44Å; L182-V185 VanDerWaalsContact O-N 3.15Å; W183-V185 VanDerWaalsContact C-N 3.35Å; V185-S188 WeakPolarHBondContact O-CB 3.13Å; V185-T189 VanDerWaalsContact O-CB 3.3Å; V185-T189 WeakPolarHBondContact O-CB 3.47Å; V185-T189 PolarHBondContact O-N 3.08Å; V185-T189 PolarHBondContact O-OG1 3.39Å
186I65.8Low64.2Low39 Ų3956.3 Ų56.320%0.232%0.321CS..Hα-helixtrans-63.3-50.4177.7-68.7167.1000110.8I128 L182 W183 S188 T189 T190I128-I186 HydrophobicContact CD1-CG2 4.25Å; L182-I186 HydrophobicContact CG-CD1 3.96Å; L182-I186 VanDerWaalsContact O-CG1 3.32Å; L182-I186 WeakPolarHBondContact O-CG1 3.5Å; L182-I186 PolarHBondContact O-N 3.45Å; W183-I186 HydrophobicContact CE3-CD1 4.09Å; W183-I186 HydrophobicContact CZ3-CD1 4.37Å; W183-I186 PolarHBondContact O-N 3.05Å; I186-S188 VanDerWaalsContact C-N 3.35Å; I186-S188 PolarHBondContact O-N 2.91Å; I186-T189 PolarHBondContact O-N 3.35Å; I186-T190 WeakPolarHBondContact O-CB 3.44Å; I186-T190 PolarHBondContact O-N 2.85Å; I186-T190 PolarHBondContact O-OG1 2.85Å
187V66.6Low64.4Low18 Ų1855.5 Ų55.511%0.10932%0.315CS..Hα-helixtrans-62.7-44.5-179.5173.60000110.6T13 V49 W183 T189 T190 C191T13-V187 HydrophobicContact CG2-CG1 3.95Å; V49-V187 HydrophobicContact CG1-CG2 4.41Å; V49-V187 HydrophobicContact CG2-CG1 3.86Å; V49-V187 HydrophobicContact CG2-CG2 4.26Å; W183-V187 WeakPolarHBondContact O-CB 3.48Å; W183-V187 VanDerWaalsContact O-CG2 3.26Å; W183-V187 WeakPolarHBondContact O-CG2 3.32Å; W183-V187 PolarHBondContact O-N 2.88Å; V187-T189 PolarHBondContact O-N 3.13Å; V187-T190 PolarHBondContact O-N 2.88Å; V187-C191 VanDerWaalsContact O-CB 3.3Å; V187-C191 WeakPolarHBondContact O-CB 3.32Å; V187-C191 PolarHBondContact O-N 3.07Å
188S66.7Low64.6Low14 Ų1451.3 Ų51.310%0.09829%0.289CS..Hα-helixtrans-52.5-53.7172.4151.60000112.7F14 N184 V185 I186 T190 C191 S192F14-S188 WeakPolarHBondContact CE2-OG 3.2Å; F14-S188 WeakPolarHBondContact CZ-OG 3.37Å; N184-S188 WeakPolarHBondContact O-CB 3.5Å; N184-S188 PolarHBondContact O-N 3.26Å; V185-S188 WeakPolarHBondContact O-CB 3.13Å; I186-S188 VanDerWaalsContact C-N 3.35Å; I186-S188 PolarHBondContact O-N 2.91Å; S188-T190 VanDerWaalsContact C-N 3.34Å; S188-T190 PolarHBondContact O-N 3Å; S188-C191 WeakPolarHBondContact O-CB 3.25Å; S188-C191 PolarHBondContact O-N 2.94Å; S188-S192 WeakPolarHBondContact O-CB 3.21Å; S188-S192 PolarHBondContact O-N 2.82Å; S188-S192 PolarHBondContact O-OG 3Å
189T64.3Low64.7Low67 Ų6750.2 Ų50.241%0.41128%0.283SS..Hα-helixtrans-68-41.7-172.2-55.80000109.4V185 I186 V187 C191 S192 I193V185-T189 VanDerWaalsContact O-CB 3.3Å; V185-T189 WeakPolarHBondContact O-CB 3.47Å; V185-T189 PolarHBondContact O-N 3.08Å; V185-T189 PolarHBondContact O-OG1 3.39Å; I186-T189 PolarHBondContact O-N 3.35Å; V187-T189 PolarHBondContact O-N 3.13Å; T189-C191 VanDerWaalsContact C-N 3.33Å; T189-C191 PolarHBondContact O-N 3.44Å; T189-S192 PolarHBondContact O-N 3.49Å; T189-I193 HydrophobicContact CG2-CD1 4.03Å; T189-I193 VanDerWaalsContact O-CG1 3.28Å; T189-I193 WeakPolarHBondContact O-CG1 3.08Å; T189-I193 PolarHBondContact O-N 3.45Å
190T66.3Low64.8Low74 Ų7452.3 Ų52.345%0.45430%0.297SS..Hα-helixtrans-59.9-44.2174.2-53.30000111.3I186 V187 S188 I193 Q194I186-T190 WeakPolarHBondContact O-CB 3.44Å; I186-T190 PolarHBondContact O-N 2.85Å; I186-T190 PolarHBondContact O-OG1 2.85Å; V187-T190 PolarHBondContact O-N 2.88Å; S188-T190 VanDerWaalsContact C-N 3.34Å; S188-T190 PolarHBondContact O-N 3Å; T190-I193 PolarHBondContact O-N 3.12Å; T190-Q194 WeakPolarHBondContact O-CB 3.43Å; T190-Q194 VanDerWaalsContact O-CG 3.26Å; T190-Q194 WeakPolarHBondContact O-CG 3.4Å; T190-Q194 PolarHBondContact O-N 3.41Å
191C64.4Low64.7Low12 Ų1249.9 Ų49.98%0.08130%0.298CS..Hα-helixtrans-63.9-40.9177.2-170.40000112.1A6 S9 M10 V187 S188 T189 Q194 F195A6-C191 PolarHBondContact O-SG 3.49Å; S9-C191 PolarHBondContact OG-SG 3.13Å; M10-C191 PolarHBondContact N-SG 3.02Å; V187-C191 VanDerWaalsContact O-CB 3.3Å; V187-C191 WeakPolarHBondContact O-CB 3.32Å; V187-C191 PolarHBondContact O-N 3.07Å; S188-C191 WeakPolarHBondContact O-CB 3.25Å; S188-C191 PolarHBondContact O-N 2.94Å; T189-C191 VanDerWaalsContact C-N 3.33Å; T189-C191 PolarHBondContact O-N 3.44Å; C191-Q194 PolarHBondContact O-N 3.12Å; C191-F195 WeakPolarHBondContact O-CB 3.14Å; C191-F195 PolarHBondContact O-N 3.37Å
192S65.8Low64.8Low41 Ų4151.8 Ų51.829%0.28730%0.299SS..Hα-helixtrans-64.6-42.4178.1-57.50000111.6S188 T189 F195 A196S188-S192 WeakPolarHBondContact O-CB 3.21Å; S188-S192 PolarHBondContact O-N 2.82Å; S188-S192 PolarHBondContact O-OG 3Å; T189-S192 PolarHBondContact O-N 3.49Å; S192-F195 PolarHBondContact O-N 3.41Å; S192-A196 WeakPolarHBondContact O-CB 3.3Å; S192-A196 PolarHBondContact O-N 3.48Å
193I64.6Low64.8Low80 Ų8052.7 Ų52.741%0.4130%0.304SS..Hα-helixtrans-63.2-44.4174.6-66.9165.1000110.6L117 T189 T190 F195 A196 L197L117-I193 HydrophobicContact CD2-CG2 4.39Å; T189-I193 HydrophobicContact CG2-CD1 4.03Å; T189-I193 VanDerWaalsContact O-CG1 3.28Å; T189-I193 WeakPolarHBondContact O-CG1 3.08Å; T189-I193 PolarHBondContact O-N 3.45Å; T190-I193 PolarHBondContact O-N 3.12Å; I193-F195 VanDerWaalsContact C-N 3.33Å; I193-F195 PolarHBondContact O-N 3.45Å; I193-A196 PolarHBondContact O-N 2.82Å; I193-L197 HydrophobicContact CG2-CD1 3.94Å; I193-L197 HydrophobicContact CG2-CG 4.48Å; I193-L197 WeakPolarHBondContact O-CB 3.48Å; I193-L197 VanDerWaalsContact O-CG 3.27Å; I193-L197 WeakPolarHBondContact O-CG 3.24Å; I193-L197 PolarHBondContact O-N 2.94Å
194Q64.9Low64.6Low67 Ų6753 Ų5331%0.31331%0.305SS..Hα-helixtrans-64.5-36.2177.8-73.4-72.9-10.100112.9T190 C191 S198T190-Q194 WeakPolarHBondContact O-CB 3.43Å; T190-Q194 VanDerWaalsContact O-CG 3.26Å; T190-Q194 WeakPolarHBondContact O-CG 3.4Å; T190-Q194 PolarHBondContact O-N 3.41Å; C191-Q194 PolarHBondContact O-N 3.12Å; Q194-S198 PolarHBondContact O-N 3.3Å; Q194-S198 VanDerWaalsContact O-N 3.13Å; Q194-S198 PolarHBondContact O-OG 2.67Å
195F64.9Low64.5Low61 Ų6153 Ų5327%0.26831%0.31SS..Hα-helixtrans-66.6-49.8172.9177.7-104.6000111.1A6 L7 C191 S192 I193 L197 S198 V199A6-F195 HydrophobicContact CB-CB 4.33Å; L7-F195 HydrophobicContact CD1-CE2 3.94Å; L7-F195 HydrophobicContact CD2-CD2 3.82Å; L7-F195 HydrophobicContact CD2-CE2 3.42Å; L7-F195 VanDerWaalsContact CD2-CE2 3.42Å; L7-F195 HydrophobicContact CD2-CZ 3.85Å; L7-F195 HydrophobicContact CG-CD2 3.85Å; L7-F195 HydrophobicContact CG-CE2 3.48Å; L7-F195 VanDerWaalsContact CG-CE2 3.48Å; L7-F195 HydrophobicContact CG-CZ 4.33Å; C191-F195 WeakPolarHBondContact O-CB 3.14Å; C191-F195 PolarHBondContact O-N 3.37Å; S192-F195 PolarHBondContact O-N 3.41Å; I193-F195 VanDerWaalsContact C-N 3.33Å; I193-F195 PolarHBondContact O-N 3.45Å; F195-L197 VanDerWaalsContact C-N 3.28Å; F195-L197 PolarHBondContact O-N 3.02Å; F195-S198 WeakPolarHBondContact O-CB 3.45Å; F195-S198 PolarHBondContact O-N 3.5Å; F195-V199 HydrophobicContact CD1-CG2 4.23Å; F195-V199 HydrophobicContact CD2-CG2 4.47Å; F195-V199 HydrophobicContact CE1-CG2 3.74Å; F195-V199 HydrophobicContact CE2-CG2 3.99Å; F195-V199 HydrophobicContact CZ-CG2 3.61Å; F195-V199 WeakPolarHBondContact O-CG2 3.32Å; F195-V199 PolarHBondContact O-N 3.48Å
196A65.3Low64.5Low50 Ų5051.4 Ų51.441%0.41330%0.302SS..Hα-helixtrans-56.5-42.9177.600000111.8S192 I193 S198 V199 V200S192-A196 WeakPolarHBondContact O-CB 3.3Å; S192-A196 PolarHBondContact O-N 3.48Å; I193-A196 PolarHBondContact O-N 2.82Å; A196-S198 VanDerWaalsContact C-N 3.34Å; A196-S198 PolarHBondContact O-N 2.83Å; A196-V199 PolarHBondContact O-N 3.06Å; A196-V200 WeakPolarHBondContact O-CG2 3.26Å; A196-V200 PolarHBondContact O-N 3.46Å
197L65.2Low64.3Low39 Ų3957.4 Ų57.420%0.20432%0.323CS..Hα-helixtrans-60.1-42174.4-76.3165.6000112.9F113 L117 I193 F195 V199 V200 A201F113-L197 HydrophobicContact CD1-CD2 4Å; F113-L197 HydrophobicContact CE1-CD2 3.5Å; F113-L197 VanDerWaalsContact CE1-CD2 3.5Å; F113-L197 HydrophobicContact CZ-CD2 4.46Å; L117-L197 HydrophobicContact CD1-CD1 3.76Å; L117-L197 HydrophobicContact CD1-CD2 3.41Å; L117-L197 VanDerWaalsContact CD1-CD2 3.41Å; L117-L197 HydrophobicContact CD1-CG 4.12Å; I193-L197 HydrophobicContact CG2-CD1 3.94Å; I193-L197 HydrophobicContact CG2-CG 4.48Å; I193-L197 WeakPolarHBondContact O-CB 3.48Å; I193-L197 VanDerWaalsContact O-CG 3.27Å; I193-L197 WeakPolarHBondContact O-CG 3.24Å; I193-L197 PolarHBondContact O-N 2.94Å; F195-L197 VanDerWaalsContact C-N 3.28Å; F195-L197 PolarHBondContact O-N 3.02Å; L197-V199 VanDerWaalsContact C-N 3.35Å; L197-V200 PolarHBondContact O-N 3.37Å; L197-A201 WeakPolarHBondContact O-CB 3.46Å; L197-A201 PolarHBondContact O-N 3.3Å
198S65.1Low63.8Low18 Ų1860.9 Ų60.913%0.12634%0.337CS..Hα-helixtrans-66.9-38178.3-57.60000111.6Q194 F195 A196 A201 I202Q194-S198 PolarHBondContact O-N 3.3Å; Q194-S198 VanDerWaalsContact O-N 3.13Å; Q194-S198 PolarHBondContact O-OG 2.67Å; F195-S198 WeakPolarHBondContact O-CB 3.45Å; F195-S198 PolarHBondContact O-N 3.5Å; A196-S198 VanDerWaalsContact C-N 3.34Å; A196-S198 PolarHBondContact O-N 2.83Å; S198-A201 PolarHBondContact O-N 2.62Å; S198-I202 WeakPolarHBondContact O-CG1 3.28Å; S198-I202 PolarHBondContact O-N 2.91Å; S198-I202 VanDerWaalsContact O-N 3.12Å
199V64Low63.2Low54 Ų5466.5 Ų66.533%0.32736%0.362SS..Hα-helixtrans-65.4-47175.5173.20000110.9F195 A196 L197 A201 I202 L203F195-V199 HydrophobicContact CD1-CG2 4.23Å; F195-V199 HydrophobicContact CD2-CG2 4.47Å; F195-V199 HydrophobicContact CE1-CG2 3.74Å; F195-V199 HydrophobicContact CE2-CG2 3.99Å; F195-V199 HydrophobicContact CZ-CG2 3.61Å; F195-V199 WeakPolarHBondContact O-CG2 3.32Å; F195-V199 PolarHBondContact O-N 3.48Å; A196-V199 PolarHBondContact O-N 3.06Å; L197-V199 VanDerWaalsContact C-N 3.35Å; V199-A201 VanDerWaalsContact C-N 3.29Å; V199-A201 PolarHBondContact O-N 3.26Å; V199-I202 PolarHBondContact O-N 3.16Å; V199-I202 VanDerWaalsContact O-N 3.16Å; V199-L203 HydrophobicContact CG1-CD1 4.03Å; V199-L203 HydrophobicContact CG1-CG 4.41Å; V199-L203 WeakPolarHBondContact O-CG 3.27Å; V199-L203 PolarHBondContact O-N 3.27Å
200V66.5Low62.8Low73 Ų7368.4 Ų68.444%0.44237%0.374SS..Hα-helixtrans-59.1-42.4176.6171.40000110.8A196 L197 I202 L203 Y204A196-V200 WeakPolarHBondContact O-CG2 3.26Å; A196-V200 PolarHBondContact O-N 3.46Å; L197-V200 PolarHBondContact O-N 3.37Å; V200-I202 VanDerWaalsContact C-N 3.34Å; V200-I202 PolarHBondContact O-N 2.93Å; V200-L203 PolarHBondContact O-N 2.73Å; V200-Y204 WeakPolarHBondContact O-CB 3.27Å; V200-Y204 PolarHBondContact O-N 3.34Å
201A59.3Low62.1Low48 Ų4869 Ų6940%0.39738%0.381SS..Hα-helixtrans-61.9-3917700000113L197 S198 V199 S205L197-A201 WeakPolarHBondContact O-CB 3.46Å; L197-A201 PolarHBondContact O-N 3.3Å; S198-A201 PolarHBondContact O-N 2.62Å; V199-A201 VanDerWaalsContact C-N 3.29Å; V199-A201 PolarHBondContact O-N 3.26Å; A201-S205 PolarHBondContact O-N 2.83Å
202I63Low61.4Low74 Ų7471.7 Ų71.738%0.37940%0.404SS..Hα-helixtrans-68-51.9177-67.5164.5000110.5W3 S198 V199 V200 Y204 S205 S206W3-I202 HydrophobicContact CG-CD1 4.2Å; S198-I202 WeakPolarHBondContact O-CG1 3.28Å; S198-I202 PolarHBondContact O-N 2.91Å; S198-I202 VanDerWaalsContact O-N 3.12Å; V199-I202 PolarHBondContact O-N 3.16Å; V199-I202 VanDerWaalsContact O-N 3.16Å; V200-I202 VanDerWaalsContact C-N 3.34Å; V200-I202 PolarHBondContact O-N 2.93Å; I202-Y204 PolarHBondContact O-N 3.22Å; I202-S205 PolarHBondContact O-N 3.22Å; I202-S205 PolarHBondContact O-OG 2.76Å; I202-S206 PolarHBondContact O-N 3.5Å; I202-S206 PolarHBondContact O-OG 3.17Å
203L66.6Low60.8Low91 Ų9176.9 Ų76.948%0.47643%0.427SS..Hα-helixtrans-54.6-45.5178.3-71173.8000110.2V199 V200 S205 S206 Y207V199-L203 HydrophobicContact CG1-CD1 4.03Å; V199-L203 HydrophobicContact CG1-CG 4.41Å; V199-L203 WeakPolarHBondContact O-CG 3.27Å; V199-L203 PolarHBondContact O-N 3.27Å; V200-L203 PolarHBondContact O-N 2.73Å; L203-S205 PolarHBondContact O-N 2.9Å; L203-S206 WeakPolarHBondContact O-CB 3.43Å; L203-S206 PolarHBondContact O-N 2.83Å; L203-Y207 HydrophobicContact CB-CE2 4.38Å; L203-Y207 WeakPolarHBondContact O-CD2 2.82Å; L203-Y207 PolarHBondContact O-N 3.3Å
204Y60Low59.9Low54 Ų5476.6 Ų76.621%0.21244%0.444CS..Hα-helixtrans-57.5-48.9175.4-168.5-102.1000111.7I107 L110 V200 I202 S206 Y207 F208I107-Y204 WeakPolarHBondContact CG1-OH 2.85Å; L110-Y204 HydrophobicContact CD2-CE1 4.44Å; V200-Y204 WeakPolarHBondContact O-CB 3.27Å; V200-Y204 PolarHBondContact O-N 3.34Å; I202-Y204 PolarHBondContact O-N 3.22Å; Y204-S206 VanDerWaalsContact C-N 3.28Å; Y204-S206 PolarHBondContact O-N 2.74Å; Y204-Y207 PolarHBondContact O-N 3.04Å; Y204-Y207 VanDerWaalsContact O-N 3.16Å; Y204-F208 AromaticContact CD1-CD2 3.9Å; Y204-F208 HydrophobicContact CD1-CD2 3.9Å; Y204-F208 AromaticContact CD1-CE2 3.61Å; Y204-F208 HydrophobicContact CD1-CE2 3.61Å; Y204-F208 AromaticContact CD2-CE2 3.82Å; Y204-F208 HydrophobicContact CD2-CE2 3.82Å; Y204-F208 AromaticContact CE1-CD2 3.72Å; Y204-F208 HydrophobicContact CE1-CD2 3.72Å; Y204-F208 AromaticContact CE1-CE2 3.13Å; Y204-F208 HydrophobicContact CE1-CE2 3.13Å; Y204-F208 AromaticContact CE1-CZ 3.87Å; Y204-F208 HydrophobicContact CE1-CZ 3.87Å; Y204-F208 HydrophobicContact CE2-CD2 4.47Å; Y204-F208 AromaticContact CE2-CE2 3.36Å; Y204-F208 HydrophobicContact CE2-CE2 3.36Å; Y204-F208 AromaticContact CE2-CZ 3.87Å; Y204-F208 HydrophobicContact CE2-CZ 3.87Å; Y204-F208 HydrophobicContact CG-CD2 4.37Å; Y204-F208 AromaticContact CG-CE2 3.93Å; Y204-F208 HydrophobicContact CG-CE2 3.93Å; Y204-F208 AromaticContact CZ-CE2 2.99Å; Y204-F208 AromaticContact CZ-CZ 3.39Å; Y204-F208 WeakPolarHBondContact O-CD2 3.39Å; Y204-F208 PolarHBondContact O-N 3.41Å; Y204-F208 VanDerWaalsContact OH-CE2 3.26Å; Y204-F208 WeakPolarHBondContact OH-CE2 3.2Å; Y204-F208 WeakPolarHBondContact OH-CZ 3.44Å
205S60.9Low58.7Low53 Ų5381.1 Ų81.137%0.37148%0.483SS..Hα-helixtrans-59.3-36.4177.472.30000113.4A201 I202 L203 F208 Q209A201-S205 PolarHBondContact O-N 2.83Å; I202-S205 PolarHBondContact O-N 3.22Å; I202-S205 PolarHBondContact O-OG 2.76Å; L203-S205 PolarHBondContact O-N 2.9Å; S205-F208 PolarHBondContact O-N 2.85Å; S205-Q209 WeakPolarHBondContact O-CG 3.45Å; S205-Q209 PolarHBondContact O-N 2.99Å
206S65.3Low58.4Low52 Ų5282.1 Ų82.136%0.36449%0.493SS..Hα-helixtrans-67.1-41.4175.8-57.80000112I202 L203 Y204 F208 Q209 T210I202-S206 PolarHBondContact O-N 3.5Å; I202-S206 PolarHBondContact O-OG 3.17Å; L203-S206 WeakPolarHBondContact O-CB 3.43Å; L203-S206 PolarHBondContact O-N 2.83Å; Y204-S206 VanDerWaalsContact C-N 3.28Å; Y204-S206 PolarHBondContact O-N 2.74Å; S206-F208 VanDerWaalsContact C-N 3.27Å; S206-F208 PolarHBondContact O-N 2.92Å; S206-Q209 PolarHBondContact O-N 3.46Å; S206-T210 PolarHBondContact O-N 3.35Å; S206-T210 PolarHBondContact O-OG1 3.33Å; S206-T210 VanDerWaalsContact O-OG1 3.13Å
207Y60.6Low58.1Low165 Ų16583.8 Ų83.865%0.64750%0.498SS*.Hα-helixtrans-60-34.1176.2-77.4-70.1000113L203 Y204 S211L203-Y207 HydrophobicContact CB-CE2 4.38Å; L203-Y207 WeakPolarHBondContact O-CD2 2.82Å; L203-Y207 PolarHBondContact O-N 3.3Å; Y204-Y207 PolarHBondContact O-N 3.04Å; Y204-Y207 VanDerWaalsContact O-N 3.16Å; Y207-S211 PolarHBondContact O-N 3.03Å; Y207-S211 PolarHBondContact O-OG 3.32Å
208F56.3Low57.7Low91 Ų9186.3 Ų86.340%0.39951%0.514SS..Hα-helixtrans-76-34.5175.5-74.6-80.2000113.2Y204 S205 S206 S211 A212Y204-F208 AromaticContact CD1-CD2 3.9Å; Y204-F208 HydrophobicContact CD1-CD2 3.9Å; Y204-F208 AromaticContact CD1-CE2 3.61Å; Y204-F208 HydrophobicContact CD1-CE2 3.61Å; Y204-F208 AromaticContact CD2-CE2 3.82Å; Y204-F208 HydrophobicContact CD2-CE2 3.82Å; Y204-F208 AromaticContact CE1-CD2 3.72Å; Y204-F208 HydrophobicContact CE1-CD2 3.72Å; Y204-F208 AromaticContact CE1-CE2 3.13Å; Y204-F208 HydrophobicContact CE1-CE2 3.13Å; Y204-F208 AromaticContact CE1-CZ 3.87Å; Y204-F208 HydrophobicContact CE1-CZ 3.87Å; Y204-F208 HydrophobicContact CE2-CD2 4.47Å; Y204-F208 AromaticContact CE2-CE2 3.36Å; Y204-F208 HydrophobicContact CE2-CE2 3.36Å; Y204-F208 AromaticContact CE2-CZ 3.87Å; Y204-F208 HydrophobicContact CE2-CZ 3.87Å; Y204-F208 HydrophobicContact CG-CD2 4.37Å; Y204-F208 AromaticContact CG-CE2 3.93Å; Y204-F208 HydrophobicContact CG-CE2 3.93Å; Y204-F208 AromaticContact CZ-CE2 2.99Å; Y204-F208 AromaticContact CZ-CZ 3.39Å; Y204-F208 WeakPolarHBondContact O-CD2 3.39Å; Y204-F208 PolarHBondContact O-N 3.41Å; Y204-F208 VanDerWaalsContact OH-CE2 3.26Å; Y204-F208 WeakPolarHBondContact OH-CE2 3.2Å; Y204-F208 WeakPolarHBondContact OH-CZ 3.44Å; S205-F208 PolarHBondContact O-N 2.85Å; S206-F208 VanDerWaalsContact C-N 3.27Å; S206-F208 PolarHBondContact O-N 2.92Å; F208-S211 PolarHBondContact O-N 2.91Å; F208-A212 PolarHBondContact O-N 2.87Å
209Q54.4Low57.2Low132 Ų13290.3 Ų90.362%0.61754%0.537SS*.Hα-helixtrans-66.8-41.1177.4-73.6179.7-10.800111.3S205 S206 S211 A212S205-Q209 WeakPolarHBondContact O-CG 3.45Å; S205-Q209 PolarHBondContact O-N 2.99Å; S206-Q209 PolarHBondContact O-N 3.46Å; Q209-S211 VanDerWaalsContact C-N 3.33Å; Q209-S211 PolarHBondContact O-N 3.12Å; Q209-A212 PolarHBondContact O-N 3.01Å
210T54.8Low56.8Low107 Ų10792.6 Ų92.666%0.65655%0.55SS*.Hα-helixtrans-64.7-38.4176.3-50.90000111.9S206 A212 I213S206-T210 PolarHBondContact O-N 3.35Å; S206-T210 PolarHBondContact O-OG1 3.33Å; S206-T210 VanDerWaalsContact O-OG1 3.13Å; T210-A212 VanDerWaalsContact C-N 3.27Å; T210-A212 PolarHBondContact O-N 3.41Å; T210-I213 PolarHBondContact O-N 2.98Å
211S53Low56.2Low87 Ų8793.9 Ų93.961%0.60856%0.557SS**Hα-helixtrans-67.2-24.5177.8-52.90000113.7Y207 F208 Q209Y207-S211 PolarHBondContact O-N 3.03Å; Y207-S211 PolarHBondContact O-OG 3.32Å; F208-S211 PolarHBondContact O-N 2.91Å; Q209-S211 VanDerWaalsContact C-N 3.33Å; Q209-S211 PolarHBondContact O-N 3.12Å
212A48.9Very low55.9Low68 Ų6897.1 Ų97.156%0.56257%0.568SS**Hα-helixtrans-86.5-13.3-177.500000114.3F208 Q209 T210F208-A212 PolarHBondContact O-N 2.87Å; Q209-A212 PolarHBondContact O-N 3.01Å; T210-A212 VanDerWaalsContact C-N 3.27Å; T210-A212 PolarHBondContact O-N 3.41Å
213I52.5Low55.4Low150 Ų15098.9 Ų98.977%0.76958%0.583SS**SBendtrans-91.2-10.3178.8-62.7167.8000111T210T210-I213 PolarHBondContact O-N 2.98Å
214G47.4Very low54.5Low74 Ų7499.6 Ų99.676%0.76359%0.592SS**  trans-103.914.3-17600000116.5
215S39.5Very low54Low162 Ų162103.7 Ų103.7100%1.13363%0.626SS**  trans-125.50173.570.40000111

Retrieved 215 of 215 residues in 100 ms (Link to these results)