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Bcl-2-related ovarian killer protein

Apoptosis regulator that functions through different apoptotic signaling pathways1,2,3. Plays a roles as pro-apoptotic protein that positively regulates intrinsic apoptotic process in a BAX- and BAK1-dependent manner or in a BAX- and BAK1-independent manner4,5. In response to endoplasmic reticulum stress promotes mitochondrial apoptosis through downstream BAX/BAK1 activation and positive regulation of PERK-mediated unfolded protein response (By similarity). Activates apoptosis independently of heterodimerization with survival-promoting BCL2 and BCL2L1 through induction of mitochondrial outer membrane permeabilization, in a BAX- and BAK1-independent manner, in response to inhibition of ERAD-proteasome degradation system, resulting in cytochrome c release6. In response to DNA damage, mediates intrinsic apoptotic process in a TP53-dependent manner7. Plays a role in granulosa cell apoptosis by CASP3 activation8. Plays a roles as anti-apoptotic protein during neuronal apoptotic process, by negatively regulating poly ADP-ribose polymerase-dependent cell death through regulation of neuronal calcium homeostasis and mitochondrial bioenergetics in response to NMDA excitation (By similarity). In addition to its role in apoptosis, may regulate trophoblast cell proliferation during the early stages of placental development, by acting on G1/S transition through regulation of CCNE1 expression9. May also play a role as an inducer of autophagy by disrupting interaction between MCL1 and BECN110. Pro-apoptotic molecule exerting its function through the mitochondrial pathway.

AlphaFold DB , UniProt , Accession Q9UMX3, Species HUMAN (Homo sapiens, Human), Gene BOK, Length 212 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
1M63.2Low78.1Confident212 Ų212120.5 Ų120.5100%1.04461%0.608SS**  0-39.20-145.3-179-82.300112.2V3 L4 R5M1-V3 PolarHBondContact O-N 3.22Å; M1-L4 PolarHBondContact O-N 3.33Å; M1-R5 PolarHBondContact O-N 3.05Å
2E74.6Confident78.1Confident128 Ų128114.6 Ų114.660%0.59859%0.591SS**Hα-helixtrans-64-37.9-178.6-161178.1160.900114.7L4 R5 R6E2-L4 PolarHBondContact O-N 3.07Å; E2-R5 PolarHBondContact O-N 2.97Å; E2-R6 PolarHBondContact O-N 3.49Å; E2-R6 IonicContact OE1-CZ 3.61Å; E2-R6 IonicContact OE1-NE 3.62Å; E2-R6 IonicContact OE1-NH2 2.8Å; E2-R6 PolarHBondContact OE1-NH2 3.16Å
3V71.9Confident78.1Confident112 Ų112115.1 Ų115.168%0.67959%0.589SS**Hα-helixtrans-59.4-45.8177.5-179.90000111.7M1 R5 R6 S7M1-V3 PolarHBondContact O-N 3.22Å; V3-R5 VanDerWaalsContact C-N 3.33Å; V3-R5 PolarHBondContact O-N 3.09Å; V3-R6 PolarHBondContact O-N 3.28Å; V3-S7 PolarHBondContact O-N 2.77Å; V3-S7 PolarHBondContact O-OG 3.25Å
4L73Confident77.9Confident131 Ų131111.6 Ų111.669%0.68657%0.571SS**Hα-helixtrans-63.7-38178.2-67.3174.6000112M1 E2 S7 S8M1-L4 PolarHBondContact O-N 3.33Å; E2-L4 PolarHBondContact O-N 3.07Å; L4-S7 PolarHBondContact O-N 3.42Å; L4-S8 PolarHBondContact O-N 3Å; L4-S8 PolarHBondContact O-OG 3.16Å
5R81.2Confident77.4Confident190 Ų190111.9 Ų111.972%0.71757%0.572SS**Hα-helixtrans-65.8-40.7176-171.3177.91801600.6111.6M1 E2 V3 S8 V9M1-R5 PolarHBondContact O-N 3.05Å; E2-R5 PolarHBondContact O-N 2.97Å; V3-R5 VanDerWaalsContact C-N 3.33Å; V3-R5 PolarHBondContact O-N 3.09Å; R5-S8 PolarHBondContact O-N 3.06Å; R5-S8 PolarHBondContact O-OG 2.84Å; R5-V9 VanDerWaalsContact O-CG2 3.24Å; R5-V9 WeakPolarHBondContact O-CG2 2.94Å; R5-V9 PolarHBondContact O-N 3.35Å
6R79.2Confident76.9Confident172 Ų172109.5 Ų109.565%0.64956%0.56SS**Hα-helixtrans-63.4-42.3174-70.5-175.5-171.1-173.84111.2E2 V3 V9 F10E2-R6 PolarHBondContact O-N 3.49Å; E2-R6 IonicContact OE1-CZ 3.61Å; E2-R6 IonicContact OE1-NE 3.62Å; E2-R6 IonicContact OE1-NH2 2.8Å; E2-R6 PolarHBondContact OE1-NH2 3.16Å; V3-R6 PolarHBondContact O-N 3.28Å; R6-V9 PolarHBondContact O-N 3.22Å; R6-F10 VanDerWaalsContact O-CB 3.29Å; R6-F10 WeakPolarHBondContact O-CB 3.32Å; R6-F10 PolarHBondContact O-N 3.38Å
7S81.7Confident75.9Confident68 Ų68106.7 Ų106.748%0.47656%0.557SS.*Hα-helixtrans-63.1-40.4175.9-60.30000112.9V3 L4 A11V3-S7 PolarHBondContact O-N 2.77Å; V3-S7 PolarHBondContact O-OG 3.25Å; L4-S7 PolarHBondContact O-N 3.42Å; S7-A11 VanDerWaalsContact O-CB 3.31Å; S7-A11 WeakPolarHBondContact O-CB 3.27Å; S7-A11 PolarHBondContact O-N 3.39Å
8S81.8Confident74.9Confident70 Ų70108.8 Ų108.849%0.4956%0.562SS.*Hα-helixtrans-70.4-38.7178.3650000112.7L4 R5 A11 A12L4-S8 PolarHBondContact O-N 3Å; L4-S8 PolarHBondContact O-OG 3.16Å; R5-S8 PolarHBondContact O-N 3.06Å; R5-S8 PolarHBondContact O-OG 2.84Å; S8-A11 PolarHBondContact O-N 2.97Å; S8-A12 WeakPolarHBondContact O-CB 3.46Å; S8-A12 PolarHBondContact O-N 3.49Å
9V84.3Confident74.2Confident70 Ų70110.6 Ų110.642%0.42457%0.572SS.*Hα-helixtrans-64.9-46.5175172.60000110.1R5 R6 A11 A12 E13R5-V9 VanDerWaalsContact O-CG2 3.24Å; R5-V9 WeakPolarHBondContact O-CG2 2.94Å; R5-V9 PolarHBondContact O-N 3.35Å; R6-V9 PolarHBondContact O-N 3.22Å; V9-A11 VanDerWaalsContact C-N 3.34Å; V9-A11 PolarHBondContact O-N 3.32Å; V9-A12 PolarHBondContact O-N 3.05Å; V9-A12 VanDerWaalsContact O-N 3.15Å; V9-E13 HydrophobicContact CG1-CG 4.49Å; V9-E13 WeakPolarHBondContact O-CG 3.47Å; V9-E13 PolarHBondContact O-N 3.33Å
10F86.7Confident74.1Confident130 Ų130114.3 Ų114.357%0.5758%0.579SS**Hα-helixtrans-61.1-41.1176.1-176.8-112.3000112.4R6 E13 I14R6-F10 VanDerWaalsContact O-CB 3.29Å; R6-F10 WeakPolarHBondContact O-CB 3.32Å; R6-F10 PolarHBondContact O-N 3.38Å; F10-E13 PolarHBondContact O-N 3.2Å; F10-I14 HydrophobicContact CD1-CD1 3.61Å; F10-I14 HydrophobicContact CD2-CD1 4.43Å; F10-I14 HydrophobicContact CE1-CD1 3.23Å; F10-I14 HydrophobicContact CE1-CG1 4.36Å; F10-I14 HydrophobicContact CE2-CD1 4.11Å; F10-I14 HydrophobicContact CE2-CG1 4.47Å; F10-I14 HydrophobicContact CG-CD1 4.21Å; F10-I14 HydrophobicContact CZ-CD1 3.51Å; F10-I14 HydrophobicContact CZ-CG1 4.29Å; F10-I14 WeakPolarHBondContact O-CB 3.41Å; F10-I14 VanDerWaalsContact O-CG1 3.3Å; F10-I14 WeakPolarHBondContact O-CG1 3.31Å; F10-I14 PolarHBondContact O-N 3.19Å
11A81.5Confident74.1Confident43 Ų43111.1 Ų111.136%0.35557%0.567SS.*Hα-helixtrans-63.9-39.7174.400000112.2S7 S8 V9 I14 M15S7-A11 VanDerWaalsContact O-CB 3.31Å; S7-A11 WeakPolarHBondContact O-CB 3.27Å; S7-A11 PolarHBondContact O-N 3.39Å; S8-A11 PolarHBondContact O-N 2.97Å; V9-A11 VanDerWaalsContact C-N 3.34Å; V9-A11 PolarHBondContact O-N 3.32Å; A11-I14 PolarHBondContact O-N 3.1Å; A11-M15 WeakPolarHBondContact O-CB 3.01Å; A11-M15 WeakPolarHBondContact O-CG 3.37Å; A11-M15 PolarHBondContact O-N 3.12Å
12A77.5Confident75.1Confident49 Ų49102 Ų10241%0.40552%0.524SS..Hα-helixtrans-66.4-41.517600000112.2S8 V9 I14 M15 D16S8-A12 WeakPolarHBondContact O-CB 3.46Å; S8-A12 PolarHBondContact O-N 3.49Å; V9-A12 PolarHBondContact O-N 3.05Å; V9-A12 VanDerWaalsContact O-N 3.15Å; A12-I14 VanDerWaalsContact C-N 3.35Å; A12-M15 PolarHBondContact O-N 2.83Å; A12-D16 WeakPolarHBondContact O-CB 3.45Å; A12-D16 PolarHBondContact O-N 3.45Å
13E78.3Confident75.8Confident121 Ų12199.2 Ų99.257%0.56552%0.515SS*.Hα-helixtrans-63.4-40.4174.4-72.817417900111.9V9 F10 A17V9-E13 HydrophobicContact CG1-CG 4.49Å; V9-E13 WeakPolarHBondContact O-CG 3.47Å; V9-E13 PolarHBondContact O-N 3.33Å; F10-E13 PolarHBondContact O-N 3.2Å; E13-A17 VanDerWaalsContact O-CB 3.29Å; E13-A17 WeakPolarHBondContact O-CB 3.34Å; E13-A17 PolarHBondContact O-N 3.23Å
14I75.3Confident76.7Confident66 Ų6696.6 Ų96.634%0.33850%0.498SS..Hα-helixtrans-63.2-45.7173.3-73.2168.4000110.6F10 A11 A12 A17 F18F10-I14 HydrophobicContact CD1-CD1 3.61Å; F10-I14 HydrophobicContact CD2-CD1 4.43Å; F10-I14 HydrophobicContact CE1-CD1 3.23Å; F10-I14 HydrophobicContact CE1-CG1 4.36Å; F10-I14 HydrophobicContact CE2-CD1 4.11Å; F10-I14 HydrophobicContact CE2-CG1 4.47Å; F10-I14 HydrophobicContact CG-CD1 4.21Å; F10-I14 HydrophobicContact CZ-CD1 3.51Å; F10-I14 HydrophobicContact CZ-CG1 4.29Å; F10-I14 WeakPolarHBondContact O-CB 3.41Å; F10-I14 VanDerWaalsContact O-CG1 3.3Å; F10-I14 WeakPolarHBondContact O-CG1 3.31Å; F10-I14 PolarHBondContact O-N 3.19Å; A11-I14 PolarHBondContact O-N 3.1Å; A12-I14 VanDerWaalsContact C-N 3.35Å; I14-A17 WeakPolarHBondContact O-CB 3.16Å; I14-A17 PolarHBondContact O-N 3.16Å; I14-F18 HydrophobicContact CG2-CD2 3.59Å; I14-F18 HydrophobicContact CG2-CE2 3.47Å; I14-F18 VanDerWaalsContact CG2-CE2 3.47Å; I14-F18 WeakPolarHBondContact O-CD2 3.47Å; I14-F18 PolarHBondContact O-N 2.8Å
15M71.1Confident77.6Confident117 Ų11799 Ų9958%0.57650%0.503SS*.Hα-helixtrans-63.9-44.6178.5-75-171.1-62.600112.1A11 A12 A17 F18 D19A11-M15 WeakPolarHBondContact O-CB 3.01Å; A11-M15 WeakPolarHBondContact O-CG 3.37Å; A11-M15 PolarHBondContact O-N 3.12Å; A12-M15 PolarHBondContact O-N 2.83Å; M15-A17 VanDerWaalsContact C-N 3.29Å; M15-A17 PolarHBondContact O-N 2.69Å; M15-F18 CarbonylContact O-C 3.58Å; M15-F18 WeakPolarHBondContact O-CA 3.27Å; M15-F18 WeakPolarHBondContact O-CB 3.34Å; M15-F18 PolarHBondContact O-N 2.91Å; M15-D19 PolarHBondContact O-N 2.75Å
16D68.8Low78.1Confident73 Ų7394.6 Ų94.639%0.3949%0.49SS..Hα-helixtrans-63.1-36.3175-173.928.2000111.2A12 F18 D19 R20A12-D16 WeakPolarHBondContact O-CB 3.45Å; A12-D16 PolarHBondContact O-N 3.45Å; D16-F18 PolarHBondContact O-N 2.96Å; D16-D19 PolarHBondContact O-N 2.95Å; D16-R20 WeakPolarHBondContact O-CB 3.34Å; D16-R20 WeakPolarHBondContact O-CG 3.42Å; D16-R20 PolarHBondContact O-N 3.45Å; D16-R20 IonicContact OD1-CZ 3.43Å; D16-R20 IonicContact OD1-NE 3.4Å; D16-R20 PolarHBondContact OD1-NE 3Å; D16-R20 IonicContact OD1-NH2 3.62Å; D16-R20 IonicContact OD2-CZ 2.65Å; D16-R20 VanDerWaalsContact OD2-CZ 3.3Å; D16-R20 IonicContact OD2-NE 2.74Å; D16-R20 PolarHBondContact OD2-NE 3.26Å; D16-R20 IonicContact OD2-NH2 3.59Å; D16-R20 PolarHBondContact OD2-NH2 3.02Å
17A60.2Low78.9Confident62 Ų6286.4 Ų86.451%0.51246%0.459SS..Hα-helixtrans-65.5-36.117200000112.8E13 I14 M15 R20 S21E13-A17 VanDerWaalsContact O-CB 3.29Å; E13-A17 WeakPolarHBondContact O-CB 3.34Å; E13-A17 PolarHBondContact O-N 3.23Å; I14-A17 WeakPolarHBondContact O-CB 3.16Å; I14-A17 PolarHBondContact O-N 3.16Å; M15-A17 VanDerWaalsContact C-N 3.29Å; M15-A17 PolarHBondContact O-N 2.69Å; A17-R20 PolarHBondContact O-N 3.12Å; A17-S21 PolarHBondContact O-N 3.4Å
18F57.7Low79.5Confident144 Ų14484 Ų8463%0.63244%0.442SS*.Hα-helixtrans-69.1-41.3173-86.1-70.4000112.2I14 M15 D16 R20 S21I14-F18 HydrophobicContact CG2-CD2 3.59Å; I14-F18 HydrophobicContact CG2-CE2 3.47Å; I14-F18 VanDerWaalsContact CG2-CE2 3.47Å; I14-F18 WeakPolarHBondContact O-CD2 3.47Å; I14-F18 PolarHBondContact O-N 2.8Å; M15-F18 CarbonylContact O-C 3.58Å; M15-F18 WeakPolarHBondContact O-CA 3.27Å; M15-F18 WeakPolarHBondContact O-CB 3.34Å; M15-F18 PolarHBondContact O-N 2.91Å; D16-F18 PolarHBondContact O-N 2.96Å; F18-R20 PolarHBondContact O-N 3.4Å; F18-S21 VanDerWaalsContact O-CB 3.26Å; F18-S21 WeakPolarHBondContact O-CB 3.14Å; F18-S21 PolarHBondContact O-N 3.46Å; F18-S21 PolarHBondContact O-OG 2.79Å
19D61.7Low80.1Confident143 Ų14383.5 Ų83.577%0.76544%0.442SS*.Hα-helixtrans-63.8-27.9175.7-81.6-18.1000112M15 D16 S21M15-D19 PolarHBondContact O-N 2.75Å; D16-D19 PolarHBondContact O-N 2.95Å; D19-S21 VanDerWaalsContact C-N 3.31Å
20R71.5Confident80.6Confident185 Ų18582.6 Ų82.670%0.69843%0.433SS*.THydrogen-bonded Turntrans-82-3.6173.2-68.9174-165.5-165.24.4114.4D16 A17 F18D16-R20 WeakPolarHBondContact O-CB 3.34Å; D16-R20 WeakPolarHBondContact O-CG 3.42Å; D16-R20 PolarHBondContact O-N 3.45Å; D16-R20 IonicContact OD1-CZ 3.43Å; D16-R20 IonicContact OD1-NE 3.4Å; D16-R20 PolarHBondContact OD1-NE 3Å; D16-R20 IonicContact OD1-NH2 3.62Å; D16-R20 IonicContact OD2-CZ 2.65Å; D16-R20 VanDerWaalsContact OD2-CZ 3.3Å; D16-R20 IonicContact OD2-NE 2.74Å; D16-R20 PolarHBondContact OD2-NE 3.26Å; D16-R20 IonicContact OD2-NH2 3.59Å; D16-R20 PolarHBondContact OD2-NH2 3.02Å; A17-R20 PolarHBondContact O-N 3.12Å; F18-R20 PolarHBondContact O-N 3.4Å
21S75.6Confident81Confident47 Ų4776.4 Ų76.433%0.32941%0.406SS..SBendtrans-68.4135.4176.970.60000110.1A17 F18 D19 T23A17-S21 PolarHBondContact O-N 3.4Å; F18-S21 VanDerWaalsContact O-CB 3.26Å; F18-S21 WeakPolarHBondContact O-CB 3.14Å; F18-S21 PolarHBondContact O-N 3.46Å; F18-S21 PolarHBondContact O-OG 2.79Å; D19-S21 VanDerWaalsContact C-N 3.31Å; S21-T23 PolarHBondContact O-N 2.79Å
22P83.2Confident81.7Confident22 Ų2277 Ų7714%0.14340%0.4CS..PPolyproline II helixtrans-62.8130.5-175.625.6-34.2000110.1E26 L27P22-E26 WeakPolarHBondContact CA-OE2 3.44Å; P22-L27 HydrophobicContact CB-CD2 3.81Å; P22-L27 HydrophobicContact CB-CG 4.01Å; P22-L27 HydrophobicContact CG-CD1 4.48Å; P22-L27 HydrophobicContact CG-CD2 3.73Å; P22-L27 HydrophobicContact CG-CG 4.18Å
23T89.3Confident82.5Confident68 Ų6875.6 Ų75.642%0.41739%0.388SS..PPolyproline II helixtrans-68157.3-179.667.80000110.8S21 K25 E26 L27S21-T23 PolarHBondContact O-N 2.79Å; T23-K25 PolarHBondContact O-N 2.87Å; T23-E26 PolarHBondContact N-OE2 2.95Å; T23-E26 WeakPolarHBondContact O-CB 3.38Å; T23-E26 PolarHBondContact O-N 2.83Å; T23-E26 VanDerWaalsContact OG1-CG 3.27Å; T23-E26 WeakPolarHBondContact OG1-CG 3.25Å; T23-E26 PolarHBondContact OG1-N 3.43Å; T23-E26 PolarHBondContact OG1-OE2 3.29Å; T23-L27 WeakPolarHBondContact O-CG 3.41Å; T23-L27 PolarHBondContact O-N 2.99Å
24D91Very high83.3Confident58 Ų5869.9 Ų69.931%0.3136%0.362SS..Hα-helixtrans-57.3-34.5176-74.2-16.9000111.6V28 A162 R166D24-V28 WeakPolarHBondContact O-CB 3.16Å; D24-V28 WeakPolarHBondContact O-CG2 3.41Å; D24-V28 PolarHBondContact O-N 3.09Å; D24-A162 HydrophobicContact CB-CB 4.46Å; D24-R166 WeakPolarHBondContact OD1-CD 3.38Å; D24-R166 IonicContact OD1-CZ 3.42Å; D24-R166 VanDerWaalsContact OD1-CZ 3.28Å; D24-R166 IonicContact OD1-NE 3.65Å; D24-R166 PolarHBondContact OD1-NE 3.26Å; D24-R166 IonicContact OD1-NH2 2.7Å; D24-R166 PolarHBondContact OD1-NH2 3.34Å; D24-R166 IonicContact OD2-CZ 3.86Å; D24-R166 IonicContact OD2-NE 3.3Å; D24-R166 IonicContact OD2-NH2 3.22Å; D24-R166 PolarHBondContact OD2-NH2 3.28Å
25K92.1Very high84.2Confident182 Ų18266.8 Ų66.879%0.79135%0.346SS*.Hα-helixtrans-64.7-44.9175.4-68.3-175.3-175.31800111.8T23 V28 A29T23-K25 PolarHBondContact O-N 2.87Å; K25-V28 PolarHBondContact O-N 3.23Å; K25-A29 WeakPolarHBondContact O-CB 3.28Å; K25-A29 PolarHBondContact O-N 3.07Å
26E92.2Very high85.3Confident96 Ų9664 Ų6445%0.44933%0.329SS..Hα-helixtrans-64.5-45.9176.3-73.6164.517400111.3P22 T23 V28 A29 Q30P22-E26 WeakPolarHBondContact CA-OE2 3.44Å; T23-E26 PolarHBondContact N-OE2 2.95Å; T23-E26 WeakPolarHBondContact O-CB 3.38Å; T23-E26 PolarHBondContact O-N 2.83Å; T23-E26 VanDerWaalsContact OG1-CG 3.27Å; T23-E26 WeakPolarHBondContact OG1-CG 3.25Å; T23-E26 PolarHBondContact OG1-N 3.43Å; T23-E26 PolarHBondContact OG1-OE2 3.29Å; E26-V28 VanDerWaalsContact C-N 3.28Å; E26-V28 PolarHBondContact O-N 3.22Å; E26-A29 PolarHBondContact O-N 2.85Å; E26-Q30 WeakPolarHBondContact O-CB 3.43Å; E26-Q30 WeakPolarHBondContact O-CG 3.27Å; E26-Q30 PolarHBondContact O-N 3.07Å
27L94.6Very high86.4Confident0 Ų064.3 Ų64.30%033%0.329CS..Hα-helixtrans-59.9-39.2178.6-70.7177000112.3P22 T23 A31 L165 R166 W171P22-L27 HydrophobicContact CB-CD2 3.81Å; P22-L27 HydrophobicContact CB-CG 4.01Å; P22-L27 HydrophobicContact CG-CD1 4.48Å; P22-L27 HydrophobicContact CG-CD2 3.73Å; P22-L27 HydrophobicContact CG-CG 4.18Å; T23-L27 WeakPolarHBondContact O-CG 3.41Å; T23-L27 PolarHBondContact O-N 2.99Å; L27-A31 VanDerWaalsContact O-CB 3.29Å; L27-A31 WeakPolarHBondContact O-CB 3.39Å; L27-A31 PolarHBondContact O-N 3.39Å; L27-L165 HydrophobicContact CD1-CB 3.87Å; L27-L165 HydrophobicContact CD2-CB 4.34Å; L27-R166 HydrophobicContact CD1-CB 4.4Å; L27-R166 HydrophobicContact CD1-CG 3.42Å; L27-R166 VanDerWaalsContact CD1-CG 3.42Å; L27-W171 PolarHBondContact O-NE1 3.39Å
28V96Very high88Confident19 Ų1961.5 Ų61.512%0.11531%0.305CS..Hα-helixtrans-71.1-41.2176.2172.40000111.3D24 K25 E26 Q30 A31 K32 V157 R158D24-V28 WeakPolarHBondContact O-CB 3.16Å; D24-V28 WeakPolarHBondContact O-CG2 3.41Å; D24-V28 PolarHBondContact O-N 3.09Å; K25-V28 PolarHBondContact O-N 3.23Å; E26-V28 VanDerWaalsContact C-N 3.28Å; E26-V28 PolarHBondContact O-N 3.22Å; V28-Q30 VanDerWaalsContact C-N 3.34Å; V28-Q30 PolarHBondContact O-N 3.35Å; V28-A31 WeakPolarHBondContact O-CB 3.31Å; V28-A31 PolarHBondContact O-N 3.31Å; V28-K32 WeakPolarHBondContact O-CG 3.18Å; V28-K32 PolarHBondContact O-N 3.11Å; V28-V157 HydrophobicContact CG2-CG1 4.39Å; V28-R158 HydrophobicContact CG2-CB 3.53Å; V28-R158 HydrophobicContact CG2-CG 3.9Å
29A93.3Very high89.8Confident59 Ų5954.9 Ų54.949%0.48828%0.276SS..Hα-helixtrans-60.9-44.8174.600000111.5K25 E26 A31 K32 A33K25-A29 WeakPolarHBondContact O-CB 3.28Å; K25-A29 PolarHBondContact O-N 3.07Å; E26-A29 PolarHBondContact O-N 2.85Å; A29-A31 VanDerWaalsContact C-N 3.35Å; A29-K32 PolarHBondContact O-N 3.2Å; A29-A33 WeakPolarHBondContact O-CB 3.15Å; A29-A33 PolarHBondContact O-N 3.06Å
30Q94.5Very high91.3Very high51 Ų5150.5 Ų50.524%0.23825%0.251CS..Hα-helixtrans-61.4-43173.9-68.7176.9-1.700111.2E26 V28 K32 A33 L34 L63 W171E26-Q30 WeakPolarHBondContact O-CB 3.43Å; E26-Q30 WeakPolarHBondContact O-CG 3.27Å; E26-Q30 PolarHBondContact O-N 3.07Å; V28-Q30 VanDerWaalsContact C-N 3.34Å; V28-Q30 PolarHBondContact O-N 3.35Å; Q30-K32 PolarHBondContact O-N 3.43Å; Q30-A33 PolarHBondContact O-N 3.44Å; Q30-L34 WeakPolarHBondContact O-CB 3.43Å; Q30-L34 VanDerWaalsContact O-CG 3.26Å; Q30-L34 WeakPolarHBondContact O-CG 3.42Å; Q30-L34 PolarHBondContact O-N 2.96Å; Q30-L63 HydrophobicContact CB-CD1 4.32Å; Q30-L63 HydrophobicContact CB-CD2 4.19Å; Q30-L63 HydrophobicContact CG-CD1 3.69Å; Q30-L63 HydrophobicContact CG-CD2 4.17Å; Q30-W171 HydrophobicContact CB-CG 4.48Å
31A96.3Very high92.3Very high0 Ų042.9 Ų42.90%023%0.227CC..Hα-helixtrans-59.5-45.8178.100000112.5L27 V28 A29 G35 Y127 V157 W171L27-A31 VanDerWaalsContact O-CB 3.29Å; L27-A31 WeakPolarHBondContact O-CB 3.39Å; L27-A31 PolarHBondContact O-N 3.39Å; V28-A31 WeakPolarHBondContact O-CB 3.31Å; V28-A31 PolarHBondContact O-N 3.31Å; A29-A31 VanDerWaalsContact C-N 3.35Å; A31-G35 PolarHBondContact O-N 2.86Å; A31-Y127 WeakPolarHBondContact CA-OH 3.39Å; A31-Y127 PolarHBondContact O-OH 3.35Å; A31-Y127 VanDerWaalsContact O-OH 3.06Å; A31-V157 HydrophobicContact CB-CB 4.07Å; A31-V157 HydrophobicContact CB-CG1 3.84Å; A31-V157 HydrophobicContact CB-CG2 3.9Å; A31-W171 HydrophobicContact CB-CH2 4.35Å; A31-W171 HydrophobicContact CB-CZ2 3.49Å; A31-W171 VanDerWaalsContact CB-CZ2 3.49Å
32K95.7Very high93.1Very high54 Ų5442 Ų4224%0.23522%0.217CC..Hα-helixtrans-64.7-42.6176.4-69-172.6178.8-160.30111.4V28 A29 Q30 G35 R36 V150 D151V28-K32 WeakPolarHBondContact O-CG 3.18Å; V28-K32 PolarHBondContact O-N 3.11Å; A29-K32 PolarHBondContact O-N 3.2Å; Q30-K32 PolarHBondContact O-N 3.43Å; K32-G35 PolarHBondContact O-N 3.49Å; K32-R36 WeakPolarHBondContact O-CG 3.39Å; K32-R36 PolarHBondContact O-N 3.45Å; K32-V150 HydrophobicContact CB-CG1 4.18Å; K32-V150 HydrophobicContact CG-CG1 4.45Å; K32-D151 WeakPolarHBondContact CE-OD1 3.41Å; K32-D151 IonicContact NZ-OD1 3.28Å; K32-D151 PolarHBondContact NZ-OD1 3.35Å
33A93.6Very high93.6Very high20 Ų2041 Ų4117%0.16521%0.21CC..Hα-helixtrans-61.1-50.4176.500000111.7A29 Q30 G35 R36 E37 V59A29-A33 WeakPolarHBondContact O-CB 3.15Å; A29-A33 PolarHBondContact O-N 3.06Å; Q30-A33 PolarHBondContact O-N 3.44Å; A33-G35 PolarHBondContact O-N 3.39Å; A33-R36 PolarHBondContact O-N 2.84Å; A33-E37 PolarHBondContact O-N 3.25Å; A33-E37 VanDerWaalsContact O-N 3.1Å; A33-V59 HydrophobicContact CB-CG2 4.33Å
34L95Very high93.7Very high1 Ų142.4 Ų42.41%0.00522%0.215CC..Hα-helixtrans-57.8-39.3173.8-69.2171.2000111.5Q30 E37 Y38 L63 V66 C67 L70 Y127 W171Q30-L34 WeakPolarHBondContact O-CB 3.43Å; Q30-L34 VanDerWaalsContact O-CG 3.26Å; Q30-L34 WeakPolarHBondContact O-CG 3.42Å; Q30-L34 PolarHBondContact O-N 2.96Å; L34-E37 PolarHBondContact O-N 3.34Å; L34-Y38 WeakPolarHBondContact O-CB 3.34Å; L34-Y38 PolarHBondContact O-N 3.07Å; L34-L63 HydrophobicContact CD1-CD2 4.26Å; L34-L63 HydrophobicContact CD2-CD2 4.47Å; L34-L63 WeakPolarHBondContact CD2-O 3.29Å; L34-L63 HydrophobicContact CG-CD2 4.49Å; L34-V66 HydrophobicContact CD1-CG1 3.69Å; L34-V66 HydrophobicContact CD2-CB 4.19Å; L34-V66 HydrophobicContact CD2-CG1 3.76Å; L34-V66 HydrophobicContact CG-CG1 4.4Å; L34-C67 HydrophobicContact CD2-CB 3.86Å; L34-L70 HydrophobicContact CB-CD1 4.4Å; L34-L70 HydrophobicContact CD1-CD1 4.21Å; L34-L70 HydrophobicContact CD2-CD1 4.44Å; L34-Y127 HydrophobicContact CB-CE1 3.87Å; L34-W171 HydrophobicContact CD1-CB 4.27Å; L34-W171 HydrophobicContact CD1-CD2 3.6Å; L34-W171 HydrophobicContact CD1-CE3 3.59Å; L34-W171 HydrophobicContact CD1-CG 3.92Å; L34-W171 HydrophobicContact CD1-CZ3 4.19Å
35G95.3Very high93.8Very high1 Ų146.2 Ų46.21%0.0123%0.225CC..Hα-helixtrans-61.9-47.2178.100000112A31 K32 A33 Y38 V39A31-G35 PolarHBondContact O-N 2.86Å; K32-G35 PolarHBondContact O-N 3.49Å; A33-G35 PolarHBondContact O-N 3.39Å; G35-Y38 PolarHBondContact O-N 3.18Å; G35-V39 WeakPolarHBondContact O-CB 3.4Å; G35-V39 WeakPolarHBondContact O-CG2 3.46Å; G35-V39 PolarHBondContact O-N 3.43Å
36R94.1Very high93.7Very high58 Ų5839.2 Ų39.222%0.21920%0.201CC..Hα-helixtrans-60-48.6177.1-67.7179.5-174.6108.9-0111.7K32 A33 V39 H40 W50 V150K32-R36 WeakPolarHBondContact O-CG 3.39Å; K32-R36 PolarHBondContact O-N 3.45Å; A33-R36 PolarHBondContact O-N 2.84Å; R36-V39 PolarHBondContact O-N 3.48Å; R36-H40 VanDerWaalsContact O-CB 3.22Å; R36-H40 WeakPolarHBondContact O-CB 3.42Å; R36-H40 PolarHBondContact O-N 3.35Å; R36-W50 HydrophobicContact CG-CH2 4.32Å; R36-V150 HydrophobicContact CG-CG1 3.76Å; R36-V150 HydrophobicContact CG-CG2 4.18Å
37E92.4Very high93.7Very high81 Ų8138 Ų3838%0.37921%0.214SC..Hα-helixtrans-63.6-44.9-180-69-57.9147.900111.9A33 L34 V39 H40 A41 V59 C67A33-E37 PolarHBondContact O-N 3.25Å; A33-E37 VanDerWaalsContact O-N 3.1Å; L34-E37 PolarHBondContact O-N 3.34Å; E37-V39 PolarHBondContact O-N 2.95Å; E37-H40 PolarHBondContact O-N 3.48Å; E37-A41 WeakPolarHBondContact O-CB 3.48Å; E37-A41 PolarHBondContact O-N 2.89Å; E37-V59 HydrophobicContact CG-CG2 4.1Å; E37-C67 VanDerWaalsContact CB-SG 3.52Å
38Y94.1Very high93.6Very high2 Ų239.8 Ų39.81%0.00822%0.224CC..Hα-helixtrans-61.5-47.4178.7-168.8-73.3000111.3L34 G35 A41 R42 L70 L71 G74 Y127 A131L34-Y38 WeakPolarHBondContact O-CB 3.34Å; L34-Y38 PolarHBondContact O-N 3.07Å; G35-Y38 PolarHBondContact O-N 3.18Å; Y38-A41 PolarHBondContact O-N 3.05Å; Y38-R42 HydrophobicContact CD1-CG 3.98Å; Y38-R42 HydrophobicContact CE1-CG 3.73Å; Y38-R42 VanDerWaalsContact O-CG 3.31Å; Y38-R42 WeakPolarHBondContact O-CG 3.11Å; Y38-R42 PolarHBondContact O-N 3.43Å; Y38-L70 HydrophobicContact CD2-CB 3.95Å; Y38-L70 HydrophobicContact CE2-CB 4.03Å; Y38-L70 WeakPolarHBondContact CE2-O 3.21Å; Y38-L71 HydrophobicContact CD1-CD2 4.28Å; Y38-L71 HydrophobicContact CD2-CD2 3.72Å; Y38-L71 HydrophobicContact CD2-CG 3.89Å; Y38-L71 HydrophobicContact CE1-CD2 4.36Å; Y38-L71 HydrophobicContact CE2-CD2 3.83Å; Y38-L71 HydrophobicContact CE2-CG 4.12Å; Y38-L71 HydrophobicContact CG-CD2 3.96Å; Y38-L71 HydrophobicContact CG-CG 4.49Å; Y38-G74 WeakPolarHBondContact OH-CA 3.25Å; Y38-Y127 HydrophobicContact CD2-CD1 4.4Å; Y38-Y127 HydrophobicContact CG-CD1 4.26Å; Y38-A131 HydrophobicContact CD1-CB 3.69Å; Y38-A131 HydrophobicContact CE1-CB 3.72Å
39V94.5Very high93.2Very high5 Ų544 Ų443%0.0325%0.254CS..Hα-helixtrans-63.1-45.5177.5172.70000110.8G35 R36 E37 A41 R42 L43 A131 A134 V146G35-V39 WeakPolarHBondContact O-CB 3.4Å; G35-V39 WeakPolarHBondContact O-CG2 3.46Å; G35-V39 PolarHBondContact O-N 3.43Å; R36-V39 PolarHBondContact O-N 3.48Å; E37-V39 PolarHBondContact O-N 2.95Å; V39-A41 PolarHBondContact O-N 3.38Å; V39-R42 PolarHBondContact O-N 3.31Å; V39-L43 HydrophobicContact CG1-CD1 3.71Å; V39-L43 HydrophobicContact CG1-CG 4.23Å; V39-L43 WeakPolarHBondContact O-CG 3.4Å; V39-L43 PolarHBondContact O-N 3.49Å; V39-A131 HydrophobicContact CG2-CB 4.07Å; V39-A134 HydrophobicContact CG1-CB 3.49Å; V39-A134 VanDerWaalsContact CG1-CB 3.49Å; V39-A134 HydrophobicContact CG2-CB 4.33Å; V39-V146 HydrophobicContact CG1-CG1 3.66Å
40H92.9Very high92.6Very high51 Ų5141.8 Ų41.824%0.23623%0.233CC..Hα-helixtrans-58.7-47.8178.3-17568.5000111.6R36 E37 R42 L43 L44 W50R36-H40 VanDerWaalsContact O-CB 3.22Å; R36-H40 WeakPolarHBondContact O-CB 3.42Å; R36-H40 PolarHBondContact O-N 3.35Å; E37-H40 PolarHBondContact O-N 3.48Å; H40-R42 VanDerWaalsContact C-N 3.3Å; H40-R42 PolarHBondContact O-N 3.24Å; H40-L43 PolarHBondContact O-N 3.23Å; H40-L44 WeakPolarHBondContact O-CG 3.45Å; H40-L44 PolarHBondContact O-N 3.06Å; H40-W50 HydrophobicContact CB-CE3 4.41Å; H40-W50 PolarHBondContact ND1-O 3.38Å
41A92.7Very high91.6Very high25 Ų2544.4 Ų44.421%0.20726%0.256CS..Hα-helixtrans-59.9-39.1176.200000112.4E37 Y38 V39 R45 L71E37-A41 WeakPolarHBondContact O-CB 3.48Å; E37-A41 PolarHBondContact O-N 2.89Å; Y38-A41 PolarHBondContact O-N 3.05Å; V39-A41 PolarHBondContact O-N 3.38Å; A41-R45 VanDerWaalsContact O-CG 3.29Å; A41-R45 WeakPolarHBondContact O-CG 3.44Å; A41-R45 PolarHBondContact O-N 2.97Å; A41-R45 VanDerWaalsContact O-N 3.1Å; A41-L71 HydrophobicContact CB-CD1 3.75Å; A41-L71 HydrophobicContact CB-CD2 3.85Å; A41-L71 HydrophobicContact CB-CG 4.47Å
42R92.6Very high89.8Confident29 Ų2945.9 Ų45.911%0.10927%0.269CS..Hα-helixtrans-70.2-36177.2-69.1-71.1-74.1110.2-11.3112.6Y38 V39 H40 A46 L71 E78 A131 V135Y38-R42 HydrophobicContact CD1-CG 3.98Å; Y38-R42 HydrophobicContact CE1-CG 3.73Å; Y38-R42 VanDerWaalsContact O-CG 3.31Å; Y38-R42 WeakPolarHBondContact O-CG 3.11Å; Y38-R42 PolarHBondContact O-N 3.43Å; V39-R42 PolarHBondContact O-N 3.31Å; H40-R42 VanDerWaalsContact C-N 3.3Å; H40-R42 PolarHBondContact O-N 3.24Å; R42-A46 PolarHBondContact O-N 3.04Å; R42-A46 VanDerWaalsContact O-N 3.13Å; R42-L71 HydrophobicContact CG-CD2 4.4Å; R42-E78 IonicContact CZ-OE2 3.81Å; R42-E78 IonicContact NE-OE2 3.62Å; R42-E78 IonicContact NH2-OE1 2.8Å; R42-E78 IonicContact NH2-OE2 2.73Å; R42-E78 PolarHBondContact NH2-OE2 3.17Å; R42-A131 HydrophobicContact CB-CB 4.03Å; R42-A131 HydrophobicContact CG-CB 3.84Å; R42-V135 HydrophobicContact CB-CG2 4.45Å
43L93.2Very high87.8Confident0 Ų047.8 Ų47.80%029%0.287CS..Hα-helixtrans-65.5-47.7173.9-72.9167.4000111.4V39 H40 R45 A46 G47 L48 W50 V135 V138V39-L43 HydrophobicContact CG1-CD1 3.71Å; V39-L43 HydrophobicContact CG1-CG 4.23Å; V39-L43 WeakPolarHBondContact O-CG 3.4Å; V39-L43 PolarHBondContact O-N 3.49Å; H40-L43 PolarHBondContact O-N 3.23Å; L43-R45 VanDerWaalsContact C-N 3.29Å; L43-R45 PolarHBondContact O-N 3.17Å; L43-A46 CarbonylContact O-C 3.48Å; L43-A46 WeakPolarHBondContact O-CA 3.34Å; L43-A46 WeakPolarHBondContact O-CB 3.37Å; L43-A46 PolarHBondContact O-N 2.91Å; L43-G47 PolarHBondContact O-N 3.46Å; L43-L48 CarbonylContact C-O 3.47Å; L43-L48 HydrophobicContact CB-CB 4.28Å; L43-L48 HydrophobicContact CD2-CB 4Å; L43-L48 HydrophobicContact CD2-CD1 3.86Å; L43-L48 PolarHBondContact O-N 3.17Å; L43-L48 VanDerWaalsContact O-O 3.13Å; L43-W50 HydrophobicContact CD1-CB 3.46Å; L43-W50 VanDerWaalsContact CD1-CB 3.46Å; L43-W50 HydrophobicContact CD1-CD2 4.28Å; L43-W50 HydrophobicContact CD1-CE3 4.2Å; L43-W50 HydrophobicContact CD1-CG 4.03Å; L43-V135 HydrophobicContact CD2-CB 4.35Å; L43-V135 HydrophobicContact CD2-CG2 3.82Å; L43-V135 HydrophobicContact CG-CG2 4.29Å; L43-V138 HydrophobicContact CD1-CG2 4.27Å; L43-V138 HydrophobicContact CD2-CB 3.87Å; L43-V138 HydrophobicContact CD2-CG1 4.21Å; L43-V138 HydrophobicContact CD2-CG2 3.75Å
44L92.7Very high85.8Confident99 Ų9953.5 Ų53.552%0.51831%0.31SS..Hα-helixtrans-57.1-43.5176-70.4178.4000111.7H40 A46 G47 L48H40-L44 WeakPolarHBondContact O-CG 3.45Å; H40-L44 PolarHBondContact O-N 3.06Å; L44-A46 PolarHBondContact O-N 3.41Å; L44-G47 PolarHBondContact O-N 2.86Å; L44-L48 PolarHBondContact N-O 2.75Å
45R91.3Very high83.7Confident138 Ų13864 Ų6452%0.52135%0.35SS..Hα-helixtrans-64.3-25175.2-74.5172.961.2-1770.6113.9A41 L43 G47 D75A41-R45 VanDerWaalsContact O-CG 3.29Å; A41-R45 WeakPolarHBondContact O-CG 3.44Å; A41-R45 PolarHBondContact O-N 2.97Å; A41-R45 VanDerWaalsContact O-N 3.1Å; L43-R45 VanDerWaalsContact C-N 3.29Å; L43-R45 PolarHBondContact O-N 3.17Å; R45-G47 VanDerWaalsContact C-N 3.28Å; R45-D75 IonicContact CZ-OD1 3.95Å; R45-D75 IonicContact CZ-OD2 2.65Å; R45-D75 IonicContact NH1-OD1 3.14Å; R45-D75 PolarHBondContact NH1-OD1 3.42Å; R45-D75 IonicContact NH1-OD2 3.55Å; R45-D75 PolarHBondContact NH1-OD2 2.95Å; R45-D75 IonicContact NH2-OD1 3.57Å; R45-D75 PolarHBondContact NH2-OD1 3.36Å; R45-D75 IonicContact NH2-OD2 3.5Å; R45-D75 PolarHBondContact NH2-OD2 3.21Å
46A90.7Very high81.7Confident34 Ų3466.1 Ų66.128%0.28137%0.367SS..THydrogen-bonded Turntrans-86.32.5174.200000113R42 L43 L44 L48 V135R42-A46 PolarHBondContact O-N 3.04Å; R42-A46 VanDerWaalsContact O-N 3.13Å; L43-A46 CarbonylContact O-C 3.48Å; L43-A46 WeakPolarHBondContact O-CA 3.34Å; L43-A46 WeakPolarHBondContact O-CB 3.37Å; L43-A46 PolarHBondContact O-N 2.91Å; L44-A46 PolarHBondContact O-N 3.41Å; A46-L48 VanDerWaalsContact C-N 3.26Å; A46-L48 HydrophobicContact CB-CD1 3.98Å; A46-L48 HydrophobicContact CB-CG 4.12Å; A46-V135 HydrophobicContact CB-CG1 4.2Å
47G92.9Very high79.9Confident71 Ų7167.2 Ų67.273%0.73239%0.388SS*.THydrogen-bonded Turntrans72.918.9-174.800000113.5L43 L44 R45L43-G47 PolarHBondContact O-N 3.46Å; L44-G47 PolarHBondContact O-N 2.86Å; R45-G47 VanDerWaalsContact C-N 3.28Å
48L92.2Very high78.2Confident38 Ų3869.4 Ų69.420%0.19941%0.41CS..  trans-105.6141-178.2-58.6171.1000109.8L43 L44 A46 V135 V138 R139L43-L48 CarbonylContact C-O 3.47Å; L43-L48 HydrophobicContact CB-CB 4.28Å; L43-L48 HydrophobicContact CD2-CB 4Å; L43-L48 HydrophobicContact CD2-CD1 3.86Å; L43-L48 PolarHBondContact O-N 3.17Å; L43-L48 VanDerWaalsContact O-O 3.13Å; L44-L48 PolarHBondContact N-O 2.75Å; A46-L48 VanDerWaalsContact C-N 3.26Å; A46-L48 HydrophobicContact CB-CD1 3.98Å; A46-L48 HydrophobicContact CB-CG 4.12Å; L48-V135 HydrophobicContact CD1-CG1 4.02Å; L48-V138 HydrophobicContact CB-CG1 4.11Å; L48-V138 HydrophobicContact CD1-CB 4.34Å; L48-V138 HydrophobicContact CD1-CG1 4.11Å; L48-V138 HydrophobicContact CD2-CG1 4.4Å; L48-V138 HydrophobicContact CG-CG1 4.44Å; L48-R139 HydrophobicContact CD1-CG 3.78Å; L48-R139 HydrophobicContact CD2-CG 4.37Å
49S86.7Confident76.7Confident107 Ų10770.8 Ų70.875%0.74842%0.418SS*.  trans-100.8136.2170.358.40000110
50W82.3Confident75.6Confident13 Ų1374.5 Ų74.55%0.04944%0.442CS..  trans-132.7112.6165171.364.6000106.7R36 H40 L43 A52 V146 H147R36-W50 HydrophobicContact CG-CH2 4.32Å; H40-W50 HydrophobicContact CB-CE3 4.41Å; H40-W50 PolarHBondContact ND1-O 3.38Å; L43-W50 HydrophobicContact CD1-CB 3.46Å; L43-W50 VanDerWaalsContact CD1-CB 3.46Å; L43-W50 HydrophobicContact CD1-CD2 4.28Å; L43-W50 HydrophobicContact CD1-CE3 4.2Å; L43-W50 HydrophobicContact CD1-CG 4.03Å; W50-A52 HydrophobicContact CE3-CB 4.16Å; W50-A52 HydrophobicContact CH2-CB 4.01Å; W50-A52 HydrophobicContact CZ2-CB 4.44Å; W50-A52 HydrophobicContact CZ3-CB 3.85Å; W50-A52 PolarHBondContact O-N 2.95Å; W50-V146 HydrophobicContact CD2-CB 4.44Å; W50-V146 HydrophobicContact CD2-CG1 3.89Å; W50-V146 HydrophobicContact CE3-CG1 4.1Å; W50-V146 HydrophobicContact CH2-CG1 3.7Å; W50-V146 HydrophobicContact CZ2-CB 3.97Å; W50-V146 HydrophobicContact CZ2-CG1 3.43Å; W50-V146 VanDerWaalsContact CZ2-CG1 3.43Å; W50-V146 HydrophobicContact CZ3-CG1 4.03Å; W50-H147 AromaticContact CE2-NE2 3.93Å; W50-H147 AromaticContact CZ2-CE1 3.44Å; W50-H147 VanDerWaalsContact CZ2-CE1 3.44Å; W50-H147 WeakPolarHBondContact CZ2-CE1 2.95Å; W50-H147 AromaticContact CZ2-ND1 3.92Å; W50-H147 AromaticContact CZ2-NE2 3.57Å; W50-H147 AromaticContact NE1-NE2 3.7Å
51S72.1Confident74.9Confident105 Ų10574.8 Ų74.873%0.73446%0.459SS*.  trans-67.5102.6167.249.80000106.3P53S51-P53 WeakPolarHBondContact O-CD 3.45Å; S51-P53 VanDerWaalsContact O-N 3.14Å
52A58.9Low74.5Confident31 Ų3182.2 Ų82.226%0.25648%0.482SS..  trans-64.2108.6163.700000106.5W50 E54W50-A52 HydrophobicContact CE3-CB 4.16Å; W50-A52 HydrophobicContact CH2-CB 4.01Å; W50-A52 HydrophobicContact CZ2-CB 4.44Å; W50-A52 HydrophobicContact CZ3-CB 3.85Å; W50-A52 PolarHBondContact O-N 2.95Å; A52-E54 PolarHBondContact O-N 3.33Å
53P53.3Low74.2Confident95 Ų9581.5 Ų81.562%0.61748%0.48SS*.SBendtrans-56.5-23.1-179.519.8-34.8000113.1S51 H147S51-P53 WeakPolarHBondContact O-CD 3.45Å; S51-P53 VanDerWaalsContact O-N 3.14Å; P53-H147 WeakPolarHBondContact CD-CE1 3.38Å; P53-H147 VanDerWaalsContact CD-NE2 3.27Å; P53-H147 WeakPolarHBondContact CD-NE2 3.44Å; P53-H147 WeakPolarHBondContact CG-CE1 3.46Å; P53-H147 WeakPolarHBondContact CG-NE2 3.49Å
54E52.4Low74Confident139 Ų13983.9 Ų83.965%0.6550%0.5SS*.  trans-122.994.8176.5-153.283.2-153.400108.2A52 A56A52-E54 PolarHBondContact O-N 3.33Å; E54-A56 PolarHBondContact O-N 3.02Å
55R50.8Low73.9Confident223 Ų22384.6 Ų84.684%0.84250%0.501SS*.  trans-65.279.9149.4-86.5-177.2177.51570.3105.5A57R55-A57 PolarHBondContact O-N 2.9Å
56A52.3Low74Confident45 Ų4578 Ų7837%0.37248%0.476SS..  trans-48.1138.1163.400000106.5E54E54-A56 PolarHBondContact O-N 3.02Å
57A57.1Low74.1Confident81 Ų8177 Ų7767%0.66947%0.466SS*.SBendtrans-32.1140.9-172.700000113R55 V59R55-A57 PolarHBondContact O-N 2.9Å; A57-V59 PolarHBondContact O-N 2.73Å
58P56.2Low74.1Confident127 Ų12776.4 Ų76.483%0.82546%0.455SS*.  trans-43.1120.3-175.516.7-30.8000110
59V63.4Low74.2Confident30 Ų3075.7 Ų75.718%0.18245%0.452CS..  trans-50.9125.2-177.81720000107.7A33 E37 A57 G61 L63A33-V59 HydrophobicContact CB-CG2 4.33Å; E37-V59 HydrophobicContact CG-CG2 4.1Å; A57-V59 PolarHBondContact O-N 2.73Å; V59-G61 PolarHBondContact O-N 2.65Å; V59-L63 HydrophobicContact CG1-CB 3.06Å; V59-L63 HydrophobicContact CG1-CD1 4.17Å; V59-L63 HydrophobicContact CG1-CG 4.25Å
60P72.1Confident74.7Confident84 Ų8470.6 Ų70.655%0.54542%0.416SS..  trans-45.2141.4178.8-29.629.2000111.4R62 L63 A64P60-R62 PolarHBondContact O-N 2.79Å; P60-L63 HydrophobicContact CB-CD1 4.43Å; P60-L63 HydrophobicContact CG-CD1 4.08Å; P60-L63 WeakPolarHBondContact O-CA 3.4Å; P60-L63 WeakPolarHBondContact O-CB 3.18Å; P60-L63 PolarHBondContact O-N 2.95Å; P60-A64 PolarHBondContact O-N 3.36Å
61G78.1Confident75.3Confident57 Ų5771.5 Ų71.559%0.58842%0.422SS*.Hα-helixtrans-48-38.5-169.700000115V59 L63 A64 E65V59-G61 PolarHBondContact O-N 2.65Å; G61-L63 PolarHBondContact O-N 3.3Å; G61-A64 WeakPolarHBondContact O-CB 3.23Å; G61-A64 PolarHBondContact O-N 2.91Å; G61-E65 PolarHBondContact O-N 3.1Å
62R82.7Confident76.3Confident181 Ų18172.6 Ų72.668%0.68341%0.41SS*.Hα-helixtrans-64.6-35.1175.4-72-171.9168.7-174-2.9114.4P60 E65 V66 T172P60-R62 PolarHBondContact O-N 2.79Å; R62-E65 PolarHBondContact O-N 3.33Å; R62-V66 WeakPolarHBondContact O-CG2 3.49Å; R62-V66 PolarHBondContact O-N 3.37Å; R62-V66 VanDerWaalsContact O-N 3.07Å; R62-T172 HydrophobicContact CB-CG2 4.17Å
63L87Confident78Confident13 Ų1373 Ų737%0.06841%0.407CS..Hα-helixtrans-76.4-25.8177-73.6170000111.7Q30 L34 V59 P60 G61 V66 C67 W171Q30-L63 HydrophobicContact CB-CD1 4.32Å; Q30-L63 HydrophobicContact CB-CD2 4.19Å; Q30-L63 HydrophobicContact CG-CD1 3.69Å; Q30-L63 HydrophobicContact CG-CD2 4.17Å; L34-L63 HydrophobicContact CD1-CD2 4.26Å; L34-L63 HydrophobicContact CD2-CD2 4.47Å; L34-L63 WeakPolarHBondContact CD2-O 3.29Å; L34-L63 HydrophobicContact CG-CD2 4.49Å; V59-L63 HydrophobicContact CG1-CB 3.06Å; V59-L63 HydrophobicContact CG1-CD1 4.17Å; V59-L63 HydrophobicContact CG1-CG 4.25Å; P60-L63 HydrophobicContact CB-CD1 4.43Å; P60-L63 HydrophobicContact CG-CD1 4.08Å; P60-L63 WeakPolarHBondContact O-CA 3.4Å; P60-L63 WeakPolarHBondContact O-CB 3.18Å; P60-L63 PolarHBondContact O-N 2.95Å; G61-L63 PolarHBondContact O-N 3.3Å; L63-V66 WeakPolarHBondContact O-CB 3.05Å; L63-V66 PolarHBondContact O-N 2.89Å; L63-C67 WeakPolarHBondContact O-CB 3.34Å; L63-C67 PolarHBondContact O-N 3.47Å; L63-W171 HydrophobicContact CD2-CB 4.11Å
64A88.2Confident79.9Confident51 Ų5168.5 Ų68.542%0.42138%0.378SS..Hα-helixtrans-65.4-42.3169.700000111.1P60 G61 V66 C67 A68P60-A64 PolarHBondContact O-N 3.36Å; G61-A64 WeakPolarHBondContact O-CB 3.23Å; G61-A64 PolarHBondContact O-N 2.91Å; A64-V66 VanDerWaalsContact C-N 3.35Å; A64-C67 WeakPolarHBondContact O-CB 3.39Å; A64-C67 PolarHBondContact O-N 2.83Å; A64-A68 PolarHBondContact O-N 3.45Å
65E91Very high81.7Confident114 Ų11464.3 Ų64.353%0.53336%0.361SS..Hα-helixtrans-60.6-43.3171.6-67.8173.4-165.200111.8G61 R62 C67 A68 V69 L175G61-E65 PolarHBondContact O-N 3.1Å; R62-E65 PolarHBondContact O-N 3.33Å; E65-C67 VanDerWaalsContact C-N 3.34Å; E65-C67 PolarHBondContact O-N 3.31Å; E65-A68 PolarHBondContact O-N 2.81Å; E65-V69 PolarHBondContact O-N 3.23Å; E65-L175 HydrophobicContact CB-CD2 4.11Å
66V94.2Very high83.6Confident0 Ų057.5 Ų57.50%034%0.338CS..Hα-helixtrans-58.1-46.8174.4167.70000110.7L34 R62 L63 A64 A68 V69 L70 W171 T172 V174 L175L34-V66 HydrophobicContact CD1-CG1 3.69Å; L34-V66 HydrophobicContact CD2-CB 4.19Å; L34-V66 HydrophobicContact CD2-CG1 3.76Å; L34-V66 HydrophobicContact CG-CG1 4.4Å; R62-V66 WeakPolarHBondContact O-CG2 3.49Å; R62-V66 PolarHBondContact O-N 3.37Å; R62-V66 VanDerWaalsContact O-N 3.07Å; L63-V66 WeakPolarHBondContact O-CB 3.05Å; L63-V66 PolarHBondContact O-N 2.89Å; A64-V66 VanDerWaalsContact C-N 3.35Å; V66-A68 VanDerWaalsContact C-N 3.35Å; V66-A68 PolarHBondContact O-N 3.01Å; V66-V69 PolarHBondContact O-N 2.77Å; V66-L70 HydrophobicContact CG1-CD1 4.03Å; V66-L70 HydrophobicContact CG1-CG 4.26Å; V66-L70 VanDerWaalsContact O-CG 3.31Å; V66-L70 WeakPolarHBondContact O-CG 3.4Å; V66-L70 PolarHBondContact O-N 3.1Å; V66-W171 HydrophobicContact CG1-CB 4.36Å; V66-W171 WeakPolarHBondContact CG2-O 3.43Å; V66-T172 HydrophobicContact CG2-CG2 4.36Å; V66-V174 HydrophobicContact CB-CG1 4.38Å; V66-V174 HydrophobicContact CG1-CG1 3.85Å; V66-V174 HydrophobicContact CG2-CG1 4.2Å; V66-L175 HydrophobicContact CG2-CD1 4.35Å; V66-L175 HydrophobicContact CG2-CD2 3.99Å; V66-L175 HydrophobicContact CG2-CG 4.08Å
67C93.2Very high85.3Confident12 Ų1257.4 Ų57.48%0.08133%0.331CS..Hα-helixtrans-60-44.8178.1-169.80000111.7L34 E37 L63 A64 E65 V69 L70 L71L34-C67 HydrophobicContact CD2-CB 3.86Å; E37-C67 VanDerWaalsContact CB-SG 3.52Å; L63-C67 WeakPolarHBondContact O-CB 3.34Å; L63-C67 PolarHBondContact O-N 3.47Å; A64-C67 WeakPolarHBondContact O-CB 3.39Å; A64-C67 PolarHBondContact O-N 2.83Å; E65-C67 VanDerWaalsContact C-N 3.34Å; E65-C67 PolarHBondContact O-N 3.31Å; C67-V69 VanDerWaalsContact C-N 3.34Å; C67-V69 PolarHBondContact O-N 3.21Å; C67-L70 PolarHBondContact O-N 3.33Å; C67-L71 WeakPolarHBondContact O-CB 3.45Å; C67-L71 WeakPolarHBondContact O-CG 3.22Å; C67-L71 PolarHBondContact O-N 2.91Å
68A92.6Very high86.7Confident59 Ų5954.4 Ų54.449%0.48830%0.303SS..Hα-helixtrans-60.5-42.3176.700000112.2A64 E65 V66 L71 R72A64-A68 PolarHBondContact O-N 3.45Å; E65-A68 PolarHBondContact O-N 2.81Å; V66-A68 VanDerWaalsContact C-N 3.35Å; V66-A68 PolarHBondContact O-N 3.01Å; A68-L71 PolarHBondContact O-N 2.92Å; A68-R72 WeakPolarHBondContact O-CB 3.47Å; A68-R72 PolarHBondContact O-N 3.39Å
69V94.6Very high88.2Confident22 Ų2254.7 Ų54.713%0.13330%0.295CS..Hα-helixtrans-65.5-44.8175.4165.30000111.6E65 V66 C67 L71 R72 L73 V174 L175 V178E65-V69 PolarHBondContact O-N 3.23Å; V66-V69 PolarHBondContact O-N 2.77Å; C67-V69 VanDerWaalsContact C-N 3.34Å; C67-V69 PolarHBondContact O-N 3.21Å; V69-L71 VanDerWaalsContact C-N 3.33Å; V69-L71 PolarHBondContact O-N 3.34Å; V69-R72 PolarHBondContact O-N 3.14Å; V69-L73 HydrophobicContact CG1-CD1 3.82Å; V69-L73 HydrophobicContact CG1-CG 4.28Å; V69-L73 WeakPolarHBondContact O-CB 3.32Å; V69-L73 WeakPolarHBondContact O-CG 3.35Å; V69-L73 PolarHBondContact O-N 3.2Å; V69-V174 HydrophobicContact CG1-CG1 4.17Å; V69-V174 HydrophobicContact CG1-CG2 4.16Å; V69-L175 HydrophobicContact CB-CD2 4.14Å; V69-L175 HydrophobicContact CG2-CD2 3.66Å; V69-V178 HydrophobicContact CG1-CB 4.49Å; V69-V178 HydrophobicContact CG1-CG2 3.65Å; V69-V178 HydrophobicContact CG2-CG2 4.3Å
70L96.1Very high89.3Confident0 Ų058.7 Ų58.70%032%0.315CS..Hα-helixtrans-58-47.5176.2-71.3176.7000110.6L34 Y38 V66 C67 R72 L73 G74 V124 Y127 V174L34-L70 HydrophobicContact CB-CD1 4.4Å; L34-L70 HydrophobicContact CD1-CD1 4.21Å; L34-L70 HydrophobicContact CD2-CD1 4.44Å; Y38-L70 HydrophobicContact CD2-CB 3.95Å; Y38-L70 HydrophobicContact CE2-CB 4.03Å; Y38-L70 WeakPolarHBondContact CE2-O 3.21Å; V66-L70 HydrophobicContact CG1-CD1 4.03Å; V66-L70 HydrophobicContact CG1-CG 4.26Å; V66-L70 VanDerWaalsContact O-CG 3.31Å; V66-L70 WeakPolarHBondContact O-CG 3.4Å; V66-L70 PolarHBondContact O-N 3.1Å; C67-L70 PolarHBondContact O-N 3.33Å; L70-R72 PolarHBondContact O-N 3.15Å; L70-L73 PolarHBondContact O-N 3.3Å; L70-G74 PolarHBondContact O-N 2.91Å; L70-V124 HydrophobicContact CD2-CG2 3.69Å; L70-Y127 HydrophobicContact CD1-CD1 4.44Å; L70-Y127 HydrophobicContact CD1-CE1 4.37Å; L70-V174 HydrophobicContact CD2-CG2 4.16Å
71L94.2Very high89.8Confident32 Ų3262.4 Ų62.417%0.16832%0.318CS..Hα-helixtrans-59.3-46.4178.2-77166.5000111.6Y38 A41 R42 C67 A68 V69 G74 D75Y38-L71 HydrophobicContact CD1-CD2 4.28Å; Y38-L71 HydrophobicContact CD2-CD2 3.72Å; Y38-L71 HydrophobicContact CD2-CG 3.89Å; Y38-L71 HydrophobicContact CE1-CD2 4.36Å; Y38-L71 HydrophobicContact CE2-CD2 3.83Å; Y38-L71 HydrophobicContact CE2-CG 4.12Å; Y38-L71 HydrophobicContact CG-CD2 3.96Å; Y38-L71 HydrophobicContact CG-CG 4.49Å; A41-L71 HydrophobicContact CB-CD1 3.75Å; A41-L71 HydrophobicContact CB-CD2 3.85Å; A41-L71 HydrophobicContact CB-CG 4.47Å; R42-L71 HydrophobicContact CG-CD2 4.4Å; C67-L71 WeakPolarHBondContact O-CB 3.45Å; C67-L71 WeakPolarHBondContact O-CG 3.22Å; C67-L71 PolarHBondContact O-N 2.91Å; A68-L71 PolarHBondContact O-N 2.92Å; V69-L71 VanDerWaalsContact C-N 3.33Å; V69-L71 PolarHBondContact O-N 3.34Å; L71-G74 PolarHBondContact O-N 2.91Å; L71-D75 PolarHBondContact O-N 3.47Å
72R94.1Very high89.9Confident129 Ų12962.3 Ų62.349%0.48731%0.306SS..Hα-helixtrans-61.3-48.3177.9-175.6173.6-176.4-109.6-6.9111.9A68 V69 L70 G74 D75 E76A68-R72 WeakPolarHBondContact O-CB 3.47Å; A68-R72 PolarHBondContact O-N 3.39Å; V69-R72 PolarHBondContact O-N 3.14Å; L70-R72 PolarHBondContact O-N 3.15Å; R72-G74 VanDerWaalsContact C-N 3.26Å; R72-G74 PolarHBondContact O-N 3.33Å; R72-D75 WeakPolarHBondContact O-CB 3.38Å; R72-D75 PolarHBondContact O-N 2.91Å; R72-E76 WeakPolarHBondContact O-CG 3.48Å; R72-E76 PolarHBondContact O-N 2.99Å; R72-E76 VanDerWaalsContact O-N 3.1Å
73L94Very high89.7Confident38 Ų3857.9 Ų57.920%0.19930%0.303CS..Hα-helixtrans-63.1-36.3177.2-68.7174.4000111.4V69 L70 D75 E76 L77 V124 V174 C177 V178V69-L73 HydrophobicContact CG1-CD1 3.82Å; V69-L73 HydrophobicContact CG1-CG 4.28Å; V69-L73 WeakPolarHBondContact O-CB 3.32Å; V69-L73 WeakPolarHBondContact O-CG 3.35Å; V69-L73 PolarHBondContact O-N 3.2Å; L70-L73 PolarHBondContact O-N 3.3Å; L73-D75 VanDerWaalsContact C-N 3.34Å; L73-E76 PolarHBondContact O-N 2.95Å; L73-L77 WeakPolarHBondContact O-CG 3.42Å; L73-L77 PolarHBondContact O-N 3.4Å; L73-V124 HydrophobicContact CB-CB 4.41Å; L73-V124 HydrophobicContact CB-CG1 3.81Å; L73-V124 HydrophobicContact CB-CG2 3.86Å; L73-V124 HydrophobicContact CD1-CG2 3.88Å; L73-V174 HydrophobicContact CD1-CG2 4.11Å; L73-C177 HydrophobicContact CD1-CB 4.31Å; L73-V178 HydrophobicContact CD1-CG2 4.41Å; L73-V178 HydrophobicContact CD2-CG2 3.99Å; L73-V178 HydrophobicContact CG-CG2 4.15Å
74G93.4Very high89.1Confident1 Ų160.2 Ų60.21%0.0132%0.318CS..Hα-helixtrans-62.6-40.7175.100000112.7Y38 L70 L71 R72 L77 E78 V124Y38-G74 WeakPolarHBondContact OH-CA 3.25Å; L70-G74 PolarHBondContact O-N 2.91Å; L71-G74 PolarHBondContact O-N 2.91Å; R72-G74 VanDerWaalsContact C-N 3.26Å; R72-G74 PolarHBondContact O-N 3.33Å; G74-L77 PolarHBondContact O-N 3.21Å; G74-E78 WeakPolarHBondContact O-CB 3.35Å; G74-E78 PolarHBondContact O-N 2.88Å; G74-V124 VanDerWaalsContact N-CG1 3.34Å
75D90.7Very high88.5Confident52 Ų5258.5 Ų58.528%0.27830%0.301SS..Hα-helixtrans-63.4-43.6174.8-73.1-28.4000112.3R45 L71 R72 L73 E78 M79R45-D75 IonicContact CZ-OD1 3.95Å; R45-D75 IonicContact CZ-OD2 2.65Å; R45-D75 IonicContact NH1-OD1 3.14Å; R45-D75 PolarHBondContact NH1-OD1 3.42Å; R45-D75 IonicContact NH1-OD2 3.55Å; R45-D75 PolarHBondContact NH1-OD2 2.95Å; R45-D75 IonicContact NH2-OD1 3.57Å; R45-D75 PolarHBondContact NH2-OD1 3.36Å; R45-D75 IonicContact NH2-OD2 3.5Å; R45-D75 PolarHBondContact NH2-OD2 3.21Å; L71-D75 PolarHBondContact O-N 3.47Å; R72-D75 WeakPolarHBondContact O-CB 3.38Å; R72-D75 PolarHBondContact O-N 2.91Å; L73-D75 VanDerWaalsContact C-N 3.34Å; D75-E78 PolarHBondContact O-N 3.13Å; D75-M79 WeakPolarHBondContact O-CB 3.48Å; D75-M79 PolarHBondContact O-N 3.06Å
76E91Very high87.8Confident79 Ų7959.4 Ų59.437%0.36930%0.299SS..Hα-helixtrans-61.3-44.6174.6-63.9-66.9162.200111R72 L73 E78 M79 I80R72-E76 WeakPolarHBondContact O-CG 3.48Å; R72-E76 PolarHBondContact O-N 2.99Å; R72-E76 VanDerWaalsContact O-N 3.1Å; L73-E76 PolarHBondContact O-N 2.95Å; E76-E78 PolarHBondContact O-N 3.35Å; E76-M79 PolarHBondContact O-N 3.1Å; E76-M79 WeakPolarHBondContact OE2-CE 3.35Å; E76-I80 WeakPolarHBondContact O-CD1 3.35Å; E76-I80 WeakPolarHBondContact O-CG1 3.45Å; E76-I80 PolarHBondContact O-N 3Å
77L88.3Confident86.9Confident43 Ų4362.2 Ų62.223%0.22531%0.314CS..Hα-helixtrans-62.9-41.5177.2-72.5178000112.5L73 G74 M79 I80 R81 Y85 V124L73-L77 WeakPolarHBondContact O-CG 3.42Å; L73-L77 PolarHBondContact O-N 3.4Å; G74-L77 PolarHBondContact O-N 3.21Å; L77-M79 VanDerWaalsContact C-N 3.35Å; L77-I80 PolarHBondContact O-N 3.24Å; L77-R81 PolarHBondContact O-N 3.3Å; L77-Y85 HydrophobicContact CB-CD2 4.49Å; L77-Y85 HydrophobicContact CB-CE2 3.77Å; L77-Y85 WeakPolarHBondContact O-CE2 3.29Å; L77-V124 HydrophobicContact CD1-CB 3.93Å; L77-V124 HydrophobicContact CD1-CG1 3.64Å
78E86.7Confident86Confident19 Ų1961.9 Ų61.99%0.08931%0.312CS..Hα-helixtrans-68.1-35.3177.2-173.7174.216200112R42 G74 D75 E76 R81 P82 Y85 R86R42-E78 IonicContact CZ-OE2 3.81Å; R42-E78 IonicContact NE-OE2 3.62Å; R42-E78 IonicContact NH2-OE1 2.8Å; R42-E78 IonicContact NH2-OE2 2.73Å; R42-E78 PolarHBondContact NH2-OE2 3.17Å; G74-E78 WeakPolarHBondContact O-CB 3.35Å; G74-E78 PolarHBondContact O-N 2.88Å; D75-E78 PolarHBondContact O-N 3.13Å; E76-E78 PolarHBondContact O-N 3.35Å; E78-R81 CarbonylContact O-C 3.48Å; E78-P82 WeakPolarHBondContact O-CA 3.38Å; E78-P82 WeakPolarHBondContact O-CB 3.25Å; E78-P82 WeakPolarHBondContact O-CD 3.31Å; E78-Y85 HydrophobicContact CB-CD2 4.46Å; E78-R86 HydrophobicContact CG-CG 4.25Å; E78-R86 VanDerWaalsContact OE1-CG 3.27Å; E78-R86 WeakPolarHBondContact OE1-CG 3.34Å; E78-R86 IonicContact OE1-CZ 3.94Å; E78-R86 IonicContact OE1-NE 3.58Å; E78-R86 PolarHBondContact OE1-NE 3.32Å; E78-R86 IonicContact OE1-NH2 3.63Å
79M87.4Confident85.1Confident132 Ų13259.3 Ų59.365%0.6529%0.29SS*.Hα-helixtrans-65.6-42.7173.5-177.9-179.661.100111.7D75 E76 L77D75-M79 WeakPolarHBondContact O-CB 3.48Å; D75-M79 PolarHBondContact O-N 3.06Å; E76-M79 PolarHBondContact O-N 3.1Å; E76-M79 WeakPolarHBondContact OE2-CE 3.35Å; L77-M79 VanDerWaalsContact C-N 3.35Å
80I85.6Confident84.3Confident115 Ų11566.2 Ų66.259%0.5931%0.314SS*.Hα-helixtrans-72.1-39-179.3-62161.7000111.2E76 L77E76-I80 WeakPolarHBondContact O-CD1 3.35Å; E76-I80 WeakPolarHBondContact O-CG1 3.45Å; E76-I80 PolarHBondContact O-N 3Å; L77-I80 PolarHBondContact O-N 3.24Å
81R82.9Confident83.4Confident162 Ų16270.1 Ų70.161%0.61133%0.332SS*.  trans-135.369.5-176.4-60-171.6-174.4162.91.4111.9L77 E78 S83 V84 Y85L77-R81 PolarHBondContact O-N 3.3Å; E78-R81 CarbonylContact O-C 3.48Å; R81-S83 PolarHBondContact O-N 2.93Å; R81-S83 VanDerWaalsContact O-N 3.16Å; R81-V84 HydrophobicContact CB-CB 4.33Å; R81-V84 HydrophobicContact CB-CG2 4.02Å; R81-V84 PolarHBondContact O-N 3.33Å; R81-Y85 HydrophobicContact CB-CE2 4.34Å; R81-Y85 WeakPolarHBondContact O-CD2 3.34Å
82P80.6Confident82.6Confident54 Ų5471.4 Ų71.435%0.35134%0.339SS..Hα-helixtrans-61-31-17723.4-33.6000112.4E78 V84 Y85 R86E78-P82 WeakPolarHBondContact O-CA 3.38Å; E78-P82 WeakPolarHBondContact O-CB 3.25Å; E78-P82 WeakPolarHBondContact O-CD 3.31Å; P82-V84 PolarHBondContact O-N 2.93Å; P82-Y85 PolarHBondContact O-N 3.16Å; P82-R86 WeakPolarHBondContact O-CB 3.42Å; P82-R86 PolarHBondContact O-N 3.01Å; P82-R86 VanDerWaalsContact O-N 3.12Å
83S77.3Confident81.9Confident88 Ų8873.7 Ų73.762%0.61536%0.355SS*.Hα-helixtrans-69.8-5.5177.661.10000114.6R81 Q91R81-S83 PolarHBondContact O-N 2.93Å; R81-S83 VanDerWaalsContact O-N 3.16Å; S83-Q91 PolarHBondContact O-NE2 3.01Å; S83-Q91 PolarHBondContact O-OE1 2.93Å
84V74.7Confident81.3Confident62 Ų6273.6 Ų73.638%0.37635%0.354SS..Hα-helixtrans-100.1-33.1175.9176.60000111.2R81 P82R81-V84 HydrophobicContact CB-CB 4.33Å; R81-V84 HydrophobicContact CB-CG2 4.02Å; R81-V84 PolarHBondContact O-N 3.33Å; P82-V84 PolarHBondContact O-N 2.93Å
85Y76.6Confident80.8Confident15 Ų1576.8 Ų76.86%0.05938%0.377CS..Hα-helixtrans-108-10.1-169.1-56.6-73.9000114.4L77 E78 R81 P82 S125 A128 V129L77-Y85 HydrophobicContact CB-CD2 4.49Å; L77-Y85 HydrophobicContact CB-CE2 3.77Å; L77-Y85 WeakPolarHBondContact O-CE2 3.29Å; E78-Y85 HydrophobicContact CB-CD2 4.46Å; R81-Y85 HydrophobicContact CB-CE2 4.34Å; R81-Y85 WeakPolarHBondContact O-CD2 3.34Å; P82-Y85 PolarHBondContact O-N 3.16Å; Y85-S125 WeakPolarHBondContact OH-CB 3.11Å; Y85-S125 PolarHBondContact OH-OG 3.48Å; Y85-A128 HydrophobicContact CD1-CB 3.6Å; Y85-A128 HydrophobicContact CE1-CB 3.91Å; Y85-A128 HydrophobicContact CG-CB 4.41Å; Y85-V129 HydrophobicContact CD1-CG2 4.27Å; Y85-V129 HydrophobicContact CE1-CG2 4.36Å
86R75.6Confident80.3Confident133 Ų13374.4 Ų74.450%0.50236%0.364SS..SBendtrans-103.9133178.9-65.9-176.2174.8166.72.7112.7E78 P82 Q91E78-R86 HydrophobicContact CG-CG 4.25Å; E78-R86 VanDerWaalsContact OE1-CG 3.27Å; E78-R86 WeakPolarHBondContact OE1-CG 3.34Å; E78-R86 IonicContact OE1-CZ 3.94Å; E78-R86 IonicContact OE1-NE 3.58Å; E78-R86 PolarHBondContact OE1-NE 3.32Å; E78-R86 IonicContact OE1-NH2 3.63Å; P82-R86 WeakPolarHBondContact O-CB 3.42Å; P82-R86 PolarHBondContact O-N 3.01Å; P82-R86 VanDerWaalsContact O-N 3.12Å; R86-Q91 PolarHBondContact O-NE2 3.31Å
87N75.2Confident79.9Confident59 Ų5976.5 Ų76.532%0.31637%0.373SS..SBendtrans5849-179.7-45.5-86.1000111.3A89 R90 Q91N87-A89 VanDerWaalsContact C-N 3.25Å; N87-A89 PolarHBondContact O-N 3.31Å; N87-R90 HydrophobicContact CB-CB 4.01Å; N87-R90 PolarHBondContact ND2-NH2 2.88Å; N87-R90 WeakPolarHBondContact O-CB 3.29Å; N87-R90 PolarHBondContact O-N 3.42Å; N87-R90 VanDerWaalsContact O-N 3.1Å; N87-Q91 WeakPolarHBondContact O-CG 3.43Å; N87-Q91 PolarHBondContact O-N 3.27Å
88V75.3Confident79.9Confident5 Ų576.4 Ų76.43%0.0338%0.377CS..Hα-helixtrans-57.5-42.3-174.6-179.30000110.1R90 Q91 L92 V129 L133 D136V88-R90 VanDerWaalsContact C-N 3.3Å; V88-R90 PolarHBondContact O-N 3.41Å; V88-Q91 PolarHBondContact O-N 3.13Å; V88-Q91 VanDerWaalsContact O-N 3.16Å; V88-L92 HydrophobicContact CG1-CD1 3.74Å; V88-L92 HydrophobicContact CG1-CG 4.28Å; V88-L92 WeakPolarHBondContact O-CG 3.44Å; V88-L92 PolarHBondContact O-N 3.49Å; V88-V129 HydrophobicContact CG1-CG1 4.21Å; V88-L133 HydrophobicContact CB-CD2 3.98Å; V88-L133 HydrophobicContact CB-CG 4.2Å; V88-L133 HydrophobicContact CG1-CD1 4.5Å; V88-L133 HydrophobicContact CG1-CD2 3.7Å; V88-L133 HydrophobicContact CG1-CG 3.85Å; V88-D136 PolarHBondContact N-OD2 3.19Å
89A73Confident80.2Confident5 Ų580.3 Ų80.34%0.04140%0.395CS..Hα-helixtrans-60.3-40.4178.700000112.5N87 L92 H93 I94 L96 L133 D136N87-A89 VanDerWaalsContact C-N 3.25Å; N87-A89 PolarHBondContact O-N 3.31Å; A89-L92 PolarHBondContact O-N 3.19Å; A89-H93 PolarHBondContact O-N 3.49Å; A89-H93 VanDerWaalsContact O-N 3.07Å; A89-I94 HydrophobicContact CB-CD1 4.37Å; A89-I94 HydrophobicContact CB-CG1 4.08Å; A89-I94 PolarHBondContact O-N 2.87Å; A89-L96 HydrophobicContact CB-CD1 3.87Å; A89-L96 HydrophobicContact CB-CD2 3.8Å; A89-L96 HydrophobicContact CB-CG 4.08Å; A89-L133 HydrophobicContact CB-CD2 4.37Å; A89-D136 HydrophobicContact CB-CB 3.95Å; A89-D136 WeakPolarHBondContact CB-OD2 3.31Å; A89-D136 PolarHBondContact N-OD2 2.94Å
90R77.4Confident80.5Confident168 Ų16877.7 Ų77.763%0.63439%0.388SS*.Hα-helixtrans-67.5-38.4177.5-177.1178.759.31710.4111.9N87 V88 L92 H93N87-R90 HydrophobicContact CB-CB 4.01Å; N87-R90 PolarHBondContact ND2-NH2 2.88Å; N87-R90 WeakPolarHBondContact O-CB 3.29Å; N87-R90 PolarHBondContact O-N 3.42Å; N87-R90 VanDerWaalsContact O-N 3.1Å; V88-R90 VanDerWaalsContact C-N 3.3Å; V88-R90 PolarHBondContact O-N 3.41Å; R90-L92 VanDerWaalsContact C-N 3.32Å; R90-H93 PolarHBondContact O-N 2.74Å
91Q77.3Confident80.8Confident81 Ų8175 Ų7538%0.37938%0.376SS..Hα-helixtrans-68.6-33.8176.6-65.3178.930.700112.6S83 R86 N87 V88 H93S83-Q91 PolarHBondContact O-NE2 3.01Å; S83-Q91 PolarHBondContact O-OE1 2.93Å; R86-Q91 PolarHBondContact O-NE2 3.31Å; N87-Q91 WeakPolarHBondContact O-CG 3.43Å; N87-Q91 PolarHBondContact O-N 3.27Å; V88-Q91 PolarHBondContact O-N 3.13Å; V88-Q91 VanDerWaalsContact O-N 3.16Å; Q91-H93 VanDerWaalsContact C-N 3.28Å
92L78.2Confident81.3Confident60 Ų6067.3 Ų67.331%0.31435%0.348SS..THydrogen-bonded Turntrans-82.4-6.6177.3-64.4174.9000112.9V88 A89 R90 I94 A105 V109 L133V88-L92 HydrophobicContact CG1-CD1 3.74Å; V88-L92 HydrophobicContact CG1-CG 4.28Å; V88-L92 WeakPolarHBondContact O-CG 3.44Å; V88-L92 PolarHBondContact O-N 3.49Å; A89-L92 PolarHBondContact O-N 3.19Å; R90-L92 VanDerWaalsContact C-N 3.32Å; L92-I94 HydrophobicContact CB-CD1 4.41Å; L92-I94 HydrophobicContact CB-CG1 4.08Å; L92-I94 HydrophobicContact CB-CG2 3.88Å; L92-I94 HydrophobicContact CD1-CD1 4.3Å; L92-I94 PolarHBondContact O-N 2.66Å; L92-A105 HydrophobicContact CD1-CB 4.23Å; L92-V109 HydrophobicContact CD1-CG2 3.93Å; L92-V109 HydrophobicContact CD2-CG2 3.67Å; L92-V109 HydrophobicContact CG-CG2 4.43Å; L92-L133 HydrophobicContact CD1-CD2 4.42Å
93H79.8Confident81.9Confident177 Ų17765.8 Ų65.882%0.81934%0.337SS*.THydrogen-bonded Turntrans52.134.2-174.6-60.5-78.4000113.4A89 R90 Q91A89-H93 PolarHBondContact O-N 3.49Å; A89-H93 VanDerWaalsContact O-N 3.07Å; R90-H93 PolarHBondContact O-N 2.74Å; Q91-H93 VanDerWaalsContact C-N 3.28Å
94I81.8Confident82.7Confident36 Ų3666.4 Ų66.419%0.18533%0.333CS..  trans-93.5145.1-176.657.6170.8000112.3A89 L92 L96 V101 A105 L133A89-I94 HydrophobicContact CB-CD1 4.37Å; A89-I94 HydrophobicContact CB-CG1 4.08Å; A89-I94 PolarHBondContact O-N 2.87Å; L92-I94 HydrophobicContact CB-CD1 4.41Å; L92-I94 HydrophobicContact CB-CG1 4.08Å; L92-I94 HydrophobicContact CB-CG2 3.88Å; L92-I94 HydrophobicContact CD1-CD1 4.3Å; L92-I94 PolarHBondContact O-N 2.66Å; I94-L96 HydrophobicContact CD1-CD2 3.7Å; I94-L96 HydrophobicContact CG1-CD2 3.96Å; I94-V101 HydrophobicContact CB-CG1 4.18Å; I94-V101 HydrophobicContact CG2-CG1 4.33Å; I94-A105 HydrophobicContact CD1-CB 3.95Å; I94-A105 HydrophobicContact CG2-CB 3.9Å; I94-L133 HydrophobicContact CD1-CD2 3.98Å
95S81.9Confident83.6Confident68 Ų6864.2 Ų64.248%0.47632%0.322SS..  trans-80.9126165.6178.90000109.6Q97S95-Q97 PolarHBondContact O-N 3.44Å; S95-Q97 WeakPolarHBondContact OG-CG 3.34Å
96L80.2Confident84.4Confident1 Ų163.5 Ų63.51%0.00532%0.319CS..THydrogen-bonded Turntrans-86.917177.5-54.1-175.2000113.1A89 I94 V102 D136 Q140A89-L96 HydrophobicContact CB-CD1 3.87Å; A89-L96 HydrophobicContact CB-CD2 3.8Å; A89-L96 HydrophobicContact CB-CG 4.08Å; I94-L96 HydrophobicContact CD1-CD2 3.7Å; I94-L96 HydrophobicContact CG1-CD2 3.96Å; L96-V102 HydrophobicContact CB-CG2 4.4Å; L96-V102 HydrophobicContact CD2-CG2 3.64Å; L96-D136 HydrophobicContact CD1-CB 3.77Å; L96-Q140 HydrophobicContact CD1-CG 4.33Å; L96-Q140 VanDerWaalsContact CD1-NE2 3.25Å
97Q82.5Confident85.4Confident123 Ų12360.3 Ų60.358%0.57531%0.312SS*.THydrogen-bonded Turntrans-80.5-20.2-177.7-62.5-59.6-45.100113.1S95S95-Q97 PolarHBondContact O-N 3.44Å; S95-Q97 WeakPolarHBondContact OG-CG 3.34Å
98S89.1Confident86.3Confident42 Ų4260 Ų6029%0.29432%0.318SS..  trans-128.7129-17760.30000111.5V101 V102S98-V101 PolarHBondContact O-N 3.31Å; S98-V101 VanDerWaalsContact OG-CB 3.25Å; S98-V101 WeakPolarHBondContact OG-CB 3.41Å; S98-V101 WeakPolarHBondContact OG-CG2 3.27Å; S98-V102 PolarHBondContact O-N 3.36Å
99E92.9Very high87.1Confident101 Ų10161.2 Ų61.247%0.47233%0.325SS..Hα-helixtrans-52-49.6176.7-171.8-175.3138.300114.3V101 V102 T103 M145 A148E99-V101 VanDerWaalsContact C-N 3.28Å; E99-V101 PolarHBondContact O-N 3.33Å; E99-V102 PolarHBondContact O-N 3.23Å; E99-V102 VanDerWaalsContact O-N 3.09Å; E99-T103 HydrophobicContact CG-CG2 4.23Å; E99-T103 PolarHBondContact O-N 3.23Å; E99-T103 PolarHBondContact O-OG1 3.33Å; E99-T103 VanDerWaalsContact O-OG1 3.1Å; E99-M145 WeakPolarHBondContact CA-SD 3.23Å; E99-M145 HydrophobicContact CB-CE 3.96Å; E99-M145 HydrophobicContact CB-SD 3.6Å; E99-M145 HydrophobicContact CG-SD 3.94Å; E99-A148 HydrophobicContact CG-CB 3.5Å; E99-A148 VanDerWaalsContact CG-CB 3.5Å; E99-A148 WeakPolarHBondContact OE1-CB 3.48Å
100P93.1Very high88.2Confident77 Ų7761 Ų6150%0.532%0.323SS..Hα-helixtrans-60.4-37.8-178.222.4-34.6000112.5V102 T103 D104P100-V102 VanDerWaalsContact C-N 3.32Å; P100-V102 PolarHBondContact O-N 2.93Å; P100-T103 WeakPolarHBondContact CA-OG1 3.46Å; P100-T103 PolarHBondContact O-N 2.84Å; P100-T103 PolarHBondContact O-OG1 3.05Å; P100-D104 WeakPolarHBondContact O-CB 3.3Å; P100-D104 PolarHBondContact O-N 2.81Å
101V91.9Very high89Confident58 Ų5854.9 Ų54.935%0.35231%0.312SS..Hα-helixtrans-63-40.4177.41720000111.3I94 S98 E99 A105I94-V101 HydrophobicContact CB-CG1 4.18Å; I94-V101 HydrophobicContact CG2-CG1 4.33Å; S98-V101 PolarHBondContact O-N 3.31Å; S98-V101 VanDerWaalsContact OG-CB 3.25Å; S98-V101 WeakPolarHBondContact OG-CB 3.41Å; S98-V101 WeakPolarHBondContact OG-CG2 3.27Å; E99-V101 VanDerWaalsContact C-N 3.28Å; E99-V101 PolarHBondContact O-N 3.33Å; V101-A105 WeakPolarHBondContact O-CB 3.34Å; V101-A105 PolarHBondContact O-N 2.84Å
102V92.8Very high89.8Confident1 Ų157.9 Ų57.91%0.00633%0.326CS..Hα-helixtrans-70.9-44.2179.9179.50000111.2L96 S98 E99 P100 F106 L149L96-V102 HydrophobicContact CB-CG2 4.4Å; L96-V102 HydrophobicContact CD2-CG2 3.64Å; S98-V102 PolarHBondContact O-N 3.36Å; E99-V102 PolarHBondContact O-N 3.23Å; E99-V102 VanDerWaalsContact O-N 3.09Å; P100-V102 VanDerWaalsContact C-N 3.32Å; P100-V102 PolarHBondContact O-N 2.93Å; V102-F106 WeakPolarHBondContact O-CB 3.08Å; V102-F106 PolarHBondContact O-N 3.4Å; V102-L149 HydrophobicContact CG1-CD1 4.28Å; V102-L149 HydrophobicContact CG1-CD2 3.94Å; V102-L149 HydrophobicContact CG1-CG 4.21Å
103T94.7Very high90.5Very high22 Ų2256.8 Ų56.814%0.13532%0.32CS..Hα-helixtrans-71.2-39.4-179.454.30000112E99 P100 F106 L107 A148 C152E99-T103 HydrophobicContact CG-CG2 4.23Å; E99-T103 PolarHBondContact O-N 3.23Å; E99-T103 PolarHBondContact O-OG1 3.33Å; E99-T103 VanDerWaalsContact O-OG1 3.1Å; P100-T103 WeakPolarHBondContact CA-OG1 3.46Å; P100-T103 PolarHBondContact O-N 2.84Å; P100-T103 PolarHBondContact O-OG1 3.05Å; T103-F106 WeakPolarHBondContact O-CB 3.38Å; T103-F106 PolarHBondContact O-N 3.38Å; T103-L107 WeakPolarHBondContact O-CG 3.19Å; T103-L107 PolarHBondContact O-N 2.9Å; T103-A148 HydrophobicContact CG2-CB 4.06Å; T103-C152 HydrophobicContact CG2-CB 4.2Å
104D93.7Very high91.3Very high100 Ų10049.1 Ų49.154%0.53528%0.284SS..Hα-helixtrans-64.9-42.7174.6-72.5-20.2000111.5P100 F106 L107 A108P100-D104 WeakPolarHBondContact O-CB 3.3Å; P100-D104 PolarHBondContact O-N 2.81Å; D104-F106 VanDerWaalsContact C-N 3.34Å; D104-F106 PolarHBondContact O-N 3.48Å; D104-L107 PolarHBondContact O-N 3.47Å; D104-A108 WeakPolarHBondContact O-CB 3.36Å; D104-A108 PolarHBondContact O-N 2.82Å
105A92.5Very high91.9Very high16 Ų1652 Ų5213%0.13231%0.308CS..Hα-helixtrans-62.2-42.8175.200000111.6L92 I94 V101 A108 V109L92-A105 HydrophobicContact CD1-CB 4.23Å; I94-A105 HydrophobicContact CD1-CB 3.95Å; I94-A105 HydrophobicContact CG2-CB 3.9Å; V101-A105 WeakPolarHBondContact O-CB 3.34Å; V101-A105 PolarHBondContact O-N 2.84Å; A105-A108 PolarHBondContact O-N 3.03Å; A105-V109 WeakPolarHBondContact O-CG2 3Å; A105-V109 PolarHBondContact O-N 3.29Å; A105-V109 VanDerWaalsContact O-N 3.07Å
106F94.9Very high92.5Very high1 Ų153.1 Ų53.10%0.00432%0.32CS..Hα-helixtrans-59.2-46.6173.5171-107.1000112V102 T103 D104 A108 V109 A110 L126 V129 A130 L133 L149 C152 L153V102-F106 WeakPolarHBondContact O-CB 3.08Å; V102-F106 PolarHBondContact O-N 3.4Å; T103-F106 WeakPolarHBondContact O-CB 3.38Å; T103-F106 PolarHBondContact O-N 3.38Å; D104-F106 VanDerWaalsContact C-N 3.34Å; D104-F106 PolarHBondContact O-N 3.48Å; F106-A108 PolarHBondContact O-N 2.82Å; F106-V109 PolarHBondContact O-N 2.76Å; F106-A110 WeakPolarHBondContact O-CB 2.93Å; F106-A110 PolarHBondContact O-N 3.34Å; F106-L126 HydrophobicContact CE1-CD1 4.37Å; F106-L126 HydrophobicContact CE2-CD1 3.61Å; F106-L126 HydrophobicContact CE2-CG 4.3Å; F106-L126 HydrophobicContact CZ-CD1 3.42Å; F106-L126 VanDerWaalsContact CZ-CD1 3.42Å; F106-L126 HydrophobicContact CZ-CG 3.97Å; F106-V129 HydrophobicContact CD2-CG1 4.05Å; F106-V129 HydrophobicContact CE2-CG1 4.38Å; F106-A130 HydrophobicContact CD2-CB 4.36Å; F106-A130 HydrophobicContact CE2-CB 3.67Å; F106-A130 HydrophobicContact CZ-CB 4.12Å; F106-L133 HydrophobicContact CB-CD1 3.81Å; F106-L133 HydrophobicContact CD2-CD1 4.1Å; F106-L133 HydrophobicContact CG-CD1 4.4Å; F106-L149 HydrophobicContact CB-CD2 4.03Å; F106-L149 HydrophobicContact CG-CD2 4.14Å; F106-C152 HydrophobicContact CD1-CB 4.17Å; F106-C152 HydrophobicContact CE1-CB 4.35Å; F106-L153 HydrophobicContact CE1-CB 4.31Å; F106-L153 HydrophobicContact CZ-CB 4.18Å; F106-L153 HydrophobicContact CZ-CD1 4.03Å
107L95.8Very high93.2Very high66 Ų6654.7 Ų54.735%0.34634%0.337SS..Hα-helixtrans-65.2-37.1178.7-72.2174.3000112.8T103 D104 A110 G111 C152 F156T103-L107 WeakPolarHBondContact O-CG 3.19Å; T103-L107 PolarHBondContact O-N 2.9Å; D104-L107 PolarHBondContact O-N 3.47Å; L107-A110 PolarHBondContact O-N 3.5Å; L107-G111 PolarHBondContact O-N 3.11Å; L107-C152 VanDerWaalsContact CD2-SG 3.59Å; L107-C152 WeakPolarHBondContact CG-SG 3.16Å; L107-F156 HydrophobicContact CD2-CB 4.22Å; L107-F156 HydrophobicContact CD2-CD2 3.82Å; L107-F156 HydrophobicContact CD2-CG 4.46Å
108A94Very high93.9Very high53 Ų5350.8 Ų50.844%0.43832%0.32SS..Hα-helixtrans-61.7-48.7174.600000110.9D104 A105 F106 A110 G111 H112D104-A108 WeakPolarHBondContact O-CB 3.36Å; D104-A108 PolarHBondContact O-N 2.82Å; A105-A108 PolarHBondContact O-N 3.03Å; F106-A108 PolarHBondContact O-N 2.82Å; A108-A110 VanDerWaalsContact C-N 3.32Å; A108-A110 PolarHBondContact O-N 2.65Å; A108-G111 PolarHBondContact O-N 3.37Å; A108-H112 PolarHBondContact O-CD2 3.34Å; A108-H112 PolarHBondContact O-N 2.91Å
109V92.8Very high94.3Very high30 Ų3052.2 Ų52.218%0.18233%0.327CS..Hα-helixtrans-60.3-43.2175.4174.90000111.1L92 A105 F106 G111 H112 I113 V129L92-V109 HydrophobicContact CD1-CG2 3.93Å; L92-V109 HydrophobicContact CD2-CG2 3.67Å; L92-V109 HydrophobicContact CG-CG2 4.43Å; A105-V109 WeakPolarHBondContact O-CG2 3Å; A105-V109 PolarHBondContact O-N 3.29Å; A105-V109 VanDerWaalsContact O-N 3.07Å; F106-V109 PolarHBondContact O-N 2.76Å; V109-G111 PolarHBondContact O-N 3.34Å; V109-H112 PolarHBondContact O-N 3.14Å; V109-I113 HydrophobicContact CG1-CD1 3.86Å; V109-I113 HydrophobicContact CG1-CG1 4.37Å; V109-I113 WeakPolarHBondContact O-CG1 3.27Å; V109-I113 PolarHBondContact O-N 3.41Å; V109-V129 HydrophobicContact CB-CG1 4.48Å; V109-V129 HydrophobicContact CG1-CG1 3.94Å; V109-V129 HydrophobicContact CG1-CG2 4.19Å
110A95.5Very high94.4Very high0 Ų048.3 Ų48.30%031%0.308CS..Hα-helixtrans-58.9-48175.800000111.4F106 L107 A108 H112 I113 F114 L126 F156F106-A110 WeakPolarHBondContact O-CB 2.93Å; F106-A110 PolarHBondContact O-N 3.34Å; L107-A110 PolarHBondContact O-N 3.5Å; A108-A110 VanDerWaalsContact C-N 3.32Å; A108-A110 PolarHBondContact O-N 2.65Å; A110-H112 VanDerWaalsContact C-N 3.29Å; A110-H112 PolarHBondContact O-N 2.86Å; A110-I113 PolarHBondContact O-N 3.4Å; A110-I113 VanDerWaalsContact O-N 3.17Å; A110-F114 WeakPolarHBondContact O-CD2 3.34Å; A110-F114 PolarHBondContact O-N 2.83Å; A110-L126 HydrophobicContact CB-CD1 3.44Å; A110-L126 VanDerWaalsContact CB-CD1 3.44Å; A110-F156 HydrophobicContact CB-CD1 4.49Å; A110-F156 HydrophobicContact CB-CD2 3.87Å; A110-F156 HydrophobicContact CB-CE1 4.22Å; A110-F156 HydrophobicContact CB-CE2 3.54Å; A110-F156 HydrophobicContact CB-CG 4.33Å; A110-F156 HydrophobicContact CB-CZ 3.74Å
111G94.7Very high94.5Very high39 Ų3946.4 Ų46.440%0.40230%0.302SS..Hα-helixtrans-54.4-44.5175.400000112.5L107 A108 V109 F114 S115L107-G111 PolarHBondContact O-N 3.11Å; A108-G111 PolarHBondContact O-N 3.37Å; V109-G111 PolarHBondContact O-N 3.34Å; G111-F114 PolarHBondContact O-N 3.49Å; G111-S115 PolarHBondContact O-N 3.16Å
112H93.7Very high94.6Very high145 Ų14545.9 Ų45.967%0.67130%0.295SS*.Hα-helixtrans-64.2-45.2176.1-75.8-65.7000113A108 V109 A110 F114 S115A108-H112 PolarHBondContact O-CD2 3.34Å; A108-H112 PolarHBondContact O-N 2.91Å; V109-H112 PolarHBondContact O-N 3.14Å; A110-H112 VanDerWaalsContact C-N 3.29Å; A110-H112 PolarHBondContact O-N 2.86Å; H112-F114 VanDerWaalsContact C-N 3.28Å; H112-F114 PolarHBondContact O-N 3.02Å; H112-S115 WeakPolarHBondContact O-CB 3.44Å; H112-S115 PolarHBondContact O-N 3.45Å; H112-S115 PolarHBondContact O-OG 2.89Å
113I93.5Very high94.8Very high37 Ų3745.8 Ų45.819%0.1929%0.294CS..Hα-helixtrans-56-44.1177.9-71.9169.1000110.8V109 A110 K122 V129V109-I113 HydrophobicContact CG1-CD1 3.86Å; V109-I113 HydrophobicContact CG1-CG1 4.37Å; V109-I113 WeakPolarHBondContact O-CG1 3.27Å; V109-I113 PolarHBondContact O-N 3.41Å; A110-I113 PolarHBondContact O-N 3.4Å; A110-I113 VanDerWaalsContact O-N 3.17Å; I113-K122 HydrophobicContact CG2-CB 3.63Å; I113-K122 HydrophobicContact CG2-CD 4.34Å; I113-K122 HydrophobicContact CG2-CG 3.87Å; I113-K122 VanDerWaalsContact O-CD 3.25Å; I113-K122 WeakPolarHBondContact O-CD 3.49Å; I113-K122 WeakPolarHBondContact O-CE 3.44Å; I113-K122 PolarHBondContact O-NZ 3.28Å; I113-V129 HydrophobicContact CD1-CG2 4.33Å
114F95.7Very high94.9Very high16 Ų1644.8 Ų44.87%0.0729%0.288CS..Hα-helixtrans-94.7-0.4-173.5-65.6-75.9000115A110 G111 H112 A116 G117 I118 K122 V123 L126 F156 L161A110-F114 WeakPolarHBondContact O-CD2 3.34Å; A110-F114 PolarHBondContact O-N 2.83Å; G111-F114 PolarHBondContact O-N 3.49Å; H112-F114 VanDerWaalsContact C-N 3.28Å; H112-F114 PolarHBondContact O-N 3.02Å; F114-A116 VanDerWaalsContact C-N 3.27Å; F114-A116 PolarHBondContact O-N 3.22Å; F114-A116 VanDerWaalsContact O-N 3.17Å; F114-G117 PolarHBondContact O-N 3.3Å; F114-I118 HydrophobicContact CD1-CB 4.31Å; F114-I118 HydrophobicContact CD1-CG1 3.92Å; F114-I118 HydrophobicContact CD1-CG2 4.26Å; F114-I118 HydrophobicContact CE1-CG2 4.06Å; F114-K122 HydrophobicContact CD1-CB 4.11Å; F114-K122 HydrophobicContact CD1-CD 4.35Å; F114-K122 HydrophobicContact CE1-CB 3.59Å; F114-K122 HydrophobicContact CZ-CB 4.06Å; F114-K122 WeakPolarHBondContact CZ-O 3.47Å; F114-V123 HydrophobicContact CE1-CG2 4.19Å; F114-V123 HydrophobicContact CZ-CG2 4.3Å; F114-L126 HydrophobicContact CE2-CB 4.04Å; F114-L126 HydrophobicContact CE2-CD1 4.24Å; F114-L126 HydrophobicContact CE2-CD2 3.94Å; F114-L126 HydrophobicContact CE2-CG 4.3Å; F114-L126 HydrophobicContact CZ-CB 4.21Å; F114-L126 HydrophobicContact CZ-CD2 4.29Å; F114-F156 AromaticContact CD2-CE1 3.47Å; F114-F156 HydrophobicContact CD2-CE1 3.47Å; F114-F156 VanDerWaalsContact CD2-CE1 3.47Å; F114-F156 AromaticContact CD2-CZ 3.5Å; F114-F156 HydrophobicContact CD2-CZ 3.5Å; F114-F156 AromaticContact CE2-CE1 3.58Å; F114-F156 HydrophobicContact CE2-CE1 3.58Å; F114-F156 HydrophobicContact CE2-CZ 4.08Å; F114-F156 HydrophobicContact CG-CE1 4.31Å; F114-F156 HydrophobicContact CG-CZ 4.26Å; F114-F156 HydrophobicContact CZ-CE1 4.46Å; F114-L161 HydrophobicContact CD1-CD2 4.08Å; F114-L161 HydrophobicContact CE1-CD2 3.79Å; F114-L161 HydrophobicContact CZ-CD1 4.19Å; F114-L161 HydrophobicContact CZ-CD2 4.14Å
115S94.9Very high95Very high97 Ų9740.7 Ų40.768%0.67827%0.267SS*.THydrogen-bonded Turntrans-50.2-41.6-179.357.70000114.3G111 H112G111-S115 PolarHBondContact O-N 3.16Å; H112-S115 WeakPolarHBondContact O-CB 3.44Å; H112-S115 PolarHBondContact O-N 3.45Å; H112-S115 PolarHBondContact O-OG 2.89Å
116A94.2Very high95.2Very high90 Ų9040 Ų4074%0.74426%0.261SS*.THydrogen-bonded Turntrans-98.823.717900000114F114F114-A116 VanDerWaalsContact C-N 3.27Å; F114-A116 PolarHBondContact O-N 3.22Å; F114-A116 VanDerWaalsContact O-N 3.17Å
117G95.2Very high95.3Very high34 Ų3440 Ų4035%0.35126%0.261SS..  trans103.1178.2177.300000115.1F114 K122F114-G117 PolarHBondContact O-N 3.3Å; G117-K122 WeakPolarHBondContact O-CD 3.38Å; G117-K122 WeakPolarHBondContact O-CE 3.31Å; G117-K122 PolarHBondContact O-NZ 3.07Å
118I97.1Very high95.3Very high42 Ų4237 Ų3722%0.21525%0.247CC..  trans-111.3128.7-166.6-54.2164.2000111.3F114 V123 L161 W164F114-I118 HydrophobicContact CD1-CB 4.31Å; F114-I118 HydrophobicContact CD1-CG1 3.92Å; F114-I118 HydrophobicContact CD1-CG2 4.26Å; F114-I118 HydrophobicContact CE1-CG2 4.06Å; I118-V123 HydrophobicContact CG2-CG2 4.31Å; I118-L161 HydrophobicContact CD1-CD2 3.81Å; I118-L161 HydrophobicContact CG1-CD2 3.95Å; I118-L161 HydrophobicContact CG2-CD2 3.71Å; I118-W164 HydrophobicContact CB-CD2 4.15Å; I118-W164 HydrophobicContact CB-CG 4.02Å; I118-W164 HydrophobicContact CD1-CB 3.73Å; I118-W164 HydrophobicContact CD1-CG 3.93Å; I118-W164 HydrophobicContact CG2-CB 4.46Å; I118-W164 HydrophobicContact CG2-CD2 3.4Å; I118-W164 VanDerWaalsContact CG2-CD2 3.4Å; I118-W164 VanDerWaalsContact CG2-CE2 3.5Å; I118-W164 HydrophobicContact CG2-CE3 3.76Å; I118-W164 HydrophobicContact CG2-CG 3.73Å; I118-W164 HydrophobicContact CG2-CH2 4.28Å; I118-W164 HydrophobicContact CG2-CZ2 3.96Å; I118-W164 HydrophobicContact CG2-CZ3 4.19Å; I118-W164 PolarHBondContact O-NE1 2.99Å
119T95.9Very high95.3Very high72 Ų7234.7 Ų34.744%0.44223%0.227SC..  trans-138.9157.717366.20000110G121 K122 V123T119-G121 VanDerWaalsContact C-N 3.26Å; T119-G121 PolarHBondContact O-N 3.45Å; T119-K122 WeakPolarHBondContact O-CB 3.33Å; T119-K122 PolarHBondContact O-N 2.87Å; T119-K122 WeakPolarHBondContact OG1-CG 3.38Å; T119-K122 PolarHBondContact OG1-N 3.43Å; T119-V123 PolarHBondContact O-N 2.91Å
120W95.9Very high95.4Very high19 Ų1933.4 Ų33.47%0.07222%0.219CC..Hα-helixtrans-57.5-38.8175.9-82.1120000112.8K122 V123 V124 W164 L165 W171 D173 V174 C177W120-K122 VanDerWaalsContact C-N 3.29Å; W120-K122 PolarHBondContact O-N 3.45Å; W120-V123 HydrophobicContact CE3-CB 4.02Å; W120-V123 HydrophobicContact CE3-CG1 4.11Å; W120-V123 HydrophobicContact CE3-CG2 4.36Å; W120-V123 HydrophobicContact CZ3-CB 4.35Å; W120-V123 HydrophobicContact CZ3-CG1 3.96Å; W120-V123 PolarHBondContact O-N 3.45Å; W120-V123 VanDerWaalsContact O-N 3.13Å; W120-V124 WeakPolarHBondContact O-CG2 3.48Å; W120-V124 PolarHBondContact O-N 3.41Å; W120-W164 AromaticContact CD1-CH2 3.95Å; W120-W164 AromaticContact CD2-CH2 3.73Å; W120-W164 HydrophobicContact CD2-CH2 3.73Å; W120-W164 HydrophobicContact CD2-CZ3 4.19Å; W120-W164 AromaticContact CE2-CH2 3.6Å; W120-W164 AromaticContact CE2-CZ3 3.95Å; W120-W164 HydrophobicContact CE3-CH2 4.31Å; W120-W164 HydrophobicContact CE3-CZ3 4.4Å; W120-W164 AromaticContact CG-CH2 3.94Å; W120-W164 HydrophobicContact CG-CH2 3.94Å; W120-W164 HydrophobicContact CH2-CZ3 4.14Å; W120-W164 HydrophobicContact CZ2-CH2 4.05Å; W120-W164 AromaticContact CZ2-CZ3 3.92Å; W120-W164 HydrophobicContact CZ2-CZ3 3.92Å; W120-W164 HydrophobicContact CZ3-CZ3 4.38Å; W120-W164 AromaticContact NE1-CH2 3.75Å; W120-L165 HydrophobicContact CH2-CD2 3.54Å; W120-L165 HydrophobicContact CZ2-CD2 4.17Å; W120-L165 HydrophobicContact CZ3-CD2 4.24Å; W120-W171 AromaticContact CH2-CE3 3.97Å; W120-W171 HydrophobicContact CH2-CE3 3.97Å; W120-W171 HydrophobicContact CH2-CZ3 4.37Å; W120-W171 AromaticContact CZ3-CE3 3.89Å; W120-W171 HydrophobicContact CZ3-CE3 3.89Å; W120-W171 AromaticContact CZ3-CZ3 3.91Å; W120-W171 HydrophobicContact CZ3-CZ3 3.91Å; W120-D173 HydrophobicContact CZ2-CB 3.94Å; W120-D173 PolarHBondContact NE1-OD2 3.1Å; W120-V174 HydrophobicContact CB-CG2 4.38Å; W120-V174 HydrophobicContact CD2-CB 3.69Å; W120-V174 HydrophobicContact CD2-CG2 3.64Å; W120-V174 HydrophobicContact CE3-CB 3.62Å; W120-V174 HydrophobicContact CE3-CG2 3.47Å; W120-V174 VanDerWaalsContact CE3-CG2 3.47Å; W120-V174 HydrophobicContact CG-CB 4.41Å; W120-V174 HydrophobicContact CG-CG2 4.06Å; W120-V174 HydrophobicContact CH2-CB 3.89Å; W120-V174 HydrophobicContact CZ2-CB 3.94Å; W120-V174 HydrophobicContact CZ3-CB 3.72Å; W120-V174 HydrophobicContact CZ3-CG2 4.01Å; W120-C177 VanDerWaalsContact CG-SG 3.59Å
121G94.1Very high95.4Very high36 Ų3633.4 Ų33.437%0.37122%0.219SC..Hα-helixtrans-56.7-41.6174.100000112.8T119 V124 S125T119-G121 VanDerWaalsContact C-N 3.26Å; T119-G121 PolarHBondContact O-N 3.45Å; G121-V124 PolarHBondContact O-N 3.36Å; G121-S125 PolarHBondContact O-N 2.93Å; G121-S125 PolarHBondContact O-OG 2.89Å
122K95.1Very high95.3Very high47 Ų4731.9 Ų31.920%0.20420%0.203CC..Hα-helixtrans-70-36.4175.8-70.8176.9175.2-156.70113I113 F114 G117 T119 W120 S125 L126I113-K122 HydrophobicContact CG2-CB 3.63Å; I113-K122 HydrophobicContact CG2-CD 4.34Å; I113-K122 HydrophobicContact CG2-CG 3.87Å; I113-K122 VanDerWaalsContact O-CD 3.25Å; I113-K122 WeakPolarHBondContact O-CD 3.49Å; I113-K122 WeakPolarHBondContact O-CE 3.44Å; I113-K122 PolarHBondContact O-NZ 3.28Å; F114-K122 HydrophobicContact CD1-CB 4.11Å; F114-K122 HydrophobicContact CD1-CD 4.35Å; F114-K122 HydrophobicContact CE1-CB 3.59Å; F114-K122 HydrophobicContact CZ-CB 4.06Å; F114-K122 WeakPolarHBondContact CZ-O 3.47Å; G117-K122 WeakPolarHBondContact O-CD 3.38Å; G117-K122 WeakPolarHBondContact O-CE 3.31Å; G117-K122 PolarHBondContact O-NZ 3.07Å; T119-K122 WeakPolarHBondContact O-CB 3.33Å; T119-K122 PolarHBondContact O-N 2.87Å; T119-K122 WeakPolarHBondContact OG1-CG 3.38Å; T119-K122 PolarHBondContact OG1-N 3.43Å; W120-K122 VanDerWaalsContact C-N 3.29Å; W120-K122 PolarHBondContact O-N 3.45Å; K122-S125 WeakPolarHBondContact O-CB 3.18Å; K122-S125 PolarHBondContact O-N 3.46Å; K122-L126 PolarHBondContact O-N 3.49Å
123V97.8Very high95.2Very high0 Ų025 Ų250%017%0.171CC..Hα-helixtrans-61.8-46.6172.6177.30000110F114 I118 T119 W120 S125 L126 Y127 L161 W164 W171F114-V123 HydrophobicContact CE1-CG2 4.19Å; F114-V123 HydrophobicContact CZ-CG2 4.3Å; I118-V123 HydrophobicContact CG2-CG2 4.31Å; T119-V123 PolarHBondContact O-N 2.91Å; W120-V123 HydrophobicContact CE3-CB 4.02Å; W120-V123 HydrophobicContact CE3-CG1 4.11Å; W120-V123 HydrophobicContact CE3-CG2 4.36Å; W120-V123 HydrophobicContact CZ3-CB 4.35Å; W120-V123 HydrophobicContact CZ3-CG1 3.96Å; W120-V123 PolarHBondContact O-N 3.45Å; W120-V123 VanDerWaalsContact O-N 3.13Å; V123-S125 VanDerWaalsContact C-N 3.32Å; V123-S125 PolarHBondContact O-N 3.06Å; V123-L126 WeakPolarHBondContact O-CB 3.18Å; V123-L126 PolarHBondContact O-N 3.46Å; V123-L126 VanDerWaalsContact O-N 3.16Å; V123-Y127 HydrophobicContact CG1-CD2 4.26Å; V123-Y127 HydrophobicContact CG1-CE2 4.06Å; V123-Y127 VanDerWaalsContact O-CD2 3.29Å; V123-Y127 WeakPolarHBondContact O-CD2 3.38Å; V123-Y127 PolarHBondContact O-N 2.92Å; V123-L161 HydrophobicContact CG2-CD1 4.27Å; V123-W164 HydrophobicContact CG2-CZ3 4.17Å; V123-W171 HydrophobicContact CG1-CH2 4.03Å; V123-W171 HydrophobicContact CG1-CZ3 3.81Å
124V96.3Very high95.2Very high0 Ų023.2 Ų23.20%016%0.162CC..Hα-helixtrans-60.5-42.5174.9178.90000111.1L70 L73 G74 L77 W120 G121 L126 Y127 A128L70-V124 HydrophobicContact CD2-CG2 3.69Å; L73-V124 HydrophobicContact CB-CB 4.41Å; L73-V124 HydrophobicContact CB-CG1 3.81Å; L73-V124 HydrophobicContact CB-CG2 3.86Å; L73-V124 HydrophobicContact CD1-CG2 3.88Å; G74-V124 VanDerWaalsContact N-CG1 3.34Å; L77-V124 HydrophobicContact CD1-CB 3.93Å; L77-V124 HydrophobicContact CD1-CG1 3.64Å; W120-V124 WeakPolarHBondContact O-CG2 3.48Å; W120-V124 PolarHBondContact O-N 3.41Å; G121-V124 PolarHBondContact O-N 3.36Å; V124-L126 VanDerWaalsContact C-N 3.28Å; V124-L126 PolarHBondContact O-N 2.95Å; V124-Y127 PolarHBondContact O-N 3.45Å; V124-A128 PolarHBondContact O-N 2.87Å
125S95.1Very high95.1Very high14 Ų1422.9 Ų22.910%0.09816%0.162CC..Hα-helixtrans-55.7-42174.7-61.30000112.6Y85 G121 K122 V123 Y127 A128 V129Y85-S125 WeakPolarHBondContact OH-CB 3.11Å; Y85-S125 PolarHBondContact OH-OG 3.48Å; G121-S125 PolarHBondContact O-N 2.93Å; G121-S125 PolarHBondContact O-OG 2.89Å; K122-S125 WeakPolarHBondContact O-CB 3.18Å; K122-S125 PolarHBondContact O-N 3.46Å; V123-S125 VanDerWaalsContact C-N 3.32Å; V123-S125 PolarHBondContact O-N 3.06Å; S125-Y127 PolarHBondContact O-N 2.9Å; S125-A128 PolarHBondContact O-N 3.46Å; S125-V129 VanDerWaalsContact O-CG2 3.29Å; S125-V129 WeakPolarHBondContact O-CG2 3.4Å; S125-V129 PolarHBondContact O-N 3.27Å
126L96.9Very high95Very high1 Ų119 Ų191%0.00513%0.133CC..Hα-helixtrans-60-45.6177.8-176.968000111.9F106 A110 F114 K122 V123 V124 V129 A130 L153 F156 L161F106-L126 HydrophobicContact CE1-CD1 4.37Å; F106-L126 HydrophobicContact CE2-CD1 3.61Å; F106-L126 HydrophobicContact CE2-CG 4.3Å; F106-L126 HydrophobicContact CZ-CD1 3.42Å; F106-L126 VanDerWaalsContact CZ-CD1 3.42Å; F106-L126 HydrophobicContact CZ-CG 3.97Å; A110-L126 HydrophobicContact CB-CD1 3.44Å; A110-L126 VanDerWaalsContact CB-CD1 3.44Å; F114-L126 HydrophobicContact CE2-CB 4.04Å; F114-L126 HydrophobicContact CE2-CD1 4.24Å; F114-L126 HydrophobicContact CE2-CD2 3.94Å; F114-L126 HydrophobicContact CE2-CG 4.3Å; F114-L126 HydrophobicContact CZ-CB 4.21Å; F114-L126 HydrophobicContact CZ-CD2 4.29Å; K122-L126 PolarHBondContact O-N 3.49Å; V123-L126 WeakPolarHBondContact O-CB 3.18Å; V123-L126 PolarHBondContact O-N 3.46Å; V123-L126 VanDerWaalsContact O-N 3.16Å; V124-L126 VanDerWaalsContact C-N 3.28Å; V124-L126 PolarHBondContact O-N 2.95Å; L126-V129 PolarHBondContact O-N 3.48Å; L126-A130 PolarHBondContact O-N 3.46Å; L126-L153 HydrophobicContact CD2-CD1 3.48Å; L126-L153 VanDerWaalsContact CD2-CD1 3.48Å; L126-L153 HydrophobicContact CG-CD1 3.65Å; L126-F156 HydrophobicContact CD2-CD1 3.67Å; L126-F156 HydrophobicContact CD2-CE1 4.05Å; L126-L161 HydrophobicContact CD2-CD1 4.12Å
127Y97.4Very high94.9Very high1 Ų114.7 Ų14.70%0.00410%0.098CC..Hα-helixtrans-65.5-41.3177.1-81.5-108.8000111.8A31 L34 Y38 L70 V123 V124 S125 A130 A131 L153 W171A31-Y127 WeakPolarHBondContact CA-OH 3.39Å; A31-Y127 PolarHBondContact O-OH 3.35Å; A31-Y127 VanDerWaalsContact O-OH 3.06Å; L34-Y127 HydrophobicContact CB-CE1 3.87Å; Y38-Y127 HydrophobicContact CD2-CD1 4.4Å; Y38-Y127 HydrophobicContact CG-CD1 4.26Å; L70-Y127 HydrophobicContact CD1-CD1 4.44Å; L70-Y127 HydrophobicContact CD1-CE1 4.37Å; V123-Y127 HydrophobicContact CG1-CD2 4.26Å; V123-Y127 HydrophobicContact CG1-CE2 4.06Å; V123-Y127 VanDerWaalsContact O-CD2 3.29Å; V123-Y127 WeakPolarHBondContact O-CD2 3.38Å; V123-Y127 PolarHBondContact O-N 2.92Å; V124-Y127 PolarHBondContact O-N 3.45Å; S125-Y127 PolarHBondContact O-N 2.9Å; Y127-A130 PolarHBondContact O-N 3.45Å; Y127-A131 WeakPolarHBondContact O-CB 3.39Å; Y127-A131 PolarHBondContact O-N 2.9Å; Y127-L153 HydrophobicContact CD1-CD2 4.1Å; Y127-L153 HydrophobicContact CD2-CD1 4.28Å; Y127-L153 HydrophobicContact CE1-CD2 3.79Å; Y127-L153 HydrophobicContact CE2-CD1 4.08Å; Y127-L153 HydrophobicContact CE2-CD2 4.32Å; Y127-L153 HydrophobicContact CG-CD2 4.48Å; Y127-W171 AromaticContact CE2-CH2 3.72Å; Y127-W171 HydrophobicContact CE2-CH2 3.72Å; Y127-W171 HydrophobicContact CE2-CZ3 4.02Å; Y127-W171 AromaticContact CZ-CH2 3.74Å; Y127-W171 WeakPolarHBondContact OH-CH2 3.22Å
128A95.1Very high94.8Very high5 Ų514.2 Ų14.24%0.0419%0.088CC..Hα-helixtrans-62.7-41.5176.500000112.1Y85 V124 S125 A131 G132Y85-A128 HydrophobicContact CD1-CB 3.6Å; Y85-A128 HydrophobicContact CE1-CB 3.91Å; Y85-A128 HydrophobicContact CG-CB 4.41Å; V124-A128 PolarHBondContact O-N 2.87Å; S125-A128 PolarHBondContact O-N 3.46Å; A128-A131 PolarHBondContact O-N 2.78Å; A128-G132 PolarHBondContact O-N 2.85Å
129V93.7Very high94.5Very high4 Ų418.9 Ų18.92%0.02410%0.103CC..Hα-helixtrans-64.8-47.5175.4169.70000111.1Y85 V88 F106 V109 I113 S125 L126 A131 G132 L133Y85-V129 HydrophobicContact CD1-CG2 4.27Å; Y85-V129 HydrophobicContact CE1-CG2 4.36Å; V88-V129 HydrophobicContact CG1-CG1 4.21Å; F106-V129 HydrophobicContact CD2-CG1 4.05Å; F106-V129 HydrophobicContact CE2-CG1 4.38Å; V109-V129 HydrophobicContact CB-CG1 4.48Å; V109-V129 HydrophobicContact CG1-CG1 3.94Å; V109-V129 HydrophobicContact CG1-CG2 4.19Å; I113-V129 HydrophobicContact CD1-CG2 4.33Å; S125-V129 VanDerWaalsContact O-CG2 3.29Å; S125-V129 WeakPolarHBondContact O-CG2 3.4Å; S125-V129 PolarHBondContact O-N 3.27Å; L126-V129 PolarHBondContact O-N 3.48Å; V129-A131 VanDerWaalsContact C-N 3.29Å; V129-A131 PolarHBondContact O-N 3.29Å; V129-G132 PolarHBondContact O-N 2.99Å; V129-L133 HydrophobicContact CG1-CD1 4.28Å; V129-L133 PolarHBondContact O-N 2.95Å
130A95.5Very high94.3Very high3 Ų319.9 Ų19.93%0.02510%0.103CC..Hα-helixtrans-57.4-43.6176.900000111.5F106 L126 Y127 L133 A134F106-A130 HydrophobicContact CD2-CB 4.36Å; F106-A130 HydrophobicContact CE2-CB 3.67Å; F106-A130 HydrophobicContact CZ-CB 4.12Å; L126-A130 PolarHBondContact O-N 3.46Å; Y127-A130 PolarHBondContact O-N 3.45Å; A130-L133 PolarHBondContact O-N 3.25Å; A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.47Å
131A94.6Very high94Very high0 Ų022.8 Ų22.80%013%0.131CC..Hα-helixtrans-70.1-36.9177.700000113.4Y38 V39 R42 Y127 A128 V129 A134 V135Y38-A131 HydrophobicContact CD1-CB 3.69Å; Y38-A131 HydrophobicContact CE1-CB 3.72Å; V39-A131 HydrophobicContact CG2-CB 4.07Å; R42-A131 HydrophobicContact CB-CB 4.03Å; R42-A131 HydrophobicContact CG-CB 3.84Å; Y127-A131 WeakPolarHBondContact O-CB 3.39Å; Y127-A131 PolarHBondContact O-N 2.9Å; A128-A131 PolarHBondContact O-N 2.78Å; V129-A131 VanDerWaalsContact C-N 3.29Å; V129-A131 PolarHBondContact O-N 3.29Å; A131-A134 PolarHBondContact O-N 2.92Å; A131-V135 VanDerWaalsContact O-CG2 3.25Å; A131-V135 WeakPolarHBondContact O-CG2 3.5Å; A131-V135 PolarHBondContact O-N 3.15Å
132G92.6Very high93.9Very high6 Ų623.7 Ų23.76%0.06213%0.125CC..Hα-helixtrans-59.9-47.1172.800000111.8A128 V129 V135 D136A128-G132 PolarHBondContact O-N 2.85Å; V129-G132 PolarHBondContact O-N 2.99Å; G132-V135 PolarHBondContact O-N 3.43Å; G132-D136 PolarHBondContact O-N 2.9Å
133L93Very high93.7Very high0 Ų024.4 Ų24.40%013%0.134CC..Hα-helixtrans-62.6-43.3174.3-71.8173.2000111.8V88 A89 L92 I94 F106 V129 A130 V135 D136 C137 L149V88-L133 HydrophobicContact CB-CD2 3.98Å; V88-L133 HydrophobicContact CB-CG 4.2Å; V88-L133 HydrophobicContact CG1-CD1 4.5Å; V88-L133 HydrophobicContact CG1-CD2 3.7Å; V88-L133 HydrophobicContact CG1-CG 3.85Å; A89-L133 HydrophobicContact CB-CD2 4.37Å; L92-L133 HydrophobicContact CD1-CD2 4.42Å; I94-L133 HydrophobicContact CD1-CD2 3.98Å; F106-L133 HydrophobicContact CB-CD1 3.81Å; F106-L133 HydrophobicContact CD2-CD1 4.1Å; F106-L133 HydrophobicContact CG-CD1 4.4Å; V129-L133 HydrophobicContact CG1-CD1 4.28Å; V129-L133 PolarHBondContact O-N 2.95Å; A130-L133 PolarHBondContact O-N 3.25Å; L133-V135 VanDerWaalsContact C-N 3.34Å; L133-V135 PolarHBondContact O-N 3.48Å; L133-D136 PolarHBondContact O-N 2.75Å; L133-C137 PolarHBondContact O-N 3.49Å; L133-C137 PolarHBondContact O-SG 2.99Å; L133-L149 HydrophobicContact CB-CD1 3.79Å; L133-L149 HydrophobicContact CB-CD2 4.28Å; L133-L149 HydrophobicContact CD1-CD2 4.09Å
134A93.9Very high93.4Very high0 Ų027.5 Ų27.50%016%0.16CC..Hα-helixtrans-60.6-42.2177.300000112.4V39 A130 A131 C137 V138 V146 L149V39-A134 HydrophobicContact CG1-CB 3.49Å; V39-A134 VanDerWaalsContact CG1-CB 3.49Å; V39-A134 HydrophobicContact CG2-CB 4.33Å; A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.47Å; A131-A134 PolarHBondContact O-N 2.92Å; A134-C137 PolarHBondContact O-N 3.23Å; A134-V138 WeakPolarHBondContact O-CG2 3.49Å; A134-V138 PolarHBondContact O-N 2.74Å; A134-V146 HydrophobicContact CB-CG1 4.23Å; A134-V146 HydrophobicContact CB-CG2 4.03Å; A134-L149 HydrophobicContact CB-CD1 4.07Å
135V93.4Very high93.2Very high10 Ų1028.1 Ų28.16%0.06116%0.163CC..Hα-helixtrans-60.8-44.9174168.60000110.9R42 L43 A46 L48 A131 G132 L133 V138 R139R42-V135 HydrophobicContact CB-CG2 4.45Å; L43-V135 HydrophobicContact CD2-CB 4.35Å; L43-V135 HydrophobicContact CD2-CG2 3.82Å; L43-V135 HydrophobicContact CG-CG2 4.29Å; A46-V135 HydrophobicContact CB-CG1 4.2Å; L48-V135 HydrophobicContact CD1-CG1 4.02Å; A131-V135 VanDerWaalsContact O-CG2 3.25Å; A131-V135 WeakPolarHBondContact O-CG2 3.5Å; A131-V135 PolarHBondContact O-N 3.15Å; G132-V135 PolarHBondContact O-N 3.43Å; L133-V135 VanDerWaalsContact C-N 3.34Å; L133-V135 PolarHBondContact O-N 3.48Å; V135-V138 PolarHBondContact O-N 3.06Å; V135-R139 VanDerWaalsContact O-CG 3.31Å; V135-R139 WeakPolarHBondContact O-CG 3.34Å; V135-R139 PolarHBondContact O-N 2.78Å
136D91.9Very high93.1Very high15 Ų1527.4 Ų27.48%0.0816%0.159CC..Hα-helixtrans-64.1-40.3178.1-68.9-20.3000111.5V88 A89 L96 G132 L133 R139 Q140V88-D136 PolarHBondContact N-OD2 3.19Å; A89-D136 HydrophobicContact CB-CB 3.95Å; A89-D136 WeakPolarHBondContact CB-OD2 3.31Å; A89-D136 PolarHBondContact N-OD2 2.94Å; L96-D136 HydrophobicContact CD1-CB 3.77Å; G132-D136 PolarHBondContact O-N 2.9Å; L133-D136 PolarHBondContact O-N 2.75Å; D136-R139 PolarHBondContact O-N 2.94Å; D136-R139 IonicContact OD1-NH1 2.78Å; D136-Q140 WeakPolarHBondContact O-CG 3.46Å; D136-Q140 PolarHBondContact O-N 2.81Å
137C92.4Very high92.9Very high0 Ų030.1 Ų30.10%017%0.171CC..Hα-helixtrans-63.7-46.2175.6-68.80000112.5L133 A134 R139 Q140 A141 Q142 M145L133-C137 PolarHBondContact O-N 3.49Å; L133-C137 PolarHBondContact O-SG 2.99Å; A134-C137 PolarHBondContact O-N 3.23Å; C137-R139 VanDerWaalsContact C-N 3.32Å; C137-R139 PolarHBondContact O-N 3.36Å; C137-Q140 CarbonylContact O-C 3.22Å; C137-Q140 PolarHBondContact O-N 2.98Å; C137-Q140 VanDerWaalsContact O-N 3.11Å; C137-A141 PolarHBondContact O-N 3.43Å; C137-Q142 HydrophobicContact CB-CB 4.41Å; C137-Q142 WeakPolarHBondContact O-CA 3.24Å; C137-Q142 PolarHBondContact O-N 2.88Å; C137-M145 HydrophobicContact CB-CB 3.83Å; C137-M145 HydrophobicContact CB-CG 4.32Å
138V92.9Very high92.8Very high23 Ų2330.6 Ų30.614%0.13918%0.175CC..Hα-helixtrans-64.1-38.8179.1173.10000111L43 L48 A134 V135 Q140 A141 P143 V146L43-V138 HydrophobicContact CD1-CG2 4.27Å; L43-V138 HydrophobicContact CD2-CB 3.87Å; L43-V138 HydrophobicContact CD2-CG1 4.21Å; L43-V138 HydrophobicContact CD2-CG2 3.75Å; L48-V138 HydrophobicContact CB-CG1 4.11Å; L48-V138 HydrophobicContact CD1-CB 4.34Å; L48-V138 HydrophobicContact CD1-CG1 4.11Å; L48-V138 HydrophobicContact CD2-CG1 4.4Å; L48-V138 HydrophobicContact CG-CG1 4.44Å; A134-V138 WeakPolarHBondContact O-CG2 3.49Å; A134-V138 PolarHBondContact O-N 2.74Å; V135-V138 PolarHBondContact O-N 3.06Å; V138-Q140 PolarHBondContact O-N 3.39Å; V138-A141 PolarHBondContact O-N 3.24Å; V138-A141 VanDerWaalsContact O-N 3.07Å; V138-P143 HydrophobicContact CG2-CB 4.32Å; V138-V146 HydrophobicContact CG2-CG2 3.66Å
139R91.5Very high92.8Very high141 Ų14130.4 Ų30.453%0.53217%0.174SC..Hα-helixtrans-61.7-30.2174.3-75.2173.1173.7165.8-3.3113.3L48 V135 D136 C137 A141L48-R139 HydrophobicContact CD1-CG 3.78Å; L48-R139 HydrophobicContact CD2-CG 4.37Å; V135-R139 VanDerWaalsContact O-CG 3.31Å; V135-R139 WeakPolarHBondContact O-CG 3.34Å; V135-R139 PolarHBondContact O-N 2.78Å; D136-R139 PolarHBondContact O-N 2.94Å; D136-R139 IonicContact OD1-NH1 2.78Å; C137-R139 VanDerWaalsContact C-N 3.32Å; C137-R139 PolarHBondContact O-N 3.36Å; R139-A141 VanDerWaalsContact C-N 3.27Å
140Q90.9Very high93Very high93 Ų9330.4 Ų30.444%0.43517%0.174SC..THydrogen-bonded Turntrans-91.418.5176.8-65.1-173.832.100113L96 D136 C137 V138 Q142L96-Q140 HydrophobicContact CD1-CG 4.33Å; L96-Q140 VanDerWaalsContact CD1-NE2 3.25Å; D136-Q140 WeakPolarHBondContact O-CG 3.46Å; D136-Q140 PolarHBondContact O-N 2.81Å; C137-Q140 CarbonylContact O-C 3.22Å; C137-Q140 PolarHBondContact O-N 2.98Å; C137-Q140 VanDerWaalsContact O-N 3.11Å; V138-Q140 PolarHBondContact O-N 3.39Å; Q140-Q142 PolarHBondContact O-N 3.5Å
141A90.1Very high93Very high80 Ų8033.6 Ų33.666%0.66119%0.19SC*.THydrogen-bonded Turntrans58.231.3-178.700000114C137 V138 R139 P143C137-A141 PolarHBondContact O-N 3.43Å; V138-A141 PolarHBondContact O-N 3.24Å; V138-A141 VanDerWaalsContact O-N 3.07Å; R139-A141 VanDerWaalsContact C-N 3.27Å; A141-P143 WeakPolarHBondContact O-CD 3.45Å
142Q91.6Very high93.1Very high54 Ų5434.3 Ų34.325%0.25220%0.195SC..  trans-115.156.1176.4-65.3-67.7-10.800112.1C137 Q140 A144 M145C137-Q142 HydrophobicContact CB-CB 4.41Å; C137-Q142 WeakPolarHBondContact O-CA 3.24Å; C137-Q142 PolarHBondContact O-N 2.88Å; Q140-Q142 PolarHBondContact O-N 3.5Å; Q142-A144 PolarHBondContact O-N 2.97Å; Q142-M145 HydrophobicContact CB-CG 3.91Å; Q142-M145 WeakPolarHBondContact O-CB 3.01Å; Q142-M145 PolarHBondContact O-N 3.24Å
143P90.9Very high93.3Very high62 Ų6234.1 Ų34.140%0.40319%0.192SC..THydrogen-bonded Turntrans-65.9-20.4-177.429.2-36.3000113.7V138 A141 M145 V146V138-P143 HydrophobicContact CG2-CB 4.32Å; A141-P143 WeakPolarHBondContact O-CD 3.45Å; P143-M145 PolarHBondContact O-N 2.86Å; P143-V146 WeakPolarHBondContact O-CB 3.44Å; P143-V146 WeakPolarHBondContact O-CG2 3.27Å; P143-V146 PolarHBondContact O-N 2.99Å; P143-V146 VanDerWaalsContact O-N 3.15Å
144A91.2Very high93.5Very high66 Ų6634.1 Ų34.155%0.54519%0.192SC..Hα-helixtrans-59.2-33.5175.100000112.1Q142 V146 H147Q142-A144 PolarHBondContact O-N 2.97Å; A144-V146 PolarHBondContact O-N 2.96Å; A144-V146 VanDerWaalsContact O-N 3.14Å; A144-H147 PolarHBondContact O-N 3.1Å; A144-H147 VanDerWaalsContact O-N 3.14Å
145M91.8Very high93.7Very high12 Ų1237.5 Ų37.56%0.05921%0.208CC..Hα-helixtrans-61.3-24.3178.6-61.3-59.9174.800113.1E99 C137 Q142 P143 H147 A148 L149E99-M145 WeakPolarHBondContact CA-SD 3.23Å; E99-M145 HydrophobicContact CB-CE 3.96Å; E99-M145 HydrophobicContact CB-SD 3.6Å; E99-M145 HydrophobicContact CG-SD 3.94Å; C137-M145 HydrophobicContact CB-CB 3.83Å; C137-M145 HydrophobicContact CB-CG 4.32Å; Q142-M145 HydrophobicContact CB-CG 3.91Å; Q142-M145 WeakPolarHBondContact O-CB 3.01Å; Q142-M145 PolarHBondContact O-N 3.24Å; P143-M145 PolarHBondContact O-N 2.86Å; M145-H147 VanDerWaalsContact C-N 3.26Å; M145-H147 PolarHBondContact O-N 3.32Å; M145-A148 PolarHBondContact O-N 2.85Å; M145-L149 WeakPolarHBondContact O-CB 3.41Å; M145-L149 WeakPolarHBondContact O-CG 3.46Å; M145-L149 PolarHBondContact O-N 3.25Å
146V93.8Very high93.9Very high0 Ų038 Ų380%021%0.209CC..Hα-helixtrans-62.5-38.4179.1-177.30000110.9V39 W50 A134 V138 P143 A144 L149 V150V39-V146 HydrophobicContact CG1-CG1 3.66Å; W50-V146 HydrophobicContact CD2-CB 4.44Å; W50-V146 HydrophobicContact CD2-CG1 3.89Å; W50-V146 HydrophobicContact CE3-CG1 4.1Å; W50-V146 HydrophobicContact CH2-CG1 3.7Å; W50-V146 HydrophobicContact CZ2-CB 3.97Å; W50-V146 HydrophobicContact CZ2-CG1 3.43Å; W50-V146 VanDerWaalsContact CZ2-CG1 3.43Å; W50-V146 HydrophobicContact CZ3-CG1 4.03Å; A134-V146 HydrophobicContact CB-CG1 4.23Å; A134-V146 HydrophobicContact CB-CG2 4.03Å; V138-V146 HydrophobicContact CG2-CG2 3.66Å; P143-V146 WeakPolarHBondContact O-CB 3.44Å; P143-V146 WeakPolarHBondContact O-CG2 3.27Å; P143-V146 PolarHBondContact O-N 2.99Å; P143-V146 VanDerWaalsContact O-N 3.15Å; A144-V146 PolarHBondContact O-N 2.96Å; A144-V146 VanDerWaalsContact O-N 3.14Å; V146-L149 PolarHBondContact O-N 3.37Å; V146-V150 WeakPolarHBondContact O-CG2 3.43Å; V146-V150 PolarHBondContact O-N 3.22Å; V146-V150 VanDerWaalsContact O-N 3.1Å
147H93.6Very high94.2Very high57 Ų5737.2 Ų37.226%0.26421%0.206SC..Hα-helixtrans-64.9-49.7176.3-71.2-70.3000111.7W50 P53 A144 M145 L149 V150 D151W50-H147 AromaticContact CE2-NE2 3.93Å; W50-H147 AromaticContact CZ2-CE1 3.44Å; W50-H147 VanDerWaalsContact CZ2-CE1 3.44Å; W50-H147 WeakPolarHBondContact CZ2-CE1 2.95Å; W50-H147 AromaticContact CZ2-ND1 3.92Å; W50-H147 AromaticContact CZ2-NE2 3.57Å; W50-H147 AromaticContact NE1-NE2 3.7Å; P53-H147 WeakPolarHBondContact CD-CE1 3.38Å; P53-H147 VanDerWaalsContact CD-NE2 3.27Å; P53-H147 WeakPolarHBondContact CD-NE2 3.44Å; P53-H147 WeakPolarHBondContact CG-CE1 3.46Å; P53-H147 WeakPolarHBondContact CG-NE2 3.49Å; A144-H147 PolarHBondContact O-N 3.1Å; A144-H147 VanDerWaalsContact O-N 3.14Å; M145-H147 VanDerWaalsContact C-N 3.26Å; M145-H147 PolarHBondContact O-N 3.32Å; H147-L149 VanDerWaalsContact C-N 3.29Å; H147-L149 PolarHBondContact O-N 3.04Å; H147-V150 PolarHBondContact O-N 3.24Å; H147-V150 VanDerWaalsContact O-N 3.16Å; H147-D151 PolarHBondContact O-N 2.92Å
148A94.7Very high94.5Very high11 Ų1142.9 Ų42.99%0.09123%0.227CC..Hα-helixtrans-57.7-41.6177.500000112E99 T103 M145 D151 C152E99-A148 HydrophobicContact CG-CB 3.5Å; E99-A148 VanDerWaalsContact CG-CB 3.5Å; E99-A148 WeakPolarHBondContact OE1-CB 3.48Å; T103-A148 HydrophobicContact CG2-CB 4.06Å; M145-A148 PolarHBondContact O-N 2.85Å; A148-D151 PolarHBondContact O-N 3.31Å; A148-C152 WeakPolarHBondContact O-CB 3.16Å; A148-C152 PolarHBondContact O-N 2.81Å
149L95.8Very high94.7Very high2 Ų248.6 Ų48.61%0.0125%0.25CC..Hα-helixtrans-63.1-43.8176.1-79169.5000112.8V102 F106 L133 A134 M145 V146 H147 C152 L153V102-L149 HydrophobicContact CG1-CD1 4.28Å; V102-L149 HydrophobicContact CG1-CD2 3.94Å; V102-L149 HydrophobicContact CG1-CG 4.21Å; F106-L149 HydrophobicContact CB-CD2 4.03Å; F106-L149 HydrophobicContact CG-CD2 4.14Å; L133-L149 HydrophobicContact CB-CD1 3.79Å; L133-L149 HydrophobicContact CB-CD2 4.28Å; L133-L149 HydrophobicContact CD1-CD2 4.09Å; A134-L149 HydrophobicContact CB-CD1 4.07Å; M145-L149 WeakPolarHBondContact O-CB 3.41Å; M145-L149 WeakPolarHBondContact O-CG 3.46Å; M145-L149 PolarHBondContact O-N 3.25Å; V146-L149 PolarHBondContact O-N 3.37Å; H147-L149 VanDerWaalsContact C-N 3.29Å; H147-L149 PolarHBondContact O-N 3.04Å; L149-C152 PolarHBondContact O-N 2.88Å; L149-L153 WeakPolarHBondContact O-CB 3.26Å; L149-L153 PolarHBondContact O-N 3.36Å
150V96Very high94.9Very high4 Ų444.6 Ų44.62%0.02424%0.241CC..Hα-helixtrans-65.9-39.7176.9168.90000111.3K32 R36 V146 H147 L153 G154K32-V150 HydrophobicContact CB-CG1 4.18Å; K32-V150 HydrophobicContact CG-CG1 4.45Å; R36-V150 HydrophobicContact CG-CG1 3.76Å; R36-V150 HydrophobicContact CG-CG2 4.18Å; V146-V150 WeakPolarHBondContact O-CG2 3.43Å; V146-V150 PolarHBondContact O-N 3.22Å; V146-V150 VanDerWaalsContact O-N 3.1Å; H147-V150 PolarHBondContact O-N 3.24Å; H147-V150 VanDerWaalsContact O-N 3.16Å; V150-L153 WeakPolarHBondContact O-CB 3.4Å; V150-L153 PolarHBondContact O-N 3.12Å; V150-G154 PolarHBondContact O-N 3.24Å
151D95.8Very high95.2Very high69 Ų6940.2 Ų40.237%0.36922%0.221SC..Hα-helixtrans-67.7-41.4176.7-77.4-38.5000111.7K32 H147 A148 G154 E155K32-D151 WeakPolarHBondContact CE-OD1 3.41Å; K32-D151 IonicContact NZ-OD1 3.28Å; K32-D151 PolarHBondContact NZ-OD1 3.35Å; H147-D151 PolarHBondContact O-N 2.92Å; A148-D151 PolarHBondContact O-N 3.31Å; D151-G154 PolarHBondContact O-N 3.07Å; D151-E155 WeakPolarHBondContact O-CB 3.38Å; D151-E155 PolarHBondContact O-N 3.33Å
152C97.1Very high95.5Very high16 Ų1636.4 Ų36.411%0.10819%0.19CC..Hα-helixtrans-61.7-42.5174.3-164.70000111.8T103 F106 L107 A148 L149 E155 F156T103-C152 HydrophobicContact CG2-CB 4.2Å; F106-C152 HydrophobicContact CD1-CB 4.17Å; F106-C152 HydrophobicContact CE1-CB 4.35Å; L107-C152 VanDerWaalsContact CD2-SG 3.59Å; L107-C152 WeakPolarHBondContact CG-SG 3.16Å; A148-C152 WeakPolarHBondContact O-CB 3.16Å; A148-C152 PolarHBondContact O-N 2.81Å; L149-C152 PolarHBondContact O-N 2.88Å; C152-E155 PolarHBondContact O-N 3.31Å; C152-F156 WeakPolarHBondContact O-CB 3.29Å; C152-F156 PolarHBondContact O-N 3.07Å
153L98Very high95.7Very high1 Ų137.4 Ų37.41%0.00520%0.199CC..Hα-helixtrans-58.1-48.2172.2173.668.2000111.5F106 L126 Y127 L149 V150 E155 F156 V157F106-L153 HydrophobicContact CE1-CB 4.31Å; F106-L153 HydrophobicContact CZ-CB 4.18Å; F106-L153 HydrophobicContact CZ-CD1 4.03Å; L126-L153 HydrophobicContact CD2-CD1 3.48Å; L126-L153 VanDerWaalsContact CD2-CD1 3.48Å; L126-L153 HydrophobicContact CG-CD1 3.65Å; Y127-L153 HydrophobicContact CD1-CD2 4.1Å; Y127-L153 HydrophobicContact CD2-CD1 4.28Å; Y127-L153 HydrophobicContact CE1-CD2 3.79Å; Y127-L153 HydrophobicContact CE2-CD1 4.08Å; Y127-L153 HydrophobicContact CE2-CD2 4.32Å; Y127-L153 HydrophobicContact CG-CD2 4.48Å; L149-L153 WeakPolarHBondContact O-CB 3.26Å; L149-L153 PolarHBondContact O-N 3.36Å; V150-L153 WeakPolarHBondContact O-CB 3.4Å; V150-L153 PolarHBondContact O-N 3.12Å; L153-E155 VanDerWaalsContact C-N 3.32Å; L153-E155 PolarHBondContact O-N 2.85Å; L153-F156 PolarHBondContact O-N 3.27Å; L153-V157 VanDerWaalsContact O-CG2 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.49Å; L153-V157 PolarHBondContact O-N 3.45Å
154G97.3Very high96Very high0 Ų036.2 Ų36.20%019%0.187CC..Hα-helixtrans-61.8-39.9177.700000112.7V150 D151 V157 R158V150-G154 PolarHBondContact O-N 3.24Å; D151-G154 PolarHBondContact O-N 3.07Å; G154-V157 PolarHBondContact O-N 3.25Å; G154-R158 PolarHBondContact O-N 3.41Å
155E97.6Very high96.3Very high72 Ų7233.1 Ų33.134%0.33616%0.161SC..Hα-helixtrans-69.1-38.9177.5-176.863.5-179.200112.3D151 C152 L153 V157 R158 K159D151-E155 WeakPolarHBondContact O-CB 3.38Å; D151-E155 PolarHBondContact O-N 3.33Å; C152-E155 PolarHBondContact O-N 3.31Å; L153-E155 VanDerWaalsContact C-N 3.32Å; L153-E155 PolarHBondContact O-N 2.85Å; E155-V157 VanDerWaalsContact C-N 3.33Å; E155-R158 WeakPolarHBondContact O-CB 3.41Å; E155-R158 PolarHBondContact O-N 3.22Å; E155-R158 IonicContact OE1-CZ 2.99Å; E155-R158 IonicContact OE1-NE 2.68Å; E155-R158 PolarHBondContact OE1-NE 3.38Å; E155-R158 IonicContact OE1-NH2 3.28Å; E155-R158 PolarHBondContact OE1-NH2 3.45Å; E155-R158 IonicContact OE2-CZ 2.74Å; E155-R158 IonicContact OE2-NE 2.66Å; E155-R158 PolarHBondContact OE2-NE 2.73Å; E155-R158 IonicContact OE2-NH2 2.87Å; E155-K159 WeakPolarHBondContact O-CG 3.49Å; E155-K159 PolarHBondContact O-N 3.24Å; E155-K159 WeakPolarHBondContact OE1-CE 3.46Å; E155-K159 IonicContact OE1-NZ 3.49Å; E155-K159 PolarHBondContact OE1-NZ 3.18Å
156F98.1Very high96.4Very high19 Ų1937.4 Ų37.48%0.08318%0.177CC..Hα-helixtrans-62.4-42.8172.5-173.1-89.4000111.2L107 A110 F114 L126 C152 L153 R158 K159 T160 L161L107-F156 HydrophobicContact CD2-CB 4.22Å; L107-F156 HydrophobicContact CD2-CD2 3.82Å; L107-F156 HydrophobicContact CD2-CG 4.46Å; A110-F156 HydrophobicContact CB-CD1 4.49Å; A110-F156 HydrophobicContact CB-CD2 3.87Å; A110-F156 HydrophobicContact CB-CE1 4.22Å; A110-F156 HydrophobicContact CB-CE2 3.54Å; A110-F156 HydrophobicContact CB-CG 4.33Å; A110-F156 HydrophobicContact CB-CZ 3.74Å; F114-F156 AromaticContact CD2-CE1 3.47Å; F114-F156 HydrophobicContact CD2-CE1 3.47Å; F114-F156 VanDerWaalsContact CD2-CE1 3.47Å; F114-F156 AromaticContact CD2-CZ 3.5Å; F114-F156 HydrophobicContact CD2-CZ 3.5Å; F114-F156 AromaticContact CE2-CE1 3.58Å; F114-F156 HydrophobicContact CE2-CE1 3.58Å; F114-F156 HydrophobicContact CE2-CZ 4.08Å; F114-F156 HydrophobicContact CG-CE1 4.31Å; F114-F156 HydrophobicContact CG-CZ 4.26Å; F114-F156 HydrophobicContact CZ-CE1 4.46Å; L126-F156 HydrophobicContact CD2-CD1 3.67Å; L126-F156 HydrophobicContact CD2-CE1 4.05Å; C152-F156 WeakPolarHBondContact O-CB 3.29Å; C152-F156 PolarHBondContact O-N 3.07Å; L153-F156 PolarHBondContact O-N 3.27Å; F156-R158 VanDerWaalsContact C-N 3.33Å; F156-R158 PolarHBondContact O-N 2.97Å; F156-K159 PolarHBondContact O-N 3.1Å; F156-T160 HydrophobicContact CE1-CG2 4.1Å; F156-T160 HydrophobicContact CZ-CG2 3.93Å; F156-T160 WeakPolarHBondContact O-CB 3.49Å; F156-T160 PolarHBondContact O-N 3.15Å; F156-T160 PolarHBondContact O-OG1 2.82Å; F156-L161 HydrophobicContact CD1-CD1 4.24Å; F156-L161 HydrophobicContact CD1-CG 4.38Å; F156-L161 HydrophobicContact CE1-CD1 4.26Å; F156-L161 HydrophobicContact CE1-CG 4.21Å
157V98Very high96.4Very high0 Ų047.5 Ų47.50%022%0.215CC..Iπ-helixtrans-59.1-46.8174.5167.40000110.5V28 A31 L153 G154 E155 K159 L161 A162 L165 W171V28-V157 HydrophobicContact CG2-CG1 4.39Å; A31-V157 HydrophobicContact CB-CB 4.07Å; A31-V157 HydrophobicContact CB-CG1 3.84Å; A31-V157 HydrophobicContact CB-CG2 3.9Å; L153-V157 VanDerWaalsContact O-CG2 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.49Å; L153-V157 PolarHBondContact O-N 3.45Å; G154-V157 PolarHBondContact O-N 3.25Å; E155-V157 VanDerWaalsContact C-N 3.33Å; V157-K159 PolarHBondContact O-N 3.31Å; V157-L161 HydrophobicContact CB-CB 4.49Å; V157-L161 HydrophobicContact CG1-CB 4.3Å; V157-L161 HydrophobicContact CG2-CD1 3.91Å; V157-L161 CarbonylContact O-C 3.49Å; V157-L161 WeakPolarHBondContact O-CA 3.37Å; V157-L161 PolarHBondContact O-N 2.81Å; V157-A162 PolarHBondContact O-N 3.25Å; V157-L165 HydrophobicContact CG1-CD1 3.83Å; V157-W171 HydrophobicContact CG1-CZ2 4.17Å; V157-W171 HydrophobicContact CG2-CZ2 4.32Å
158R97.2Very high96.4Very high119 Ų11950.6 Ų50.645%0.44922%0.224SC..Iπ-helixtrans-56.7-47.6178.6-168.9-171.665.673.9-5112.2V28 G154 E155 F156 A162V28-R158 HydrophobicContact CG2-CB 3.53Å; V28-R158 HydrophobicContact CG2-CG 3.9Å; G154-R158 PolarHBondContact O-N 3.41Å; E155-R158 WeakPolarHBondContact O-CB 3.41Å; E155-R158 PolarHBondContact O-N 3.22Å; E155-R158 IonicContact OE1-CZ 2.99Å; E155-R158 IonicContact OE1-NE 2.68Å; E155-R158 PolarHBondContact OE1-NE 3.38Å; E155-R158 IonicContact OE1-NH2 3.28Å; E155-R158 PolarHBondContact OE1-NH2 3.45Å; E155-R158 IonicContact OE2-CZ 2.74Å; E155-R158 IonicContact OE2-NE 2.66Å; E155-R158 PolarHBondContact OE2-NE 2.73Å; E155-R158 IonicContact OE2-NH2 2.87Å; F156-R158 VanDerWaalsContact C-N 3.33Å; F156-R158 PolarHBondContact O-N 2.97Å; R158-A162 WeakPolarHBondContact O-CB 3.46Å
159K97Very high96.2Very high142 Ų14252.2 Ų52.262%0.61724%0.242SC*.Iπ-helixtrans-75.6-38.8-175.1-70-177.5-174.5168.90113.2E155 F156 V157E155-K159 WeakPolarHBondContact O-CG 3.49Å; E155-K159 PolarHBondContact O-N 3.24Å; E155-K159 WeakPolarHBondContact OE1-CE 3.46Å; E155-K159 IonicContact OE1-NZ 3.49Å; E155-K159 PolarHBondContact OE1-NZ 3.18Å; F156-K159 PolarHBondContact O-N 3.1Å; V157-K159 PolarHBondContact O-N 3.31Å
160T96.9Very high96.1Very high58 Ų5852.2 Ų52.236%0.35624%0.242SC..Iπ-helixtrans-114.6-37.5-164.7-50.30000112.9F156F156-T160 HydrophobicContact CE1-CG2 4.1Å; F156-T160 HydrophobicContact CZ-CG2 3.93Å; F156-T160 WeakPolarHBondContact O-CB 3.49Å; F156-T160 PolarHBondContact O-N 3.15Å; F156-T160 PolarHBondContact O-OG1 2.82Å
161L97.7Very high96.1Very high0 Ų052.1 Ų52.10%024%0.242CC..Iπ-helixtrans-104.9-20.9-168.1-56.2179.8000113.7F114 I118 V123 L126 F156 V157 T163 W164 L165F114-L161 HydrophobicContact CD1-CD2 4.08Å; F114-L161 HydrophobicContact CE1-CD2 3.79Å; F114-L161 HydrophobicContact CZ-CD1 4.19Å; F114-L161 HydrophobicContact CZ-CD2 4.14Å; I118-L161 HydrophobicContact CD1-CD2 3.81Å; I118-L161 HydrophobicContact CG1-CD2 3.95Å; I118-L161 HydrophobicContact CG2-CD2 3.71Å; V123-L161 HydrophobicContact CG2-CD1 4.27Å; L126-L161 HydrophobicContact CD2-CD1 4.12Å; F156-L161 HydrophobicContact CD1-CD1 4.24Å; F156-L161 HydrophobicContact CD1-CG 4.38Å; F156-L161 HydrophobicContact CE1-CD1 4.26Å; F156-L161 HydrophobicContact CE1-CG 4.21Å; V157-L161 HydrophobicContact CB-CB 4.49Å; V157-L161 HydrophobicContact CG1-CB 4.3Å; V157-L161 HydrophobicContact CG2-CD1 3.91Å; V157-L161 CarbonylContact O-C 3.49Å; V157-L161 WeakPolarHBondContact O-CA 3.37Å; V157-L161 PolarHBondContact O-N 2.81Å; L161-T163 PolarHBondContact O-N 3.5Å; L161-W164 PolarHBondContact O-N 2.92Å; L161-L165 HydrophobicContact CB-CD1 4.13Å; L161-L165 HydrophobicContact CB-CG 4.46Å; L161-L165 WeakPolarHBondContact O-CB 3.42Å; L161-L165 WeakPolarHBondContact O-CG 3.49Å; L161-L165 PolarHBondContact O-N 3Å
162A96.2Very high96Very high1 Ų151.2 Ų51.21%0.00824%0.238CC..Hα-helixtrans-55.7-49.8-172.700000112.8D24 V157 R158 W164 L165 R166D24-A162 HydrophobicContact CB-CB 4.46Å; V157-A162 PolarHBondContact O-N 3.25Å; R158-A162 WeakPolarHBondContact O-CB 3.46Å; A162-W164 VanDerWaalsContact C-N 3.32Å; A162-W164 PolarHBondContact O-N 3.21Å; A162-L165 PolarHBondContact O-N 3.1Å; A162-R166 PolarHBondContact O-N 3.37Å
163T95.5Very high95.8Very high75 Ų7551.1 Ų51.146%0.4624%0.237SC..Hα-helixtrans-60.8-39.6176.4-53.80000112.5L161 R167L161-T163 PolarHBondContact O-N 3.5Å; T163-R167 WeakPolarHBondContact O-CG 3.31Å; T163-R167 PolarHBondContact O-N 2.97Å
164W97.3Very high95.7Very high37 Ų3751 Ų5114%0.1424%0.237CC..Hα-helixtrans-69.4-43.4178.7179.293.5000111.6I118 W120 V123 L161 A162 R167 R168I118-W164 HydrophobicContact CB-CD2 4.15Å; I118-W164 HydrophobicContact CB-CG 4.02Å; I118-W164 HydrophobicContact CD1-CB 3.73Å; I118-W164 HydrophobicContact CD1-CG 3.93Å; I118-W164 HydrophobicContact CG2-CB 4.46Å; I118-W164 HydrophobicContact CG2-CD2 3.4Å; I118-W164 VanDerWaalsContact CG2-CD2 3.4Å; I118-W164 VanDerWaalsContact CG2-CE2 3.5Å; I118-W164 HydrophobicContact CG2-CE3 3.76Å; I118-W164 HydrophobicContact CG2-CG 3.73Å; I118-W164 HydrophobicContact CG2-CH2 4.28Å; I118-W164 HydrophobicContact CG2-CZ2 3.96Å; I118-W164 HydrophobicContact CG2-CZ3 4.19Å; I118-W164 PolarHBondContact O-NE1 2.99Å; W120-W164 AromaticContact CD1-CH2 3.95Å; W120-W164 AromaticContact CD2-CH2 3.73Å; W120-W164 HydrophobicContact CD2-CH2 3.73Å; W120-W164 HydrophobicContact CD2-CZ3 4.19Å; W120-W164 AromaticContact CE2-CH2 3.6Å; W120-W164 AromaticContact CE2-CZ3 3.95Å; W120-W164 HydrophobicContact CE3-CH2 4.31Å; W120-W164 HydrophobicContact CE3-CZ3 4.4Å; W120-W164 AromaticContact CG-CH2 3.94Å; W120-W164 HydrophobicContact CG-CH2 3.94Å; W120-W164 HydrophobicContact CH2-CZ3 4.14Å; W120-W164 HydrophobicContact CZ2-CH2 4.05Å; W120-W164 AromaticContact CZ2-CZ3 3.92Å; W120-W164 HydrophobicContact CZ2-CZ3 3.92Å; W120-W164 HydrophobicContact CZ3-CZ3 4.38Å; W120-W164 AromaticContact NE1-CH2 3.75Å; V123-W164 HydrophobicContact CG2-CZ3 4.17Å; L161-W164 PolarHBondContact O-N 2.92Å; A162-W164 VanDerWaalsContact C-N 3.32Å; A162-W164 PolarHBondContact O-N 3.21Å; W164-R167 PolarHBondContact O-N 2.68Å; W164-R168 HydrophobicContact CD2-CG 4.15Å; W164-R168 HydrophobicContact CE3-CG 4.24Å; W164-R168 HydrophobicContact CH2-CG 4.07Å; W164-R168 HydrophobicContact CZ2-CG 3.99Å; W164-R168 HydrophobicContact CZ3-CG 4.2Å; W164-R168 WeakPolarHBondContact O-CG 3.5Å; W164-R168 PolarHBondContact O-N 3.46Å; W164-R168 VanDerWaalsContact O-N 3.12Å
165L96.8Very high95.4Very high0 Ų052.9 Ų52.90%025%0.246CC..Hα-helixtrans-61.5-44.1176.4-75.4167.9000111.3L27 W120 V157 L161 A162 R167 R168 G169 G170 W171L27-L165 HydrophobicContact CD1-CB 3.87Å; L27-L165 HydrophobicContact CD2-CB 4.34Å; W120-L165 HydrophobicContact CH2-CD2 3.54Å; W120-L165 HydrophobicContact CZ2-CD2 4.17Å; W120-L165 HydrophobicContact CZ3-CD2 4.24Å; V157-L165 HydrophobicContact CG1-CD1 3.83Å; L161-L165 HydrophobicContact CB-CD1 4.13Å; L161-L165 HydrophobicContact CB-CG 4.46Å; L161-L165 WeakPolarHBondContact O-CB 3.42Å; L161-L165 WeakPolarHBondContact O-CG 3.49Å; L161-L165 PolarHBondContact O-N 3Å; A162-L165 PolarHBondContact O-N 3.1Å; L165-R167 VanDerWaalsContact C-N 3.33Å; L165-R167 PolarHBondContact O-N 3.28Å; L165-R168 PolarHBondContact O-N 3.03Å; L165-R168 VanDerWaalsContact O-N 3.07Å; L165-G169 PolarHBondContact O-N 3.39Å; L165-G170 WeakPolarHBondContact O-CA 3.32Å; L165-G170 PolarHBondContact O-N 2.79Å; L165-W171 HydrophobicContact CD1-CD2 4.5Å; L165-W171 HydrophobicContact CD1-CH2 4.18Å; L165-W171 HydrophobicContact CD1-CZ2 3.49Å; L165-W171 VanDerWaalsContact CD1-CZ2 3.49Å; L165-W171 HydrophobicContact CD2-CD2 4.18Å; L165-W171 HydrophobicContact CD2-CE3 4.34Å; L165-W171 HydrophobicContact CD2-CH2 4.48Å; L165-W171 HydrophobicContact CD2-CZ2 4.33Å
166R94.1Very high95.1Very high102 Ų10257.1 Ų57.139%0.38526%0.263SS..Hα-helixtrans-56.6-46.7174.3-79.1-165.6-77.7155-10.5112D24 L27 A162 R168 G169D24-R166 WeakPolarHBondContact OD1-CD 3.38Å; D24-R166 IonicContact OD1-CZ 3.42Å; D24-R166 VanDerWaalsContact OD1-CZ 3.28Å; D24-R166 IonicContact OD1-NE 3.65Å; D24-R166 PolarHBondContact OD1-NE 3.26Å; D24-R166 IonicContact OD1-NH2 2.7Å; D24-R166 PolarHBondContact OD1-NH2 3.34Å; D24-R166 IonicContact OD2-CZ 3.86Å; D24-R166 IonicContact OD2-NE 3.3Å; D24-R166 IonicContact OD2-NH2 3.22Å; D24-R166 PolarHBondContact OD2-NH2 3.28Å; L27-R166 HydrophobicContact CD1-CB 4.4Å; L27-R166 HydrophobicContact CD1-CG 3.42Å; L27-R166 VanDerWaalsContact CD1-CG 3.42Å; A162-R166 PolarHBondContact O-N 3.37Å; R166-R168 PolarHBondContact O-N 3.33Å; R166-G169 PolarHBondContact O-N 2.99Å
167R93.8Very high94.6Very high212 Ų21259.2 Ų59.280%0.828%0.28SS*.Hα-helixtrans-62.8-25.5177.6-71.6178.7-176.2-160.21.6113.5T163 W164 L165 G169T163-R167 WeakPolarHBondContact O-CG 3.31Å; T163-R167 PolarHBondContact O-N 2.97Å; W164-R167 PolarHBondContact O-N 2.68Å; L165-R167 VanDerWaalsContact C-N 3.33Å; L165-R167 PolarHBondContact O-N 3.28Å; R167-G169 VanDerWaalsContact C-N 3.35Å
168R92.9Very high93.8Very high123 Ų12360.2 Ų60.246%0.46429%0.286SS..Hα-helixtrans-83.5-8.8174.8-68.2-63.9-175.3175.3-4.1113.5W164 L165 R166 D173W164-R168 HydrophobicContact CD2-CG 4.15Å; W164-R168 HydrophobicContact CE3-CG 4.24Å; W164-R168 HydrophobicContact CH2-CG 4.07Å; W164-R168 HydrophobicContact CZ2-CG 3.99Å; W164-R168 HydrophobicContact CZ3-CG 4.2Å; W164-R168 WeakPolarHBondContact O-CG 3.5Å; W164-R168 PolarHBondContact O-N 3.46Å; W164-R168 VanDerWaalsContact O-N 3.12Å; L165-R168 PolarHBondContact O-N 3.03Å; L165-R168 VanDerWaalsContact O-N 3.07Å; R166-R168 PolarHBondContact O-N 3.33Å; R168-D173 HydrophobicContact CB-CB 3.93Å; R168-D173 WeakPolarHBondContact CD-OD2 3.38Å; R168-D173 VanDerWaalsContact O-CB 3.31Å; R168-D173 WeakPolarHBondContact O-CB 3.3Å
169G91.6Very high92.6Very high45 Ų4560.4 Ų60.446%0.46430%0.3SS..THydrogen-bonded Turntrans84.818.3-172.900000113.7L165 R166 R167L165-G169 PolarHBondContact O-N 3.39Å; R166-G169 PolarHBondContact O-N 2.99Å; R167-G169 VanDerWaalsContact C-N 3.35Å
170G93.7Very high90.8Very high2 Ų257.5 Ų57.52%0.02130%0.298CS..SBendtrans94.2-165.7176.300000114.6L165 T172 D173L165-G170 WeakPolarHBondContact O-CA 3.32Å; L165-G170 PolarHBondContact O-N 2.79Å; G170-T172 VanDerWaalsContact C-N 3.29Å; G170-T172 PolarHBondContact O-N 2.88Å; G170-D173 WeakPolarHBondContact O-CB 3.39Å; G170-D173 PolarHBondContact O-N 3.05Å
171W95.3Very high88.5Confident2 Ų259.4 Ų59.41%0.00831%0.309CS..G310 helixtrans-67.6-24.8-171.9-7698.3000114.4L27 Q30 A31 L34 L63 V66 W120 V123 Y127 V157 L165 D173 V174L27-W171 PolarHBondContact O-NE1 3.39Å; Q30-W171 HydrophobicContact CB-CG 4.48Å; A31-W171 HydrophobicContact CB-CH2 4.35Å; A31-W171 HydrophobicContact CB-CZ2 3.49Å; A31-W171 VanDerWaalsContact CB-CZ2 3.49Å; L34-W171 HydrophobicContact CD1-CB 4.27Å; L34-W171 HydrophobicContact CD1-CD2 3.6Å; L34-W171 HydrophobicContact CD1-CE3 3.59Å; L34-W171 HydrophobicContact CD1-CG 3.92Å; L34-W171 HydrophobicContact CD1-CZ3 4.19Å; L63-W171 HydrophobicContact CD2-CB 4.11Å; V66-W171 HydrophobicContact CG1-CB 4.36Å; V66-W171 WeakPolarHBondContact CG2-O 3.43Å; W120-W171 AromaticContact CH2-CE3 3.97Å; W120-W171 HydrophobicContact CH2-CE3 3.97Å; W120-W171 HydrophobicContact CH2-CZ3 4.37Å; W120-W171 AromaticContact CZ3-CE3 3.89Å; W120-W171 HydrophobicContact CZ3-CE3 3.89Å; W120-W171 AromaticContact CZ3-CZ3 3.91Å; W120-W171 HydrophobicContact CZ3-CZ3 3.91Å; V123-W171 HydrophobicContact CG1-CH2 4.03Å; V123-W171 HydrophobicContact CG1-CZ3 3.81Å; Y127-W171 AromaticContact CE2-CH2 3.72Å; Y127-W171 HydrophobicContact CE2-CH2 3.72Å; Y127-W171 HydrophobicContact CE2-CZ3 4.02Å; Y127-W171 AromaticContact CZ-CH2 3.74Å; Y127-W171 WeakPolarHBondContact OH-CH2 3.22Å; V157-W171 HydrophobicContact CG1-CZ2 4.17Å; V157-W171 HydrophobicContact CG2-CZ2 4.32Å; L165-W171 HydrophobicContact CD1-CD2 4.5Å; L165-W171 HydrophobicContact CD1-CH2 4.18Å; L165-W171 HydrophobicContact CD1-CZ2 3.49Å; L165-W171 VanDerWaalsContact CD1-CZ2 3.49Å; L165-W171 HydrophobicContact CD2-CD2 4.18Å; L165-W171 HydrophobicContact CD2-CE3 4.34Å; L165-W171 HydrophobicContact CD2-CH2 4.48Å; L165-W171 HydrophobicContact CD2-CZ2 4.33Å; W171-D173 PolarHBondContact O-N 3.18Å; W171-V174 VanDerWaalsContact O-CG1 3.31Å; W171-V174 WeakPolarHBondContact O-CG1 3.42Å; W171-V174 PolarHBondContact O-N 3.18Å
172T93.4Very high86Confident49 Ų4965 Ų6530%0.30134%0.339SS..G310 helixtrans-68.4-14.5178.651.70000113.3R62 V66 G170 V174 L175R62-T172 HydrophobicContact CB-CG2 4.17Å; V66-T172 HydrophobicContact CG2-CG2 4.36Å; G170-T172 VanDerWaalsContact C-N 3.29Å; G170-T172 PolarHBondContact O-N 2.88Å; T172-V174 PolarHBondContact O-N 3.18Å; T172-L175 VanDerWaalsContact O-CB 3.28Å; T172-L175 WeakPolarHBondContact O-CB 3.31Å; T172-L175 VanDerWaalsContact O-CG 3.3Å; T172-L175 WeakPolarHBondContact O-CG 3.38Å; T172-L175 PolarHBondContact O-N 2.93Å; T172-L175 VanDerWaalsContact O-N 3.15Å
173D94.2Very high83.7Confident14 Ų1469.7 Ų69.78%0.07537%0.37CS..G310 helixtrans-64.9-26.4176.9-176.873000112.7W120 R168 G170 W171 L175 K176W120-D173 HydrophobicContact CZ2-CB 3.94Å; W120-D173 PolarHBondContact NE1-OD2 3.1Å; R168-D173 HydrophobicContact CB-CB 3.93Å; R168-D173 WeakPolarHBondContact CD-OD2 3.38Å; R168-D173 VanDerWaalsContact O-CB 3.31Å; R168-D173 WeakPolarHBondContact O-CB 3.3Å; G170-D173 WeakPolarHBondContact O-CB 3.39Å; G170-D173 PolarHBondContact O-N 3.05Å; W171-D173 PolarHBondContact O-N 3.18Å; D173-L175 PolarHBondContact O-N 2.81Å; D173-K176 WeakPolarHBondContact O-CB 3.28Å; D173-K176 PolarHBondContact O-N 3.24Å; D173-K176 VanDerWaalsContact O-N 3.1Å; D173-K176 WeakPolarHBondContact OD1-CD 3.18Å; D173-K176 WeakPolarHBondContact OD1-CE 3.37Å; D173-K176 IonicContact OD1-NZ 3.41Å; D173-K176 PolarHBondContact OD1-NZ 3.24Å
174V94.8Very high81.6Confident0 Ų069.3 Ų69.30%038%0.38CS..G310 helixtrans-61.8-24.6174.979.20000112.8V66 V69 L70 L73 W120 W171 T172 K176 C177V66-V174 HydrophobicContact CB-CG1 4.38Å; V66-V174 HydrophobicContact CG1-CG1 3.85Å; V66-V174 HydrophobicContact CG2-CG1 4.2Å; V69-V174 HydrophobicContact CG1-CG1 4.17Å; V69-V174 HydrophobicContact CG1-CG2 4.16Å; L70-V174 HydrophobicContact CD2-CG2 4.16Å; L73-V174 HydrophobicContact CD1-CG2 4.11Å; W120-V174 HydrophobicContact CB-CG2 4.38Å; W120-V174 HydrophobicContact CD2-CB 3.69Å; W120-V174 HydrophobicContact CD2-CG2 3.64Å; W120-V174 HydrophobicContact CE3-CB 3.62Å; W120-V174 HydrophobicContact CE3-CG2 3.47Å; W120-V174 VanDerWaalsContact CE3-CG2 3.47Å; W120-V174 HydrophobicContact CG-CB 4.41Å; W120-V174 HydrophobicContact CG-CG2 4.06Å; W120-V174 HydrophobicContact CH2-CB 3.89Å; W120-V174 HydrophobicContact CZ2-CB 3.94Å; W120-V174 HydrophobicContact CZ3-CB 3.72Å; W120-V174 HydrophobicContact CZ3-CG2 4.01Å; W171-V174 VanDerWaalsContact O-CG1 3.31Å; W171-V174 WeakPolarHBondContact O-CG1 3.42Å; W171-V174 PolarHBondContact O-N 3.18Å; T172-V174 PolarHBondContact O-N 3.18Å; V174-K176 PolarHBondContact O-N 3.02Å; V174-K176 VanDerWaalsContact O-N 3.15Å; V174-C177 VanDerWaalsContact O-CB 3.24Å; V174-C177 WeakPolarHBondContact O-CB 3.5Å; V174-C177 PolarHBondContact O-N 2.94Å
175L92.5Very high79.4Confident39 Ų3972 Ų7220%0.20440%0.397CS..G310 helixtrans-61.7-24.2178.4-58.5178.9000111.5E65 V66 V69 T172 D173 C177 V178E65-L175 HydrophobicContact CB-CD2 4.11Å; V66-L175 HydrophobicContact CG2-CD1 4.35Å; V66-L175 HydrophobicContact CG2-CD2 3.99Å; V66-L175 HydrophobicContact CG2-CG 4.08Å; V69-L175 HydrophobicContact CB-CD2 4.14Å; V69-L175 HydrophobicContact CG2-CD2 3.66Å; T172-L175 VanDerWaalsContact O-CB 3.28Å; T172-L175 WeakPolarHBondContact O-CB 3.31Å; T172-L175 VanDerWaalsContact O-CG 3.3Å; T172-L175 WeakPolarHBondContact O-CG 3.38Å; T172-L175 PolarHBondContact O-N 2.93Å; T172-L175 VanDerWaalsContact O-N 3.15Å; D173-L175 PolarHBondContact O-N 2.81Å; L175-C177 VanDerWaalsContact C-N 3.29Å; L175-C177 PolarHBondContact O-N 2.75Å; L175-V178 VanDerWaalsContact O-O 3.04Å
176K90.7Very high77.2Confident160 Ų16081.8 Ų81.870%0.69643%0.434SS*.G310 helixtrans-75-16.3175-55.8174.3-169.4158.80113.2D173 V174 V178D173-K176 WeakPolarHBondContact O-CB 3.28Å; D173-K176 PolarHBondContact O-N 3.24Å; D173-K176 VanDerWaalsContact O-N 3.1Å; D173-K176 WeakPolarHBondContact OD1-CD 3.18Å; D173-K176 WeakPolarHBondContact OD1-CE 3.37Å; D173-K176 IonicContact OD1-NZ 3.41Å; D173-K176 PolarHBondContact OD1-NZ 3.24Å; V174-K176 PolarHBondContact O-N 3.02Å; V174-K176 VanDerWaalsContact O-N 3.15Å; K176-V178 VanDerWaalsContact C-N 3.27Å
177C86.4Confident75.3Confident64 Ų6479.4 Ų79.443%0.43243%0.433SS..G310 helixtrans-75.9-20178-63.30000112.7L73 W120 V174 L175L73-C177 HydrophobicContact CD1-CB 4.31Å; W120-C177 VanDerWaalsContact CG-SG 3.59Å; V174-C177 VanDerWaalsContact O-CB 3.24Å; V174-C177 WeakPolarHBondContact O-CB 3.5Å; V174-C177 PolarHBondContact O-N 2.94Å; L175-C177 VanDerWaalsContact C-N 3.29Å; L175-C177 PolarHBondContact O-N 2.75Å
178V81.4Confident73.8Confident20 Ų2075.5 Ų75.512%0.12142%0.423CS..SBendtrans-103.2125.1172176.20000106.2V69 L73 L175 K176 S180V69-V178 HydrophobicContact CG1-CB 4.49Å; V69-V178 HydrophobicContact CG1-CG2 3.65Å; V69-V178 HydrophobicContact CG2-CG2 4.3Å; L73-V178 HydrophobicContact CD1-CG2 4.41Å; L73-V178 HydrophobicContact CD2-CG2 3.99Å; L73-V178 HydrophobicContact CG-CG2 4.15Å; L175-V178 VanDerWaalsContact O-O 3.04Å; K176-V178 VanDerWaalsContact C-N 3.27Å; V178-S180 VanDerWaalsContact C-N 3.27Å; V178-S180 PolarHBondContact O-N 3.45Å
179V73.3Confident72.8Confident123 Ų12378.2 Ų78.275%0.74543%0.434SS*.  trans-61.9105.7158.7179.30000104.1T181V179-T181 PolarHBondContact O-N 2.98Å
180S57.9Low71.9Confident82 Ų8280 Ų8057%0.57343%0.432SS*.  trans-53.897.7159.4-63.10000104.2V178 D182V178-S180 VanDerWaalsContact C-N 3.27Å; V178-S180 PolarHBondContact O-N 3.45Å; S180-D182 PolarHBondContact O-N 3.45Å
181T49.3Very low70.8Confident97 Ų9783.3 Ų83.360%0.59545%0.452SS*.  trans-55.2105.2160-53.60000102.6V179 L185V179-T181 PolarHBondContact O-N 2.98Å; T181-L185 HydrophobicContact CG2-CB 3.92Å; T181-L185 HydrophobicContact CG2-CD2 3.45Å; T181-L185 VanDerWaalsContact CG2-CD2 3.45Å; T181-L185 HydrophobicContact CG2-CG 4.32Å
182D45.4Very low69.6Low118 Ų11885.3 Ų85.363%0.63147%0.468SS*.  trans-43.9139.7-171.5-84.7-47.9000109.2S180 G184 L185S180-D182 PolarHBondContact O-N 3.45Å; D182-G184 PolarHBondContact O-N 3.47Å; D182-L185 PolarHBondContact O-N 3.42Å
183P48.4Very low68.9Low100 Ų10085 Ų8565%0.64947%0.471SS*.G310 helixtrans-58.7-7.7167.324-31.2000112.2L185 R186P183-L185 VanDerWaalsContact C-N 3.27Å; P183-L185 PolarHBondContact O-N 2.68Å; P183-R186 WeakPolarHBondContact O-CD 3.46Å; P183-R186 WeakPolarHBondContact O-CG 3.49Å; P183-R186 PolarHBondContact O-N 3.29Å
184G50.8Low68.1Low66 Ų6690 Ų9068%0.6850%0.498SS*.G310 helixtrans-64.9-21.4164.800000114.6D182 R186D182-G184 PolarHBondContact O-N 3.47Å; G184-R186 PolarHBondContact O-N 3.22Å
185L50.2Low67.3Low93 Ų9393.8 Ų93.849%0.48752%0.523SS..G310 helixtrans-77.829170.2-149.775.8000112.3T181 D182 P183 S187 H188T181-L185 HydrophobicContact CG2-CB 3.92Å; T181-L185 HydrophobicContact CG2-CD2 3.45Å; T181-L185 VanDerWaalsContact CG2-CD2 3.45Å; T181-L185 HydrophobicContact CG2-CG 4.32Å; D182-L185 PolarHBondContact O-N 3.42Å; P183-L185 VanDerWaalsContact C-N 3.27Å; P183-L185 PolarHBondContact O-N 2.68Å; L185-S187 PolarHBondContact O-N 2.86Å; L185-S187 VanDerWaalsContact O-N 3.1Å; L185-H188 WeakPolarHBondContact O-CB 3.38Å; L185-H188 PolarHBondContact O-N 3.32Å
186R51.6Low66.6Low207 Ų20795.2 Ų95.278%0.78154%0.536SS*.THydrogen-bonded Turntrans-63.53.8161.8-87.3173.5-179.7-106.42.8113.5P183 G184 H188P183-R186 WeakPolarHBondContact O-CD 3.46Å; P183-R186 WeakPolarHBondContact O-CG 3.49Å; P183-R186 PolarHBondContact O-N 3.29Å; G184-R186 PolarHBondContact O-N 3.22Å; R186-H188 PolarHBondContact O-N 3.5Å
187S53.5Low66.3Low51 Ų5193.1 Ų93.136%0.35753%0.527SS..THydrogen-bonded Turntrans-69.98.6154.849.40000113.4L185 W189 L190 V191L185-S187 PolarHBondContact O-N 2.86Å; L185-S187 VanDerWaalsContact O-N 3.1Å; S187-W189 VanDerWaalsContact C-N 3.25Å; S187-W189 PolarHBondContact O-N 2.91Å; S187-L190 WeakPolarHBondContact O-CB 3.18Å; S187-L190 PolarHBondContact O-N 3Å; S187-V191 PolarHBondContact O-N 3.43Å
188H62.4Low65.9Low130 Ų13091.8 Ų91.860%0.60252%0.524SS*.Hα-helixtrans-53.9-29.3175.8-168.4-90.5000115L185 R186 L190 V191 A192L185-H188 WeakPolarHBondContact O-CB 3.38Å; L185-H188 PolarHBondContact O-N 3.32Å; R186-H188 PolarHBondContact O-N 3.5Å; H188-L190 VanDerWaalsContact C-N 3.32Å; H188-V191 PolarHBondContact O-N 3.07Å; H188-A192 WeakPolarHBondContact O-CB 3.45Å; H188-A192 PolarHBondContact O-N 3.49Å
189W72.3Confident65.9Low181 Ų181100.3 Ų100.369%0.68655%0.554SS**Hα-helixtrans-67.4-35174.668.3-91000111.7S187 A193S187-W189 VanDerWaalsContact C-N 3.25Å; S187-W189 PolarHBondContact O-N 2.91Å; W189-A193 WeakPolarHBondContact O-CB 3.46Å; W189-A193 PolarHBondContact O-N 3.02Å
190L71.8Confident66.4Low81 Ų81101.2 Ų101.242%0.42455%0.548SS..Hα-helixtrans-70.3-44.6174.7-74169.3000111.3S187 H188 A193 L194S187-L190 WeakPolarHBondContact O-CB 3.18Å; S187-L190 PolarHBondContact O-N 3Å; H188-L190 VanDerWaalsContact C-N 3.32Å; L190-A193 PolarHBondContact O-N 3.39Å; L190-L194 VanDerWaalsContact O-CB 3.3Å; L190-L194 WeakPolarHBondContact O-CB 3.4Å; L190-L194 WeakPolarHBondContact O-CG 3.27Å; L190-L194 PolarHBondContact O-N 3.29Å
191V71.9Confident67.6Low73 Ų73101.5 Ų101.544%0.44254%0.543SS..Hα-helixtrans-66.4-44.4178.5179.80000110.6S187 H188 A193 L194 C195S187-V191 PolarHBondContact O-N 3.43Å; H188-V191 PolarHBondContact O-N 3.07Å; V191-A193 VanDerWaalsContact C-N 3.33Å; V191-A193 PolarHBondContact O-N 2.92Å; V191-L194 PolarHBondContact O-N 2.84Å; V191-C195 WeakPolarHBondContact O-CB 3.34Å; V191-C195 PolarHBondContact O-N 3.22Å; V191-C195 PolarHBondContact O-SG 3.45Å; V191-C195 VanDerWaalsContact O-SG 3.33Å
192A69.3Low69.1Low43 Ų43103.8 Ų103.836%0.35555%0.545SS..Hα-helixtrans-63.4-39.217500000111.7H188 C195 S196H188-A192 WeakPolarHBondContact O-CB 3.45Å; H188-A192 PolarHBondContact O-N 3.49Å; A192-C195 PolarHBondContact O-N 2.83Å; A192-S196 VanDerWaalsContact O-CB 3.27Å; A192-S196 WeakPolarHBondContact O-CB 3.43Å; A192-S196 PolarHBondContact O-N 2.91Å; A192-S196 PolarHBondContact O-OG 3.4Å; A192-S196 VanDerWaalsContact O-OG 3.11Å
193A78.8Confident70.9Confident44 Ų44100.7 Ų100.736%0.36454%0.536SS..Hα-helixtrans-66.9-39.7174.200000112.3W189 L190 V191 S196 F197W189-A193 WeakPolarHBondContact O-CB 3.46Å; W189-A193 PolarHBondContact O-N 3.02Å; L190-A193 PolarHBondContact O-N 3.39Å; V191-A193 VanDerWaalsContact C-N 3.33Å; V191-A193 PolarHBondContact O-N 2.92Å; A193-S196 WeakPolarHBondContact CA-OG 3.43Å; A193-S196 PolarHBondContact O-N 3.41Å; A193-S196 PolarHBondContact O-OG 3.43Å; A193-F197 WeakPolarHBondContact O-CA 3.26Å; A193-F197 WeakPolarHBondContact O-CB 3.48Å; A193-F197 PolarHBondContact O-N 2.95Å
194L77.6Confident72.5Confident119 Ų11997.2 Ų97.262%0.62352%0.515SS*.Hα-helixtrans-68.8-39.6175.9-73.9169.3000111.2L190 V191 G198L190-L194 VanDerWaalsContact O-CB 3.3Å; L190-L194 WeakPolarHBondContact O-CB 3.4Å; L190-L194 WeakPolarHBondContact O-CG 3.27Å; L190-L194 PolarHBondContact O-N 3.29Å; V191-L194 PolarHBondContact O-N 2.84Å; L194-G198 PolarHBondContact O-N 3.42Å
195C78.8Confident74Confident78 Ų78100.2 Ų100.253%0.52751%0.51SS..Hα-helixtrans-67.1-42.1173.8-73.20000111.9V191 A192 R199V191-C195 WeakPolarHBondContact O-CB 3.34Å; V191-C195 PolarHBondContact O-N 3.22Å; V191-C195 PolarHBondContact O-SG 3.45Å; V191-C195 VanDerWaalsContact O-SG 3.33Å; A192-C195 PolarHBondContact O-N 2.83Å; C195-R199 WeakPolarHBondContact O-CB 3.49Å; C195-R199 VanDerWaalsContact O-CG 3.23Å; C195-R199 WeakPolarHBondContact O-CG 3.22Å; C195-R199 PolarHBondContact O-N 3.42Å
196S77.8Confident75.4Confident69 Ų69103.1 Ų103.148%0.48352%0.519SS..Hα-helixtrans-69.6-40.7177.168.60000111.4A192 A193 R199 F200A192-S196 VanDerWaalsContact O-CB 3.27Å; A192-S196 WeakPolarHBondContact O-CB 3.43Å; A192-S196 PolarHBondContact O-N 2.91Å; A192-S196 PolarHBondContact O-OG 3.4Å; A192-S196 VanDerWaalsContact O-OG 3.11Å; A193-S196 WeakPolarHBondContact CA-OG 3.43Å; A193-S196 PolarHBondContact O-N 3.41Å; A193-S196 PolarHBondContact O-OG 3.43Å; S196-R199 PolarHBondContact O-N 2.9Å; S196-F200 WeakPolarHBondContact O-CB 3.17Å; S196-F200 PolarHBondContact O-N 3.28Å
197F83Confident76.8Confident117 Ų11798.8 Ų98.851%0.51352%0.515SS..Hα-helixtrans-63.3-43.6173.9-174.6-107.4000111.5A193 R199 F200 L201A193-F197 WeakPolarHBondContact O-CA 3.26Å; A193-F197 WeakPolarHBondContact O-CB 3.48Å; A193-F197 PolarHBondContact O-N 2.95Å; F197-R199 PolarHBondContact O-N 2.88Å; F197-F200 PolarHBondContact O-N 3.17Å; F197-L201 HydrophobicContact CD1-CD1 3.72Å; F197-L201 HydrophobicContact CD1-CG 4.19Å; F197-L201 HydrophobicContact CE1-CD1 3.3Å; F197-L201 HydrophobicContact CE1-CD2 4.45Å; F197-L201 HydrophobicContact CE1-CG 3.91Å; F197-L201 HydrophobicContact CE2-CG 4.4Å; F197-L201 HydrophobicContact CZ-CD1 3.82Å; F197-L201 HydrophobicContact CZ-CD2 4.12Å; F197-L201 HydrophobicContact CZ-CG 4.01Å; F197-L201 WeakPolarHBondContact O-CB 3.31Å; F197-L201 WeakPolarHBondContact O-CG 3.34Å; F197-L201 PolarHBondContact O-N 3Å
198G79.4Confident78Confident36 Ų36102.8 Ų102.837%0.37153%0.532SS..Hα-helixtrans-61.9-40.8174.500000112.7L194 K202L194-G198 PolarHBondContact O-N 3.42Å; G198-K202 WeakPolarHBondContact O-CB 3.48Å; G198-K202 PolarHBondContact O-N 2.93Å
199R79.7Confident78.2Confident198 Ų198101.4 Ų101.475%0.74753%0.528SS*.Hα-helixtrans-66.8-39.5174.3-71.2172.674.91264.1112C195 S196 F197 K202 A203C195-R199 WeakPolarHBondContact O-CB 3.49Å; C195-R199 VanDerWaalsContact O-CG 3.23Å; C195-R199 WeakPolarHBondContact O-CG 3.22Å; C195-R199 PolarHBondContact O-N 3.42Å; S196-R199 PolarHBondContact O-N 2.9Å; F197-R199 PolarHBondContact O-N 2.88Å; R199-K202 PolarHBondContact O-N 3.15Å; R199-A203 WeakPolarHBondContact O-CB 3.47Å; R199-A203 PolarHBondContact O-N 2.7Å
200F83.9Confident77.9Confident142 Ų14297.7 Ų97.762%0.62353%0.527SS*.Hα-helixtrans-65.7-47176.6-175.4-92.8000111.5S196 F197 K202 A203 A204S196-F200 WeakPolarHBondContact O-CB 3.17Å; S196-F200 PolarHBondContact O-N 3.28Å; F197-F200 PolarHBondContact O-N 3.17Å; F200-K202 VanDerWaalsContact C-N 3.31Å; F200-K202 PolarHBondContact O-N 3.41Å; F200-A203 PolarHBondContact O-N 2.98Å; F200-A204 VanDerWaalsContact O-CB 3.27Å; F200-A204 WeakPolarHBondContact O-CB 3.48Å; F200-A204 PolarHBondContact O-N 3.45Å
201L84Confident77.8Confident89 Ų89103.1 Ų103.147%0.46655%0.55SS.*Hα-helixtrans-59.5-41.7174.9-76.3-179.9000111.8F197 A204 F205F197-L201 HydrophobicContact CD1-CD1 3.72Å; F197-L201 HydrophobicContact CD1-CG 4.19Å; F197-L201 HydrophobicContact CE1-CD1 3.3Å; F197-L201 HydrophobicContact CE1-CD2 4.45Å; F197-L201 HydrophobicContact CE1-CG 3.91Å; F197-L201 HydrophobicContact CE2-CG 4.4Å; F197-L201 HydrophobicContact CZ-CD1 3.82Å; F197-L201 HydrophobicContact CZ-CD2 4.12Å; F197-L201 HydrophobicContact CZ-CG 4.01Å; F197-L201 WeakPolarHBondContact O-CB 3.31Å; F197-L201 WeakPolarHBondContact O-CG 3.34Å; F197-L201 PolarHBondContact O-N 3Å; L201-A204 PolarHBondContact O-N 2.92Å; L201-F205 VanDerWaalsContact O-CB 3.28Å; L201-F205 WeakPolarHBondContact O-CB 3.3Å; L201-F205 PolarHBondContact O-N 2.93Å
202K79.9Confident76.8Confident144 Ų144114.9 Ų114.963%0.62659%0.587SS**Hα-helixtrans-64.4-46.1177.1-151.8-177-169.6-176.90111.2G198 R199 F200 F205 F206G198-K202 WeakPolarHBondContact O-CB 3.48Å; G198-K202 PolarHBondContact O-N 2.93Å; R199-K202 PolarHBondContact O-N 3.15Å; F200-K202 VanDerWaalsContact C-N 3.31Å; F200-K202 PolarHBondContact O-N 3.41Å; K202-F205 PolarHBondContact O-N 3.34Å; K202-F206 HydrophobicContact CG-CD2 4.37Å; K202-F206 HydrophobicContact CG-CE2 4.24Å; K202-F206 VanDerWaalsContact O-CD2 3.27Å; K202-F206 WeakPolarHBondContact O-CD2 3.39Å; K202-F206 PolarHBondContact O-N 3.45Å; K202-F206 VanDerWaalsContact O-N 3.09Å
203A83.3Confident77.1Confident54 Ų54118.5 Ų118.545%0.44660%0.599SS.*Hα-helixtrans-63.2-43.8176.500000112R199 F200 F205 F206 V207R199-A203 WeakPolarHBondContact O-CB 3.47Å; R199-A203 PolarHBondContact O-N 2.7Å; F200-A203 PolarHBondContact O-N 2.98Å; A203-F205 PolarHBondContact O-N 3.41Å; A203-F206 PolarHBondContact O-N 3.25Å; A203-V207 WeakPolarHBondContact O-CG2 3.42Å; A203-V207 PolarHBondContact O-N 2.93Å
204A83.1Confident77Confident26 Ų26122.4 Ų122.422%0.21561%0.611CS.*Hα-helixtrans-62.7-41.2176.200000111.6F200 L201 F206 V207 L208F200-A204 VanDerWaalsContact O-CB 3.27Å; F200-A204 WeakPolarHBondContact O-CB 3.48Å; F200-A204 PolarHBondContact O-N 3.45Å; L201-A204 PolarHBondContact O-N 2.92Å; A204-F206 PolarHBondContact O-N 2.98Å; A204-V207 PolarHBondContact O-N 3.23Å; A204-L208 HydrophobicContact CB-CD1 4.26Å; A204-L208 WeakPolarHBondContact O-CB 3.29Å; A204-L208 VanDerWaalsContact O-CG 3.31Å; A204-L208 WeakPolarHBondContact O-CG 3.29Å; A204-L208 PolarHBondContact O-N 3.36Å
205F81.4Confident77Confident129 Ų129122.6 Ų122.657%0.56661%0.61SS**Hα-helixtrans-58.6-46.4173.9-178.5-88000111.7L201 K202 A203 V207 L209L201-F205 VanDerWaalsContact O-CB 3.28Å; L201-F205 WeakPolarHBondContact O-CB 3.3Å; L201-F205 PolarHBondContact O-N 2.93Å; K202-F205 PolarHBondContact O-N 3.34Å; A203-F205 PolarHBondContact O-N 3.41Å; F205-V207 VanDerWaalsContact C-N 3.32Å; F205-V207 PolarHBondContact O-N 3.42Å; F205-L209 HydrophobicContact CD1-CD1 4Å; F205-L209 HydrophobicContact CD2-CD1 3.45Å; F205-L209 VanDerWaalsContact CD2-CD1 3.45Å; F205-L209 HydrophobicContact CE1-CD1 3.66Å; F205-L209 HydrophobicContact CE2-CD1 3.09Å; F205-L209 HydrophobicContact CG-CD1 3.9Å; F205-L209 HydrophobicContact CZ-CD1 3.2Å; F205-L209 WeakPolarHBondContact O-CB 3.43Å; F205-L209 PolarHBondContact O-N 3.44Å
206F80.7Confident76.9Confident155 Ų155125.2 Ų125.268%0.6862%0.615SS**Hα-helixtrans-66.5-29177.2-87.2-74.6000114K202 A203 A204K202-F206 HydrophobicContact CG-CD2 4.37Å; K202-F206 HydrophobicContact CG-CE2 4.24Å; K202-F206 VanDerWaalsContact O-CD2 3.27Å; K202-F206 WeakPolarHBondContact O-CD2 3.39Å; K202-F206 PolarHBondContact O-N 3.45Å; K202-F206 VanDerWaalsContact O-N 3.09Å; A203-F206 PolarHBondContact O-N 3.25Å; A204-F206 PolarHBondContact O-N 2.98Å
207V81.1Confident76.9Confident115 Ų115128.8 Ų128.870%0.69762%0.624SS**Hα-helixtrans-88.6-35.7-179.8173.70000112.3A203 A204 F205A203-V207 WeakPolarHBondContact O-CG2 3.42Å; A203-V207 PolarHBondContact O-N 2.93Å; A204-V207 PolarHBondContact O-N 3.23Å; F205-V207 VanDerWaalsContact C-N 3.32Å; F205-V207 PolarHBondContact O-N 3.42Å
208L77.9Confident76.5Confident136 Ų136129.5 Ų129.571%0.71263%0.631SS**Hα-helixtrans-93-11.6-174.5-66173.3000114.2A204 P210A204-L208 HydrophobicContact CB-CD1 4.26Å; A204-L208 WeakPolarHBondContact O-CB 3.29Å; A204-L208 VanDerWaalsContact O-CG 3.31Å; A204-L208 WeakPolarHBondContact O-CG 3.29Å; A204-L208 PolarHBondContact O-N 3.36Å; L208-P210 WeakPolarHBondContact O-CD 3.24Å
209L66.7Low76.2Confident100 Ų100136.2 Ų136.252%0.52465%0.649SS.*  trans-100.477.9161-70.4162.1000108.8F205 E211F205-L209 HydrophobicContact CD1-CD1 4Å; F205-L209 HydrophobicContact CD2-CD1 3.45Å; F205-L209 VanDerWaalsContact CD2-CD1 3.45Å; F205-L209 HydrophobicContact CE1-CD1 3.66Å; F205-L209 HydrophobicContact CE2-CD1 3.09Å; F205-L209 HydrophobicContact CG-CD1 3.9Å; F205-L209 HydrophobicContact CZ-CD1 3.2Å; F205-L209 WeakPolarHBondContact O-CB 3.43Å; F205-L209 PolarHBondContact O-N 3.44Å; L209-E211 PolarHBondContact O-N 3.47Å
210P66.6Low76Confident103 Ų103131.5 Ų131.567%0.66964%0.642SS**  trans-56124.1156.86-1.3000107L208 R212L208-P210 WeakPolarHBondContact O-CD 3.24Å; P210-R212 PolarHBondContact O-N 2.8Å; P210-R212 VanDerWaalsContact O-N 3.16Å
211E69.9Low75.3Confident195 Ų195130.6 Ų130.691%0.91164%0.644SS**  trans-49.1124.3170.7-65.7-155.8160.500108.8L209L209-E211 PolarHBondContact O-N 3.47Å
212R49.3Very low74.5Confident321 Ų321134.4 Ų134.4100%1.21166%0.66SS**  trans-78.30163.5-77.8-164.6176.6-179.8-0.5109.4P210P210-R212 PolarHBondContact O-N 2.8Å; P210-R212 VanDerWaalsContact O-N 3.16Å

Retrieved 212 of 212 residues in 533.4 ms (Link to these results)