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ADP/ATP translocase 1

ADP:ATP antiporter that mediates import of ADP into the mitochondrial matrix for ATP synthesis, and export of ATP out to fuel the cell (By similarity). Cycles between the cytoplasmic-open state (c-state) and the matrix-open state (m-state): operates by the alternating access mechanism with a single substrate-binding site intermittently exposed to either the cytosolic (c-state) or matrix (m-state) side of the inner mitochondrial membrane (By similarity). Substrate exchange across the membrane occurs consecutively with one substrate being transported first, then dissociating from the substrate binding site before the second substrate binds for transport in the opposite direction (By similarity). In addition to its ADP:ATP antiporter activity, also involved in mitochondrial uncoupling and mitochondrial permeability transition pore (mPTP) activity (By similarity). Plays a role in mitochondrial uncoupling by acting as a proton transporter: proton transport uncouples the proton flows via the electron transport chain and ATP synthase to reduce the efficiency of ATP production and cause mitochondrial thermogenesis1. Proton transporter activity is inhibited by ADP:ATP antiporter activity, suggesting that SLC25A4/ANT1 acts as a master regulator of mitochondrial energy output by maintaining a delicate balance between ATP production (ADP:ATP antiporter activity) and thermogenesis (proton transporter activity) (By similarity). Proton transporter activity requires free fatty acids as cofactor, but does not transport it2. Probably mediates mitochondrial uncoupling in tissues that do not express UCP1 (By similarity). Also plays a key role in mPTP opening, a non-specific pore that enables free passage of the mitochondrial membranes to solutes of up to 1.5 kDa, and which contributes to cell death (By similarity). It is however unclear if SLC25A4/ANT1 constitutes a pore-forming component of mPTP or regulates it (By similarity). Acts as a regulator of mitophagy independently of ADP:ATP antiporter activity: promotes mitophagy via interaction with TIMM44, leading to inhibit the presequence translocase TIMM23, thereby promoting stabilization of PINK1 (By similarity).

AlphaFold DB , UniProt , Accession P02722, Species BOVIN (Bos taurus, Bovine), Gene SLC25A4, Length 298 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
1M58.7Low83.3Confident162 Ų162102.5 Ų102.580%0.79854%0.539SS*.  0136.40-88.416857.400107.5A5 L6 L9M1-A5 HydrophobicContact CB-CB 4.31Å; M1-A5 HydrophobicContact CE-CB 4.23Å; M1-A5 HydrophobicContact CG-CB 4.36Å; M1-L6 HydrophobicContact CE-CB 3.86Å; M1-L6 HydrophobicContact CE-CD1 3.85Å; M1-L6 HydrophobicContact CE-CG 4.49Å; M1-L9 HydrophobicContact CE-CB 4.39Å; M1-L9 HydrophobicContact CE-CD2 4.03Å
2S82Confident83.4Confident72 Ų7298 Ų9850%0.50351%0.512SS..  trans-66.4155.1169.258.90000110.1Q4 A5 L6S2-Q4 PolarHBondContact O-N 3.22Å; S2-Q4 VanDerWaalsContact O-N 3.14Å; S2-A5 WeakPolarHBondContact O-CB 3.13Å; S2-A5 PolarHBondContact O-N 3.41Å; S2-A5 PolarHBondContact OG-N 3.33Å; S2-L6 PolarHBondContact O-N 3.22Å; S2-L6 VanDerWaalsContact O-N 3.07Å
3D87.1Confident83.7Confident139 Ų13997.4 Ų97.474%0.74351%0.509SS*.Hα-helixtrans-54.3-33.9177.1-68.3-28.7000112.3L6 S7D3-L6 PolarHBondContact O-N 3.37Å; D3-S7 VanDerWaalsContact O-CB 3.31Å; D3-S7 WeakPolarHBondContact O-CB 3.31Å; D3-S7 PolarHBondContact O-N 3.19Å
4Q85.8Confident83.9Confident163 Ų16392.8 Ų92.876%0.76249%0.492SS*.Hα-helixtrans-63.5-44.1174.1-67.8179.3-1200112.5S2 L6 S7 F8S2-Q4 PolarHBondContact O-N 3.22Å; S2-Q4 VanDerWaalsContact O-N 3.14Å; Q4-L6 VanDerWaalsContact C-N 3.32Å; Q4-L6 PolarHBondContact O-N 2.74Å; Q4-S7 PolarHBondContact O-N 2.85Å; Q4-F8 WeakPolarHBondContact O-CB 3.4Å; Q4-F8 PolarHBondContact O-N 3.36Å
5A86.7Confident84.1Confident38 Ų3888.2 Ų88.231%0.31448%0.476SS..Hα-helixtrans-66-37.2177.700000111.5M1 S2 L9M1-A5 HydrophobicContact CB-CB 4.31Å; M1-A5 HydrophobicContact CE-CB 4.23Å; M1-A5 HydrophobicContact CG-CB 4.36Å; S2-A5 WeakPolarHBondContact O-CB 3.13Å; S2-A5 PolarHBondContact O-N 3.41Å; S2-A5 PolarHBondContact OG-N 3.33Å; A5-L9 WeakPolarHBondContact O-CB 3.12Å; A5-L9 PolarHBondContact O-N 3.04Å
6L88.1Confident84.5Confident72 Ų7282.8 Ų82.838%0.37745%0.447SS..Hα-helixtrans-69-44.1176.2-174.961.9000112.1M1 S2 D3 Q4 L9 K10M1-L6 HydrophobicContact CE-CB 3.86Å; M1-L6 HydrophobicContact CE-CD1 3.85Å; M1-L6 HydrophobicContact CE-CG 4.49Å; S2-L6 PolarHBondContact O-N 3.22Å; S2-L6 VanDerWaalsContact O-N 3.07Å; D3-L6 PolarHBondContact O-N 3.37Å; Q4-L6 VanDerWaalsContact C-N 3.32Å; Q4-L6 PolarHBondContact O-N 2.74Å; L6-L9 PolarHBondContact O-N 2.93Å; L6-K10 WeakPolarHBondContact O-CG 3.26Å; L6-K10 PolarHBondContact O-N 2.9Å
7S86.2Confident84.8Confident63 Ų6382.6 Ų82.644%0.44145%0.449SS..Hα-helixtrans-59.5-49175.4-173.60000111.2D3 Q4 L9 K10 D11D3-S7 VanDerWaalsContact O-CB 3.31Å; D3-S7 WeakPolarHBondContact O-CB 3.31Å; D3-S7 PolarHBondContact O-N 3.19Å; Q4-S7 PolarHBondContact O-N 2.85Å; S7-L9 VanDerWaalsContact C-N 3.34Å; S7-L9 PolarHBondContact O-N 3.39Å; S7-K10 PolarHBondContact O-N 3.15Å; S7-D11 PolarHBondContact O-N 3.35Å
8F84.2Confident85Confident108 Ų10878.6 Ų78.647%0.47443%0.429SS..Hα-helixtrans-57.1-45.2175.7175.1-96.6000112.4Q4 K10 D11 F12Q4-F8 WeakPolarHBondContact O-CB 3.4Å; Q4-F8 PolarHBondContact O-N 3.36Å; F8-K10 PolarHBondContact O-N 3.44Å; F8-D11 PolarHBondContact O-N 3.47Å; F8-F12 WeakPolarHBondContact O-CB 3.31Å; F8-F12 PolarHBondContact O-N 3.45Å
9L86.4Confident85.3Confident71 Ų7174.8 Ų74.837%0.37241%0.409SS..Hα-helixtrans-63.5-41.9178.8-177.562.7000111.6M1 A5 L6 S7 F12 L13M1-L9 HydrophobicContact CE-CB 4.39Å; M1-L9 HydrophobicContact CE-CD2 4.03Å; A5-L9 WeakPolarHBondContact O-CB 3.12Å; A5-L9 PolarHBondContact O-N 3.04Å; L6-L9 PolarHBondContact O-N 2.93Å; S7-L9 VanDerWaalsContact C-N 3.34Å; S7-L9 PolarHBondContact O-N 3.39Å; L9-F12 PolarHBondContact O-N 2.82Å; L9-L13 HydrophobicContact CD1-CD1 4.01Å; L9-L13 HydrophobicContact CD1-CG 4.08Å; L9-L13 HydrophobicContact CG-CD1 3.95Å; L9-L13 HydrophobicContact CG-CG 4.39Å; L9-L13 WeakPolarHBondContact O-CB 3.25Å; L9-L13 VanDerWaalsContact O-CG 3.23Å; L9-L13 WeakPolarHBondContact O-CG 3.09Å; L9-L13 PolarHBondContact O-N 3.5Å
10K87.2Confident85.7Confident133 Ų13372.4 Ų72.458%0.57840%0.399SS*.Hα-helixtrans-60.8-48.4176.1-74.7177178.6-179.10111.3L6 S7 F8 L13 A14L6-K10 WeakPolarHBondContact O-CG 3.26Å; L6-K10 PolarHBondContact O-N 2.9Å; S7-K10 PolarHBondContact O-N 3.15Å; F8-K10 PolarHBondContact O-N 3.44Å; K10-L13 PolarHBondContact O-N 2.94Å; K10-A14 VanDerWaalsContact O-CB 3.28Å; K10-A14 WeakPolarHBondContact O-CB 3.35Å; K10-A14 PolarHBondContact O-N 2.88Å
11D84Confident86Confident106 Ų10672.8 Ų72.857%0.56740%0.4SS*.Hα-helixtrans-65.1-41.6179.3-73.3-19.2000112.2S7 F8 A14 G15S7-D11 PolarHBondContact O-N 3.35Å; F8-D11 PolarHBondContact O-N 3.47Å; D11-A14 PolarHBondContact O-N 3.27Å; D11-G15 PolarHBondContact O-N 3.37Å
12F84.5Confident87.6Confident49 Ų4965.7 Ų65.722%0.21537%0.367CS..Hα-helixtrans-62.9-44.8177.1-178.3-100.1000111.9F8 L9 G16 F82 Q85F8-F12 WeakPolarHBondContact O-CB 3.31Å; F8-F12 PolarHBondContact O-N 3.45Å; L9-F12 PolarHBondContact O-N 2.82Å; F12-G16 PolarHBondContact O-N 3.19Å; F12-F82 AromaticContact CE1-CD1 3.73Å; F12-F82 HydrophobicContact CE1-CD1 3.73Å; F12-F82 HydrophobicContact CE1-CE1 4.39Å; F12-F82 HydrophobicContact CZ-CB 4.27Å; F12-F82 AromaticContact CZ-CD1 3.79Å; F12-F82 HydrophobicContact CZ-CD1 3.79Å; F12-Q85 HydrophobicContact CE2-CB 4.14Å
13L87.5Confident88.2Confident90 Ų9064 Ų6447%0.47135%0.35SS..Hα-helixtrans-68.4-43.8177.6-70.7175.5000111.7L9 K10 G15 G16 V17L9-L13 HydrophobicContact CD1-CD1 4.01Å; L9-L13 HydrophobicContact CD1-CG 4.08Å; L9-L13 HydrophobicContact CG-CD1 3.95Å; L9-L13 HydrophobicContact CG-CG 4.39Å; L9-L13 WeakPolarHBondContact O-CB 3.25Å; L9-L13 VanDerWaalsContact O-CG 3.23Å; L9-L13 WeakPolarHBondContact O-CG 3.09Å; L9-L13 PolarHBondContact O-N 3.5Å; K10-L13 PolarHBondContact O-N 2.94Å; L13-G15 PolarHBondContact O-N 3.07Å; L13-G16 WeakPolarHBondContact O-CA 3.34Å; L13-G16 PolarHBondContact O-N 3.48Å; L13-G16 VanDerWaalsContact O-N 3.13Å; L13-V17 WeakPolarHBondContact O-CG2 2.98Å; L13-V17 PolarHBondContact O-N 2.7Å
14A86.5Confident88.6Confident33 Ų3360 Ų6027%0.27333%0.33SS..Hα-helixtrans-60.2-45.5176.500000111.5K10 D11 G16 V17 A18K10-A14 VanDerWaalsContact O-CB 3.28Å; K10-A14 WeakPolarHBondContact O-CB 3.35Å; K10-A14 PolarHBondContact O-N 2.88Å; D11-A14 PolarHBondContact O-N 3.27Å; A14-G16 VanDerWaalsContact C-N 3.32Å; A14-G16 PolarHBondContact O-N 2.76Å; A14-V17 PolarHBondContact O-N 3.16Å; A14-A18 WeakPolarHBondContact O-CB 3.39Å; A14-A18 PolarHBondContact O-N 3.43Å
15G86.6Confident89Confident24 Ų2454.9 Ų54.925%0.24732%0.317CS..Hα-helixtrans-62.2-38.4173.400000112.8D11 L13 A19 Y81D11-G15 PolarHBondContact O-N 3.37Å; L13-G15 PolarHBondContact O-N 3.07Å; G15-A19 VanDerWaalsContact O-CB 3.22Å; G15-A19 WeakPolarHBondContact O-CB 3.48Å; G15-A19 PolarHBondContact O-N 2.9Å; G15-Y81 PolarHBondContact O-OH 2.87Å
16G89.9Confident89.5Confident1 Ų153.8 Ų53.81%0.0131%0.306CS..Hα-helixtrans-61.4-45.6174.200000113.5F12 L13 A14 A19 A20F12-G16 PolarHBondContact O-N 3.19Å; L13-G16 WeakPolarHBondContact O-CA 3.34Å; L13-G16 PolarHBondContact O-N 3.48Å; L13-G16 VanDerWaalsContact O-N 3.13Å; A14-G16 VanDerWaalsContact C-N 3.32Å; A14-G16 PolarHBondContact O-N 2.76Å; G16-A19 PolarHBondContact O-N 3.28Å; G16-A20 WeakPolarHBondContact O-CB 3.12Å; G16-A20 PolarHBondContact O-N 3.25Å
17V89.8Confident89.9Confident81 Ų8150.6 Ų50.649%0.49129%0.29SS..Hα-helixtrans-65.5-49.3177.2172.50000110.8L13 A14 A19 A20 I21L13-V17 WeakPolarHBondContact O-CG2 2.98Å; L13-V17 PolarHBondContact O-N 2.7Å; A14-V17 PolarHBondContact O-N 3.16Å; V17-A19 VanDerWaalsContact C-N 3.27Å; V17-A19 PolarHBondContact O-N 3.13Å; V17-A20 WeakPolarHBondContact O-CB 3.4Å; V17-A20 PolarHBondContact O-N 3.36Å; V17-I21 HydrophobicContact CG1-CD1 3.89Å; V17-I21 HydrophobicContact CG1-CG1 4.48Å; V17-I21 WeakPolarHBondContact O-CG1 3.35Å; V17-I21 PolarHBondContact O-N 2.9Å
18A89.3Confident90.4Very high10 Ų1049.2 Ų49.28%0.08328%0.279CS..Hα-helixtrans-57.3-42.2177.100000111.6A14 I21 S22 L288 Y291A14-A18 WeakPolarHBondContact O-CB 3.39Å; A14-A18 PolarHBondContact O-N 3.43Å; A18-I21 PolarHBondContact O-N 2.65Å; A18-S22 WeakPolarHBondContact O-CB 3.36Å; A18-S22 PolarHBondContact O-N 3.22Å; A18-L288 HydrophobicContact CB-CD2 4.33Å; A18-Y291 HydrophobicContact CB-CD1 3.91Å; A18-Y291 HydrophobicContact CB-CE1 3.76Å; A18-Y291 HydrophobicContact CB-CE2 4.39Å; A18-Y291 HydrophobicContact CB-CG 4.28Å
19A90.3Very high91Very high7 Ų745.7 Ų45.76%0.05827%0.265CS..Hα-helixtrans-67.6-37.4175.800000113.1G15 G16 V17 K23 Y81G15-A19 VanDerWaalsContact O-CB 3.22Å; G15-A19 WeakPolarHBondContact O-CB 3.48Å; G15-A19 PolarHBondContact O-N 2.9Å; G16-A19 PolarHBondContact O-N 3.28Å; V17-A19 VanDerWaalsContact C-N 3.27Å; V17-A19 PolarHBondContact O-N 3.13Å; A19-K23 WeakPolarHBondContact O-CB 3.31Å; A19-K23 WeakPolarHBondContact O-CD 3.37Å; A19-K23 WeakPolarHBondContact O-CG 3.49Å; A19-K23 PolarHBondContact O-N 2.86Å; A19-Y81 HydrophobicContact CB-CD1 3.71Å; A19-Y81 HydrophobicContact CB-CD2 3.5Å; A19-Y81 VanDerWaalsContact CB-CD2 3.5Å; A19-Y81 HydrophobicContact CB-CE1 3.56Å; A19-Y81 HydrophobicContact CB-CE2 3.31Å; A19-Y81 HydrophobicContact CB-CG 3.68Å
20A92.7Very high91.5Very high25 Ų2542.8 Ų42.821%0.20725%0.25CC..Hα-helixtrans-64-44.2175.700000111.3G16 V17 T24 V78G16-A20 WeakPolarHBondContact O-CB 3.12Å; G16-A20 PolarHBondContact O-N 3.25Å; V17-A20 WeakPolarHBondContact O-CB 3.4Å; V17-A20 PolarHBondContact O-N 3.36Å; A20-T24 VanDerWaalsContact O-CB 3.23Å; A20-T24 WeakPolarHBondContact O-CB 3.28Å; A20-T24 PolarHBondContact O-N 3.34Å; A20-T24 PolarHBondContact O-OG1 2.8Å; A20-V78 HydrophobicContact CB-CG1 3.76Å
21I92.4Very high92Very high81 Ų8136.6 Ų36.642%0.41522%0.223SC..Hα-helixtrans-61.5-54.5175.3-66.4168.5000109.9V17 A18 K23 T24 A25 V287V17-I21 HydrophobicContact CG1-CD1 3.89Å; V17-I21 HydrophobicContact CG1-CG1 4.48Å; V17-I21 WeakPolarHBondContact O-CG1 3.35Å; V17-I21 PolarHBondContact O-N 2.9Å; A18-I21 PolarHBondContact O-N 2.65Å; I21-K23 PolarHBondContact O-N 2.67Å; I21-T24 PolarHBondContact O-N 2.94Å; I21-T24 VanDerWaalsContact O-N 3.11Å; I21-A25 WeakPolarHBondContact O-CB 3.33Å; I21-A25 PolarHBondContact O-N 3.12Å; I21-V287 HydrophobicContact CG2-CG1 4.16Å
22S92.5Very high92.7Very high14 Ų1431.6 Ų31.610%0.09820%0.196CC..Hα-helixtrans-56.5-47.9-179.7177.50000112A18 T24 A25 V26 G284A18-S22 WeakPolarHBondContact O-CB 3.36Å; A18-S22 PolarHBondContact O-N 3.22Å; S22-T24 VanDerWaalsContact C-N 3.32Å; S22-T24 PolarHBondContact O-N 2.77Å; S22-A25 PolarHBondContact O-N 2.76Å; S22-V26 WeakPolarHBondContact O-CG2 3.46Å; S22-V26 PolarHBondContact O-N 2.86Å; S22-V26 VanDerWaalsContact O-N 3.13Å; S22-G284 PolarHBondContact OG-O 2.97Å
23K93.7Very high93.3Very high36 Ų3629.6 Ų29.616%0.15719%0.187CC..Hα-helixtrans-63-37.5177.7-76.1172.8178.4-70.70112.9A19 I21 A27 N74 N77 V78A19-K23 WeakPolarHBondContact O-CB 3.31Å; A19-K23 WeakPolarHBondContact O-CD 3.37Å; A19-K23 WeakPolarHBondContact O-CG 3.49Å; A19-K23 PolarHBondContact O-N 2.86Å; I21-K23 PolarHBondContact O-N 2.67Å; K23-A27 WeakPolarHBondContact O-CB 3.3Å; K23-A27 PolarHBondContact O-N 2.98Å; K23-N74 PolarHBondContact O-OD1 3.17Å; K23-N77 WeakPolarHBondContact CD-O 3.16Å; K23-N77 WeakPolarHBondContact CE-O 3.25Å; K23-N77 PolarHBondContact NZ-O 2.75Å; K23-N77 PolarHBondContact NZ-OD1 3.4Å; K23-V78 HydrophobicContact CB-CG2 4.19Å; K23-V78 HydrophobicContact CD-CG2 4.41Å
24T96.1Very high93.8Very high54 Ų5425.4 Ų25.433%0.33117%0.165SC..Hα-helixtrans-71.8-41.4179.1-58.90000111.1A20 I21 S22 V26 A27 W71 N74A20-T24 VanDerWaalsContact O-CB 3.23Å; A20-T24 WeakPolarHBondContact O-CB 3.28Å; A20-T24 PolarHBondContact O-N 3.34Å; A20-T24 PolarHBondContact O-OG1 2.8Å; I21-T24 PolarHBondContact O-N 2.94Å; I21-T24 VanDerWaalsContact O-N 3.11Å; S22-T24 VanDerWaalsContact C-N 3.32Å; S22-T24 PolarHBondContact O-N 2.77Å; T24-V26 VanDerWaalsContact C-N 3.32Å; T24-V26 PolarHBondContact O-N 3.26Å; T24-A27 WeakPolarHBondContact O-CB 3.27Å; T24-A27 PolarHBondContact O-N 3.05Å; T24-W71 PolarHBondContact O-NE1 3.04Å; T24-N74 PolarHBondContact OG1-ND2 3.28Å
25A95.1Very high94.4Very high57 Ų5723.9 Ų23.947%0.47115%0.153SC..Hα-helixtrans-60.1-41.2175.900000112.1I21 S22 V287I21-A25 WeakPolarHBondContact O-CB 3.33Å; I21-A25 PolarHBondContact O-N 3.12Å; S22-A25 PolarHBondContact O-N 2.76Å; A25-V287 HydrophobicContact CB-CG2 3.94Å
26V95.8Very high94.9Very high15 Ų1523.3 Ų23.39%0.09114%0.144CC..THydrogen-bonded Turntrans-93.23.3-179.5-51.70000114.5S22 T24 P28 I29 E30 R280S22-V26 WeakPolarHBondContact O-CG2 3.46Å; S22-V26 PolarHBondContact O-N 2.86Å; S22-V26 VanDerWaalsContact O-N 3.13Å; T24-V26 VanDerWaalsContact C-N 3.32Å; T24-V26 PolarHBondContact O-N 3.26Å; V26-P28 VanDerWaalsContact C-CD 3.49Å; V26-I29 HydrophobicContact CB-CG2 4.27Å; V26-I29 WeakPolarHBondContact O-CG2 3.17Å; V26-I29 PolarHBondContact O-N 3.1Å; V26-E30 PolarHBondContact O-N 2.67Å; V26-R280 HydrophobicContact CB-CG 3.92Å; V26-R280 HydrophobicContact CG2-CG 3.68Å
27A96.9Very high95.3Very high5 Ų523.3 Ų23.34%0.04114%0.143CC..Hα-helixtrans-60.1-39.5-178.500000113.8K23 T24 I29 E30 R31 W71 N74K23-A27 WeakPolarHBondContact O-CB 3.3Å; K23-A27 PolarHBondContact O-N 2.98Å; T24-A27 WeakPolarHBondContact O-CB 3.27Å; T24-A27 PolarHBondContact O-N 3.05Å; A27-I29 PolarHBondContact O-N 3.36Å; A27-E30 PolarHBondContact O-N 3.41Å; A27-R31 PolarHBondContact O-N 3.41Å; A27-W71 VanDerWaalsContact CB-CD1 3.42Å; A27-W71 HydrophobicContact CB-CG 4.17Å; A27-N74 HydrophobicContact CB-CB 3.96Å
28P97.6Very high95.7Very high33 Ų3319.5 Ų19.521%0.21412%0.12CC..Hα-helixtrans-58.3-46.2178.9-2736000113.4V26 R31 V32 F70 W71V26-P28 VanDerWaalsContact C-CD 3.49Å; P28-R31 WeakPolarHBondContact O-CB 3.11Å; P28-R31 PolarHBondContact O-N 3.16Å; P28-V32 WeakPolarHBondContact O-CG2 3.38Å; P28-V32 PolarHBondContact O-N 3.4Å; P28-F70 HydrophobicContact CB-CB 3.94Å; P28-F70 HydrophobicContact CB-CD1 3.85Å; P28-F70 HydrophobicContact CB-CG 4.02Å; P28-F70 HydrophobicContact CG-CB 4.07Å; P28-W71 HydrophobicContact CG-CD2 4.48Å; P28-W71 HydrophobicContact CG-CH2 3.9Å; P28-W71 HydrophobicContact CG-CZ2 3.59Å; P28-W71 HydrophobicContact CG-CZ3 4.45Å
29I96.8Very high96Very high35 Ų3519.3 Ų19.318%0.17912%0.118CC..Hα-helixtrans-72.2-31.1179.5-170.860.6000112V26 A27 V32 K33 I54 S276 L279 R280V26-I29 HydrophobicContact CB-CG2 4.27Å; V26-I29 WeakPolarHBondContact O-CG2 3.17Å; V26-I29 PolarHBondContact O-N 3.1Å; A27-I29 PolarHBondContact O-N 3.36Å; I29-V32 HydrophobicContact CD1-CB 4.33Å; I29-V32 HydrophobicContact CD1-CG1 4.5Å; I29-V32 PolarHBondContact O-N 3.26Å; I29-K33 PolarHBondContact O-N 3.42Å; I29-I54 HydrophobicContact CD1-CG2 4.22Å; I29-S276 WeakPolarHBondContact CG1-O 3.42Å; I29-L279 HydrophobicContact CD1-CD1 4.38Å; I29-L279 HydrophobicContact CG1-CB 4.17Å; I29-R280 HydrophobicContact CG2-CB 3.86Å; I29-R280 HydrophobicContact CG2-CG 4.27Å
30E96.7Very high96.3Very high9 Ų921.2 Ų21.24%0.04213%0.125CC..Hα-helixtrans-65.7-39.6170.8-179.474.7152.400111.9V26 A27 V32 K33 L34 R138 R280V26-E30 PolarHBondContact O-N 2.67Å; A27-E30 PolarHBondContact O-N 3.41Å; E30-V32 VanDerWaalsContact C-N 3.31Å; E30-V32 PolarHBondContact O-N 3.28Å; E30-K33 WeakPolarHBondContact O-CB 3.42Å; E30-K33 PolarHBondContact O-N 3.34Å; E30-K33 VanDerWaalsContact OE2-CD 3.25Å; E30-K33 WeakPolarHBondContact OE2-CD 3.21Å; E30-L34 HydrophobicContact CG-CD1 4.03Å; E30-L34 WeakPolarHBondContact O-CG 3.47Å; E30-L34 PolarHBondContact O-N 2.81Å; E30-R138 IonicContact OE1-CZ 3.82Å; E30-R138 IonicContact OE1-NE 3.4Å; E30-R138 IonicContact OE1-NH1 3.6Å; E30-R138 PolarHBondContact OE1-NH1 3.47Å; E30-R138 IonicContact OE1-NH2 3.89Å; E30-R138 PolarHBondContact OE1-NH2 2.93Å; E30-R280 VanDerWaalsContact CD-CD 3.49Å; E30-R280 WeakPolarHBondContact OE2-CD 3.05Å; E30-R280 IonicContact OE2-NE 2.73Å; E30-R280 PolarHBondContact OE2-NE 2.92Å
31R97.7Very high96.4Very high4 Ų420 Ų202%0.01512%0.115CC..Hα-helixtrans-60.8-43.8174.5174.765.1-174.8-158.712.3110.5A27 P28 L34 L35 I61 Q65 F70 L141 A142 D144A27-R31 PolarHBondContact O-N 3.41Å; P28-R31 WeakPolarHBondContact O-CB 3.11Å; P28-R31 PolarHBondContact O-N 3.16Å; R31-L34 PolarHBondContact O-N 3.41Å; R31-L35 HydrophobicContact CG-CD1 4.18Å; R31-L35 WeakPolarHBondContact O-CG 3.23Å; R31-L35 PolarHBondContact O-N 2.79Å; R31-I61 HydrophobicContact CG-CD1 4.45Å; R31-Q65 VanDerWaalsContact NH2-OE1 3.12Å; R31-F70 VanDerWaalsContact CB-O 3.26Å; R31-F70 WeakPolarHBondContact CB-O 3.32Å; R31-L141 PolarHBondContact NH1-O 3.31Å; R31-A142 VanDerWaalsContact CD-O 3.25Å; R31-A142 WeakPolarHBondContact CD-O 3.31Å; R31-A142 PolarHBondContact NE-O 3.27Å; R31-A142 PolarHBondContact NH1-O 3.33Å; R31-A142 PolarHBondContact NH2-O 3.15Å; R31-D144 PolarHBondContact NH2-O 2.97Å
32V97.9Very high96.5Very high1 Ų116.9 Ų16.91%0.00610%0.101CC..Hα-helixtrans-60.2-46.5174.3173.20000111.4P28 I29 E30 L34 L35 L36 I54 C57 V58 I61 F70P28-V32 WeakPolarHBondContact O-CG2 3.38Å; P28-V32 PolarHBondContact O-N 3.4Å; I29-V32 HydrophobicContact CD1-CB 4.33Å; I29-V32 HydrophobicContact CD1-CG1 4.5Å; I29-V32 PolarHBondContact O-N 3.26Å; E30-V32 VanDerWaalsContact C-N 3.31Å; E30-V32 PolarHBondContact O-N 3.28Å; V32-L34 PolarHBondContact O-N 3.22Å; V32-L35 PolarHBondContact O-N 3.16Å; V32-L36 HydrophobicContact CG1-CD1 3.83Å; V32-L36 HydrophobicContact CG1-CG 4.37Å; V32-L36 WeakPolarHBondContact O-CG 3.37Å; V32-L36 PolarHBondContact O-N 3.35Å; V32-I54 HydrophobicContact CG1-CB 4.3Å; V32-I54 HydrophobicContact CG1-CG1 4.25Å; V32-I54 HydrophobicContact CG1-CG2 4.08Å; V32-C57 HydrophobicContact CB-CB 4.33Å; V32-C57 HydrophobicContact CG1-CB 3.73Å; V32-C57 HydrophobicContact CG2-CB 3.96Å; V32-V58 HydrophobicContact CG2-CG2 3.88Å; V32-I61 HydrophobicContact CG2-CD1 3.97Å; V32-F70 HydrophobicContact CG2-CE1 4.42Å
33K98.1Very high96.4Very high7 Ų720.9 Ų20.93%0.0312%0.116CC..Hα-helixtrans-51.7-56174.8178.4-156.8169177.30110.6I29 E30 L35 L36 Q37 Y229 D232 N277I29-K33 PolarHBondContact O-N 3.42Å; E30-K33 WeakPolarHBondContact O-CB 3.42Å; E30-K33 PolarHBondContact O-N 3.34Å; E30-K33 VanDerWaalsContact OE2-CD 3.25Å; E30-K33 WeakPolarHBondContact OE2-CD 3.21Å; K33-L35 PolarHBondContact O-N 3.45Å; K33-L36 PolarHBondContact O-N 2.86Å; K33-Q37 VanDerWaalsContact O-CB 3.23Å; K33-Q37 WeakPolarHBondContact O-CB 3.29Å; K33-Q37 PolarHBondContact O-N 2.98Å; K33-Y229 VanDerWaalsContact CE-OH 3.27Å; K33-Y229 WeakPolarHBondContact CE-OH 3.39Å; K33-D232 WeakPolarHBondContact CE-OD2 3.41Å; K33-D232 IonicContact NZ-OD2 2.9Å; K33-D232 PolarHBondContact NZ-OD2 3.18Å; K33-N277 HydrophobicContact CD-CB 3.84Å; K33-N277 HydrophobicContact CG-CB 4.28Å; K33-N277 PolarHBondContact NZ-OD1 2.81Å
34L98.2Very high96.4Very high2 Ų222.1 Ų22.11%0.0112%0.123CC..Hα-helixtrans-64.8-41.8-173-71.1170.4000111.4E30 R31 V32 Q37 V38 A142 R236E30-L34 HydrophobicContact CG-CD1 4.03Å; E30-L34 WeakPolarHBondContact O-CG 3.47Å; E30-L34 PolarHBondContact O-N 2.81Å; R31-L34 PolarHBondContact O-N 3.41Å; V32-L34 PolarHBondContact O-N 3.22Å; L34-Q37 PolarHBondContact O-N 3.36Å; L34-V38 WeakPolarHBondContact O-CG2 3.39Å; L34-V38 PolarHBondContact O-N 2.9Å; L34-A142 HydrophobicContact CB-CB 3.89Å; L34-A142 HydrophobicContact CD1-CB 3.31Å; L34-A142 HydrophobicContact CG-CB 4.21Å; L34-R236 HydrophobicContact CD2-CG 4.24Å
35L98.1Very high96.2Very high1 Ų120.2 Ų20.21%0.00511%0.111CC..Hα-helixtrans-59.4-51.6174.4-75.9171000111.7R31 V32 K33 Q37 V38 Q39 I45 Y51 I61 V145R31-L35 HydrophobicContact CG-CD1 4.18Å; R31-L35 WeakPolarHBondContact O-CG 3.23Å; R31-L35 PolarHBondContact O-N 2.79Å; V32-L35 PolarHBondContact O-N 3.16Å; K33-L35 PolarHBondContact O-N 3.45Å; L35-Q37 VanDerWaalsContact C-N 3.28Å; L35-Q37 PolarHBondContact O-N 2.71Å; L35-V38 PolarHBondContact O-N 3.41Å; L35-Q39 WeakPolarHBondContact O-CA 3.46Å; L35-Q39 WeakPolarHBondContact O-CB 3.11Å; L35-Q39 WeakPolarHBondContact O-CG 3.17Å; L35-Q39 PolarHBondContact O-N 3.34Å; L35-I45 HydrophobicContact CD2-CD1 4.23Å; L35-Y51 HydrophobicContact CB-CD2 4.32Å; L35-Y51 HydrophobicContact CB-CE2 4.26Å; L35-Y51 HydrophobicContact CD1-CE2 4.05Å; L35-Y51 HydrophobicContact CD2-CE2 4.26Å; L35-Y51 HydrophobicContact CG-CE2 4.44Å; L35-I61 HydrophobicContact CD1-CD1 3.61Å; L35-I61 HydrophobicContact CD1-CG1 3.88Å; L35-V145 HydrophobicContact CD2-CG1 3.71Å
36L97.8Very high96.1Very high12 Ų1219.5 Ų19.56%0.06310%0.102CC..Hα-helixtrans-59.9-40.4179.1-71.1173.1000112.2V32 K33 I54 C57 K272V32-L36 HydrophobicContact CG1-CD1 3.83Å; V32-L36 HydrophobicContact CG1-CG 4.37Å; V32-L36 WeakPolarHBondContact O-CG 3.37Å; V32-L36 PolarHBondContact O-N 3.35Å; K33-L36 PolarHBondContact O-N 2.86Å; L36-I54 HydrophobicContact CD1-CG1 3.86Å; L36-C57 VanDerWaalsContact CD2-SG 3.58Å; L36-K272 WeakPolarHBondContact O-CB 3.36Å
37Q97.7Very high95.9Very high0 Ų022.3 Ų22.30%013%0.127CC..Hα-helixtrans-69-35.4-177.2-167.7174.136.200112.2K33 L34 L35 Y229 D232 T233 R236 R237K33-Q37 VanDerWaalsContact O-CB 3.23Å; K33-Q37 WeakPolarHBondContact O-CB 3.29Å; K33-Q37 PolarHBondContact O-N 2.98Å; L34-Q37 PolarHBondContact O-N 3.36Å; L35-Q37 VanDerWaalsContact C-N 3.28Å; L35-Q37 PolarHBondContact O-N 2.71Å; Q37-Y229 PolarHBondContact NE2-OH 2.81Å; Q37-D232 PolarHBondContact NE2-OD2 2.93Å; Q37-D232 PolarHBondContact OE1-OD2 3.44Å; Q37-T233 HydrophobicContact CG-CG2 4.05Å; Q37-T233 VanDerWaalsContact NE2-CA 3.29Å; Q37-T233 PolarHBondContact NE2-OG1 3.33Å; Q37-R236 VanDerWaalsContact OE1-CG 3.28Å; Q37-R237 PolarHBondContact O-NE 3.31Å; Q37-R237 PolarHBondContact O-NH2 3.4Å
38V97.6Very high95.8Very high1 Ų129.1 Ų29.11%0.00616%0.158CC..Hα-helixtrans-113.1-8.3-170.9-51.40000115.9L34 L35 H40 A41 S42 T139 A143 R236 M240L34-V38 WeakPolarHBondContact O-CG2 3.39Å; L34-V38 PolarHBondContact O-N 2.9Å; L35-V38 PolarHBondContact O-N 3.41Å; V38-H40 VanDerWaalsContact C-N 3.25Å; V38-H40 PolarHBondContact O-N 2.54Å; V38-H40 VanDerWaalsContact O-N 3.09Å; V38-A41 CarbonylContact O-C 3.59Å; V38-A41 WeakPolarHBondContact O-CA 3.18Å; V38-A41 PolarHBondContact O-N 3.35Å; V38-S42 PolarHBondContact O-N 3.46Å; V38-T139 HydrophobicContact CG1-CG2 4.44Å; V38-A143 HydrophobicContact CG2-CB 3.53Å; V38-R236 HydrophobicContact CG1-CB 3.5Å; V38-R236 VanDerWaalsContact CG1-CB 3.5Å; V38-M240 HydrophobicContact CB-CG 3.95Å; V38-M240 HydrophobicContact CB-SD 4.46Å; V38-M240 HydrophobicContact CG1-CG 4.3Å; V38-M240 HydrophobicContact CG2-CE 4.41Å; V38-M240 HydrophobicContact CG2-CG 4.4Å; V38-M240 HydrophobicContact CG2-SD 4.29Å
39Q97Very high95.6Very high7 Ų733.5 Ų33.53%0.03317%0.173CC..G310 helixtrans-55.1-32-172.156.4-178.5-28.800115.2L35 A41 S42 I45 Q50 Y51L35-Q39 WeakPolarHBondContact O-CA 3.46Å; L35-Q39 WeakPolarHBondContact O-CB 3.11Å; L35-Q39 WeakPolarHBondContact O-CG 3.17Å; L35-Q39 PolarHBondContact O-N 3.34Å; Q39-A41 PolarHBondContact O-N 2.92Å; Q39-S42 WeakPolarHBondContact O-CB 3.28Å; Q39-S42 PolarHBondContact O-N 3.42Å; Q39-I45 HydrophobicContact CB-CD1 3.99Å; Q39-Q50 HydrophobicContact CG-CG 4.47Å; Q39-Y51 PolarHBondContact NE2-O 3.34Å
40H95.6Very high95.6Very high46 Ų4634 Ų3421%0.21318%0.175CC..G310 helixtrans-73.1-20.4177.8-5543.4000111.7V38 Q50 M250 E265 K272V38-H40 VanDerWaalsContact C-N 3.25Å; V38-H40 PolarHBondContact O-N 2.54Å; V38-H40 VanDerWaalsContact O-N 3.09Å; H40-Q50 PolarHBondContact CE1-OE1 3.28Å; H40-Q50 PolarHBondContact NE2-OE1 2.99Å; H40-Q50 VanDerWaalsContact NE2-OE1 3.1Å; H40-M250 WeakPolarHBondContact O-CE 3.35Å; H40-E265 IonicContact CD2-OE1 2.79Å; H40-E265 IonicContact CD2-OE2 3.22Å; H40-E265 PolarHBondContact CD2-OE2 3.29Å; H40-E265 IonicContact CE1-OE2 2.82Å; H40-E265 IonicContact CG-OE1 3.99Å; H40-E265 IonicContact CG-OE2 2.75Å; H40-E265 VanDerWaalsContact CG-OE2 3.27Å; H40-E265 IonicContact ND1-OE2 3.91Å; H40-E265 IonicContact NE2-OE2 3.45Å; H40-E265 PolarHBondContact NE2-OE2 3.49Å; H40-K272 PolarHBondContact CE1-NZ 2.95Å; H40-K272 PolarHBondContact NE2-NZ 2.85Å
41A94.9Very high95.6Very high0 Ų034.1 Ų34.10%018%0.175CC..G310 helixtrans-99.424.5168.800000112V38 Q39 M240 R244 M250 Y251V38-A41 CarbonylContact O-C 3.59Å; V38-A41 WeakPolarHBondContact O-CA 3.18Å; V38-A41 PolarHBondContact O-N 3.35Å; Q39-A41 PolarHBondContact O-N 2.92Å; A41-M240 HydrophobicContact CB-CB 4Å; A41-M240 HydrophobicContact CB-CG 4.42Å; A41-M240 WeakPolarHBondContact O-CB 3.24Å; A41-R244 PolarHBondContact O-NH2 2.87Å; A41-M250 HydrophobicContact CB-SD 4.16Å; A41-Y251 HydrophobicContact CB-CE2 4.16Å
42S93.9Very high95.5Very high16 Ų1643.3 Ų43.311%0.11222%0.215CC..  trans-87.7144.8171.4-173.50000110.8V38 Q39 Q44 I45V38-S42 PolarHBondContact O-N 3.46Å; Q39-S42 WeakPolarHBondContact O-CB 3.28Å; Q39-S42 PolarHBondContact O-N 3.42Å; S42-Q44 PolarHBondContact OG-N 2.86Å; S42-Q44 VanDerWaalsContact OG-N 3.12Å; S42-I45 PolarHBondContact OG-N 3.2Å
43K91Very high95.4Very high97 Ų9744.3 Ų44.342%0.42223%0.226SC..SBendtrans-86.4-19.5167.1-76-175.4156.6-170.90112.6D248K43-D248 WeakPolarHBondContact CE-OD2 3.39Å; K43-D248 IonicContact NZ-OD2 3.43Å; K43-D248 PolarHBondContact NZ-OD2 2.93Å
44Q93Very high95.4Very high62 Ų6245.9 Ų45.929%0.2923%0.234SC..SBendtrans-99.6-19.6-173.8-66.3166.7-53.800112.8S42 D144 V145 Q151S42-Q44 PolarHBondContact OG-N 2.86Å; S42-Q44 VanDerWaalsContact OG-N 3.12Å; Q44-D144 PolarHBondContact NE2-OD1 2.91Å; Q44-D144 VanDerWaalsContact OE1-CA 3.31Å; Q44-D144 PolarHBondContact OE1-OD1 3.4Å; Q44-V145 HydrophobicContact CB-CG2 3.43Å; Q44-V145 VanDerWaalsContact CB-CG2 3.43Å; Q44-V145 HydrophobicContact CG-CG2 4.32Å; Q44-V145 PolarHBondContact NE2-O 3.07Å; Q44-Q151 PolarHBondContact NE2-O 3.25Å
45I93.6Very high95.3Very high15 Ų1552 Ų528%0.07727%0.266CS..SBendtrans-106.8105.1179.5-54.6170.9000107.4L35 Q39 S42 K49 Q50 Y51 V145L35-I45 HydrophobicContact CD2-CD1 4.23Å; Q39-I45 HydrophobicContact CB-CD1 3.99Å; S42-I45 PolarHBondContact OG-N 3.2Å; I45-K49 HydrophobicContact CG2-CB 4.43Å; I45-Q50 HydrophobicContact CG2-CG 4.02Å; I45-Y51 HydrophobicContact CD1-CE2 3.96Å; I45-V145 HydrophobicContact CD1-CG1 4.07Å; I45-V145 HydrophobicContact CG1-CG1 4.35Å; I45-V145 HydrophobicContact CG1-CG2 3.92Å
46S92.8Very high95.3Very high41 Ų4154 Ų5429%0.28728%0.276SS..  trans-68.8159.8172.456.60000111.2E48 K49 Q50S46-E48 VanDerWaalsContact C-N 3.28Å; S46-E48 VanDerWaalsContact CB-CD 3.48Å; S46-E48 WeakPolarHBondContact CB-OE1 3.27Å; S46-E48 VanDerWaalsContact CB-OE2 3.28Å; S46-E48 WeakPolarHBondContact CB-OE2 3.49Å; S46-E48 PolarHBondContact O-N 2.87Å; S46-E48 PolarHBondContact OG-OE1 3.24Å; S46-E48 PolarHBondContact OG-OE2 2.83Å; S46-K49 CarbonylContact O-C 3.59Å; S46-K49 PolarHBondContact O-N 2.94Å; S46-K49 WeakPolarHBondContact OG-CG 3.47Å; S46-Q50 PolarHBondContact O-N 3.47Å
47A91.4Very high95.3Very high74 Ų7453.4 Ų53.461%0.61227%0.273SS*.G310 helixtrans-56.9-41.6-173.600000112.4K49 Q50A47-K49 VanDerWaalsContact C-N 3.27Å; A47-K49 PolarHBondContact O-N 3.21Å; A47-Q50 WeakPolarHBondContact O-CB 3.41Å; A47-Q50 WeakPolarHBondContact O-CG 3.41Å; A47-Q50 PolarHBondContact O-N 3.26Å
48E93.5Very high95.3Very high148 Ų14856.5 Ų56.569%0.69229%0.292SS*.G310 helixtrans-71.2-19.2178.772.5-72.4170.400113.8S46S46-E48 VanDerWaalsContact C-N 3.28Å; S46-E48 VanDerWaalsContact CB-CD 3.48Å; S46-E48 WeakPolarHBondContact CB-OE1 3.27Å; S46-E48 VanDerWaalsContact CB-OE2 3.28Å; S46-E48 WeakPolarHBondContact CB-OE2 3.49Å; S46-E48 PolarHBondContact O-N 2.87Å; S46-E48 PolarHBondContact OG-OE1 3.24Å; S46-E48 PolarHBondContact OG-OE2 2.83Å
49K94.6Very high95.3Very high126 Ų12659.7 Ų59.755%0.54831%0.311SS..G310 helixtrans-99.95.1178-67.2-175.3-177.8174.30113.4I45 S46 A47 R60I45-K49 HydrophobicContact CG2-CB 4.43Å; S46-K49 CarbonylContact O-C 3.59Å; S46-K49 PolarHBondContact O-N 2.94Å; S46-K49 WeakPolarHBondContact OG-CG 3.47Å; A47-K49 VanDerWaalsContact C-N 3.27Å; A47-K49 PolarHBondContact O-N 3.21Å; K49-R60 PolarHBondContact O-NH1 3.01Å; K49-R60 PolarHBondContact O-NH2 3.39Å
50Q96.8Very high95.4Very high45 Ų4561.4 Ų61.421%0.2132%0.317CS..  trans-59.6145.3176.5-70.4-179.70.300111.6Q39 H40 I45 S46 A47 R60Q39-Q50 HydrophobicContact CG-CG 4.47Å; H40-Q50 PolarHBondContact CE1-OE1 3.28Å; H40-Q50 PolarHBondContact NE2-OE1 2.99Å; H40-Q50 VanDerWaalsContact NE2-OE1 3.1Å; I45-Q50 HydrophobicContact CG2-CG 4.02Å; S46-Q50 PolarHBondContact O-N 3.47Å; A47-Q50 WeakPolarHBondContact O-CB 3.41Å; A47-Q50 WeakPolarHBondContact O-CG 3.41Å; A47-Q50 PolarHBondContact O-N 3.26Å; Q50-R60 PolarHBondContact O-NH1 3.34Å; Q50-R60 VanDerWaalsContact O-NH1 3.12Å
51Y96.9Very high95.4Very high11 Ų1159.2 Ų59.24%0.04331%0.307CS..  trans-72.6131.5175.9-59.6-70.2000110.7L35 Q39 I45 G53 D56 C57 R60 E64 Q65L35-Y51 HydrophobicContact CB-CD2 4.32Å; L35-Y51 HydrophobicContact CB-CE2 4.26Å; L35-Y51 HydrophobicContact CD1-CE2 4.05Å; L35-Y51 HydrophobicContact CD2-CE2 4.26Å; L35-Y51 HydrophobicContact CG-CE2 4.44Å; Q39-Y51 PolarHBondContact NE2-O 3.34Å; I45-Y51 HydrophobicContact CD1-CE2 3.96Å; Y51-G53 VanDerWaalsContact C-N 3.31Å; Y51-G53 PolarHBondContact O-N 3.28Å; Y51-D56 VanDerWaalsContact CA-OD2 3.28Å; Y51-D56 WeakPolarHBondContact CA-OD2 3.48Å; Y51-C57 WeakPolarHBondContact CB-SG 3.11Å; Y51-C57 HydrophobicContact CD1-CB 4.38Å; Y51-C57 VanDerWaalsContact CD2-SG 3.59Å; Y51-C57 HydrophobicContact CG-CB 4.4Å; Y51-R60 HydrophobicContact CD1-CB 4.24Å; Y51-R60 HydrophobicContact CE1-CB 3.73Å; Y51-E64 WeakPolarHBondContact CE1-OE2 3.4Å; Y51-E64 PolarHBondContact OH-OE2 2.98Å; Y51-Q65 PolarHBondContact OH-NE2 3.43Å; Y51-Q65 VanDerWaalsContact OH-NE2 3.08Å
52K95.7Very high95.5Very high197 Ų19761.1 Ų61.186%0.85732%0.32SS*.  trans-77.9-17-176.4-61.2-179.9-179.5179.20113.5D56K52-D56 HydrophobicContact CB-CB 4.13Å; K52-D56 PolarHBondContact N-OD2 3.06Å
53G95.8Very high95.6Very high23 Ų2367.4 Ų67.424%0.23735%0.345CS..SBendtrans167.8-170.2-178.700000112.2Y51 D56 C57Y51-G53 VanDerWaalsContact C-N 3.31Å; Y51-G53 PolarHBondContact O-N 3.28Å; G53-D56 PolarHBondContact O-N 3.18Å; G53-C57 PolarHBondContact O-N 2.9Å
54I96.7Very high95.8Very high40 Ų4066 Ų6621%0.20534%0.34CS..Hα-helixtrans-61-49.6-175.6-62.2179000111.4I29 V32 L36 D56 C57 V58 W275 S276I29-I54 HydrophobicContact CD1-CG2 4.22Å; V32-I54 HydrophobicContact CG1-CB 4.3Å; V32-I54 HydrophobicContact CG1-CG1 4.25Å; V32-I54 HydrophobicContact CG1-CG2 4.08Å; L36-I54 HydrophobicContact CD1-CG1 3.86Å; I54-D56 VanDerWaalsContact C-N 3.33Å; I54-D56 PolarHBondContact O-N 2.91Å; I54-C57 WeakPolarHBondContact O-CB 3.43Å; I54-C57 PolarHBondContact O-N 2.81Å; I54-V58 HydrophobicContact CG2-CG2 4.37Å; I54-V58 WeakPolarHBondContact O-CG2 3.22Å; I54-V58 PolarHBondContact O-N 3.32Å; I54-W275 HydrophobicContact CD1-CB 4.21Å; I54-W275 HydrophobicContact CD1-CG 4.25Å; I54-S276 WeakPolarHBondContact CD1-OG 3.38Å; I54-S276 WeakPolarHBondContact CG1-OG 3.35Å
55I97.6Very high95.9Very high130 Ų13063.4 Ų63.467%0.66733%0.328SS*.Hα-helixtrans-62.5-43.6-178.4-57.6-55.9000110.6C57 V58 V59I55-C57 PolarHBondContact O-N 3.16Å; I55-V58 PolarHBondContact O-N 2.95Å; I55-V59 HydrophobicContact CG2-CG2 4.33Å; I55-V59 WeakPolarHBondContact O-CG2 3.37Å; I55-V59 PolarHBondContact O-N 3.26Å
56D97.8Very high96Very high43 Ų4364.1 Ų64.123%0.2334%0.339CS..Hα-helixtrans-60-45.3176.3-169.856.3000111.5Y51 K52 G53 I54 V59 R60Y51-D56 VanDerWaalsContact CA-OD2 3.28Å; Y51-D56 WeakPolarHBondContact CA-OD2 3.48Å; K52-D56 HydrophobicContact CB-CB 4.13Å; K52-D56 PolarHBondContact N-OD2 3.06Å; G53-D56 PolarHBondContact O-N 3.18Å; I54-D56 VanDerWaalsContact C-N 3.33Å; I54-D56 PolarHBondContact O-N 2.91Å; D56-V59 PolarHBondContact O-N 2.86Å; D56-R60 WeakPolarHBondContact O-CB 3.38Å; D56-R60 VanDerWaalsContact O-CG 3.25Å; D56-R60 WeakPolarHBondContact O-CG 3.32Å; D56-R60 PolarHBondContact O-N 3.25Å; D56-R60 WeakPolarHBondContact OD1-CD 3.48Å; D56-R60 WeakPolarHBondContact OD2-CD 3.09Å; D56-R60 IonicContact OD2-CZ 2.8Å; D56-R60 IonicContact OD2-NE 3.77Å; D56-R60 IonicContact OD2-NH1 3.28Å; D56-R60 PolarHBondContact OD2-NH1 3.11Å
57C97.5Very high96.1Very high0 Ų068.5 Ų68.50%035%0.353CS..Hα-helixtrans-57.3-51.6172.1-76.30000112.1V32 L36 Y51 G53 I54 I55 V59 R60 I61V32-C57 HydrophobicContact CB-CB 4.33Å; V32-C57 HydrophobicContact CG1-CB 3.73Å; V32-C57 HydrophobicContact CG2-CB 3.96Å; L36-C57 VanDerWaalsContact CD2-SG 3.58Å; Y51-C57 WeakPolarHBondContact CB-SG 3.11Å; Y51-C57 HydrophobicContact CD1-CB 4.38Å; Y51-C57 VanDerWaalsContact CD2-SG 3.59Å; Y51-C57 HydrophobicContact CG-CB 4.4Å; G53-C57 PolarHBondContact O-N 2.9Å; I54-C57 WeakPolarHBondContact O-CB 3.43Å; I54-C57 PolarHBondContact O-N 2.81Å; I55-C57 PolarHBondContact O-N 3.16Å; C57-V59 VanDerWaalsContact C-N 3.28Å; C57-V59 PolarHBondContact O-N 2.65Å; C57-R60 PolarHBondContact O-N 3.03Å; C57-I61 HydrophobicContact CB-CD1 4.1Å; C57-I61 VanDerWaalsContact O-CB 3.32Å; C57-I61 WeakPolarHBondContact O-CB 3.24Å; C57-I61 VanDerWaalsContact O-CD1 3.31Å; C57-I61 WeakPolarHBondContact O-CD1 3.15Å; C57-I61 WeakPolarHBondContact O-CG1 3.35Å; C57-I61 PolarHBondContact O-N 2.97Å
58V97.7Very high96.3Very high65 Ų6571.7 Ų71.739%0.39436%0.359SS..Hα-helixtrans-61.1-38.2-176.1171.20000111.4V32 I54 I55 P62 F70V32-V58 HydrophobicContact CG2-CG2 3.88Å; I54-V58 HydrophobicContact CG2-CG2 4.37Å; I54-V58 WeakPolarHBondContact O-CG2 3.22Å; I54-V58 PolarHBondContact O-N 3.32Å; I55-V58 PolarHBondContact O-N 2.95Å; V58-P62 WeakPolarHBondContact O-CD 3.36Å; V58-P62 WeakPolarHBondContact O-CG 3.39Å; V58-F70 HydrophobicContact CG1-CZ 4.4Å; V58-F70 WeakPolarHBondContact O-CZ 3.46Å
59V98Very high96.4Very high67 Ų6765 Ų6541%0.40633%0.328SS..Hα-helixtrans-74.8-39.2178.3172.70000111.9I55 D56 C57 K63I55-V59 HydrophobicContact CG2-CG2 4.33Å; I55-V59 WeakPolarHBondContact O-CG2 3.37Å; I55-V59 PolarHBondContact O-N 3.26Å; D56-V59 PolarHBondContact O-N 2.86Å; C57-V59 VanDerWaalsContact C-N 3.28Å; C57-V59 PolarHBondContact O-N 2.65Å; V59-K63 HydrophobicContact CG1-CD 4.41Å; V59-K63 WeakPolarHBondContact O-CG 3.29Å
60R97.6Very high96.6Very high44 Ų4459.7 Ų59.717%0.16631%0.305CS..Hα-helixtrans-84.8-36.6-172.1-72.3172.959.1-164.8-4.1113.9K49 Q50 Y51 D56 C57 K63 E64K49-R60 PolarHBondContact O-NH1 3.01Å; K49-R60 PolarHBondContact O-NH2 3.39Å; Q50-R60 PolarHBondContact O-NH1 3.34Å; Q50-R60 VanDerWaalsContact O-NH1 3.12Å; Y51-R60 HydrophobicContact CD1-CB 4.24Å; Y51-R60 HydrophobicContact CE1-CB 3.73Å; D56-R60 WeakPolarHBondContact O-CB 3.38Å; D56-R60 VanDerWaalsContact O-CG 3.25Å; D56-R60 WeakPolarHBondContact O-CG 3.32Å; D56-R60 PolarHBondContact O-N 3.25Å; D56-R60 WeakPolarHBondContact OD1-CD 3.48Å; D56-R60 WeakPolarHBondContact OD2-CD 3.09Å; D56-R60 IonicContact OD2-CZ 2.8Å; D56-R60 IonicContact OD2-NE 3.77Å; D56-R60 IonicContact OD2-NH1 3.28Å; D56-R60 PolarHBondContact OD2-NH1 3.11Å; C57-R60 PolarHBondContact O-N 3.03Å; R60-K63 PolarHBondContact O-N 3.18Å; R60-K63 VanDerWaalsContact O-N 3.09Å; R60-E64 HydrophobicContact CB-CG 4.38Å; R60-E64 IonicContact CZ-OE1 3.04Å; R60-E64 IonicContact NE-OE1 3.35Å; R60-E64 PolarHBondContact NE-OE1 3.26Å; R60-E64 IonicContact NH2-OE1 2.61Å; R60-E64 PolarHBondContact NH2-OE1 2.6Å; R60-E64 IonicContact NH2-OE2 3.94Å; R60-E64 VanDerWaalsContact O-CB 3.29Å; R60-E64 WeakPolarHBondContact O-CB 3.45Å; R60-E64 VanDerWaalsContact O-CG 3.31Å; R60-E64 WeakPolarHBondContact O-CG 3.45Å; R60-E64 PolarHBondContact O-N 3.32Å
61I97.4Very high96.6Very high0 Ų061.5 Ų61.50%031%0.31CS..Hα-helixtrans-48.5-54.5178.6-73.6163.8000112.5R31 V32 L35 C57 K63 E64 Q65 S69 F70R31-I61 HydrophobicContact CG-CD1 4.45Å; V32-I61 HydrophobicContact CG2-CD1 3.97Å; L35-I61 HydrophobicContact CD1-CD1 3.61Å; L35-I61 HydrophobicContact CD1-CG1 3.88Å; C57-I61 HydrophobicContact CB-CD1 4.1Å; C57-I61 VanDerWaalsContact O-CB 3.32Å; C57-I61 WeakPolarHBondContact O-CB 3.24Å; C57-I61 VanDerWaalsContact O-CD1 3.31Å; C57-I61 WeakPolarHBondContact O-CD1 3.15Å; C57-I61 WeakPolarHBondContact O-CG1 3.35Å; C57-I61 PolarHBondContact O-N 2.97Å; I61-K63 VanDerWaalsContact C-N 3.35Å; I61-K63 PolarHBondContact O-N 3.34Å; I61-E64 PolarHBondContact O-N 3.03Å; I61-Q65 WeakPolarHBondContact O-CA 3.27Å; I61-Q65 VanDerWaalsContact O-CB 3.31Å; I61-Q65 WeakPolarHBondContact O-CB 3.24Å; I61-Q65 PolarHBondContact O-N 3.21Å; I61-S69 WeakPolarHBondContact CG2-OG 3.1Å; I61-F70 HydrophobicContact CB-CD1 4.49Å; I61-F70 HydrophobicContact CB-CE1 3.92Å; I61-F70 HydrophobicContact CB-CZ 3.98Å; I61-F70 HydrophobicContact CD1-CD1 4.08Å; I61-F70 HydrophobicContact CD1-CE1 3.65Å; I61-F70 HydrophobicContact CD1-CZ 4.48Å; I61-F70 HydrophobicContact CG1-CE1 4.41Å; I61-F70 HydrophobicContact CG2-CD1 3.89Å; I61-F70 HydrophobicContact CG2-CD2 4.29Å; I61-F70 HydrophobicContact CG2-CE1 3.8Å; I61-F70 HydrophobicContact CG2-CE2 4.2Å; I61-F70 HydrophobicContact CG2-CG 4.13Å; I61-F70 HydrophobicContact CG2-CZ 3.96Å
62P96.7Very high96.6Very high40 Ų4062.4 Ų62.426%0.2631%0.314SS..Hα-helixtrans-65.8-36.8-179.424.6-33.2000112.4V58 G66 F70V58-P62 WeakPolarHBondContact O-CD 3.36Å; V58-P62 WeakPolarHBondContact O-CG 3.39Å; P62-G66 WeakPolarHBondContact O-CA 3.45Å; P62-G66 PolarHBondContact O-N 2.74Å; P62-F70 HydrophobicContact CB-CE2 4.39Å; P62-F70 HydrophobicContact CG-CE2 4.18Å; P62-F70 HydrophobicContact CG-CZ 4.43Å
63K95.4Very high96.6Very high147 Ų14753.5 Ų53.564%0.63928%0.278SS*.Hα-helixtrans-67.2-40178.2-66.7-178.6179.7-176.30112.4V59 R60 I61 K147V59-K63 HydrophobicContact CG1-CD 4.41Å; V59-K63 WeakPolarHBondContact O-CG 3.29Å; R60-K63 PolarHBondContact O-N 3.18Å; R60-K63 VanDerWaalsContact O-N 3.09Å; I61-K63 VanDerWaalsContact C-N 3.35Å; I61-K63 PolarHBondContact O-N 3.34Å; K63-K147 WeakPolarHBondContact O-CE 3.47Å; K63-K147 PolarHBondContact O-NZ 3.48Å
64E94.9Very high96.7Very high67 Ų6753.1 Ų53.131%0.31327%0.27SS..Hα-helixtrans-89.9-28.3-174.5-68.2174.3173.100113.4Y51 R60 I61 K147Y51-E64 WeakPolarHBondContact CE1-OE2 3.4Å; Y51-E64 PolarHBondContact OH-OE2 2.98Å; R60-E64 HydrophobicContact CB-CG 4.38Å; R60-E64 IonicContact CZ-OE1 3.04Å; R60-E64 IonicContact NE-OE1 3.35Å; R60-E64 PolarHBondContact NE-OE1 3.26Å; R60-E64 IonicContact NH2-OE1 2.61Å; R60-E64 PolarHBondContact NH2-OE1 2.6Å; R60-E64 IonicContact NH2-OE2 3.94Å; R60-E64 VanDerWaalsContact O-CB 3.29Å; R60-E64 WeakPolarHBondContact O-CB 3.45Å; R60-E64 VanDerWaalsContact O-CG 3.31Å; R60-E64 WeakPolarHBondContact O-CG 3.45Å; R60-E64 PolarHBondContact O-N 3.32Å; I61-E64 PolarHBondContact O-N 3.03Å; E64-K147 WeakPolarHBondContact O-CE 3.46Å; E64-K147 WeakPolarHBondContact O-CG 3.35Å
65Q95.5Very high96.7Very high8 Ų856.7 Ų56.74%0.03729%0.289CS..Hα-helixtrans-134.1-7.2-166.5-55.7174.355.900113.6R31 Y51 I61 S69 V145R31-Q65 VanDerWaalsContact NH2-OE1 3.12Å; Y51-Q65 PolarHBondContact OH-NE2 3.43Å; Y51-Q65 VanDerWaalsContact OH-NE2 3.08Å; I61-Q65 WeakPolarHBondContact O-CA 3.27Å; I61-Q65 VanDerWaalsContact O-CB 3.31Å; I61-Q65 WeakPolarHBondContact O-CB 3.24Å; I61-Q65 PolarHBondContact O-N 3.21Å; Q65-S69 WeakPolarHBondContact CB-OG 3.1Å; Q65-V145 HydrophobicContact CG-CB 4.39Å
66G95.5Very high96.7Very high30 Ų3050.6 Ų50.631%0.30926%0.258SS..  trans86.6153.6-17400000112.8P62 L68 S69P62-G66 WeakPolarHBondContact O-CA 3.45Å; P62-G66 PolarHBondContact O-N 2.74Å; G66-L68 PolarHBondContact O-N 3.43Å; G66-S69 VanDerWaalsContact O-CB 3.24Å; G66-S69 WeakPolarHBondContact O-CB 3.26Å; G66-S69 PolarHBondContact O-N 2.78Å; G66-S69 VanDerWaalsContact O-N 3.12Å; G66-S69 PolarHBondContact O-OG 3.39Å
67F95.4Very high96.5Very high133 Ų13348.8 Ų48.858%0.58325%0.248SC*.G310 helixtrans-59.6-43.3-172.4-177.1-103000113.8S69 F70 W71F67-S69 PolarHBondContact O-N 2.92Å; F67-F70 HydrophobicContact CD2-CD2 4.39Å; F67-F70 HydrophobicContact CD2-CE2 4.39Å; F67-F70 HydrophobicContact CE2-CD2 4.5Å; F67-F70 VanDerWaalsContact O-CD2 3.27Å; F67-F70 WeakPolarHBondContact O-CD2 3.09Å; F67-F70 PolarHBondContact O-N 3.3Å; F67-W71 HydrophobicContact CE1-CH2 4.35Å; F67-W71 HydrophobicContact CE1-CZ3 4.04Å; F67-W71 HydrophobicContact CZ-CH2 4.47Å; F67-W71 HydrophobicContact CZ-CZ3 4.4Å
68L95.6Very high96.5Very high142 Ų14249.9 Ų49.974%0.74326%0.255SS*.G310 helixtrans-65.9-11.4-179.5-62.6179.1000113.8G66 F70 W71G66-L68 PolarHBondContact O-N 3.43Å; L68-F70 PolarHBondContact O-N 2.79Å; L68-W71 PolarHBondContact O-N 3.36Å
69S95.8Very high96.4Very high6 Ų650 Ų504%0.04225%0.253CS..G310 helixtrans-64.9-19177.969.20000113.5I61 Q65 G66 F67 W71 R72I61-S69 WeakPolarHBondContact CG2-OG 3.1Å; Q65-S69 WeakPolarHBondContact CB-OG 3.1Å; G66-S69 VanDerWaalsContact O-CB 3.24Å; G66-S69 WeakPolarHBondContact O-CB 3.26Å; G66-S69 PolarHBondContact O-N 2.78Å; G66-S69 VanDerWaalsContact O-N 3.12Å; G66-S69 PolarHBondContact O-OG 3.39Å; F67-S69 PolarHBondContact O-N 2.92Å; S69-W71 PolarHBondContact O-N 3.34Å; S69-W71 VanDerWaalsContact O-N 3.17Å; S69-R72 WeakPolarHBondContact O-CB 3.2Å; S69-R72 PolarHBondContact O-N 3.18Å
70F97.5Very high96.2Very high16 Ų1648.8 Ų48.87%0.0724%0.241CC..G310 helixtrans-56.7-28172.2-80.9-63000113.7P28 R31 V32 V58 I61 P62 F67 L68P28-F70 HydrophobicContact CB-CB 3.94Å; P28-F70 HydrophobicContact CB-CD1 3.85Å; P28-F70 HydrophobicContact CB-CG 4.02Å; P28-F70 HydrophobicContact CG-CB 4.07Å; R31-F70 VanDerWaalsContact CB-O 3.26Å; R31-F70 WeakPolarHBondContact CB-O 3.32Å; V32-F70 HydrophobicContact CG2-CE1 4.42Å; V58-F70 HydrophobicContact CG1-CZ 4.4Å; V58-F70 WeakPolarHBondContact O-CZ 3.46Å; I61-F70 HydrophobicContact CB-CD1 4.49Å; I61-F70 HydrophobicContact CB-CE1 3.92Å; I61-F70 HydrophobicContact CB-CZ 3.98Å; I61-F70 HydrophobicContact CD1-CD1 4.08Å; I61-F70 HydrophobicContact CD1-CE1 3.65Å; I61-F70 HydrophobicContact CD1-CZ 4.48Å; I61-F70 HydrophobicContact CG1-CE1 4.41Å; I61-F70 HydrophobicContact CG2-CD1 3.89Å; I61-F70 HydrophobicContact CG2-CD2 4.29Å; I61-F70 HydrophobicContact CG2-CE1 3.8Å; I61-F70 HydrophobicContact CG2-CE2 4.2Å; I61-F70 HydrophobicContact CG2-CG 4.13Å; I61-F70 HydrophobicContact CG2-CZ 3.96Å; P62-F70 HydrophobicContact CB-CE2 4.39Å; P62-F70 HydrophobicContact CG-CE2 4.18Å; P62-F70 HydrophobicContact CG-CZ 4.43Å; F67-F70 HydrophobicContact CD2-CD2 4.39Å; F67-F70 HydrophobicContact CD2-CE2 4.39Å; F67-F70 HydrophobicContact CE2-CD2 4.5Å; F67-F70 VanDerWaalsContact O-CD2 3.27Å; F67-F70 WeakPolarHBondContact O-CD2 3.09Å; F67-F70 PolarHBondContact O-N 3.3Å; L68-F70 PolarHBondContact O-N 2.79Å
71W97.8Very high96Very high82 Ų8249.2 Ų49.231%0.31124%0.243SC..G310 helixtrans-96.36.3178.9-72.8-93000113.6T24 A27 P28 F67 L68 S69 G73 N74T24-W71 PolarHBondContact O-NE1 3.04Å; A27-W71 VanDerWaalsContact CB-CD1 3.42Å; A27-W71 HydrophobicContact CB-CG 4.17Å; P28-W71 HydrophobicContact CG-CD2 4.48Å; P28-W71 HydrophobicContact CG-CH2 3.9Å; P28-W71 HydrophobicContact CG-CZ2 3.59Å; P28-W71 HydrophobicContact CG-CZ3 4.45Å; F67-W71 HydrophobicContact CE1-CH2 4.35Å; F67-W71 HydrophobicContact CE1-CZ3 4.04Å; F67-W71 HydrophobicContact CZ-CH2 4.47Å; F67-W71 HydrophobicContact CZ-CZ3 4.4Å; L68-W71 PolarHBondContact O-N 3.36Å; S69-W71 PolarHBondContact O-N 3.34Å; S69-W71 VanDerWaalsContact O-N 3.17Å; W71-G73 PolarHBondContact O-N 3.12Å; W71-G73 VanDerWaalsContact O-N 3.16Å; W71-N74 HydrophobicContact CB-CB 4.34Å; W71-N74 WeakPolarHBondContact O-CB 3.19Å; W71-N74 PolarHBondContact O-N 2.79Å
72R96.9Very high95.7Very high31 Ų3152.5 Ų52.512%0.11726%0.257CS..THydrogen-bonded Turntrans-65.6119.1-177.6-173.6174.8178.168.84.7110.9S69 L141 D144 R152 F154S69-R72 WeakPolarHBondContact O-CB 3.2Å; S69-R72 PolarHBondContact O-N 3.18Å; R72-L141 WeakPolarHBondContact CG-O 3.33Å; R72-L141 PolarHBondContact NE-O 3.07Å; R72-D144 WeakPolarHBondContact CD-O 3.31Å; R72-D144 IonicContact CZ-OD2 3.21Å; R72-D144 PolarHBondContact NE-O 2.59Å; R72-D144 IonicContact NE-OD2 3.65Å; R72-D144 IonicContact NH2-OD2 3.02Å; R72-D144 PolarHBondContact NH2-OD2 3.02Å; R72-R152 VanDerWaalsContact NH1-NH1 3.14Å; R72-F154 PolarHBondContact NH2-O 3.44Å
73G96.2Very high95.5Very high10 Ų1052.6 Ų52.610%0.10326%0.258CS..THydrogen-bonded Turntrans94.1-7.4-173.200000114.3W71 L75 A76 N77W71-G73 PolarHBondContact O-N 3.12Å; W71-G73 VanDerWaalsContact O-N 3.16Å; G73-L75 VanDerWaalsContact C-N 3.33Å; G73-L75 PolarHBondContact O-N 3.2Å; G73-A76 PolarHBondContact O-N 2.7Å; G73-N77 PolarHBondContact O-N 2.79Å
74N97.1Very high95.3Very high15 Ų1547.3 Ų47.38%0.0824%0.238CC..Hα-helixtrans-65.4-34.1-179.9-172.850.1000112.7K23 T24 A27 W71 A76 N77 V78K23-N74 PolarHBondContact O-OD1 3.17Å; T24-N74 PolarHBondContact OG1-ND2 3.28Å; A27-N74 HydrophobicContact CB-CB 3.96Å; W71-N74 HydrophobicContact CB-CB 4.34Å; W71-N74 WeakPolarHBondContact O-CB 3.19Å; W71-N74 PolarHBondContact O-N 2.79Å; N74-A76 VanDerWaalsContact C-N 3.29Å; N74-A76 PolarHBondContact O-N 3.4Å; N74-N77 CarbonylContact O-C 3.32Å; N74-N77 WeakPolarHBondContact O-CA 3.23Å; N74-N77 VanDerWaalsContact O-CB 3.24Å; N74-N77 WeakPolarHBondContact O-CB 3.47Å; N74-N77 PolarHBondContact O-N 3.09Å; N74-V78 WeakPolarHBondContact O-CG2 3.43Å; N74-V78 PolarHBondContact O-N 3.42Å
75L96.5Very high95.1Very high115 Ų11546.1 Ų46.160%0.60223%0.232SC*.Hα-helixtrans-55.4-45.4175.7179.661.9000111.8G73 N77 V78 I79G73-L75 VanDerWaalsContact C-N 3.33Å; G73-L75 PolarHBondContact O-N 3.2Å; L75-N77 VanDerWaalsContact C-N 3.27Å; L75-N77 PolarHBondContact O-N 3.21Å; L75-V78 PolarHBondContact O-N 3.02Å; L75-I79 HydrophobicContact CD1-CD1 3.92Å; L75-I79 HydrophobicContact CD1-CG1 4.14Å; L75-I79 HydrophobicContact CD2-CD1 4.49Å; L75-I79 HydrophobicContact CG-CD1 3.86Å; L75-I79 HydrophobicContact CG-CG1 4.45Å; L75-I79 WeakPolarHBondContact O-CG1 3.24Å; L75-I79 PolarHBondContact O-N 3.08Å
76A97Very high94.8Very high1 Ų148.1 Ų48.11%0.00825%0.25CC..Hα-helixtrans-61.6-37.3175.500000111.6G73 N74 R80 R138 L157G73-A76 PolarHBondContact O-N 2.7Å; N74-A76 VanDerWaalsContact C-N 3.29Å; N74-A76 PolarHBondContact O-N 3.4Å; A76-R80 WeakPolarHBondContact O-CB 3.38Å; A76-R80 PolarHBondContact O-N 3.31Å; A76-R138 HydrophobicContact CB-CB 3.94Å; A76-L157 HydrophobicContact CB-CD1 3.91Å; A76-L157 HydrophobicContact CB-CD2 4.22Å
77N94.7Very high94.6Very high5 Ų547.8 Ų47.83%0.02724%0.241CC..Hα-helixtrans-66.9-37.6176.1-173.835.5000113.5K23 G73 N74 L75 R80 R138K23-N77 WeakPolarHBondContact CD-O 3.16Å; K23-N77 WeakPolarHBondContact CE-O 3.25Å; K23-N77 PolarHBondContact NZ-O 2.75Å; K23-N77 PolarHBondContact NZ-OD1 3.4Å; G73-N77 PolarHBondContact O-N 2.79Å; N74-N77 CarbonylContact O-C 3.32Å; N74-N77 WeakPolarHBondContact O-CA 3.23Å; N74-N77 VanDerWaalsContact O-CB 3.24Å; N74-N77 WeakPolarHBondContact O-CB 3.47Å; N74-N77 PolarHBondContact O-N 3.09Å; L75-N77 VanDerWaalsContact C-N 3.27Å; L75-N77 PolarHBondContact O-N 3.21Å; N77-R80 PolarHBondContact OD1-NH2 3.33Å; N77-R80 VanDerWaalsContact OD1-NH2 3.12Å; N77-R138 HydrophobicContact CB-CG 4.22Å; N77-R138 PolarHBondContact ND2-NH2 2.89Å; N77-R138 VanDerWaalsContact ND2-NH2 3.1Å; N77-R138 PolarHBondContact OD1-NH1 2.87Å; N77-R138 VanDerWaalsContact OD1-NH1 3.17Å; N77-R138 PolarHBondContact OD1-NH2 2.94Å
78V96.3Very high94.2Very high23 Ų2344.9 Ų44.914%0.13923%0.232CC..Hα-helixtrans-70.7-52.8176.9173.30000109.9A20 K23 N74 L75 R80 Y81 F82A20-V78 HydrophobicContact CB-CG1 3.76Å; K23-V78 HydrophobicContact CB-CG2 4.19Å; K23-V78 HydrophobicContact CD-CG2 4.41Å; N74-V78 WeakPolarHBondContact O-CG2 3.43Å; N74-V78 PolarHBondContact O-N 3.42Å; L75-V78 PolarHBondContact O-N 3.02Å; V78-R80 PolarHBondContact O-N 2.89Å; V78-Y81 WeakPolarHBondContact O-CB 3.45Å; V78-Y81 PolarHBondContact O-N 3.01Å; V78-F82 HydrophobicContact CG1-CE2 4.4Å
79I96Very high93.8Very high69 Ų6944.1 Ų44.135%0.35422%0.223SC..Hα-helixtrans-55.2-43.6178.1-68.5171.7000110.5L75 Y81 F82 P83 L134 L157L75-I79 HydrophobicContact CD1-CD1 3.92Å; L75-I79 HydrophobicContact CD1-CG1 4.14Å; L75-I79 HydrophobicContact CD2-CD1 4.49Å; L75-I79 HydrophobicContact CG-CD1 3.86Å; L75-I79 HydrophobicContact CG-CG1 4.45Å; L75-I79 WeakPolarHBondContact O-CG1 3.24Å; L75-I79 PolarHBondContact O-N 3.08Å; I79-Y81 PolarHBondContact O-N 2.77Å; I79-Y81 VanDerWaalsContact O-N 3.08Å; I79-F82 PolarHBondContact O-N 3.34Å; I79-P83 WeakPolarHBondContact O-CD 3.46Å; I79-L134 HydrophobicContact CG2-CD1 3.99Å; I79-L134 HydrophobicContact CG2-CD2 4.21Å; I79-L157 HydrophobicContact CD1-CD2 3.83Å
80R94.9Very high93.4Very high41 Ų4146.3 Ų46.316%0.15524%0.241CC..THydrogen-bonded Turntrans-56.7-25.8179.3-171.4-178.762.679.1-0.9113.7A76 N77 V78 P83 T84 V131 L134A76-R80 WeakPolarHBondContact O-CB 3.38Å; A76-R80 PolarHBondContact O-N 3.31Å; N77-R80 PolarHBondContact OD1-NH2 3.33Å; N77-R80 VanDerWaalsContact OD1-NH2 3.12Å; V78-R80 PolarHBondContact O-N 2.89Å; R80-P83 WeakPolarHBondContact O-CD 3.18Å; R80-T84 WeakPolarHBondContact O-CB 3.38Å; R80-T84 PolarHBondContact O-N 3.25Å; R80-T84 PolarHBondContact O-OG1 2.98Å; R80-V131 HydrophobicContact CG-CB 4.12Å; R80-V131 HydrophobicContact CG-CG2 4.32Å; R80-L134 HydrophobicContact CB-CB 3.99Å; R80-L134 HydrophobicContact CB-CD1 4.08Å; R80-L134 HydrophobicContact CG-CB 4.11Å; R80-L134 HydrophobicContact CG-CD1 4.45Å
81Y92Very high92.9Very high53 Ų5348.6 Ų48.621%0.20825%0.251CS..Hα-helixtrans-59.5-49.5178.6-178-99.1000112.1G15 A19 V78 I79 T84 Q85G15-Y81 PolarHBondContact O-OH 2.87Å; A19-Y81 HydrophobicContact CB-CD1 3.71Å; A19-Y81 HydrophobicContact CB-CD2 3.5Å; A19-Y81 VanDerWaalsContact CB-CD2 3.5Å; A19-Y81 HydrophobicContact CB-CE1 3.56Å; A19-Y81 HydrophobicContact CB-CE2 3.31Å; A19-Y81 HydrophobicContact CB-CG 3.68Å; V78-Y81 WeakPolarHBondContact O-CB 3.45Å; V78-Y81 PolarHBondContact O-N 3.01Å; I79-Y81 PolarHBondContact O-N 2.77Å; I79-Y81 VanDerWaalsContact O-N 3.08Å; Y81-T84 WeakPolarHBondContact O-CB 2.95Å; Y81-T84 PolarHBondContact O-N 3.08Å; Y81-Q85 HydrophobicContact CD1-CG 3.93Å; Y81-Q85 HydrophobicContact CD2-CG 4.23Å; Y81-Q85 HydrophobicContact CE1-CG 3.46Å; Y81-Q85 VanDerWaalsContact CE1-CG 3.46Å; Y81-Q85 HydrophobicContact CE2-CG 3.82Å; Y81-Q85 HydrophobicContact CG-CG 4.29Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.41Å; Y81-Q85 VanDerWaalsContact CZ-NE2 3.34Å; Y81-Q85 WeakPolarHBondContact O-CG 3.42Å; Y81-Q85 PolarHBondContact O-N 3.24Å; Y81-Q85 PolarHBondContact OH-NE2 3.12Å
82F91.8Very high92.2Very high69 Ų6949.5 Ų49.530%0.30326%0.257SS..Hα-helixtrans-58.6-54-174.4-63.9-88.3000113.8F12 V78 I79 T84 Q85 A86F12-F82 AromaticContact CE1-CD1 3.73Å; F12-F82 HydrophobicContact CE1-CD1 3.73Å; F12-F82 HydrophobicContact CE1-CE1 4.39Å; F12-F82 HydrophobicContact CZ-CB 4.27Å; F12-F82 AromaticContact CZ-CD1 3.79Å; F12-F82 HydrophobicContact CZ-CD1 3.79Å; V78-F82 HydrophobicContact CG1-CE2 4.4Å; I79-F82 PolarHBondContact O-N 3.34Å; F82-T84 VanDerWaalsContact C-N 3.3Å; F82-T84 PolarHBondContact O-N 2.91Å; F82-Q85 PolarHBondContact O-N 2.99Å; F82-A86 PolarHBondContact O-N 3.38Å
83P92.6Very high91.7Very high42 Ų4253.2 Ų53.227%0.27328%0.279SS..Hα-helixtrans-67.6-32.1176.428.8-34.2000111.6I79 R80 Q85 A86 L87 V131 L134I79-P83 WeakPolarHBondContact O-CD 3.46Å; R80-P83 WeakPolarHBondContact O-CD 3.18Å; P83-Q85 VanDerWaalsContact C-N 3.32Å; P83-Q85 PolarHBondContact O-N 3.01Å; P83-A86 PolarHBondContact O-N 3.32Å; P83-L87 WeakPolarHBondContact O-CB 3.15Å; P83-L87 VanDerWaalsContact O-CD1 3.3Å; P83-L87 WeakPolarHBondContact O-CD1 3.37Å; P83-L87 WeakPolarHBondContact O-CG 3.27Å; P83-L87 PolarHBondContact O-N 2.88Å; P83-V131 HydrophobicContact CB-CG1 3.85Å; P83-V131 HydrophobicContact CG-CG1 3.84Å; P83-L134 HydrophobicContact CG-CD1 4.16Å
84T92.2Very high91.4Very high35 Ų3558.8 Ų58.822%0.21530%0.301CS..Hα-helixtrans-60.5-44173.5-55.90000110.9R80 Y81 F82 N88R80-T84 WeakPolarHBondContact O-CB 3.38Å; R80-T84 PolarHBondContact O-N 3.25Å; R80-T84 PolarHBondContact O-OG1 2.98Å; Y81-T84 WeakPolarHBondContact O-CB 2.95Å; Y81-T84 PolarHBondContact O-N 3.08Å; F82-T84 VanDerWaalsContact C-N 3.3Å; F82-T84 PolarHBondContact O-N 2.91Å; T84-N88 WeakPolarHBondContact O-CB 3.14Å; T84-N88 PolarHBondContact O-N 3.44Å
85Q89.6Confident91.2Very high43 Ų4360 Ų6020%0.20131%0.305CS..Hα-helixtrans-68.7-44.8177.4-70-56.4-13.500112.2F12 Y81 F82 P83 L87 N88 F89F12-Q85 HydrophobicContact CE2-CB 4.14Å; Y81-Q85 HydrophobicContact CD1-CG 3.93Å; Y81-Q85 HydrophobicContact CD2-CG 4.23Å; Y81-Q85 HydrophobicContact CE1-CG 3.46Å; Y81-Q85 VanDerWaalsContact CE1-CG 3.46Å; Y81-Q85 HydrophobicContact CE2-CG 3.82Å; Y81-Q85 HydrophobicContact CG-CG 4.29Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.41Å; Y81-Q85 VanDerWaalsContact CZ-NE2 3.34Å; Y81-Q85 WeakPolarHBondContact O-CG 3.42Å; Y81-Q85 PolarHBondContact O-N 3.24Å; Y81-Q85 PolarHBondContact OH-NE2 3.12Å; F82-Q85 PolarHBondContact O-N 2.99Å; P83-Q85 VanDerWaalsContact C-N 3.32Å; P83-Q85 PolarHBondContact O-N 3.01Å; Q85-L87 VanDerWaalsContact C-N 3.27Å; Q85-L87 PolarHBondContact O-N 3.45Å; Q85-N88 WeakPolarHBondContact O-CB 3.4Å; Q85-N88 PolarHBondContact O-N 3.35Å; Q85-N88 VanDerWaalsContact O-N 3.11Å; Q85-F89 HydrophobicContact CB-CE2 4.48Å; Q85-F89 WeakPolarHBondContact O-CD2 3.09Å; Q85-F89 PolarHBondContact O-N 3.33Å
86A89.6Confident90.8Very high49 Ų4959.1 Ų59.141%0.40530%0.296SS..Hα-helixtrans-56.3-43.3176.500000111.7F82 P83 F89 A90F82-A86 PolarHBondContact O-N 3.38Å; P83-A86 PolarHBondContact O-N 3.32Å; A86-F89 PolarHBondContact O-N 3.1Å; A86-A90 WeakPolarHBondContact O-CB 3.39Å; A86-A90 PolarHBondContact O-N 3.02Å
87L91.3Very high90.5Very high24 Ų2466 Ų6613%0.12633%0.328CS..Hα-helixtrans-68.8-37.1177.1-66.6164.3000112.3P83 Q85 A90 F91 F130 V131P83-L87 WeakPolarHBondContact O-CB 3.15Å; P83-L87 VanDerWaalsContact O-CD1 3.3Å; P83-L87 WeakPolarHBondContact O-CD1 3.37Å; P83-L87 WeakPolarHBondContact O-CG 3.27Å; P83-L87 PolarHBondContact O-N 2.88Å; Q85-L87 VanDerWaalsContact C-N 3.27Å; Q85-L87 PolarHBondContact O-N 3.45Å; L87-A90 PolarHBondContact O-N 3.36Å; L87-F91 HydrophobicContact CB-CD2 4.4Å; L87-F91 HydrophobicContact CD2-CD2 4.01Å; L87-F91 HydrophobicContact CD2-CE2 3.63Å; L87-F91 WeakPolarHBondContact O-CB 3.02Å; L87-F91 WeakPolarHBondContact O-CD2 3.47Å; L87-F91 PolarHBondContact O-N 3.48Å; L87-F130 HydrophobicContact CD1-CB 3.73Å; L87-F130 HydrophobicContact CD1-CD2 3.92Å; L87-F130 HydrophobicContact CD1-CG 4.13Å; L87-F130 HydrophobicContact CD2-CD2 3.69Å; L87-F130 HydrophobicContact CD2-CE2 4.05Å; L87-F130 HydrophobicContact CD2-CG 4.27Å; L87-F130 HydrophobicContact CG-CD2 4.49Å; L87-V131 HydrophobicContact CD1-CG1 3.82Å
88N87.6Confident90.5Very high72 Ų7271.4 Ų71.439%0.38536%0.355SS..Hα-helixtrans-60.6-49.2173.4-172.317.6000110.4T84 Q85 A90 F91 K92T84-N88 WeakPolarHBondContact O-CB 3.14Å; T84-N88 PolarHBondContact O-N 3.44Å; Q85-N88 WeakPolarHBondContact O-CB 3.4Å; Q85-N88 PolarHBondContact O-N 3.35Å; Q85-N88 VanDerWaalsContact O-N 3.11Å; N88-A90 VanDerWaalsContact C-N 3.34Å; N88-A90 PolarHBondContact O-N 2.91Å; N88-F91 PolarHBondContact O-N 3.37Å; N88-K92 WeakPolarHBondContact O-CB 3.49Å; N88-K92 PolarHBondContact O-N 3.01Å
89F85.4Confident90.3Very high126 Ų12674 Ų7455%0.55337%0.365SS*.Hα-helixtrans-60.2-41.6174.7-77.1-68000112.6Q85 A86Q85-F89 HydrophobicContact CB-CE2 4.48Å; Q85-F89 WeakPolarHBondContact O-CD2 3.09Å; Q85-F89 PolarHBondContact O-N 3.33Å; A86-F89 PolarHBondContact O-N 3.1Å
90A87.9Confident90Very high51 Ų5172 Ų7242%0.42136%0.355SS..Hα-helixtrans-70.1-34.8-177.100000114.1A86 L87 N88A86-A90 WeakPolarHBondContact O-CB 3.39Å; A86-A90 PolarHBondContact O-N 3.02Å; L87-A90 PolarHBondContact O-N 3.36Å; N88-A90 VanDerWaalsContact C-N 3.34Å; N88-A90 PolarHBondContact O-N 2.91Å
91F88.6Confident89.8Confident64 Ų6472.3 Ų72.328%0.28137%0.37SS..Hα-helixtrans-121.9-15-165.3-64.9-70.7000115.9L87 N88 D93 K94 Y95 T126L87-F91 HydrophobicContact CB-CD2 4.4Å; L87-F91 HydrophobicContact CD2-CD2 4.01Å; L87-F91 HydrophobicContact CD2-CE2 3.63Å; L87-F91 WeakPolarHBondContact O-CB 3.02Å; L87-F91 WeakPolarHBondContact O-CD2 3.47Å; L87-F91 PolarHBondContact O-N 3.48Å; N88-F91 PolarHBondContact O-N 3.37Å; F91-D93 VanDerWaalsContact C-N 3.33Å; F91-D93 PolarHBondContact O-N 3.23Å; F91-K94 HydrophobicContact CD1-CD 4.24Å; F91-K94 PolarHBondContact O-N 3.42Å; F91-Y95 HydrophobicContact CB-CD2 3.8Å; F91-Y95 HydrophobicContact CB-CE2 3.63Å; F91-Y95 HydrophobicContact CD1-CE2 4.31Å; F91-Y95 HydrophobicContact CG-CE2 4.15Å; F91-Y95 VanDerWaalsContact O-CD2 3.31Å; F91-Y95 WeakPolarHBondContact O-CD2 3.48Å; F91-Y95 PolarHBondContact O-N 2.64Å; F91-T126 HydrophobicContact CD2-CG2 4.35Å; F91-T126 HydrophobicContact CE2-CG2 4.32Å
92K82Confident89.6Confident101 Ų10173.6 Ų73.644%0.43940%0.4SS..Hα-helixtrans-55-47.3-174.5178.8-173.8-174.8-174.30112.6N88 K96N88-K92 WeakPolarHBondContact O-CB 3.49Å; N88-K92 PolarHBondContact O-N 3.01Å; K92-K96 WeakPolarHBondContact O-CG 3.41Å; K92-K96 PolarHBondContact O-N 3.23Å
93D85.7Confident89.5Confident110 Ų11071.3 Ų71.359%0.58839%0.391SS*.Hα-helixtrans-77.5-34.6-176.3-61.3-33.8000111.9F91 Y95 K96 Q97F91-D93 VanDerWaalsContact C-N 3.33Å; F91-D93 PolarHBondContact O-N 3.23Å; D93-Y95 PolarHBondContact O-N 3.19Å; D93-K96 PolarHBondContact O-N 3.49Å; D93-Q97 WeakPolarHBondContact O-CB 3.3Å; D93-Q97 PolarHBondContact O-N 3.36Å
94K91.7Very high89.2Confident127 Ų12772.2 Ų72.255%0.55239%0.394SS*.Hα-helixtrans-58.1-50.2173.7-69.6-179.9-177.9-77.20111.6F91 K96 Q97 I98F91-K94 HydrophobicContact CD1-CD 4.24Å; F91-K94 PolarHBondContact O-N 3.42Å; K94-K96 PolarHBondContact O-N 2.8Å; K94-Q97 PolarHBondContact O-N 3.21Å; K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.32Å; K94-I98 PolarHBondContact O-N 2.73Å
95Y91.5Very high88.8Confident41 Ų4175.5 Ų75.516%0.16140%0.402CS..Hα-helixtrans-68.4-34.5179.2-74.1-57.3000112.9F91 D93 F99 S119 A122 A123 T126F91-Y95 HydrophobicContact CB-CD2 3.8Å; F91-Y95 HydrophobicContact CB-CE2 3.63Å; F91-Y95 HydrophobicContact CD1-CE2 4.31Å; F91-Y95 HydrophobicContact CG-CE2 4.15Å; F91-Y95 VanDerWaalsContact O-CD2 3.31Å; F91-Y95 WeakPolarHBondContact O-CD2 3.48Å; F91-Y95 PolarHBondContact O-N 2.64Å; D93-Y95 PolarHBondContact O-N 3.19Å; Y95-F99 HydrophobicContact CD1-CD2 4.41Å; Y95-F99 AromaticContact CD1-CE2 3.91Å; Y95-F99 HydrophobicContact CD1-CE2 3.91Å; Y95-F99 VanDerWaalsContact O-CD2 3.26Å; Y95-F99 WeakPolarHBondContact O-CD2 3.42Å; Y95-F99 PolarHBondContact O-N 3.04Å; Y95-S119 VanDerWaalsContact C-OG 3.23Å; Y95-S119 PolarHBondContact O-OG 2.88Å; Y95-A122 HydrophobicContact CD1-CB 3.76Å; Y95-A122 HydrophobicContact CE1-CB 3.73Å; Y95-A122 HydrophobicContact CG-CB 4.38Å; Y95-A123 HydrophobicContact CD2-CB 3.62Å; Y95-A123 HydrophobicContact CE2-CB 4.18Å; Y95-A123 HydrophobicContact CG-CB 4.3Å; Y95-T126 PolarHBondContact OH-OG1 3.45Å
96K88.2Confident88.4Confident95 Ų9581.7 Ų81.741%0.41343%0.431SS..Hα-helixtrans-63.2-46.3172.7-77.7179.9174-171.30110.9K92 D93 K94 I98 F99 L100 S119K92-K96 WeakPolarHBondContact O-CG 3.41Å; K92-K96 PolarHBondContact O-N 3.23Å; D93-K96 PolarHBondContact O-N 3.49Å; K94-K96 PolarHBondContact O-N 2.8Å; K96-I98 PolarHBondContact O-N 2.82Å; K96-F99 PolarHBondContact O-N 2.61Å; K96-L100 WeakPolarHBondContact O-CA 3.27Å; K96-L100 WeakPolarHBondContact O-CB 3.33Å; K96-L100 PolarHBondContact O-N 3.43Å; K96-S119 PolarHBondContact N-OG 3.42Å
97Q91.8Very high88.3Confident147 Ų14787.8 Ų87.869%0.68745%0.448SS*.Hα-helixtrans-61.1-45.1178.9-172.8179.76.500112.1D93 K94 F99 G101D93-Q97 WeakPolarHBondContact O-CB 3.3Å; D93-Q97 PolarHBondContact O-N 3.36Å; K94-Q97 PolarHBondContact O-N 3.21Å; Q97-F99 PolarHBondContact O-N 3.36Å; Q97-G101 VanDerWaalsContact O-CA 3.27Å; Q97-G101 WeakPolarHBondContact O-CA 3.11Å; Q97-G101 PolarHBondContact O-N 3.02Å
98I93.1Very high88.1Confident118 Ų11890.1 Ų90.161%0.60546%0.459SS*.Hα-helixtrans-60.9-46179.9-70.3164.6000111.9K94 K96K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.32Å; K94-I98 PolarHBondContact O-N 2.73Å; K96-I98 PolarHBondContact O-N 2.82Å
99F91.9Very high88.1Confident77 Ų7791 Ų9134%0.33846%0.459SS..Hα-helixtrans-97.6-18.2-171.2-68.5-70.5000114.7Y95 K96 Q97 G115 A118 S119 A122Y95-F99 HydrophobicContact CD1-CD2 4.41Å; Y95-F99 AromaticContact CD1-CE2 3.91Å; Y95-F99 HydrophobicContact CD1-CE2 3.91Å; Y95-F99 VanDerWaalsContact O-CD2 3.26Å; Y95-F99 WeakPolarHBondContact O-CD2 3.42Å; Y95-F99 PolarHBondContact O-N 3.04Å; K96-F99 PolarHBondContact O-N 2.61Å; Q97-F99 PolarHBondContact O-N 3.36Å; F99-G115 WeakPolarHBondContact CB-O 3.35Å; F99-A118 HydrophobicContact CD1-CB 3.57Å; F99-A118 HydrophobicContact CD2-CB 4.45Å; F99-A118 HydrophobicContact CE1-CB 3.76Å; F99-A118 HydrophobicContact CG-CB 3.95Å; F99-A118 HydrophobicContact CZ-CB 4.28Å; F99-S119 VanDerWaalsContact CD2-CA 3.48Å; F99-A122 HydrophobicContact CE2-CB 3.72Å; F99-A122 HydrophobicContact CZ-CB 4.2Å
100L91.1Very high88.3Confident28 Ų2894.1 Ų94.115%0.14747%0.467CS..Hα-helixtrans-123.81.5-176.8-61167.8000113.2K96 G102 V103 Y112K96-L100 WeakPolarHBondContact O-CA 3.27Å; K96-L100 WeakPolarHBondContact O-CB 3.33Å; K96-L100 PolarHBondContact O-N 3.43Å; L100-G102 PolarHBondContact O-N 2.83Å; L100-G102 VanDerWaalsContact O-N 3.14Å; L100-V103 PolarHBondContact O-N 3.37Å; L100-Y112 HydrophobicContact CD2-CD2 3.96Å; L100-Y112 HydrophobicContact CD2-CE2 4.35Å
101G89.2Confident88.5Confident46 Ų4698.7 Ų98.747%0.47447%0.474SS..THydrogen-bonded Turntrans-54.9119174.100000111.1Q97 V103Q97-G101 VanDerWaalsContact O-CA 3.27Å; Q97-G101 WeakPolarHBondContact O-CA 3.11Å; Q97-G101 PolarHBondContact O-N 3.02Å; G101-V103 VanDerWaalsContact C-N 3.26Å; G101-V103 PolarHBondContact O-N 3.09Å
102G89.5Confident88.6Confident80 Ų8098 Ų9883%0.82547%0.47SS*.THydrogen-bonded Turntrans72.79.5-179.400000115.6L100L100-G102 PolarHBondContact O-N 2.83Å; L100-G102 VanDerWaalsContact O-N 3.14Å
103V88.2Confident89Confident21 Ų2195.1 Ų95.113%0.12746%0.457CS..  trans-90.4116.1178.1-176.20000110.4L100 G101 Q108 R111 Y112L100-V103 PolarHBondContact O-N 3.37Å; G101-V103 VanDerWaalsContact C-N 3.26Å; G101-V103 PolarHBondContact O-N 3.09Å; V103-Q108 HydrophobicContact CG1-CB 4.47Å; V103-R111 HydrophobicContact CG1-CB 4.14Å; V103-R111 HydrophobicContact CG1-CG 3.97Å; V103-R111 HydrophobicContact CG2-CG 4.12Å; V103-Y112 HydrophobicContact CG1-CD2 4.46Å
104D86.1Confident89.3Confident62 Ų6292.4 Ų92.433%0.33245%0.45SS..  trans-85.7119.7175.6-175.2-26.3000110.6H106 K107 Q108D104-H106 VanDerWaalsContact C-N 3.29Å; D104-H106 PolarHBondContact O-N 3.34Å; D104-H106 IonicContact OD1-CD2 3.95Å; D104-H106 PolarHBondContact OD1-N 3.11Å; D104-K107 HydrophobicContact CB-CB 4.21Å; D104-K107 PolarHBondContact OD1-N 3.45Å; D104-K107 WeakPolarHBondContact OD2-CD 3.05Å; D104-Q108 WeakPolarHBondContact O-CA 3.34Å; D104-Q108 WeakPolarHBondContact O-CB 3.26Å; D104-Q108 PolarHBondContact O-N 3.07Å
105R84.1Confident89.4Confident104 Ų10486.8 Ų86.839%0.39243%0.428SS..THydrogen-bonded Turntrans-60.1-35.9179.2-178.8178.2-176.5-179.84.1112.9Y112 D196R105-Y112 HydrophobicContact CB-CD1 4.2Å; R105-Y112 HydrophobicContact CB-CD2 3.86Å; R105-Y112 HydrophobicContact CB-CE1 4.36Å; R105-Y112 HydrophobicContact CB-CE2 4.05Å; R105-Y112 HydrophobicContact CB-CG 3.94Å; R105-Y112 HydrophobicContact CG-CD1 3.73Å; R105-Y112 HydrophobicContact CG-CD2 4.31Å; R105-Y112 HydrophobicContact CG-CE1 3.8Å; R105-Y112 HydrophobicContact CG-CE2 4.38Å; R105-Y112 HydrophobicContact CG-CG 3.99Å; R105-D196 IonicContact NH2-OD1 3.44Å; R105-D196 PolarHBondContact NH2-OD1 3.46Å; R105-D196 VanDerWaalsContact NH2-OD1 3.11Å; R105-D196 IonicContact NH2-OD2 2.61Å; R105-D196 PolarHBondContact NH2-OD2 2.94Å
106H82.7Confident89.4Confident172 Ų17285.9 Ų85.980%0.79643%0.426SS*.THydrogen-bonded Turntrans-82.1-32.8-173.6-64.3-74.9000112.3D104D104-H106 VanDerWaalsContact C-N 3.29Å; D104-H106 PolarHBondContact O-N 3.34Å; D104-H106 IonicContact OD1-CD2 3.95Å; D104-H106 PolarHBondContact OD1-N 3.11Å
107K87.2Confident89.6Confident178 Ų17882.8 Ų82.877%0.77441%0.414SS*.THydrogen-bonded Turntrans-91.4-28.7179.2-62.7-179.4-176.9177.20113.4D104D104-K107 HydrophobicContact CB-CB 4.21Å; D104-K107 PolarHBondContact OD1-N 3.45Å; D104-K107 WeakPolarHBondContact OD2-CD 3.05Å
108Q87.6Confident89.7Confident73 Ų7377.6 Ų77.634%0.34140%0.396SS..  trans-131.752.1-169-57.9-179.4-32.300112V103 D104 W110 R111 Y112V103-Q108 HydrophobicContact CG1-CB 4.47Å; D104-Q108 WeakPolarHBondContact O-CA 3.34Å; D104-Q108 WeakPolarHBondContact O-CB 3.26Å; D104-Q108 PolarHBondContact O-N 3.07Å; Q108-W110 VanDerWaalsContact C-N 3.34Å; Q108-W110 PolarHBondContact O-N 3.04Å; Q108-R111 HydrophobicContact CB-CB 3.99Å; Q108-R111 PolarHBondContact O-N 3.14Å; Q108-Y112 PolarHBondContact O-N 3.15Å
109F87.7Confident89.7Confident89 Ų8972.2 Ų72.239%0.3937%0.369SS..Hα-helixtrans-46.7-50.7-176175.6-95.6000113.8R111 Y112 F113 F192F109-R111 PolarHBondContact O-N 2.83Å; F109-Y112 WeakPolarHBondContact O-CB 3.26Å; F109-Y112 PolarHBondContact O-N 2.87Å; F109-F113 WeakPolarHBondContact O-CB 3.24Å; F109-F113 PolarHBondContact O-N 3.2Å; F109-F192 AromaticContact CE2-CE1 3.76Å; F109-F192 HydrophobicContact CE2-CE1 3.76Å; F109-F192 HydrophobicContact CE2-CZ 4.02Å; F109-F192 AromaticContact CZ-CE1 3.76Å; F109-F192 HydrophobicContact CZ-CE1 3.76Å; F109-F192 HydrophobicContact CZ-CZ 4.45Å
110W89Confident89.6Confident193 Ų19369 Ų6973%0.73136%0.357SS*.Hα-helixtrans-65.5-36.6-178.9-75.1114.7000113.5Q108 F113 A114Q108-W110 VanDerWaalsContact C-N 3.34Å; Q108-W110 PolarHBondContact O-N 3.04Å; W110-F113 HydrophobicContact CE3-CD1 4.05Å; W110-F113 HydrophobicContact CZ3-CD1 4.06Å; W110-F113 HydrophobicContact CZ3-CE1 4.31Å; W110-F113 PolarHBondContact O-N 3.45Å; W110-A114 VanDerWaalsContact O-CB 3.3Å; W110-A114 WeakPolarHBondContact O-CB 3.14Å; W110-A114 PolarHBondContact O-N 3.25Å
111R91.3Very high89.7Confident147 Ų14767.9 Ų67.956%0.55535%0.352SS*.Hα-helixtrans-68.8-40.6174.7-171178176.3178.5-2.3110.9V103 Q108 F109 G115V103-R111 HydrophobicContact CG1-CB 4.14Å; V103-R111 HydrophobicContact CG1-CG 3.97Å; V103-R111 HydrophobicContact CG2-CG 4.12Å; Q108-R111 HydrophobicContact CB-CB 3.99Å; Q108-R111 PolarHBondContact O-N 3.14Å; F109-R111 PolarHBondContact O-N 2.83Å; R111-G115 PolarHBondContact O-N 3.44Å
112Y90.9Very high89.9Confident50 Ų5066.9 Ų66.920%0.19634%0.34CS..Hα-helixtrans-63.2-44.3174.7178.3-96000111.5L100 V103 R105 Q108 F109 N116 F192L100-Y112 HydrophobicContact CD2-CD2 3.96Å; L100-Y112 HydrophobicContact CD2-CE2 4.35Å; V103-Y112 HydrophobicContact CG1-CD2 4.46Å; R105-Y112 HydrophobicContact CB-CD1 4.2Å; R105-Y112 HydrophobicContact CB-CD2 3.86Å; R105-Y112 HydrophobicContact CB-CE1 4.36Å; R105-Y112 HydrophobicContact CB-CE2 4.05Å; R105-Y112 HydrophobicContact CB-CG 3.94Å; R105-Y112 HydrophobicContact CG-CD1 3.73Å; R105-Y112 HydrophobicContact CG-CD2 4.31Å; R105-Y112 HydrophobicContact CG-CE1 3.8Å; R105-Y112 HydrophobicContact CG-CE2 4.38Å; R105-Y112 HydrophobicContact CG-CG 3.99Å; Q108-Y112 PolarHBondContact O-N 3.15Å; F109-Y112 WeakPolarHBondContact O-CB 3.26Å; F109-Y112 PolarHBondContact O-N 2.87Å; Y112-N116 WeakPolarHBondContact CE1-ND2 3.22Å; Y112-N116 VanDerWaalsContact CE2-ND2 3.34Å; Y112-N116 WeakPolarHBondContact CE2-ND2 3.38Å; Y112-N116 WeakPolarHBondContact O-CB 3.22Å; Y112-N116 PolarHBondContact O-N 2.9Å; Y112-N116 PolarHBondContact O-ND2 2.91Å; Y112-F192 HydrophobicContact CD1-CE2 4.5Å; Y112-F192 HydrophobicContact CD1-CZ 4.39Å; Y112-F192 AromaticContact CE1-CE2 4Å; Y112-F192 HydrophobicContact CE1-CE2 4Å; Y112-F192 HydrophobicContact CE1-CZ 4.25Å
113F90.5Very high90.1Very high39 Ų3964.6 Ų64.617%0.17131%0.313CS..Hα-helixtrans-60.9-54.3175.8177.8-108.7000111.1F109 W110 G115 N116 L117 A189 F192F109-F113 WeakPolarHBondContact O-CB 3.24Å; F109-F113 PolarHBondContact O-N 3.2Å; W110-F113 HydrophobicContact CE3-CD1 4.05Å; W110-F113 HydrophobicContact CZ3-CD1 4.06Å; W110-F113 HydrophobicContact CZ3-CE1 4.31Å; W110-F113 PolarHBondContact O-N 3.45Å; F113-G115 PolarHBondContact O-N 3.31Å; F113-N116 WeakPolarHBondContact O-CB 3.41Å; F113-N116 PolarHBondContact O-N 3.39Å; F113-N116 VanDerWaalsContact O-N 3.12Å; F113-L117 HydrophobicContact CD1-CD1 4.2Å; F113-L117 HydrophobicContact CE1-CD1 3.59Å; F113-L117 HydrophobicContact CE1-CG 4.3Å; F113-L117 HydrophobicContact CE2-CD1 4.38Å; F113-L117 HydrophobicContact CE2-CD2 4.31Å; F113-L117 HydrophobicContact CE2-CG 4.4Å; F113-L117 HydrophobicContact CZ-CD1 3.71Å; F113-L117 HydrophobicContact CZ-CD2 4.34Å; F113-L117 HydrophobicContact CZ-CG 4.21Å; F113-L117 WeakPolarHBondContact O-CG 3.35Å; F113-L117 PolarHBondContact O-N 3.32Å; F113-A189 HydrophobicContact CZ-CB 4.13Å; F113-F192 HydrophobicContact CD2-CB 4.39Å; F113-F192 AromaticContact CD2-CD1 3.32Å; F113-F192 HydrophobicContact CD2-CD1 3.32Å; F113-F192 HydrophobicContact CD2-CD2 4.48Å; F113-F192 AromaticContact CD2-CE1 3.58Å; F113-F192 HydrophobicContact CD2-CE1 3.58Å; F113-F192 AromaticContact CD2-CG 3.81Å; F113-F192 HydrophobicContact CD2-CG 3.81Å; F113-F192 HydrophobicContact CD2-CZ 4.27Å; F113-F192 HydrophobicContact CE2-CB 3.97Å; F113-F192 AromaticContact CE2-CD1 3.48Å; F113-F192 HydrophobicContact CE2-CD1 3.48Å; F113-F192 VanDerWaalsContact CE2-CD1 3.48Å; F113-F192 HydrophobicContact CE2-CE1 4.19Å; F113-F192 AromaticContact CE2-CG 3.86Å; F113-F192 HydrophobicContact CE2-CG 3.86Å
114A92.6Very high90.3Very high54 Ų5464.2 Ų64.245%0.44631%0.314SS..Hα-helixtrans-59.1-43.7178.300000112.3W110 N116 L117 A118W110-A114 VanDerWaalsContact O-CB 3.3Å; W110-A114 WeakPolarHBondContact O-CB 3.14Å; W110-A114 PolarHBondContact O-N 3.25Å; A114-N116 VanDerWaalsContact C-N 3.32Å; A114-N116 PolarHBondContact O-N 2.85Å; A114-L117 PolarHBondContact O-N 2.7Å; A114-A118 WeakPolarHBondContact O-CB 3.5Å; A114-A118 PolarHBondContact O-N 3.03Å
115G93.1Very high90.7Very high8 Ų862.3 Ų62.38%0.08231%0.307CS..Hα-helixtrans-62.5-37175.700000112.7F99 R111 F113 S119F99-G115 WeakPolarHBondContact CB-O 3.35Å; R111-G115 PolarHBondContact O-N 3.44Å; F113-G115 PolarHBondContact O-N 3.31Å; G115-S119 WeakPolarHBondContact O-CB 3.28Å; G115-S119 PolarHBondContact O-N 3.15Å
116N91.5Very high91.2Very high23 Ų2358.8 Ų58.812%0.12330%0.296CS..Hα-helixtrans-67.5-39.7174.1-91-80.4000112.5Y112 F113 A114 G120 R188Y112-N116 WeakPolarHBondContact CE1-ND2 3.22Å; Y112-N116 VanDerWaalsContact CE2-ND2 3.34Å; Y112-N116 WeakPolarHBondContact CE2-ND2 3.38Å; Y112-N116 WeakPolarHBondContact O-CB 3.22Å; Y112-N116 PolarHBondContact O-N 2.9Å; Y112-N116 PolarHBondContact O-ND2 2.91Å; F113-N116 WeakPolarHBondContact O-CB 3.41Å; F113-N116 PolarHBondContact O-N 3.39Å; F113-N116 VanDerWaalsContact O-N 3.12Å; A114-N116 VanDerWaalsContact C-N 3.32Å; A114-N116 PolarHBondContact O-N 2.85Å; N116-G120 PolarHBondContact O-N 3.21Å; N116-R188 WeakPolarHBondContact O-CD 3.49Å; N116-R188 PolarHBondContact O-NH1 3.38Å
117L93.4Very high91.7Very high29 Ų2951.6 Ų51.615%0.15227%0.265CS..Hα-helixtrans-65-47.3174.7-63.4-170.2000111.3F113 A114 G120 G121 R188 A189F113-L117 HydrophobicContact CD1-CD1 4.2Å; F113-L117 HydrophobicContact CE1-CD1 3.59Å; F113-L117 HydrophobicContact CE1-CG 4.3Å; F113-L117 HydrophobicContact CE2-CD1 4.38Å; F113-L117 HydrophobicContact CE2-CD2 4.31Å; F113-L117 HydrophobicContact CE2-CG 4.4Å; F113-L117 HydrophobicContact CZ-CD1 3.71Å; F113-L117 HydrophobicContact CZ-CD2 4.34Å; F113-L117 HydrophobicContact CZ-CG 4.21Å; F113-L117 WeakPolarHBondContact O-CG 3.35Å; F113-L117 PolarHBondContact O-N 3.32Å; A114-L117 PolarHBondContact O-N 2.7Å; L117-G120 PolarHBondContact O-N 2.89Å; L117-G121 PolarHBondContact O-N 3.29Å; L117-R188 HydrophobicContact CD2-CB 4.12Å; L117-R188 HydrophobicContact CD2-CG 3.89Å; L117-A189 HydrophobicContact CD1-CB 4.03Å; L117-A189 HydrophobicContact CD2-CB 3.82Å
118A93.4Very high92.1Very high39 Ų3943.8 Ų43.832%0.32223%0.232SC..Hα-helixtrans-62.6-46.5178.500000111.8F99 A114 G120 G121 A122F99-A118 HydrophobicContact CD1-CB 3.57Å; F99-A118 HydrophobicContact CD2-CB 4.45Å; F99-A118 HydrophobicContact CE1-CB 3.76Å; F99-A118 HydrophobicContact CG-CB 3.95Å; F99-A118 HydrophobicContact CZ-CB 4.28Å; A114-A118 WeakPolarHBondContact O-CB 3.5Å; A114-A118 PolarHBondContact O-N 3.03Å; A118-G120 PolarHBondContact O-N 3.5Å; A118-G121 PolarHBondContact O-N 2.92Å; A118-A122 VanDerWaalsContact O-CB 3.23Å; A118-A122 WeakPolarHBondContact O-CB 3.49Å; A118-A122 PolarHBondContact O-N 3.46Å
119S92.7Very high92.5Very high5 Ų543.2 Ų43.24%0.03524%0.236CC..Hα-helixtrans-58.2-48.7175.6-1750000112.1Y95 K96 F99 G115 A123Y95-S119 VanDerWaalsContact C-OG 3.23Å; Y95-S119 PolarHBondContact O-OG 2.88Å; K96-S119 PolarHBondContact N-OG 3.42Å; F99-S119 VanDerWaalsContact CD2-CA 3.48Å; G115-S119 WeakPolarHBondContact O-CB 3.28Å; G115-S119 PolarHBondContact O-N 3.15Å; S119-A123 VanDerWaalsContact O-CB 3.25Å; S119-A123 WeakPolarHBondContact O-CB 3.11Å; S119-A123 PolarHBondContact O-N 2.96Å
120G90.3Very high92.8Very high8 Ų845.2 Ų45.28%0.08224%0.244CC..Hα-helixtrans-66.8-41.5178.600000113.6N116 L117 A118 G124N116-G120 PolarHBondContact O-N 3.21Å; L117-G120 PolarHBondContact O-N 2.89Å; A118-G120 PolarHBondContact O-N 3.5Å; G120-G124 PolarHBondContact O-N 3.34Å
121G93.2Very high93.2Very high5 Ų536.1 Ų36.15%0.05221%0.21CC..Hα-helixtrans-63.6-45.8176.500000112L117 A118 G124 A125L117-G121 PolarHBondContact O-N 3.29Å; A118-G121 PolarHBondContact O-N 2.92Å; G121-G124 PolarHBondContact O-N 2.71Å; G121-A125 VanDerWaalsContact O-CB 3.3Å; G121-A125 WeakPolarHBondContact O-CB 3.37Å; G121-A125 PolarHBondContact O-N 2.91Å
122A93.6Very high93.5Very high25 Ų2529.1 Ų29.121%0.20718%0.184CC..Hα-helixtrans-66.9-43.8178.100000112.5Y95 F99 A118 G124 A125 T126Y95-A122 HydrophobicContact CD1-CB 3.76Å; Y95-A122 HydrophobicContact CE1-CB 3.73Å; Y95-A122 HydrophobicContact CG-CB 4.38Å; F99-A122 HydrophobicContact CE2-CB 3.72Å; F99-A122 HydrophobicContact CZ-CB 4.2Å; A118-A122 VanDerWaalsContact O-CB 3.23Å; A118-A122 WeakPolarHBondContact O-CB 3.49Å; A118-A122 PolarHBondContact O-N 3.46Å; A122-G124 VanDerWaalsContact C-N 3.33Å; A122-G124 PolarHBondContact O-N 3.1Å; A122-A125 PolarHBondContact O-N 3.3Å; A122-T126 WeakPolarHBondContact O-CB 3.32Å; A122-T126 PolarHBondContact O-N 3.17Å; A122-T126 PolarHBondContact O-OG1 3.3Å
123A92.5Very high93.8Very high33 Ų3327.8 Ų27.827%0.27318%0.181SC..Hα-helixtrans-61.6-43.4173.800000111.4Y95 S119 S127Y95-A123 HydrophobicContact CD2-CB 3.62Å; Y95-A123 HydrophobicContact CE2-CB 4.18Å; Y95-A123 HydrophobicContact CG-CB 4.3Å; S119-A123 VanDerWaalsContact O-CB 3.25Å; S119-A123 WeakPolarHBondContact O-CB 3.11Å; S119-A123 PolarHBondContact O-N 2.96Å; A123-S127 WeakPolarHBondContact O-CB 3.49Å; A123-S127 PolarHBondContact O-N 2.99Å
124G92.4Very high94.2Very high13 Ų1327.2 Ų27.213%0.13418%0.18CC..Hα-helixtrans-62.1-49.8175.900000112.7G120 G121 A122 T126 S127 L128G120-G124 PolarHBondContact O-N 3.34Å; G121-G124 PolarHBondContact O-N 2.71Å; A122-G124 VanDerWaalsContact C-N 3.33Å; A122-G124 PolarHBondContact O-N 3.1Å; G124-T126 PolarHBondContact O-N 3.39Å; G124-S127 WeakPolarHBondContact O-CB 3.25Å; G124-S127 PolarHBondContact O-N 3.34Å; G124-L128 WeakPolarHBondContact O-CB 3.45Å; G124-L128 VanDerWaalsContact O-CG 3.28Å; G124-L128 WeakPolarHBondContact O-CG 3.19Å; G124-L128 PolarHBondContact O-N 2.8Å
125A95Very high94.4Very high22 Ų2225 Ų2518%0.18216%0.161CC..Hα-helixtrans-59.4-46.1178.200000111.6G121 A122 S127 L128 C129 V181G121-A125 VanDerWaalsContact O-CB 3.3Å; G121-A125 WeakPolarHBondContact O-CB 3.37Å; G121-A125 PolarHBondContact O-N 2.91Å; A122-A125 PolarHBondContact O-N 3.3Å; A125-S127 PolarHBondContact O-N 3Å; A125-L128 CarbonylContact O-C 3.55Å; A125-L128 WeakPolarHBondContact O-CB 3.49Å; A125-L128 PolarHBondContact O-N 3.41Å; A125-C129 PolarHBondContact O-N 2.85Å; A125-C129 PolarHBondContact O-SG 3.08Å; A125-V181 HydrophobicContact CB-CG1 4.09Å; A125-V181 HydrophobicContact CB-CG2 3.89Å
126T94.2Very high94.7Very high29 Ų2924.7 Ų24.718%0.17816%0.157CC..Hα-helixtrans-63.4-43.9177.7-58.30000111.4F91 Y95 A122 G124 L128 C129 F130F91-T126 HydrophobicContact CD2-CG2 4.35Å; F91-T126 HydrophobicContact CE2-CG2 4.32Å; Y95-T126 PolarHBondContact OH-OG1 3.45Å; A122-T126 WeakPolarHBondContact O-CB 3.32Å; A122-T126 PolarHBondContact O-N 3.17Å; A122-T126 PolarHBondContact O-OG1 3.3Å; G124-T126 PolarHBondContact O-N 3.39Å; T126-L128 VanDerWaalsContact C-N 3.32Å; T126-L128 PolarHBondContact O-N 3.45Å; T126-C129 WeakPolarHBondContact O-CB 3.46Å; T126-C129 PolarHBondContact O-N 2.76Å; T126-C129 VanDerWaalsContact O-N 3.15Å; T126-F130 HydrophobicContact CG2-CE2 4.25Å; T126-F130 VanDerWaalsContact O-CD2 3.24Å; T126-F130 WeakPolarHBondContact O-CD2 3.49Å
127S94.2Very high95Very high21 Ų2123.6 Ų23.615%0.14715%0.151CC..Hα-helixtrans-56.5-49.4173.8-172.90000110.9A123 G124 A125 C129 F130 V131A123-S127 WeakPolarHBondContact O-CB 3.49Å; A123-S127 PolarHBondContact O-N 2.99Å; G124-S127 WeakPolarHBondContact O-CB 3.25Å; G124-S127 PolarHBondContact O-N 3.34Å; A125-S127 PolarHBondContact O-N 3Å; S127-C129 VanDerWaalsContact C-N 3.29Å; S127-C129 PolarHBondContact O-N 3.45Å; S127-F130 PolarHBondContact O-N 3.5Å; S127-F130 VanDerWaalsContact O-N 3.11Å; S127-V131 WeakPolarHBondContact O-CG2 3.36Å; S127-V131 PolarHBondContact O-N 3.46Å
128L95.5Very high95.2Very high15 Ų1523 Ų238%0.07915%0.147CC..Hα-helixtrans-59.8-37177.6-68.7179.5000111.8G124 A125 T126 F130 V131 Y132 F177 V181 I184G124-L128 WeakPolarHBondContact O-CB 3.45Å; G124-L128 VanDerWaalsContact O-CG 3.28Å; G124-L128 WeakPolarHBondContact O-CG 3.19Å; G124-L128 PolarHBondContact O-N 2.8Å; A125-L128 CarbonylContact O-C 3.55Å; A125-L128 WeakPolarHBondContact O-CB 3.49Å; A125-L128 PolarHBondContact O-N 3.41Å; T126-L128 VanDerWaalsContact C-N 3.32Å; T126-L128 PolarHBondContact O-N 3.45Å; L128-F130 PolarHBondContact O-N 3.22Å; L128-V131 HydrophobicContact CD2-CG2 4.48Å; L128-V131 PolarHBondContact O-N 3.34Å; L128-Y132 HydrophobicContact CB-CD2 4.13Å; L128-Y132 HydrophobicContact CD1-CD2 4.38Å; L128-Y132 HydrophobicContact CD2-CD2 3.93Å; L128-Y132 HydrophobicContact CG-CD2 4.36Å; L128-Y132 WeakPolarHBondContact O-CB 3.3Å; L128-Y132 PolarHBondContact O-N 2.98Å; L128-F177 HydrophobicContact CB-CD2 4.13Å; L128-F177 HydrophobicContact CB-CE2 3.47Å; L128-F177 VanDerWaalsContact CB-CE2 3.47Å; L128-F177 HydrophobicContact CB-CZ 4.22Å; L128-V181 HydrophobicContact CD1-CG2 4.28Å; L128-I184 HydrophobicContact CD1-CD1 3.72Å; L128-I184 HydrophobicContact CG-CD1 4.28Å
129C95.7Very high95.4Very high61 Ų6121.1 Ų21.141%0.41213%0.131SC..Hα-helixtrans-51.8-34.3176.5-69.40000112.7A125 T126 S127 Y174A125-C129 PolarHBondContact O-N 2.85Å; A125-C129 PolarHBondContact O-SG 3.08Å; T126-C129 WeakPolarHBondContact O-CB 3.46Å; T126-C129 PolarHBondContact O-N 2.76Å; T126-C129 VanDerWaalsContact O-N 3.15Å; S127-C129 VanDerWaalsContact C-N 3.29Å; S127-C129 PolarHBondContact O-N 3.45Å; C129-Y174 PolarHBondContact O-OH 2.85Å
130F94.8Very high95.7Very high131 Ų13121.2 Ų21.258%0.57513%0.131SC*.Hα-helixtrans-94.6-39.1177.6-62.1-82.1000113.4L87 T126 S127 L128L87-F130 HydrophobicContact CD1-CB 3.73Å; L87-F130 HydrophobicContact CD1-CD2 3.92Å; L87-F130 HydrophobicContact CD1-CG 4.13Å; L87-F130 HydrophobicContact CD2-CD2 3.69Å; L87-F130 HydrophobicContact CD2-CE2 4.05Å; L87-F130 HydrophobicContact CD2-CG 4.27Å; L87-F130 HydrophobicContact CG-CD2 4.49Å; T126-F130 HydrophobicContact CG2-CE2 4.25Å; T126-F130 VanDerWaalsContact O-CD2 3.24Å; T126-F130 WeakPolarHBondContact O-CD2 3.49Å; S127-F130 PolarHBondContact O-N 3.5Å; S127-F130 VanDerWaalsContact O-N 3.11Å; L128-F130 PolarHBondContact O-N 3.22Å
131V96.3Very high96Very high2 Ų221.2 Ų21.21%0.01213%0.129CC..Hα-helixtrans-99.8-5.3-168.8-480000114.4R80 P83 L87 S127 L128 L134 D135R80-V131 HydrophobicContact CG-CB 4.12Å; R80-V131 HydrophobicContact CG-CG2 4.32Å; P83-V131 HydrophobicContact CB-CG1 3.85Å; P83-V131 HydrophobicContact CG-CG1 3.84Å; L87-V131 HydrophobicContact CD1-CG1 3.82Å; S127-V131 WeakPolarHBondContact O-CG2 3.36Å; S127-V131 PolarHBondContact O-N 3.46Å; L128-V131 HydrophobicContact CD2-CG2 4.48Å; L128-V131 PolarHBondContact O-N 3.34Å; V131-L134 WeakPolarHBondContact O-CB 3.41Å; V131-L134 PolarHBondContact O-N 3.02Å; V131-D135 PolarHBondContact O-N 2.78Å
132Y97.7Very high96.2Very high0 Ų021.1 Ų21.10%013%0.128CC..Hα-helixtrans-57.5-43.7-177.8-154.5-92000113.7L128 L134 D135 F136 L173 Y174 Q175 G176 F177 S180 R235 M239L128-Y132 HydrophobicContact CB-CD2 4.13Å; L128-Y132 HydrophobicContact CD1-CD2 4.38Å; L128-Y132 HydrophobicContact CD2-CD2 3.93Å; L128-Y132 HydrophobicContact CG-CD2 4.36Å; L128-Y132 WeakPolarHBondContact O-CB 3.3Å; L128-Y132 PolarHBondContact O-N 2.98Å; Y132-L134 PolarHBondContact O-N 2.69Å; Y132-L134 VanDerWaalsContact O-N 3.16Å; Y132-D135 PolarHBondContact O-N 3.4Å; Y132-F136 HydrophobicContact CD1-CB 4.33Å; Y132-F136 HydrophobicContact CE1-CB 4.46Å; Y132-F136 WeakPolarHBondContact O-CB 3.39Å; Y132-F136 PolarHBondContact O-N 2.92Å; Y132-L173 WeakPolarHBondContact CD1-O 3.23Å; Y132-Y174 HydrophobicContact CD1-CD1 4.29Å; Y132-Y174 HydrophobicContact CD1-CG 4.44Å; Y132-Y174 HydrophobicContact CG-CD1 4.2Å; Y132-Q175 PolarHBondContact OH-O 3.04Å; Y132-Q175 VanDerWaalsContact OH-O 3.11Å; Y132-G176 PolarHBondContact OH-O 3.46Å; Y132-F177 AromaticContact CD2-CD2 3.69Å; Y132-F177 HydrophobicContact CD2-CD2 3.69Å; Y132-F177 HydrophobicContact CD2-CE2 4.44Å; Y132-F177 HydrophobicContact CE2-CB 4.22Å; Y132-F177 HydrophobicContact CE2-CD2 4.06Å; Y132-F177 HydrophobicContact CG-CD2 4.07Å; Y132-F177 PolarHBondContact OH-N 2.92Å; Y132-F177 VanDerWaalsContact OH-N 3.14Å; Y132-S180 VanDerWaalsContact CE2-OG 3.24Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.48Å; Y132-S180 PolarHBondContact OH-OG 2.84Å; Y132-S180 VanDerWaalsContact OH-OG 3.04Å; Y132-R235 PolarHBondContact OH-NE 3.27Å; Y132-M239 HydrophobicContact CD1-CE 4.49Å; Y132-M239 HydrophobicContact CE1-CE 3.63Å; Y132-M239 HydrophobicContact CE2-CE 4.16Å; Y132-M239 VanDerWaalsContact CZ-CE 3.44Å; Y132-M239 VanDerWaalsContact OH-CE 3.26Å; Y132-M239 WeakPolarHBondContact OH-CE 3.48Å
133P98Very high96.4Very high22 Ų2220 Ų2014%0.14312%0.118CC..Hα-helixtrans-57.4-32.8178.9-27.837.4000113.3A137 Y174P133-A137 VanDerWaalsContact O-CB 3.27Å; P133-A137 WeakPolarHBondContact O-CB 3.5Å; P133-A137 PolarHBondContact O-N 3.36Å; P133-Y174 HydrophobicContact CG-CE2 3.8Å
134L97.8Very high96.6Very high27 Ų2718.4 Ų18.414%0.14111%0.105CC..Hα-helixtrans-72-38.5175.3-65.8172.3000112.2I79 R80 P83 V131 Y132 R138 L157I79-L134 HydrophobicContact CG2-CD1 3.99Å; I79-L134 HydrophobicContact CG2-CD2 4.21Å; R80-L134 HydrophobicContact CB-CB 3.99Å; R80-L134 HydrophobicContact CB-CD1 4.08Å; R80-L134 HydrophobicContact CG-CB 4.11Å; R80-L134 HydrophobicContact CG-CD1 4.45Å; P83-L134 HydrophobicContact CG-CD1 4.16Å; V131-L134 WeakPolarHBondContact O-CB 3.41Å; V131-L134 PolarHBondContact O-N 3.02Å; Y132-L134 PolarHBondContact O-N 2.69Å; Y132-L134 VanDerWaalsContact O-N 3.16Å; L134-R138 VanDerWaalsContact O-CB 3.27Å; L134-R138 WeakPolarHBondContact O-CB 3.23Å; L134-R138 PolarHBondContact O-N 3.41Å; L134-L157 HydrophobicContact CD2-CD1 4.28Å; L134-L157 HydrophobicContact CD2-CD2 4.08Å
135D97.3Very high96.7Very high8 Ų818.6 Ų18.64%0.04310%0.104CC..Hα-helixtrans-71.7-37.5176.3-156.89.7000111.7V131 Y132 R138 T139 R235 R236V131-D135 PolarHBondContact O-N 2.78Å; Y132-D135 PolarHBondContact O-N 3.4Å; D135-R138 WeakPolarHBondContact O-CB 3.43Å; D135-R138 PolarHBondContact O-N 3.17Å; D135-T139 PolarHBondContact O-N 3.49Å; D135-T139 PolarHBondContact O-OG1 3.29Å; D135-R235 IonicContact OD2-CZ 2.96Å; D135-R235 IonicContact OD2-NH1 3.37Å; D135-R235 PolarHBondContact OD2-NH1 2.91Å; D135-R235 IonicContact OD2-NH2 2.79Å; D135-R235 PolarHBondContact OD2-NH2 3.26Å; D135-R236 VanDerWaalsContact CG-NH1 3.28Å; D135-R236 IonicContact OD1-CZ 2.76Å; D135-R236 IonicContact OD1-NH1 3.63Å; D135-R236 PolarHBondContact OD1-NH1 3.02Å; D135-R236 IonicContact OD1-NH2 2.77Å; D135-R236 PolarHBondContact OD1-NH2 3.22Å; D135-R236 IonicContact OD2-CZ 3.92Å; D135-R236 IonicContact OD2-NH1 3.74Å; D135-R236 PolarHBondContact OD2-NH1 3.4Å; D135-R236 IonicContact OD2-NH2 2.97Å; D135-R236 PolarHBondContact OD2-NH2 3.34Å
136F98.4Very high96.6Very high0 Ų017.9 Ų17.90%010%0.099CC..Hα-helixtrans-58.2-54.5170.2172.7-85.9000110.8Y132 R138 T139 R140 I164 G172 L173 M239Y132-F136 HydrophobicContact CD1-CB 4.33Å; Y132-F136 HydrophobicContact CE1-CB 4.46Å; Y132-F136 WeakPolarHBondContact O-CB 3.39Å; Y132-F136 PolarHBondContact O-N 2.92Å; F136-R138 VanDerWaalsContact C-N 3.3Å; F136-R138 PolarHBondContact O-N 3.5Å; F136-T139 PolarHBondContact O-N 3.45Å; F136-R140 HydrophobicContact CD1-CG 4.07Å; F136-R140 HydrophobicContact CD2-CG 4.47Å; F136-R140 HydrophobicContact CE1-CG 3.54Å; F136-R140 HydrophobicContact CE2-CG 4.01Å; F136-R140 HydrophobicContact CG-CG 4.48Å; F136-R140 HydrophobicContact CZ-CG 3.49Å; F136-R140 VanDerWaalsContact CZ-CG 3.49Å; F136-R140 WeakPolarHBondContact O-CG 3.4Å; F136-R140 PolarHBondContact O-N 2.93Å; F136-I164 HydrophobicContact CE1-CB 4.17Å; F136-I164 HydrophobicContact CE1-CG1 3.87Å; F136-I164 HydrophobicContact CE1-CG2 3.94Å; F136-I164 HydrophobicContact CZ-CB 4.38Å; F136-I164 HydrophobicContact CZ-CD1 4.49Å; F136-I164 HydrophobicContact CZ-CG1 4.01Å; F136-I164 HydrophobicContact CZ-CG2 3.8Å; F136-G172 WeakPolarHBondContact CE2-O 3.43Å; F136-L173 HydrophobicContact CD1-CD2 3.98Å; F136-L173 HydrophobicContact CE1-CD2 4.01Å; F136-M239 HydrophobicContact CB-CE 4.4Å; F136-M239 HydrophobicContact CD2-CB 3.85Å; F136-M239 HydrophobicContact CD2-CG 3.86Å; F136-M239 HydrophobicContact CE2-CB 4.02Å; F136-M239 HydrophobicContact CE2-CG 4.49Å; F136-M239 WeakPolarHBondContact CE2-O 3.44Å
137A98.2Very high96.3Very high0 Ų022.8 Ų22.80%012%0.118CC..Hα-helixtrans-63.2-37.9-178.600000111.8P133 T139 R140 L141 L157 C160 I161P133-A137 VanDerWaalsContact O-CB 3.27Å; P133-A137 WeakPolarHBondContact O-CB 3.5Å; P133-A137 PolarHBondContact O-N 3.36Å; A137-T139 VanDerWaalsContact C-N 3.35Å; A137-T139 PolarHBondContact O-N 3.33Å; A137-R140 PolarHBondContact O-N 2.97Å; A137-L141 VanDerWaalsContact O-CB 3.23Å; A137-L141 WeakPolarHBondContact O-CB 3.05Å; A137-L141 WeakPolarHBondContact O-CG 3.37Å; A137-L141 PolarHBondContact O-N 2.88Å; A137-L157 HydrophobicContact CB-CD1 3.34Å; A137-C160 HydrophobicContact CB-CB 4.5Å; A137-I161 HydrophobicContact CB-CD1 4.43Å; A137-I161 HydrophobicContact CB-CG1 4.01Å
138R97.8Very high95.9Very high17 Ų1723.4 Ų23.46%0.06413%0.127CC..Hα-helixtrans-54.6-50.8170.9178.7-165.8-174.5-173.97.8111E30 A76 N77 L134 D135 F136 A142E30-R138 IonicContact OE1-CZ 3.82Å; E30-R138 IonicContact OE1-NE 3.4Å; E30-R138 IonicContact OE1-NH1 3.6Å; E30-R138 PolarHBondContact OE1-NH1 3.47Å; E30-R138 IonicContact OE1-NH2 3.89Å; E30-R138 PolarHBondContact OE1-NH2 2.93Å; A76-R138 HydrophobicContact CB-CB 3.94Å; N77-R138 HydrophobicContact CB-CG 4.22Å; N77-R138 PolarHBondContact ND2-NH2 2.89Å; N77-R138 VanDerWaalsContact ND2-NH2 3.1Å; N77-R138 PolarHBondContact OD1-NH1 2.87Å; N77-R138 VanDerWaalsContact OD1-NH1 3.17Å; N77-R138 PolarHBondContact OD1-NH2 2.94Å; L134-R138 VanDerWaalsContact O-CB 3.27Å; L134-R138 WeakPolarHBondContact O-CB 3.23Å; L134-R138 PolarHBondContact O-N 3.41Å; D135-R138 WeakPolarHBondContact O-CB 3.43Å; D135-R138 PolarHBondContact O-N 3.17Å; F136-R138 VanDerWaalsContact C-N 3.3Å; F136-R138 PolarHBondContact O-N 3.5Å; R138-A142 WeakPolarHBondContact O-CB 3.46Å; R138-A142 PolarHBondContact O-N 2.89Å
139T98Very high95.4Very high0 Ų026.4 Ų26.40%015%0.154CC..Hα-helixtrans-64.5-45.7179.9-69.20000112.3V38 D135 F136 A137 A142 A143 R236 M239V38-T139 HydrophobicContact CG1-CG2 4.44Å; D135-T139 PolarHBondContact O-N 3.49Å; D135-T139 PolarHBondContact O-OG1 3.29Å; F136-T139 PolarHBondContact O-N 3.45Å; A137-T139 VanDerWaalsContact C-N 3.35Å; A137-T139 PolarHBondContact O-N 3.33Å; T139-A142 CarbonylContact O-C 3.52Å; T139-A142 PolarHBondContact O-N 3.46Å; T139-A143 WeakPolarHBondContact O-CB 3.31Å; T139-A143 PolarHBondContact O-N 3.48Å; T139-R236 HydrophobicContact CG2-CB 4.19Å; T139-R236 HydrophobicContact CG2-CG 4.43Å; T139-R236 WeakPolarHBondContact OG1-CD 3.42Å; T139-R236 PolarHBondContact OG1-NH1 2.96Å; T139-M239 HydrophobicContact CG2-CB 4.4Å; T139-M239 HydrophobicContact CG2-SD 3.94Å
140R98.1Very high95Very high6 Ų628.6 Ų28.62%0.02318%0.177CC..Hα-helixtrans-63.3-45.6179.5-65.4-64.3-79.8122.12.3111.6F136 A137 A142 A143 D144 E153 F154 M239 M240 S242F136-R140 HydrophobicContact CD1-CG 4.07Å; F136-R140 HydrophobicContact CD2-CG 4.47Å; F136-R140 HydrophobicContact CE1-CG 3.54Å; F136-R140 HydrophobicContact CE2-CG 4.01Å; F136-R140 HydrophobicContact CG-CG 4.48Å; F136-R140 HydrophobicContact CZ-CG 3.49Å; F136-R140 VanDerWaalsContact CZ-CG 3.49Å; F136-R140 WeakPolarHBondContact O-CG 3.4Å; F136-R140 PolarHBondContact O-N 2.93Å; A137-R140 PolarHBondContact O-N 2.97Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-A142 PolarHBondContact O-N 2.91Å; R140-A143 PolarHBondContact O-N 2.95Å; R140-D144 WeakPolarHBondContact O-CB 3.28Å; R140-D144 PolarHBondContact O-N 3.47Å; R140-E153 IonicContact CZ-OE1 2.7Å; R140-E153 IonicContact CZ-OE2 3.27Å; R140-E153 IonicContact NH1-OE2 3.95Å; R140-E153 PolarHBondContact NH1-OE2 3.07Å; R140-E153 IonicContact NH2-OE1 3.9Å; R140-E153 PolarHBondContact NH2-OE1 3.14Å; R140-E153 IonicContact NH2-OE2 3.07Å; R140-E153 PolarHBondContact NH2-OE2 2.93Å; R140-F154 HydrophobicContact CB-CD2 4.43Å; R140-F154 HydrophobicContact CB-CE2 3.82Å; R140-F154 HydrophobicContact CB-CZ 4.4Å; R140-M239 WeakPolarHBondContact CD-O 3.25Å; R140-M240 PolarHBondContact NH1-SD 2.87Å; R140-M240 VanDerWaalsContact NH1-SD 3.41Å; R140-S242 PolarHBondContact NH2-O 3.13Å
141L98Very high94.8Very high8 Ų828.1 Ų28.14%0.04218%0.176CC..Hα-helixtrans-63.9-39.5174.4-68.7170.8000112R31 R72 A137 A143 D144 F154 L157 C160R31-L141 PolarHBondContact NH1-O 3.31Å; R72-L141 WeakPolarHBondContact CG-O 3.33Å; R72-L141 PolarHBondContact NE-O 3.07Å; A137-L141 VanDerWaalsContact O-CB 3.23Å; A137-L141 WeakPolarHBondContact O-CB 3.05Å; A137-L141 WeakPolarHBondContact O-CG 3.37Å; A137-L141 PolarHBondContact O-N 2.88Å; L141-A143 PolarHBondContact O-N 3.35Å; L141-D144 PolarHBondContact O-N 3.46Å; L141-F154 HydrophobicContact CD2-CB 3.75Å; L141-F154 HydrophobicContact CD2-CD2 4.48Å; L141-F154 HydrophobicContact CD2-CG 4.43Å; L141-L157 HydrophobicContact CD1-CB 4.33Å; L141-C160 HydrophobicContact CD2-CB 4.26Å; L141-C160 HydrophobicContact CG-CB 4.34Å
142A97.5Very high94.8Very high3 Ų331 Ų313%0.02519%0.187CC..Hα-helixtrans-68-20.2176.100000113.7R31 L34 R138 T139 R140R31-A142 VanDerWaalsContact CD-O 3.25Å; R31-A142 WeakPolarHBondContact CD-O 3.31Å; R31-A142 PolarHBondContact NE-O 3.27Å; R31-A142 PolarHBondContact NH1-O 3.33Å; R31-A142 PolarHBondContact NH2-O 3.15Å; L34-A142 HydrophobicContact CB-CB 3.89Å; L34-A142 HydrophobicContact CD1-CB 3.31Å; L34-A142 HydrophobicContact CG-CB 4.21Å; R138-A142 WeakPolarHBondContact O-CB 3.46Å; R138-A142 PolarHBondContact O-N 2.89Å; T139-A142 CarbonylContact O-C 3.52Å; T139-A142 PolarHBondContact O-N 3.46Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-A142 PolarHBondContact O-N 2.91Å
143A97Very high94.6Very high1 Ų132.9 Ų32.91%0.00820%0.196CC..Hα-helixtrans-95.3-22.8175.300000112.6V38 T139 R140 L141 V145 M240V38-A143 HydrophobicContact CG2-CB 3.53Å; T139-A143 WeakPolarHBondContact O-CB 3.31Å; T139-A143 PolarHBondContact O-N 3.48Å; R140-A143 PolarHBondContact O-N 2.95Å; L141-A143 PolarHBondContact O-N 3.35Å; A143-V145 PolarHBondContact O-N 3.42Å; A143-M240 HydrophobicContact CB-CE 3.49Å; A143-M240 VanDerWaalsContact CB-CE 3.49Å; A143-M240 HydrophobicContact CB-SD 3.6Å; A143-M240 VanDerWaalsContact CB-SD 3.6Å
144D96.4Very high94.6Very high0 Ų031.9 Ų31.90%019%0.189CC..  trans-70.4114.5-178-176.510000110.9R31 Q44 R72 R140 L141 R152 E153 F154R31-D144 PolarHBondContact NH2-O 2.97Å; Q44-D144 PolarHBondContact NE2-OD1 2.91Å; Q44-D144 VanDerWaalsContact OE1-CA 3.31Å; Q44-D144 PolarHBondContact OE1-OD1 3.4Å; R72-D144 WeakPolarHBondContact CD-O 3.31Å; R72-D144 IonicContact CZ-OD2 3.21Å; R72-D144 PolarHBondContact NE-O 2.59Å; R72-D144 IonicContact NE-OD2 3.65Å; R72-D144 IonicContact NH2-OD2 3.02Å; R72-D144 PolarHBondContact NH2-OD2 3.02Å; R140-D144 WeakPolarHBondContact O-CB 3.28Å; R140-D144 PolarHBondContact O-N 3.47Å; L141-D144 PolarHBondContact O-N 3.46Å; D144-R152 VanDerWaalsContact OD1-CA 3.31Å; D144-R152 WeakPolarHBondContact OD1-CA 3.22Å; D144-E153 VanDerWaalsContact CG-N 3.33Å; D144-E153 PolarHBondContact OD1-N 2.95Å; D144-E153 PolarHBondContact OD2-N 2.84Å; D144-F154 HydrophobicContact CB-CD2 4.27Å; D144-F154 PolarHBondContact OD2-N 3.24Å
145V95.9Very high94.5Very high17 Ų1735.5 Ų35.510%0.10321%0.212CC..  trans-108.9146.6-175.9-630000111.6L35 Q44 I45 Q65 A143L35-V145 HydrophobicContact CD2-CG1 3.71Å; Q44-V145 HydrophobicContact CB-CG2 3.43Å; Q44-V145 VanDerWaalsContact CB-CG2 3.43Å; Q44-V145 HydrophobicContact CG-CG2 4.32Å; Q44-V145 PolarHBondContact NE2-O 3.07Å; I45-V145 HydrophobicContact CD1-CG1 4.07Å; I45-V145 HydrophobicContact CG1-CG1 4.35Å; I45-V145 HydrophobicContact CG1-CG2 3.92Å; Q65-V145 HydrophobicContact CG-CB 4.39Å; A143-V145 PolarHBondContact O-N 3.42Å
146G92.5Very high94.4Very high8 Ų836.2 Ų36.28%0.08222%0.222CC..  trans148.8157.5175.600000112.4R152G146-R152 VanDerWaalsContact O-CZ 3.3Å; G146-R152 PolarHBondContact O-NE 2.97Å; G146-R152 PolarHBondContact O-NH2 3.37Å
147K87.8Confident94.3Very high132 Ų13237.6 Ų37.657%0.57423%0.229SC*.SBendtrans-82-39.1178.9-65.2-167.5175-179.10112.6K63 E64K63-K147 WeakPolarHBondContact O-CE 3.47Å; K63-K147 PolarHBondContact O-NZ 3.48Å; E64-K147 WeakPolarHBondContact O-CE 3.46Å; E64-K147 WeakPolarHBondContact O-CG 3.35Å
148G84.8Confident94.3Very high34 Ų3439.9 Ų39.935%0.35125%0.252SS..SBendtrans-124.3174-173.400000114A150 Q151 R152G148-A150 VanDerWaalsContact C-N 3.28Å; G148-A150 PolarHBondContact O-N 3.27Å; G148-Q151 PolarHBondContact O-N 3.17Å; G148-R152 WeakPolarHBondContact O-CG 3.37Å; G148-R152 PolarHBondContact O-N 3.37Å
149A85.1Confident94.3Very high78 Ų7842 Ų4265%0.64527%0.265SS*.G310 helixtrans-59.2-36.3179.700000112.9Q151 R152A149-Q151 VanDerWaalsContact C-N 3.29Å; A149-Q151 PolarHBondContact O-N 3.46Å; A149-R152 PolarHBondContact O-N 3Å
150A88.8Confident94.3Very high107 Ų10742 Ų4288%0.88427%0.265SS*.G310 helixtrans-68.2-24.4-18000000114.2G148G148-A150 VanDerWaalsContact C-N 3.28Å; G148-A150 PolarHBondContact O-N 3.27Å
151Q90.6Very high94.3Very high120 Ų12043.8 Ų43.856%0.56127%0.274SS*.G310 helixtrans-93.9-16-179.8-67.3176.8-19.800112.7Q44 G148 A149Q44-Q151 PolarHBondContact NE2-O 3.25Å; G148-Q151 PolarHBondContact O-N 3.17Å; A149-Q151 VanDerWaalsContact C-N 3.29Å; A149-Q151 PolarHBondContact O-N 3.46Å
152R94.3Very high94.3Very high64 Ų6446.7 Ų46.724%0.24229%0.292CS..  trans-94.4143.6-174.2-74.4175.6176.6-179.56.7110.8R72 D144 G146 G148 A149 F154R72-R152 VanDerWaalsContact NH1-NH1 3.14Å; D144-R152 VanDerWaalsContact OD1-CA 3.31Å; D144-R152 WeakPolarHBondContact OD1-CA 3.22Å; G146-R152 VanDerWaalsContact O-CZ 3.3Å; G146-R152 PolarHBondContact O-NE 2.97Å; G146-R152 PolarHBondContact O-NH2 3.37Å; G148-R152 WeakPolarHBondContact O-CG 3.37Å; G148-R152 PolarHBondContact O-N 3.37Å; A149-R152 PolarHBondContact O-N 3Å; R152-F154 VanDerWaalsContact C-N 3.33Å
153E95.1Very high94.4Very high38 Ų3851 Ų5118%0.17831%0.311CS..SBendtrans-71.7-33.1176.5-169.8-179.6175.500111.7R140 D144 K163R140-E153 IonicContact CZ-OE1 2.7Å; R140-E153 IonicContact CZ-OE2 3.27Å; R140-E153 IonicContact NH1-OE2 3.95Å; R140-E153 PolarHBondContact NH1-OE2 3.07Å; R140-E153 IonicContact NH2-OE1 3.9Å; R140-E153 PolarHBondContact NH2-OE1 3.14Å; R140-E153 IonicContact NH2-OE2 3.07Å; R140-E153 PolarHBondContact NH2-OE2 2.93Å; D144-E153 VanDerWaalsContact CG-N 3.33Å; D144-E153 PolarHBondContact OD1-N 2.95Å; D144-E153 PolarHBondContact OD2-N 2.84Å; E153-K163 PolarHBondContact O-NZ 2.97Å
154F96.5Very high94.4Very high1 Ų151 Ų510%0.00431%0.311CS..  trans-130.2142.4-175.4-52.3-68.5000112.1R72 R140 L141 D144 R152 N159 C160 K163 I164R72-F154 PolarHBondContact NH2-O 3.44Å; R140-F154 HydrophobicContact CB-CD2 4.43Å; R140-F154 HydrophobicContact CB-CE2 3.82Å; R140-F154 HydrophobicContact CB-CZ 4.4Å; L141-F154 HydrophobicContact CD2-CB 3.75Å; L141-F154 HydrophobicContact CD2-CD2 4.48Å; L141-F154 HydrophobicContact CD2-CG 4.43Å; D144-F154 HydrophobicContact CB-CD2 4.27Å; D144-F154 PolarHBondContact OD2-N 3.24Å; R152-F154 VanDerWaalsContact C-N 3.33Å; F154-N159 VanDerWaalsContact CA-OD1 3.31Å; F154-N159 WeakPolarHBondContact CA-OD1 3.41Å; F154-C160 HydrophobicContact CB-CB 4.11Å; F154-C160 VanDerWaalsContact CD1-CA 3.42Å; F154-C160 HydrophobicContact CD1-CB 3.76Å; F154-C160 HydrophobicContact CD2-CB 4.39Å; F154-C160 HydrophobicContact CE1-CB 4.25Å; F154-C160 HydrophobicContact CG-CB 3.81Å; F154-K163 HydrophobicContact CD1-CD 4.1Å; F154-K163 HydrophobicContact CE1-CB 4.35Å; F154-K163 HydrophobicContact CE1-CD 4Å; F154-K163 HydrophobicContact CE1-CG 4.43Å; F154-I164 HydrophobicContact CE1-CD1 4.26Å; F154-I164 HydrophobicContact CE1-CG1 4.13Å; F154-I164 HydrophobicContact CZ-CD1 4.11Å; F154-I164 HydrophobicContact CZ-CG1 4.21Å
155T95.5Very high94.5Very high103 Ų10356.4 Ų56.463%0.63233%0.334SS*.SBendtrans-82.4-2717458.50000112.4N159T155-N159 PolarHBondContact N-OD1 2.86Å; T155-N159 WeakPolarHBondContact OG1-CB 3.5Å; T155-N159 VanDerWaalsContact OG1-CG 3.27Å
156G95.6Very high94.6Very high23 Ų2363.8 Ų63.824%0.23737%0.365CS..SBendtrans179.1-168.6-179.500000112.9N159 C160G156-N159 PolarHBondContact O-N 3.4Å; G156-C160 WeakPolarHBondContact O-CB 3.42Å; G156-C160 PolarHBondContact O-N 2.87Å
157L97.2Very high94.8Very high30 Ų3065.8 Ų65.816%0.15738%0.378CS..Hα-helixtrans-58.3-55.2-176.3175.256000113.1A76 I79 L134 A137 L141 N159 C160 I161A76-L157 HydrophobicContact CB-CD1 3.91Å; A76-L157 HydrophobicContact CB-CD2 4.22Å; I79-L157 HydrophobicContact CD1-CD2 3.83Å; L134-L157 HydrophobicContact CD2-CD1 4.28Å; L134-L157 HydrophobicContact CD2-CD2 4.08Å; A137-L157 HydrophobicContact CB-CD1 3.34Å; L141-L157 HydrophobicContact CD1-CB 4.33Å; L157-N159 VanDerWaalsContact C-N 3.32Å; L157-N159 PolarHBondContact O-N 2.92Å; L157-C160 WeakPolarHBondContact O-CB 3.18Å; L157-C160 PolarHBondContact O-N 2.91Å; L157-I161 HydrophobicContact CD1-CD1 3.69Å; L157-I161 HydrophobicContact CD1-CG1 4.18Å; L157-I161 HydrophobicContact CG-CD1 4.27Å; L157-I161 PolarHBondContact O-N 3.49Å
158G97.7Very high95.2Very high47 Ų4761.9 Ų61.949%0.48536%0.363SS..Hα-helixtrans-61.1-40.8-179.200000112.5T162G158-T162 VanDerWaalsContact O-CB 3.26Å; G158-T162 WeakPolarHBondContact O-CB 3.22Å; G158-T162 PolarHBondContact O-N 3.38Å; G158-T162 PolarHBondContact O-OG1 3.02Å
159N97.8Very high95.8Very high61 Ų6161.5 Ų61.533%0.32636%0.359SS..Hα-helixtrans-64-42175.4176.4-99.1000112.2F154 T155 G156 L157 T162 K163F154-N159 VanDerWaalsContact CA-OD1 3.31Å; F154-N159 WeakPolarHBondContact CA-OD1 3.41Å; T155-N159 PolarHBondContact N-OD1 2.86Å; T155-N159 WeakPolarHBondContact OG1-CB 3.5Å; T155-N159 VanDerWaalsContact OG1-CG 3.27Å; G156-N159 PolarHBondContact O-N 3.4Å; L157-N159 VanDerWaalsContact C-N 3.32Å; L157-N159 PolarHBondContact O-N 2.92Å; N159-T162 PolarHBondContact O-N 3.35Å; N159-K163 WeakPolarHBondContact O-CB 3.38Å; N159-K163 PolarHBondContact O-N 3.41Å
160C98.1Very high96.4Very high0 Ų062.9 Ų62.90%036%0.355CS..Hα-helixtrans-60-51.2176.7-1770000112.1A137 L141 F154 G156 L157 I164A137-C160 HydrophobicContact CB-CB 4.5Å; L141-C160 HydrophobicContact CD2-CB 4.26Å; L141-C160 HydrophobicContact CG-CB 4.34Å; F154-C160 HydrophobicContact CB-CB 4.11Å; F154-C160 VanDerWaalsContact CD1-CA 3.42Å; F154-C160 HydrophobicContact CD1-CB 3.76Å; F154-C160 HydrophobicContact CD2-CB 4.39Å; F154-C160 HydrophobicContact CE1-CB 4.25Å; F154-C160 HydrophobicContact CG-CB 3.81Å; G156-C160 WeakPolarHBondContact O-CB 3.42Å; G156-C160 PolarHBondContact O-N 2.87Å; L157-C160 WeakPolarHBondContact O-CB 3.18Å; L157-C160 PolarHBondContact O-N 2.91Å; C160-I164 WeakPolarHBondContact O-CG1 3.26Å; C160-I164 PolarHBondContact O-N 2.96Å; C160-I164 VanDerWaalsContact O-N 3.15Å
161I98.3Very high96.7Very high44 Ų4467.7 Ų67.723%0.22635%0.351CS..Hα-helixtrans-61.7-48.4178.9-66.7173.1000110.4A137 L157 I164 F165 L173A137-I161 HydrophobicContact CB-CD1 4.43Å; A137-I161 HydrophobicContact CB-CG1 4.01Å; L157-I161 HydrophobicContact CD1-CD1 3.69Å; L157-I161 HydrophobicContact CD1-CG1 4.18Å; L157-I161 HydrophobicContact CG-CD1 4.27Å; L157-I161 PolarHBondContact O-N 3.49Å; I161-I164 PolarHBondContact O-N 3.43Å; I161-F165 VanDerWaalsContact O-CB 3.25Å; I161-F165 WeakPolarHBondContact O-CB 3.28Å; I161-F165 PolarHBondContact O-N 3.12Å; I161-L173 HydrophobicContact CG2-CD1 4.03Å; I161-L173 HydrophobicContact CG2-CD2 4.33Å
162T98.5Very high97Very high69 Ų6962.1 Ų62.142%0.42333%0.326SS..Hα-helixtrans-64.2-45.2-177-56.20000111.9G158 N159 F165 K166G158-T162 VanDerWaalsContact O-CB 3.26Å; G158-T162 WeakPolarHBondContact O-CB 3.22Å; G158-T162 PolarHBondContact O-N 3.38Å; G158-T162 PolarHBondContact O-OG1 3.02Å; N159-T162 PolarHBondContact O-N 3.35Å; T162-F165 PolarHBondContact O-N 3.26Å; T162-K166 HydrophobicContact CG2-CD 4.13Å; T162-K166 HydrophobicContact CG2-CG 4.47Å; T162-K166 WeakPolarHBondContact O-CB 3.31Å; T162-K166 VanDerWaalsContact O-CG 3.31Å; T162-K166 WeakPolarHBondContact O-CG 3.21Å; T162-K166 PolarHBondContact O-N 3.17Å
163K98.1Very high97.2Very high95 Ų9559.4 Ų59.441%0.41332%0.316SS..Hα-helixtrans-63.4-44.2-178.3-176.4171.7173.2179.60111.1E153 F154 N159 K166 S167E153-K163 PolarHBondContact O-NZ 2.97Å; F154-K163 HydrophobicContact CD1-CD 4.1Å; F154-K163 HydrophobicContact CE1-CB 4.35Å; F154-K163 HydrophobicContact CE1-CD 4Å; F154-K163 HydrophobicContact CE1-CG 4.43Å; N159-K163 WeakPolarHBondContact O-CB 3.38Å; N159-K163 PolarHBondContact O-N 3.41Å; K163-K166 PolarHBondContact O-N 3.1Å; K163-S167 PolarHBondContact O-N 2.61Å; K163-S167 VanDerWaalsContact O-N 3.07Å; K163-S167 PolarHBondContact O-OG 3.35Å
164I98.2Very high97.3Very high1 Ų160.4 Ų60.41%0.00532%0.319CS..Hα-helixtrans-71.2-40.5178.3-63.7-61.6000111.8F136 F154 C160 I161 K166 S167 D168 L173F136-I164 HydrophobicContact CE1-CB 4.17Å; F136-I164 HydrophobicContact CE1-CG1 3.87Å; F136-I164 HydrophobicContact CE1-CG2 3.94Å; F136-I164 HydrophobicContact CZ-CB 4.38Å; F136-I164 HydrophobicContact CZ-CD1 4.49Å; F136-I164 HydrophobicContact CZ-CG1 4.01Å; F136-I164 HydrophobicContact CZ-CG2 3.8Å; F154-I164 HydrophobicContact CE1-CD1 4.26Å; F154-I164 HydrophobicContact CE1-CG1 4.13Å; F154-I164 HydrophobicContact CZ-CD1 4.11Å; F154-I164 HydrophobicContact CZ-CG1 4.21Å; C160-I164 WeakPolarHBondContact O-CG1 3.26Å; C160-I164 PolarHBondContact O-N 2.96Å; C160-I164 VanDerWaalsContact O-N 3.15Å; I161-I164 PolarHBondContact O-N 3.43Å; I164-K166 VanDerWaalsContact C-N 3.3Å; I164-K166 PolarHBondContact O-N 2.91Å; I164-S167 PolarHBondContact O-N 3.2Å; I164-S167 PolarHBondContact O-OG 3.27Å; I164-D168 PolarHBondContact O-N 3.34Å; I164-L173 HydrophobicContact CB-CD2 3.99Å; I164-L173 HydrophobicContact CG2-CD2 3.79Å; I164-L173 HydrophobicContact CG2-CG 4.32Å
165F98.2Very high97.4Very high112 Ų11262.4 Ų62.449%0.49133%0.328SS..Hα-helixtrans-61.4-40.2175.3-174.2-98.8000111.8I161 T162 G169 L170 L173I161-F165 VanDerWaalsContact O-CB 3.25Å; I161-F165 WeakPolarHBondContact O-CB 3.28Å; I161-F165 PolarHBondContact O-N 3.12Å; T162-F165 PolarHBondContact O-N 3.26Å; F165-G169 WeakPolarHBondContact O-CA 3.33Å; F165-G169 PolarHBondContact O-N 3Å; F165-L170 HydrophobicContact CE2-CB 4.14Å; F165-L170 HydrophobicContact CE2-CD1 4.43Å; F165-L173 HydrophobicContact CB-CD1 4.19Å; F165-L173 HydrophobicContact CD2-CD1 4.01Å
166K98Very high97.4Very high173 Ų17357.9 Ų57.975%0.75230%0.301SS*.Hα-helixtrans-67.9-33.4175.6-74.6-178.1177.6-172.20113.2T162 K163 I164T162-K166 HydrophobicContact CG2-CD 4.13Å; T162-K166 HydrophobicContact CG2-CG 4.47Å; T162-K166 WeakPolarHBondContact O-CB 3.31Å; T162-K166 VanDerWaalsContact O-CG 3.31Å; T162-K166 WeakPolarHBondContact O-CG 3.21Å; T162-K166 PolarHBondContact O-N 3.17Å; K163-K166 PolarHBondContact O-N 3.1Å; I164-K166 VanDerWaalsContact C-N 3.3Å; I164-K166 PolarHBondContact O-N 2.91Å
167S96.7Very high97.5Very high49 Ų4958.5 Ų58.534%0.34330%0.298SS..Hα-helixtrans-84.3-38.7-177.469.60000113.5K163 I164K163-S167 PolarHBondContact O-N 2.61Å; K163-S167 VanDerWaalsContact O-N 3.07Å; K163-S167 PolarHBondContact O-OG 3.35Å; I164-S167 PolarHBondContact O-N 3.2Å; I164-S167 PolarHBondContact O-OG 3.27Å
168D96.5Very high97.5Very high50 Ų5062.3 Ų62.327%0.26732%0.318SS..Hα-helixtrans-128.5-1.8-165.9-64.728.8000112.9I164 G172 S242 G243I164-D168 PolarHBondContact O-N 3.34Å; D168-G172 PolarHBondContact O-N 3.42Å; D168-S242 WeakPolarHBondContact OD2-CA 2.9Å; D168-S242 WeakPolarHBondContact OD2-CB 3.25Å; D168-G243 PolarHBondContact OD1-N 3.08Å; D168-G243 PolarHBondContact OD2-N 2.91Å
169G97.1Very high97.5Very high27 Ų2760 Ų6028%0.27830%0.295SS..Hα-helixtrans66.9-162.9-174.800000113.5F165 R171 G172F165-G169 WeakPolarHBondContact O-CA 3.33Å; F165-G169 PolarHBondContact O-N 3Å; G169-R171 VanDerWaalsContact C-N 3.28Å; G169-R171 PolarHBondContact O-N 3.11Å; G169-G172 PolarHBondContact O-N 3.32Å
170L96.7Very high97.4Very high107 Ų10757.5 Ų57.556%0.5628%0.282SS*.Hα-helixtrans-61.6-37.3178.8-170.463.7000111.9F165 G172 L173 Y174F165-L170 HydrophobicContact CE2-CB 4.14Å; F165-L170 HydrophobicContact CE2-CD1 4.43Å; L170-G172 PolarHBondContact O-N 2.85Å; L170-L173 PolarHBondContact O-N 2.96Å; L170-L173 VanDerWaalsContact O-N 3.1Å; L170-Y174 HydrophobicContact CD1-CD2 4.1Å; L170-Y174 HydrophobicContact CD1-CE2 3.68Å; L170-Y174 HydrophobicContact CG-CD2 4.19Å; L170-Y174 HydrophobicContact CG-CE2 4.15Å; L170-Y174 WeakPolarHBondContact O-CD2 3.38Å; L170-Y174 PolarHBondContact O-N 2.99Å
171R95.7Very high97.4Very high207 Ų20758.9 Ų58.978%0.78129%0.29SS*.Hα-helixtrans-56.7-39.6178.8-175.2178.7176.5178.6-0.6111.9G169 L173 Y174 Q175G169-R171 VanDerWaalsContact C-N 3.28Å; G169-R171 PolarHBondContact O-N 3.11Å; R171-L173 VanDerWaalsContact C-N 3.32Å; R171-L173 PolarHBondContact O-N 3.49Å; R171-Y174 CarbonylContact O-C 3.57Å; R171-Y174 PolarHBondContact O-N 2.79Å; R171-Y174 VanDerWaalsContact O-N 3.15Å; R171-Q175 PolarHBondContact O-N 2.89Å
172G96.7Very high97.3Very high4 Ų461.1 Ų61.14%0.04130%0.3CS..Hα-helixtrans-60.4-38.2177.500000113.7F136 D168 G169 L170 Y174 S242F136-G172 WeakPolarHBondContact CE2-O 3.43Å; D168-G172 PolarHBondContact O-N 3.42Å; G169-G172 PolarHBondContact O-N 3.32Å; L170-G172 PolarHBondContact O-N 2.85Å; G172-Y174 VanDerWaalsContact C-N 3.28Å; G172-Y174 PolarHBondContact O-N 3.45Å; G172-S242 WeakPolarHBondContact O-CB 3.37Å; G172-S242 PolarHBondContact O-OG 3.37Å
173L98.1Very high97.3Very high7 Ų758.3 Ų58.34%0.03728%0.284CS..Hα-helixtrans-71.4-21.5177.7-65.3176.6000113.2Y132 F136 I161 I164 F165 L170 R171Y132-L173 WeakPolarHBondContact CD1-O 3.23Å; F136-L173 HydrophobicContact CD1-CD2 3.98Å; F136-L173 HydrophobicContact CE1-CD2 4.01Å; I161-L173 HydrophobicContact CG2-CD1 4.03Å; I161-L173 HydrophobicContact CG2-CD2 4.33Å; I164-L173 HydrophobicContact CB-CD2 3.99Å; I164-L173 HydrophobicContact CG2-CD2 3.79Å; I164-L173 HydrophobicContact CG2-CG 4.32Å; F165-L173 HydrophobicContact CB-CD1 4.19Å; F165-L173 HydrophobicContact CD2-CD1 4.01Å; L170-L173 PolarHBondContact O-N 2.96Å; L170-L173 VanDerWaalsContact O-N 3.1Å; R171-L173 VanDerWaalsContact C-N 3.32Å; R171-L173 PolarHBondContact O-N 3.49Å
174Y98.2Very high97.2Very high59 Ų5956.1 Ų56.123%0.23128%0.277CS..THydrogen-bonded Turntrans-104.914.9-179-74.6-101.8000113.2C129 Y132 P133 L170 R171 G172 G176 F177C129-Y174 PolarHBondContact O-OH 2.85Å; Y132-Y174 HydrophobicContact CD1-CD1 4.29Å; Y132-Y174 HydrophobicContact CD1-CG 4.44Å; Y132-Y174 HydrophobicContact CG-CD1 4.2Å; P133-Y174 HydrophobicContact CG-CE2 3.8Å; L170-Y174 HydrophobicContact CD1-CD2 4.1Å; L170-Y174 HydrophobicContact CD1-CE2 3.68Å; L170-Y174 HydrophobicContact CG-CD2 4.19Å; L170-Y174 HydrophobicContact CG-CE2 4.15Å; L170-Y174 WeakPolarHBondContact O-CD2 3.38Å; L170-Y174 PolarHBondContact O-N 2.99Å; R171-Y174 CarbonylContact O-C 3.57Å; R171-Y174 PolarHBondContact O-N 2.79Å; R171-Y174 VanDerWaalsContact O-N 3.15Å; G172-Y174 VanDerWaalsContact C-N 3.28Å; G172-Y174 PolarHBondContact O-N 3.45Å; Y174-G176 PolarHBondContact O-N 3.44Å; Y174-F177 AromaticContact CD1-CD2 3.71Å; Y174-F177 HydrophobicContact CD1-CD2 3.71Å; Y174-F177 HydrophobicContact CD1-CE2 4.22Å; Y174-F177 HydrophobicContact CD1-CG 4.32Å; Y174-F177 HydrophobicContact CE1-CD2 4.31Å; Y174-F177 HydrophobicContact CE1-CE2 4.42Å; Y174-F177 WeakPolarHBondContact O-CB 3.15Å; Y174-F177 PolarHBondContact O-N 2.98Å
175Q97.6Very high97.1Very high43 Ų4359.1 Ų59.120%0.20129%0.292CS..THydrogen-bonded Turntrans-63.3122.8-179.3-166.269.4-17.100111.2Y132 R171 M238 M239 S242Y132-Q175 PolarHBondContact OH-O 3.04Å; Y132-Q175 VanDerWaalsContact OH-O 3.11Å; R171-Q175 PolarHBondContact O-N 2.89Å; Q175-M238 HydrophobicContact CG-CB 4.34Å; Q175-M238 HydrophobicContact CG-CE 4.34Å; Q175-M238 WeakPolarHBondContact CG-O 3.41Å; Q175-M238 VanDerWaalsContact NE2-CE 3.33Å; Q175-M239 WeakPolarHBondContact O-CG 3.46Å; Q175-S242 VanDerWaalsContact CB-OG 3.3Å; Q175-S242 WeakPolarHBondContact CB-OG 3.41Å
176G97.3Very high97Very high7 Ų756.7 Ų56.77%0.07228%0.284CS..THydrogen-bonded Turntrans90.14.4-173.900000115Y132 Y174 N178 V179 S180Y132-G176 PolarHBondContact OH-O 3.46Å; Y174-G176 PolarHBondContact O-N 3.44Å; G176-N178 PolarHBondContact O-N 2.73Å; G176-V179 PolarHBondContact O-N 2.82Å; G176-S180 PolarHBondContact O-N 2.97Å; G176-S180 VanDerWaalsContact O-N 3.17Å; G176-S180 PolarHBondContact O-OG 2.98Å
177F97.6Very high96.9Very high36 Ų3652.2 Ų52.216%0.15826%0.263CS..Hα-helixtrans-54.2-49.8-177.9-180-89.8000112.9L128 Y132 Y174 V179 S180 V181L128-F177 HydrophobicContact CB-CD2 4.13Å; L128-F177 HydrophobicContact CB-CE2 3.47Å; L128-F177 VanDerWaalsContact CB-CE2 3.47Å; L128-F177 HydrophobicContact CB-CZ 4.22Å; Y132-F177 AromaticContact CD2-CD2 3.69Å; Y132-F177 HydrophobicContact CD2-CD2 3.69Å; Y132-F177 HydrophobicContact CD2-CE2 4.44Å; Y132-F177 HydrophobicContact CE2-CB 4.22Å; Y132-F177 HydrophobicContact CE2-CD2 4.06Å; Y132-F177 HydrophobicContact CG-CD2 4.07Å; Y132-F177 PolarHBondContact OH-N 2.92Å; Y132-F177 VanDerWaalsContact OH-N 3.14Å; Y174-F177 AromaticContact CD1-CD2 3.71Å; Y174-F177 HydrophobicContact CD1-CD2 3.71Å; Y174-F177 HydrophobicContact CD1-CE2 4.22Å; Y174-F177 HydrophobicContact CD1-CG 4.32Å; Y174-F177 HydrophobicContact CE1-CD2 4.31Å; Y174-F177 HydrophobicContact CE1-CE2 4.42Å; Y174-F177 WeakPolarHBondContact O-CB 3.15Å; Y174-F177 PolarHBondContact O-N 2.98Å; F177-V179 VanDerWaalsContact C-N 3.33Å; F177-V179 PolarHBondContact O-N 2.77Å; F177-S180 WeakPolarHBondContact O-CA 3.48Å; F177-S180 WeakPolarHBondContact O-CB 3.35Å; F177-S180 PolarHBondContact O-N 3.41Å; F177-S180 PolarHBondContact O-OG 3.49Å; F177-V181 HydrophobicContact CD1-CG2 4.16Å; F177-V181 HydrophobicContact CE1-CG2 3.72Å; F177-V181 HydrophobicContact CZ-CG2 4.05Å; F177-V181 PolarHBondContact O-N 2.9Å; F177-V181 VanDerWaalsContact O-N 3.1Å
178N95.9Very high96.8Very high110 Ų11054.3 Ų54.359%0.58826%0.263SS*.Hα-helixtrans-59.1-41.9-178-64.8-8.2000112.7G176 S180 V181 Q182G176-N178 PolarHBondContact O-N 2.73Å; N178-S180 PolarHBondContact O-N 3.35Å; N178-V181 PolarHBondContact O-N 2.99Å; N178-Q182 WeakPolarHBondContact O-CG 3.38Å; N178-Q182 PolarHBondContact O-N 3.43Å; N178-Q182 VanDerWaalsContact O-N 3.08Å
179V97.4Very high96.7Very high0 Ų053.2 Ų53.20%026%0.261CS..Hα-helixtrans-63.7-31.7176.2-1720000111.1G176 F177 G183 F231 V234 R235 T254G176-V179 PolarHBondContact O-N 2.82Å; F177-V179 VanDerWaalsContact C-N 3.33Å; F177-V179 PolarHBondContact O-N 2.77Å; V179-G183 PolarHBondContact O-N 2.92Å; V179-F231 HydrophobicContact CG1-CB 4.09Å; V179-F231 HydrophobicContact CG1-CD1 4.01Å; V179-F231 VanDerWaalsContact CG1-O 3.28Å; V179-F231 WeakPolarHBondContact CG1-O 3.27Å; V179-V234 HydrophobicContact CG1-CB 4.14Å; V179-V234 HydrophobicContact CG1-CG1 4.12Å; V179-V234 HydrophobicContact CG2-CG1 4.19Å; V179-R235 HydrophobicContact CB-CB 4.45Å; V179-R235 HydrophobicContact CG1-CB 4.33Å; V179-T254 HydrophobicContact CG2-CG2 3.25Å; V179-T254 WeakPolarHBondContact CG2-OG1 3.41Å
180S97.3Very high96.7Very high7 Ų752.8 Ų52.85%0.04926%0.255CS..Hα-helixtrans-69.1-42.8179.2-43.40000111.1Y132 G176 F177 N178 G183 I184 R235Y132-S180 VanDerWaalsContact CE2-OG 3.24Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.48Å; Y132-S180 PolarHBondContact OH-OG 2.84Å; Y132-S180 VanDerWaalsContact OH-OG 3.04Å; G176-S180 PolarHBondContact O-N 2.97Å; G176-S180 VanDerWaalsContact O-N 3.17Å; G176-S180 PolarHBondContact O-OG 2.98Å; F177-S180 WeakPolarHBondContact O-CA 3.48Å; F177-S180 WeakPolarHBondContact O-CB 3.35Å; F177-S180 PolarHBondContact O-N 3.41Å; F177-S180 PolarHBondContact O-OG 3.49Å; N178-S180 PolarHBondContact O-N 3.35Å; S180-G183 PolarHBondContact O-N 3.32Å; S180-I184 WeakPolarHBondContact O-CG1 2.99Å; S180-I184 PolarHBondContact O-N 3.4Å; S180-R235 WeakPolarHBondContact OG-CD 3.38Å; S180-R235 VanDerWaalsContact OG-CG 3.26Å; S180-R235 WeakPolarHBondContact OG-CG 3.49Å; S180-R235 PolarHBondContact OG-NE 3.4Å
181V96.8Very high96.5Very high29 Ų2951.2 Ų51.218%0.17624%0.242CC..Hα-helixtrans-63.7-45.8175.71790000110.7A125 L128 F177 N178 G183 I184 I185A125-V181 HydrophobicContact CB-CG1 4.09Å; A125-V181 HydrophobicContact CB-CG2 3.89Å; L128-V181 HydrophobicContact CD1-CG2 4.28Å; F177-V181 HydrophobicContact CD1-CG2 4.16Å; F177-V181 HydrophobicContact CE1-CG2 3.72Å; F177-V181 HydrophobicContact CZ-CG2 4.05Å; F177-V181 PolarHBondContact O-N 2.9Å; F177-V181 VanDerWaalsContact O-N 3.1Å; N178-V181 PolarHBondContact O-N 2.99Å; V181-G183 VanDerWaalsContact C-N 3.35Å; V181-G183 PolarHBondContact O-N 3Å; V181-I184 PolarHBondContact O-N 2.97Å; V181-I185 HydrophobicContact CG1-CD1 4.41Å; V181-I185 PolarHBondContact O-N 2.98Å
182Q97.1Very high96.3Very high91 Ų9142.8 Ų42.843%0.42521%0.211SC..Hα-helixtrans-58.4-47174.6-67.2169.821.900111.4N178 I184 I185 I186 F231N178-Q182 WeakPolarHBondContact O-CG 3.38Å; N178-Q182 PolarHBondContact O-N 3.43Å; N178-Q182 VanDerWaalsContact O-N 3.08Å; Q182-I184 VanDerWaalsContact C-N 3.28Å; Q182-I184 PolarHBondContact O-N 2.65Å; Q182-I185 PolarHBondContact O-N 3.32Å; Q182-I185 VanDerWaalsContact O-N 3.09Å; Q182-I186 WeakPolarHBondContact O-CG1 3.27Å; Q182-I186 PolarHBondContact O-N 3.14Å; Q182-F231 HydrophobicContact CB-CD1 3.88Å; Q182-F231 HydrophobicContact CB-CE1 3.81Å
183G97.8Very high95.8Very high10 Ų1044.2 Ų44.210%0.10323%0.225CC..Hα-helixtrans-58.3-36.4177.900000113.5V179 S180 V181 Y187V179-G183 PolarHBondContact O-N 2.92Å; S180-G183 PolarHBondContact O-N 3.32Å; V181-G183 VanDerWaalsContact C-N 3.35Å; V181-G183 PolarHBondContact O-N 3Å; G183-Y187 VanDerWaalsContact O-CB 3.23Å; G183-Y187 WeakPolarHBondContact O-CB 3.38Å; G183-Y187 PolarHBondContact O-N 3.45Å
184I95.7Very high95.5Very high50 Ų5045.7 Ų45.726%0.25624%0.235SC..Hα-helixtrans-64.5-44.4174.8-70.3167.6000111.3L128 S180 V181 Q182 Y187 R188L128-I184 HydrophobicContact CD1-CD1 3.72Å; L128-I184 HydrophobicContact CG-CD1 4.28Å; S180-I184 WeakPolarHBondContact O-CG1 2.99Å; S180-I184 PolarHBondContact O-N 3.4Å; V181-I184 PolarHBondContact O-N 2.97Å; Q182-I184 VanDerWaalsContact C-N 3.28Å; Q182-I184 PolarHBondContact O-N 2.65Å; I184-Y187 PolarHBondContact O-N 3.45Å; I184-R188 WeakPolarHBondContact O-CB 3.47Å; I184-R188 PolarHBondContact O-N 3.14Å
185I96Very high95Very high63 Ų6346.3 Ų46.332%0.32324%0.237SC..Hα-helixtrans-64.1-46.8179.7-64.1167.4000110V181 Q182 R188 A189V181-I185 HydrophobicContact CG1-CD1 4.41Å; V181-I185 PolarHBondContact O-N 2.98Å; Q182-I185 PolarHBondContact O-N 3.32Å; Q182-I185 VanDerWaalsContact O-N 3.09Å; I185-R188 PolarHBondContact O-N 3.3Å; I185-A189 WeakPolarHBondContact O-CB 3.34Å; I185-A189 PolarHBondContact O-N 2.8Å
186I96.9Very high94.3Very high62 Ų6246.2 Ų46.232%0.31824%0.238SC..Hα-helixtrans-63.6-45.7178.1-62.8-58.6000111.3Q182 R188 A189 A190 V227 F231Q182-I186 WeakPolarHBondContact O-CG1 3.27Å; Q182-I186 PolarHBondContact O-N 3.14Å; I186-R188 VanDerWaalsContact C-N 3.27Å; I186-R188 PolarHBondContact O-N 3.28Å; I186-A189 PolarHBondContact O-N 3.09Å; I186-A190 WeakPolarHBondContact O-CB 3.46Å; I186-A190 PolarHBondContact O-N 3.46Å; I186-V227 HydrophobicContact CG2-CG1 4.03Å; I186-F231 HydrophobicContact CB-CE2 4.39Å; I186-F231 HydrophobicContact CG1-CE2 3.91Å; I186-F231 HydrophobicContact CG1-CZ 3.93Å; I186-F231 HydrophobicContact CG2-CE2 4.26Å
187Y96.7Very high93.8Very high78 Ų7850.1 Ų50.131%0.30626%0.261SS..Hα-helixtrans-55.9-45.9175.1175.7-91.7000110.8G183 I184 A190 Y191 A224 S228G183-Y187 VanDerWaalsContact O-CB 3.23Å; G183-Y187 WeakPolarHBondContact O-CB 3.38Å; G183-Y187 PolarHBondContact O-N 3.45Å; I184-Y187 PolarHBondContact O-N 3.45Å; Y187-A190 PolarHBondContact O-N 3.36Å; Y187-Y191 HydrophobicContact CE1-CD2 4.15Å; Y187-Y191 VanDerWaalsContact O-CB 3.23Å; Y187-Y191 WeakPolarHBondContact O-CB 3.46Å; Y187-Y191 PolarHBondContact O-N 3.02Å; Y187-A224 HydrophobicContact CD2-CB 3.91Å; Y187-A224 HydrophobicContact CE2-CB 3.75Å; Y187-S228 WeakPolarHBondContact CD2-OG 3.4Å
188R93.7Very high93.2Very high94 Ų9449.5 Ų49.536%0.35526%0.262SS..Hα-helixtrans-68.4-40-178.4-174.5173.8-100.9-115.7-6.5112.5N116 L117 I184 I185 I186 Y191 F192N116-R188 WeakPolarHBondContact O-CD 3.49Å; N116-R188 PolarHBondContact O-NH1 3.38Å; L117-R188 HydrophobicContact CD2-CB 4.12Å; L117-R188 HydrophobicContact CD2-CG 3.89Å; I184-R188 WeakPolarHBondContact O-CB 3.47Å; I184-R188 PolarHBondContact O-N 3.14Å; I185-R188 PolarHBondContact O-N 3.3Å; I186-R188 VanDerWaalsContact C-N 3.27Å; I186-R188 PolarHBondContact O-N 3.28Å; R188-Y191 PolarHBondContact O-N 2.87Å; R188-F192 WeakPolarHBondContact O-CB 3.37Å; R188-F192 PolarHBondContact O-N 3.5Å
189A94.9Very high92.4Very high27 Ų2747.9 Ų47.922%0.22325%0.25CC..Hα-helixtrans-62.2-47.9175.100000111.5F113 L117 I185 I186 F192 G193F113-A189 HydrophobicContact CZ-CB 4.13Å; L117-A189 HydrophobicContact CD1-CB 4.03Å; L117-A189 HydrophobicContact CD2-CB 3.82Å; I185-A189 WeakPolarHBondContact O-CB 3.34Å; I185-A189 PolarHBondContact O-N 2.8Å; I186-A189 PolarHBondContact O-N 3.09Å; A189-F192 PolarHBondContact O-N 3.28Å; A189-G193 PolarHBondContact O-N 3.06Å
190A95.9Very high91.6Very high17 Ų1751.1 Ų51.114%0.1428%0.283CS..Hα-helixtrans-62.9-44.5176.300000111.7I186 Y187 F192 G193 V194 A224 V227I186-A190 WeakPolarHBondContact O-CB 3.46Å; I186-A190 PolarHBondContact O-N 3.46Å; Y187-A190 PolarHBondContact O-N 3.36Å; A190-F192 VanDerWaalsContact C-N 3.33Å; A190-F192 PolarHBondContact O-N 3.06Å; A190-G193 PolarHBondContact O-N 2.87Å; A190-V194 WeakPolarHBondContact O-CB 3.49Å; A190-V194 VanDerWaalsContact O-CG2 3.23Å; A190-V194 WeakPolarHBondContact O-CG2 3.45Å; A190-V194 PolarHBondContact O-N 2.86Å; A190-A224 HydrophobicContact CB-CB 4.06Å; A190-V227 HydrophobicContact CB-CB 3.98Å; A190-V227 HydrophobicContact CB-CG1 3.88Å; A190-V227 HydrophobicContact CB-CG2 4.37Å
191Y94.1Very high91Very high75 Ų7558 Ų5829%0.29432%0.316SS..Hα-helixtrans-57.4-47.7177.2-171.8-76.5000111.1Y187 R188 Y195 V220 A224Y187-Y191 HydrophobicContact CE1-CD2 4.15Å; Y187-Y191 VanDerWaalsContact O-CB 3.23Å; Y187-Y191 WeakPolarHBondContact O-CB 3.46Å; Y187-Y191 PolarHBondContact O-N 3.02Å; R188-Y191 PolarHBondContact O-N 2.87Å; Y191-Y195 HydrophobicContact CE1-CD2 4.33Å; Y191-Y195 HydrophobicContact CE1-CG 4.4Å; Y191-Y195 WeakPolarHBondContact O-CB 3.36Å; Y191-Y195 PolarHBondContact O-N 3.45Å; Y191-V220 HydrophobicContact CD1-CG1 3.98Å; Y191-V220 HydrophobicContact CD2-CG1 3.58Å; Y191-V220 HydrophobicContact CE1-CG1 3.96Å; Y191-V220 HydrophobicContact CE2-CB 4.48Å; Y191-V220 HydrophobicContact CE2-CG1 3.57Å; Y191-V220 HydrophobicContact CG-CG1 3.78Å; Y191-V220 WeakPolarHBondContact O-CG1 3.13Å; Y191-A224 HydrophobicContact CD2-CB 4.33Å
192F89.6Confident90.3Very high30 Ų3058.4 Ų58.413%0.13232%0.317CS..Hα-helixtrans-62.4-49179.6-173-85.1000111.8F109 Y112 F113 R188 A189 A190 V194 Y195 D196F109-F192 AromaticContact CE2-CE1 3.76Å; F109-F192 HydrophobicContact CE2-CE1 3.76Å; F109-F192 HydrophobicContact CE2-CZ 4.02Å; F109-F192 AromaticContact CZ-CE1 3.76Å; F109-F192 HydrophobicContact CZ-CE1 3.76Å; F109-F192 HydrophobicContact CZ-CZ 4.45Å; Y112-F192 HydrophobicContact CD1-CE2 4.5Å; Y112-F192 HydrophobicContact CD1-CZ 4.39Å; Y112-F192 AromaticContact CE1-CE2 4Å; Y112-F192 HydrophobicContact CE1-CE2 4Å; Y112-F192 HydrophobicContact CE1-CZ 4.25Å; F113-F192 HydrophobicContact CD2-CB 4.39Å; F113-F192 AromaticContact CD2-CD1 3.32Å; F113-F192 HydrophobicContact CD2-CD1 3.32Å; F113-F192 HydrophobicContact CD2-CD2 4.48Å; F113-F192 AromaticContact CD2-CE1 3.58Å; F113-F192 HydrophobicContact CD2-CE1 3.58Å; F113-F192 AromaticContact CD2-CG 3.81Å; F113-F192 HydrophobicContact CD2-CG 3.81Å; F113-F192 HydrophobicContact CD2-CZ 4.27Å; F113-F192 HydrophobicContact CE2-CB 3.97Å; F113-F192 AromaticContact CE2-CD1 3.48Å; F113-F192 HydrophobicContact CE2-CD1 3.48Å; F113-F192 VanDerWaalsContact CE2-CD1 3.48Å; F113-F192 HydrophobicContact CE2-CE1 4.19Å; F113-F192 AromaticContact CE2-CG 3.86Å; F113-F192 HydrophobicContact CE2-CG 3.86Å; R188-F192 WeakPolarHBondContact O-CB 3.37Å; R188-F192 PolarHBondContact O-N 3.5Å; A189-F192 PolarHBondContact O-N 3.28Å; A190-F192 VanDerWaalsContact C-N 3.33Å; A190-F192 PolarHBondContact O-N 3.06Å; F192-V194 PolarHBondContact O-N 3.32Å; F192-Y195 PolarHBondContact O-N 3.23Å; F192-D196 WeakPolarHBondContact CE1-OD2 3.19Å; F192-D196 WeakPolarHBondContact CZ-OD2 3.45Å; F192-D196 WeakPolarHBondContact O-CB 3.36Å; F192-D196 PolarHBondContact O-N 3.45Å
193G88Confident89.6Confident33 Ų3360.6 Ų60.634%0.3434%0.339SS..Hα-helixtrans-58.9-50.1179.300000112.4A189 A190 Y195 D196 T197A189-G193 PolarHBondContact O-N 3.06Å; A190-G193 PolarHBondContact O-N 2.87Å; G193-Y195 VanDerWaalsContact C-N 3.35Å; G193-Y195 PolarHBondContact O-N 3.11Å; G193-D196 PolarHBondContact O-N 3.4Å; G193-T197 PolarHBondContact O-N 3.38Å; G193-T197 PolarHBondContact O-OG1 2.96Å; G193-T197 VanDerWaalsContact O-OG1 3.06Å
194V90.5Very high88.9Confident39 Ų3963.3 Ų63.324%0.23635%0.352CS..Hα-helixtrans-67.5-36.9-179.3-176.70000111.3A190 F192 A198 V220 V223A190-V194 WeakPolarHBondContact O-CB 3.49Å; A190-V194 VanDerWaalsContact O-CG2 3.23Å; A190-V194 WeakPolarHBondContact O-CG2 3.45Å; A190-V194 PolarHBondContact O-N 2.86Å; F192-V194 PolarHBondContact O-N 3.32Å; V194-A198 VanDerWaalsContact O-CB 3.24Å; V194-A198 WeakPolarHBondContact O-CB 3.4Å; V194-A198 PolarHBondContact O-N 2.85Å; V194-V220 HydrophobicContact CB-CG1 4.4Å; V194-V220 HydrophobicContact CB-CG2 4.48Å; V194-V220 HydrophobicContact CG1-CB 4.32Å; V194-V220 HydrophobicContact CG1-CG2 3.93Å; V194-V223 HydrophobicContact CG1-CB 4.32Å; V194-V223 HydrophobicContact CG1-CG1 4.47Å; V194-V223 HydrophobicContact CG2-CB 4.22Å; V194-V223 HydrophobicContact CG2-CG1 3.65Å
195Y87.5Confident88Confident71 Ų7163.8 Ų63.828%0.27836%0.358SS..Hα-helixtrans-65.9-46.4178-175.6-99.7000112.5Y191 F192 G193 A198 K199 V220Y191-Y195 HydrophobicContact CE1-CD2 4.33Å; Y191-Y195 HydrophobicContact CE1-CG 4.4Å; Y191-Y195 WeakPolarHBondContact O-CB 3.36Å; Y191-Y195 PolarHBondContact O-N 3.45Å; F192-Y195 PolarHBondContact O-N 3.23Å; G193-Y195 VanDerWaalsContact C-N 3.35Å; G193-Y195 PolarHBondContact O-N 3.11Å; Y195-A198 PolarHBondContact O-N 3.36Å; Y195-K199 HydrophobicContact CD1-CD 4.33Å; Y195-K199 HydrophobicContact CE1-CD 3.58Å; Y195-K199 HydrophobicContact CE1-CG 4.24Å; Y195-K199 HydrophobicContact CE2-CD 4.46Å; Y195-K199 VanDerWaalsContact CZ-CE 3.42Å; Y195-K199 WeakPolarHBondContact O-CB 3.31Å; Y195-K199 PolarHBondContact O-N 2.98Å; Y195-K199 WeakPolarHBondContact OH-CE 3.25Å; Y195-K199 PolarHBondContact OH-NZ 2.9Å; Y195-V220 HydrophobicContact CD2-CG2 4.27Å
196D84.4Confident87.1Confident41 Ų4169.9 Ų69.922%0.21938%0.382CS..Hα-helixtrans-66.4-39.6179.5-83.42.7000110.7R105 F192 G193 G200R105-D196 IonicContact NH2-OD1 3.44Å; R105-D196 PolarHBondContact NH2-OD1 3.46Å; R105-D196 VanDerWaalsContact NH2-OD1 3.11Å; R105-D196 IonicContact NH2-OD2 2.61Å; R105-D196 PolarHBondContact NH2-OD2 2.94Å; F192-D196 WeakPolarHBondContact CE1-OD2 3.19Å; F192-D196 WeakPolarHBondContact CZ-OD2 3.45Å; F192-D196 WeakPolarHBondContact O-CB 3.36Å; F192-D196 PolarHBondContact O-N 3.45Å; G193-D196 PolarHBondContact O-N 3.4Å; D196-G200 PolarHBondContact O-N 3.48Å
197T85.9Confident86.4Confident90 Ų9073.1 Ų73.155%0.55240%0.4SS*.Hα-helixtrans-60.9-50.3171-59.30000111.8G193 K199 G200 M201G193-T197 PolarHBondContact O-N 3.38Å; G193-T197 PolarHBondContact O-OG1 2.96Å; G193-T197 VanDerWaalsContact O-OG1 3.06Å; T197-K199 VanDerWaalsContact C-N 3.3Å; T197-K199 PolarHBondContact O-N 2.92Å; T197-G200 PolarHBondContact O-N 2.96Å; T197-M201 HydrophobicContact CG2-SD 4.19Å; T197-M201 WeakPolarHBondContact O-CG 3.28Å; T197-M201 PolarHBondContact O-N 2.9Å
198A84.6Confident85.5Confident23 Ų2371 Ų7119%0.1940%0.395CS..Hα-helixtrans-61.5-38.4-178.200000112.3V194 Y195 I216 V220V194-A198 VanDerWaalsContact O-CB 3.24Å; V194-A198 WeakPolarHBondContact O-CB 3.4Å; V194-A198 PolarHBondContact O-N 2.85Å; Y195-A198 PolarHBondContact O-N 3.36Å; A198-I216 HydrophobicContact CB-CG2 3.82Å; A198-V220 HydrophobicContact CB-CG2 4.32Å
199K80.1Confident84.9Confident75 Ų7572.1 Ų72.133%0.32640%0.404SS..Hα-helixtrans-71-37.7174.5-85.1-161.6159.8-179.50113.4Y195 T197 M201 L202Y195-K199 HydrophobicContact CD1-CD 4.33Å; Y195-K199 HydrophobicContact CE1-CD 3.58Å; Y195-K199 HydrophobicContact CE1-CG 4.24Å; Y195-K199 HydrophobicContact CE2-CD 4.46Å; Y195-K199 VanDerWaalsContact CZ-CE 3.42Å; Y195-K199 WeakPolarHBondContact O-CB 3.31Å; Y195-K199 PolarHBondContact O-N 2.98Å; Y195-K199 WeakPolarHBondContact OH-CE 3.25Å; Y195-K199 PolarHBondContact OH-NZ 2.9Å; T197-K199 VanDerWaalsContact C-N 3.3Å; T197-K199 PolarHBondContact O-N 2.92Å; K199-M201 PolarHBondContact O-N 3.25Å; K199-L202 PolarHBondContact O-N 3.13Å; K199-L202 VanDerWaalsContact O-N 3.15Å
200G80.6Confident84.2Confident68 Ų6877.3 Ų77.370%0.70143%0.427SS*.Hα-helixtrans-65-21.5177.900000113.8D196 T197D196-G200 PolarHBondContact O-N 3.48Å; T197-G200 PolarHBondContact O-N 2.96Å
201M83.3Confident83.6Confident152 Ų15281.1 Ų81.175%0.74944%0.444SS*.THydrogen-bonded Turntrans-85-8.7176-65.2175.974.900113.7T197 K199T197-M201 HydrophobicContact CG2-SD 4.19Å; T197-M201 WeakPolarHBondContact O-CG 3.28Å; T197-M201 PolarHBondContact O-N 2.9Å; K199-M201 PolarHBondContact O-N 3.25Å
202L83.7Confident83.2Confident37 Ų3780 Ų8019%0.19444%0.444CS..  trans-83.2135.3-179.8-69.9168.3000110.9K199 D204 P205 V208 V212 I216K199-L202 PolarHBondContact O-N 3.13Å; K199-L202 VanDerWaalsContact O-N 3.15Å; L202-D204 VanDerWaalsContact C-N 3.33Å; L202-D204 PolarHBondContact O-N 3.32Å; L202-P205 HydrophobicContact CB-CG 4.26Å; L202-V208 HydrophobicContact CD1-CG1 4.34Å; L202-V208 HydrophobicContact CD1-CG2 3.59Å; L202-V212 HydrophobicContact CD2-CG1 4.27Å; L202-I216 HydrophobicContact CD1-CD1 3.4Å; L202-I216 VanDerWaalsContact CD1-CD1 3.4Å; L202-I216 HydrophobicContact CD2-CD1 3.99Å; L202-I216 HydrophobicContact CG-CD1 4.06Å
203P82.1Confident82.9Confident137 Ų13781.1 Ų81.189%0.8946%0.456SS*.SBendtrans-65.8-35.2178.725.1-32.9000112.5
204D83.8Confident82.7Confident68 Ų6884.5 Ų84.536%0.36446%0.459SS..  trans-134.995.3170.5-175.7-9.2000110.3L202 K206 N207 V208L202-D204 VanDerWaalsContact C-N 3.33Å; L202-D204 PolarHBondContact O-N 3.32Å; D204-K206 PolarHBondContact O-N 3.3Å; D204-K206 VanDerWaalsContact O-N 3.15Å; D204-K206 WeakPolarHBondContact OD1-CB 3.47Å; D204-K206 PolarHBondContact OD1-N 3.13Å; D204-N207 PolarHBondContact O-N 2.95Å; D204-N207 PolarHBondContact OD1-N 2.95Å; D204-N207 WeakPolarHBondContact OD2-CB 3.43Å; D204-N207 PolarHBondContact OD2-ND2 3.07Å; D204-V208 VanDerWaalsContact O-CG2 3.25Å; D204-V208 WeakPolarHBondContact O-CG2 3.22Å
205P76.1Confident82.5Confident59 Ų5987 Ų8738%0.38347%0.469SS..SBendtrans-65.9-11.3179.8-22.233.1000115.2L202L202-P205 HydrophobicContact CB-CG 4.26Å
206K77.4Confident82.5Confident191 Ų19184.9 Ų84.983%0.8346%0.462SS*.SBendtrans-92.5-34.6-179.5-66.2-178.4-179.3176.50112.1D204D204-K206 PolarHBondContact O-N 3.3Å; D204-K206 VanDerWaalsContact O-N 3.15Å; D204-K206 WeakPolarHBondContact OD1-CB 3.47Å; D204-K206 PolarHBondContact OD1-N 3.13Å
207N81.1Confident82.6Confident131 Ų13184.6 Ų84.670%0.70147%0.466SS*.SBendtrans-110.453-177.3-61.6-52.6000112.8D204D204-N207 PolarHBondContact O-N 2.95Å; D204-N207 PolarHBondContact OD1-N 2.95Å; D204-N207 WeakPolarHBondContact OD2-CB 3.43Å; D204-N207 PolarHBondContact OD2-ND2 3.07Å
208V77.6Confident82.9Confident33 Ų3382 Ų8220%0.245%0.447CS..  trans-86.9125.6-178.7-175.20000110.3L202 D204 V212 S213L202-V208 HydrophobicContact CD1-CG1 4.34Å; L202-V208 HydrophobicContact CD1-CG2 3.59Å; D204-V208 VanDerWaalsContact O-CG2 3.25Å; D204-V208 WeakPolarHBondContact O-CG2 3.22Å; V208-V212 HydrophobicContact CG1-CB 3.66Å; V208-V212 HydrophobicContact CG1-CG1 3.57Å; V208-S213 WeakPolarHBondContact CB-OG 3.46Å; V208-S213 WeakPolarHBondContact CG1-OG 3.35Å
209H81.4Confident83.2Confident118 Ų11884.8 Ų84.855%0.54646%0.462SS..  trans-51.6141.3175-171.1-97.7000111.7I211 V212 S213H209-I211 VanDerWaalsContact C-N 3.26Å; H209-I211 PolarHBondContact ND1-N 2.96Å; H209-I211 PolarHBondContact O-N 2.95Å; H209-I211 VanDerWaalsContact O-N 3.15Å; H209-V212 HydrophobicContact CB-CG2 4.21Å; H209-V212 WeakPolarHBondContact O-CA 3.23Å; H209-V212 WeakPolarHBondContact O-CB 3.34Å; H209-V212 PolarHBondContact O-N 3.29Å; H209-S213 PolarHBondContact O-N 3.28Å
210I81.5Confident83.8Confident135 Ų13581.3 Ų81.369%0.69245%0.447SS*.Hα-helixtrans-54.5-40-173.2-169.8170.2000113V212 S213 W214I210-V212 PolarHBondContact O-N 2.94Å; I210-S213 PolarHBondContact O-N 3.26Å; I210-W214 WeakPolarHBondContact O-CB 3.47Å; I210-W214 PolarHBondContact O-N 3.2Å
211I83.3Confident84.4Confident98 Ų9880.4 Ų80.450%0.50343%0.428SS..Hα-helixtrans-64.7-40.9177.7-59.3176.9000110.8H209 W214 M215H209-I211 VanDerWaalsContact C-N 3.26Å; H209-I211 PolarHBondContact ND1-N 2.96Å; H209-I211 PolarHBondContact O-N 2.95Å; H209-I211 VanDerWaalsContact O-N 3.15Å; I211-W214 PolarHBondContact O-N 3.25Å; I211-M215 HydrophobicContact CG2-CE 4.26Å; I211-M215 VanDerWaalsContact O-CG 3.32Å; I211-M215 WeakPolarHBondContact O-CG 3.34Å; I211-M215 PolarHBondContact O-N 3Å
212V83.9Confident84.9Confident50 Ų5074.6 Ų74.630%0.30340%0.404SS..Hα-helixtrans-68.6-43.1179179.20000110.4L202 V208 H209 I210 W214 M215 I216L202-V212 HydrophobicContact CD2-CG1 4.27Å; V208-V212 HydrophobicContact CG1-CB 3.66Å; V208-V212 HydrophobicContact CG1-CG1 3.57Å; H209-V212 HydrophobicContact CB-CG2 4.21Å; H209-V212 WeakPolarHBondContact O-CA 3.23Å; H209-V212 WeakPolarHBondContact O-CB 3.34Å; H209-V212 PolarHBondContact O-N 3.29Å; I210-V212 PolarHBondContact O-N 2.94Å; V212-W214 VanDerWaalsContact C-N 3.31Å; V212-W214 PolarHBondContact O-N 2.77Å; V212-M215 HydrophobicContact CB-CE 4.41Å; V212-M215 HydrophobicContact CG2-CE 4.05Å; V212-M215 PolarHBondContact O-N 3.04Å; V212-I216 HydrophobicContact CG1-CD1 4.08Å; V212-I216 WeakPolarHBondContact O-CG1 3.49Å; V212-I216 PolarHBondContact O-N 3.3Å
213S83.6Confident85.5Confident55 Ų5575.4 Ų75.439%0.38541%0.411SS..Hα-helixtrans-58.8-42.3173.1-70.70000112V208 H209 I210 I216 A217V208-S213 WeakPolarHBondContact CB-OG 3.46Å; V208-S213 WeakPolarHBondContact CG1-OG 3.35Å; H209-S213 PolarHBondContact O-N 3.28Å; I210-S213 PolarHBondContact O-N 3.26Å; S213-I216 PolarHBondContact O-N 3.39Å; S213-A217 WeakPolarHBondContact O-CB 3.2Å; S213-A217 PolarHBondContact O-N 3.03Å
214W83.4Confident86.2Confident103 Ų10368.9 Ų68.939%0.3937%0.368SS..Hα-helixtrans-63.7-46.6175176.687.3000111.7I210 I211 V212 I216 A217 Q218I210-W214 WeakPolarHBondContact O-CB 3.47Å; I210-W214 PolarHBondContact O-N 3.2Å; I211-W214 PolarHBondContact O-N 3.25Å; V212-W214 VanDerWaalsContact C-N 3.31Å; V212-W214 PolarHBondContact O-N 2.77Å; W214-I216 VanDerWaalsContact C-N 3.34Å; W214-I216 PolarHBondContact O-N 3.38Å; W214-A217 PolarHBondContact O-N 3.22Å; W214-Q218 HydrophobicContact CD2-CG 3.97Å; W214-Q218 HydrophobicContact CE3-CG 4.39Å; W214-Q218 HydrophobicContact CG-CG 4.5Å; W214-Q218 HydrophobicContact CH2-CG 4.22Å; W214-Q218 HydrophobicContact CZ2-CG 3.78Å; W214-Q218 WeakPolarHBondContact O-CG 3.35Å; W214-Q218 PolarHBondContact O-N 3.11Å
215M86.3Confident86.8Confident91 Ų9166.1 Ų66.145%0.44836%0.356SS..Hα-helixtrans-60.3-41.8177-73.5-170.5-62.300112.2I211 V212 Q218 T219I211-M215 HydrophobicContact CG2-CE 4.26Å; I211-M215 VanDerWaalsContact O-CG 3.32Å; I211-M215 WeakPolarHBondContact O-CG 3.34Å; I211-M215 PolarHBondContact O-N 3Å; V212-M215 HydrophobicContact CB-CE 4.41Å; V212-M215 HydrophobicContact CG2-CE 4.05Å; V212-M215 PolarHBondContact O-N 3.04Å; M215-Q218 PolarHBondContact O-N 3.2Å; M215-T219 WeakPolarHBondContact O-CB 3.32Å; M215-T219 PolarHBondContact O-N 3.49Å; M215-T219 PolarHBondContact O-OG1 3.23Å
216I87.7Confident87.8Confident27 Ų2766.8 Ų66.814%0.13836%0.356CS..Hα-helixtrans-61.2-49.2174.2-71.2163000110.2A198 L202 V212 S213 W214 Q218 T219 V220A198-I216 HydrophobicContact CB-CG2 3.82Å; L202-I216 HydrophobicContact CD1-CD1 3.4Å; L202-I216 VanDerWaalsContact CD1-CD1 3.4Å; L202-I216 HydrophobicContact CD2-CD1 3.99Å; L202-I216 HydrophobicContact CG-CD1 4.06Å; V212-I216 HydrophobicContact CG1-CD1 4.08Å; V212-I216 WeakPolarHBondContact O-CG1 3.49Å; V212-I216 PolarHBondContact O-N 3.3Å; S213-I216 PolarHBondContact O-N 3.39Å; W214-I216 VanDerWaalsContact C-N 3.34Å; W214-I216 PolarHBondContact O-N 3.38Å; I216-Q218 VanDerWaalsContact C-N 3.3Å; I216-Q218 PolarHBondContact O-N 2.95Å; I216-T219 PolarHBondContact O-N 3.26Å; I216-V220 HydrophobicContact CG2-CG2 3.96Å; I216-V220 WeakPolarHBondContact O-CB 3.38Å; I216-V220 WeakPolarHBondContact O-CG2 3.21Å; I216-V220 PolarHBondContact O-N 2.87Å
217A88.1Confident88.7Confident36 Ų3661.3 Ų61.330%0.29834%0.338SS..Hα-helixtrans-59.8-40.818000000112.1S213 W214 T221S213-A217 WeakPolarHBondContact O-CB 3.2Å; S213-A217 PolarHBondContact O-N 3.03Å; W214-A217 PolarHBondContact O-N 3.22Å; A217-T221 WeakPolarHBondContact O-CB 3.33Å; A217-T221 PolarHBondContact O-N 3.18Å; A217-T221 PolarHBondContact O-OG1 2.96Å
218Q90.7Very high89.5Confident35 Ų3555.8 Ų55.816%0.16431%0.31CS..Hα-helixtrans-64.8-47.1175.3-68.4-54.6-44.900111.7W214 M215 I216 T221 A222W214-Q218 HydrophobicContact CD2-CG 3.97Å; W214-Q218 HydrophobicContact CE3-CG 4.39Å; W214-Q218 HydrophobicContact CG-CG 4.5Å; W214-Q218 HydrophobicContact CH2-CG 4.22Å; W214-Q218 HydrophobicContact CZ2-CG 3.78Å; W214-Q218 WeakPolarHBondContact O-CG 3.35Å; W214-Q218 PolarHBondContact O-N 3.11Å; M215-Q218 PolarHBondContact O-N 3.2Å; I216-Q218 VanDerWaalsContact C-N 3.3Å; I216-Q218 PolarHBondContact O-N 2.95Å; Q218-T221 PolarHBondContact O-N 3.07Å; Q218-A222 VanDerWaalsContact O-CB 3.28Å; Q218-A222 WeakPolarHBondContact O-CB 3.32Å; Q218-A222 PolarHBondContact O-N 3.48Å
219T91Very high90.5Very high82 Ų8254.4 Ų54.450%0.50330%0.301SS..Hα-helixtrans-61.6-49.3178.9-62.90000111.5M215 I216 T221 A222 V223M215-T219 WeakPolarHBondContact O-CB 3.32Å; M215-T219 PolarHBondContact O-N 3.49Å; M215-T219 PolarHBondContact O-OG1 3.23Å; I216-T219 PolarHBondContact O-N 3.26Å; T219-T221 VanDerWaalsContact C-N 3.32Å; T219-T221 PolarHBondContact O-N 3.31Å; T219-A222 PolarHBondContact O-N 3.29Å; T219-V223 HydrophobicContact CG2-CG2 4.35Å; T219-V223 WeakPolarHBondContact O-CG2 3.35Å; T219-V223 PolarHBondContact O-N 3.29Å
220V92.6Very high91.3Very high1 Ų149.6 Ų49.61%0.00628%0.28CS..Hα-helixtrans-58-46.4177.4173.50000110.5Y191 V194 Y195 A198 I216 A224Y191-V220 HydrophobicContact CD1-CG1 3.98Å; Y191-V220 HydrophobicContact CD2-CG1 3.58Å; Y191-V220 HydrophobicContact CE1-CG1 3.96Å; Y191-V220 HydrophobicContact CE2-CB 4.48Å; Y191-V220 HydrophobicContact CE2-CG1 3.57Å; Y191-V220 HydrophobicContact CG-CG1 3.78Å; Y191-V220 WeakPolarHBondContact O-CG1 3.13Å; V194-V220 HydrophobicContact CB-CG1 4.4Å; V194-V220 HydrophobicContact CB-CG2 4.48Å; V194-V220 HydrophobicContact CG1-CB 4.32Å; V194-V220 HydrophobicContact CG1-CG2 3.93Å; Y195-V220 HydrophobicContact CD2-CG2 4.27Å; A198-V220 HydrophobicContact CB-CG2 4.32Å; I216-V220 HydrophobicContact CG2-CG2 3.96Å; I216-V220 WeakPolarHBondContact O-CB 3.38Å; I216-V220 WeakPolarHBondContact O-CG2 3.21Å; I216-V220 PolarHBondContact O-N 2.87Å; V220-A224 VanDerWaalsContact O-CB 3.24Å; V220-A224 WeakPolarHBondContact O-CB 3.28Å; V220-A224 PolarHBondContact O-N 3.16Å
221T93.5Very high92.1Very high50 Ų5045 Ų4531%0.30726%0.255SS..Hα-helixtrans-64.1-41.9179-60.40000111.8A217 Q218 T219 G225A217-T221 WeakPolarHBondContact O-CB 3.33Å; A217-T221 PolarHBondContact O-N 3.18Å; A217-T221 PolarHBondContact O-OG1 2.96Å; Q218-T221 PolarHBondContact O-N 3.07Å; T219-T221 VanDerWaalsContact C-N 3.32Å; T219-T221 PolarHBondContact O-N 3.31Å; T221-G225 WeakPolarHBondContact O-CA 3.4Å; T221-G225 PolarHBondContact O-N 2.86Å
222A94.6Very high92.8Very high29 Ų2941.7 Ų41.724%0.2424%0.239CC..Hα-helixtrans-65.9-48.217900000111.5Q218 T219 G225 L226 V278Q218-A222 VanDerWaalsContact O-CB 3.28Å; Q218-A222 WeakPolarHBondContact O-CB 3.32Å; Q218-A222 PolarHBondContact O-N 3.48Å; T219-A222 PolarHBondContact O-N 3.29Å; A222-G225 PolarHBondContact O-N 3.49Å; A222-L226 VanDerWaalsContact O-CG 3.3Å; A222-L226 WeakPolarHBondContact O-CG 3.15Å; A222-L226 PolarHBondContact O-N 3.34Å; A222-V278 HydrophobicContact CB-CG1 4.38Å; A222-V278 HydrophobicContact CB-CG2 4.39Å
223V95.5Very high93.5Very high55 Ų5539.3 Ų39.333%0.33322%0.224SC..Hα-helixtrans-65-48.5179.91770000111V194 T219 G225 L226 V227V194-V223 HydrophobicContact CG1-CB 4.32Å; V194-V223 HydrophobicContact CG1-CG1 4.47Å; V194-V223 HydrophobicContact CG2-CB 4.22Å; V194-V223 HydrophobicContact CG2-CG1 3.65Å; T219-V223 HydrophobicContact CG2-CG2 4.35Å; T219-V223 WeakPolarHBondContact O-CG2 3.35Å; T219-V223 PolarHBondContact O-N 3.29Å; V223-G225 VanDerWaalsContact C-N 3.25Å; V223-G225 PolarHBondContact O-N 3.38Å; V223-L226 PolarHBondContact O-N 2.8Å; V223-L226 VanDerWaalsContact O-N 3.11Å; V223-V227 HydrophobicContact CG1-CG2 4.4Å; V223-V227 WeakPolarHBondContact O-CG2 3.46Å; V223-V227 PolarHBondContact O-N 3.01Å
224A96.4Very high94.2Very high0 Ų036.7 Ų36.70%021%0.206CC..Hα-helixtrans-60.7-38.6175.900000112Y187 A190 Y191 V220 S228Y187-A224 HydrophobicContact CD2-CB 3.91Å; Y187-A224 HydrophobicContact CE2-CB 3.75Å; A190-A224 HydrophobicContact CB-CB 4.06Å; Y191-A224 HydrophobicContact CD2-CB 4.33Å; V220-A224 VanDerWaalsContact O-CB 3.24Å; V220-A224 WeakPolarHBondContact O-CB 3.28Å; V220-A224 PolarHBondContact O-N 3.16Å; A224-S228 WeakPolarHBondContact O-CB 3.23Å; A224-S228 PolarHBondContact O-N 3.18Å; A224-S228 VanDerWaalsContact O-N 3.08Å; A224-S228 PolarHBondContact O-OG 3.4Å
225G96.5Very high94.9Very high10 Ų1032.9 Ų32.910%0.10319%0.191CC..Hα-helixtrans-60.9-42173.800000112.5T221 A222 V223 S228 Y229T221-G225 WeakPolarHBondContact O-CA 3.4Å; T221-G225 PolarHBondContact O-N 2.86Å; A222-G225 PolarHBondContact O-N 3.49Å; V223-G225 VanDerWaalsContact C-N 3.25Å; V223-G225 PolarHBondContact O-N 3.38Å; G225-S228 PolarHBondContact O-OG 2.86Å; G225-Y229 WeakPolarHBondContact O-CA 3.25Å; G225-Y229 VanDerWaalsContact O-CB 3.23Å; G225-Y229 WeakPolarHBondContact O-CB 3.39Å; G225-Y229 PolarHBondContact O-N 2.97Å
226L97.2Very high95.5Very high72 Ų7229 Ų2938%0.37717%0.172SC..Hα-helixtrans-68.7-46.6176.7-72.9169.8000111.9A222 V223 S228 Y229 F271 A274A222-L226 VanDerWaalsContact O-CG 3.3Å; A222-L226 WeakPolarHBondContact O-CG 3.15Å; A222-L226 PolarHBondContact O-N 3.34Å; V223-L226 PolarHBondContact O-N 2.8Å; V223-L226 VanDerWaalsContact O-N 3.11Å; L226-S228 VanDerWaalsContact C-N 3.29Å; L226-S228 PolarHBondContact O-N 3.48Å; L226-Y229 VanDerWaalsContact O-CB 3.28Å; L226-Y229 WeakPolarHBondContact O-CB 3.34Å; L226-Y229 PolarHBondContact O-N 3.09Å; L226-Y229 VanDerWaalsContact O-N 3.11Å; L226-F271 WeakPolarHBondContact O-CE1 3.43Å; L226-A274 HydrophobicContact CD2-CB 3.89Å
227V97.4Very high96Very high77 Ų7727.8 Ų27.847%0.46717%0.165SC..Hα-helixtrans-59.7-40.9179.5171.70000111.6I186 A190 V223I186-V227 HydrophobicContact CG2-CG1 4.03Å; A190-V227 HydrophobicContact CB-CB 3.98Å; A190-V227 HydrophobicContact CB-CG1 3.88Å; A190-V227 HydrophobicContact CB-CG2 4.37Å; V223-V227 HydrophobicContact CG1-CG2 4.4Å; V223-V227 WeakPolarHBondContact O-CG2 3.46Å; V223-V227 PolarHBondContact O-N 3.01Å
228S97.6Very high96.5Very high14 Ų1426.2 Ų26.210%0.09815%0.152CC..Hα-helixtrans-86.3-8.2178.3610000114.2Y187 A224 G225 L226 P230 F231 D232Y187-S228 WeakPolarHBondContact CD2-OG 3.4Å; A224-S228 WeakPolarHBondContact O-CB 3.23Å; A224-S228 PolarHBondContact O-N 3.18Å; A224-S228 VanDerWaalsContact O-N 3.08Å; A224-S228 PolarHBondContact O-OG 3.4Å; G225-S228 PolarHBondContact O-OG 2.86Å; L226-S228 VanDerWaalsContact C-N 3.29Å; L226-S228 PolarHBondContact O-N 3.48Å; S228-P230 VanDerWaalsContact C-CD 3.48Å; S228-F231 WeakPolarHBondContact O-CB 3.37Å; S228-F231 PolarHBondContact O-N 3.48Å; S228-F231 VanDerWaalsContact O-N 3.07Å; S228-D232 PolarHBondContact O-N 2.87Å
229Y98.1Very high96.8Very high4 Ų424.5 Ų24.52%0.01614%0.144CC..Hα-helixtrans-58.4-39-172.9-156.3-95.4000114.4K33 Q37 G225 L226 F231 D232 T233 F270 F271 K272 G273 A274 N277K33-Y229 VanDerWaalsContact CE-OH 3.27Å; K33-Y229 WeakPolarHBondContact CE-OH 3.39Å; Q37-Y229 PolarHBondContact NE2-OH 2.81Å; G225-Y229 WeakPolarHBondContact O-CA 3.25Å; G225-Y229 VanDerWaalsContact O-CB 3.23Å; G225-Y229 WeakPolarHBondContact O-CB 3.39Å; G225-Y229 PolarHBondContact O-N 2.97Å; L226-Y229 VanDerWaalsContact O-CB 3.28Å; L226-Y229 WeakPolarHBondContact O-CB 3.34Å; L226-Y229 PolarHBondContact O-N 3.09Å; L226-Y229 VanDerWaalsContact O-N 3.11Å; Y229-F231 PolarHBondContact O-N 2.93Å; Y229-D232 WeakPolarHBondContact O-CA 3.26Å; Y229-D232 WeakPolarHBondContact O-CB 3.13Å; Y229-D232 PolarHBondContact O-N 2.98Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.23Å; Y229-T233 PolarHBondContact O-N 3.31Å; Y229-T233 PolarHBondContact O-OG1 3.38Å; Y229-F270 WeakPolarHBondContact CD1-O 2.99Å; Y229-F271 HydrophobicContact CD1-CD1 4.4Å; Y229-K272 WeakPolarHBondContact CE1-O 3.39Å; Y229-K272 PolarHBondContact OH-O 2.9Å; Y229-G273 PolarHBondContact OH-O 2.79Å; Y229-A274 HydrophobicContact CD1-CB 3.91Å; Y229-A274 HydrophobicContact CD2-CB 4.23Å; Y229-A274 HydrophobicContact CE1-CB 3.85Å; Y229-A274 HydrophobicContact CE2-CB 4.17Å; Y229-A274 HydrophobicContact CG-CB 4.11Å; Y229-A274 VanDerWaalsContact CZ-CA 3.47Å; Y229-A274 PolarHBondContact OH-N 2.87Å; Y229-N277 HydrophobicContact CD2-CB 4.49Å; Y229-N277 HydrophobicContact CE2-CB 3.69Å
230P98.5Very high97.1Very high17 Ų1720.8 Ų20.811%0.1112%0.121CC..Hα-helixtrans-54.7-37.2175.1-30.839.8000113.6S228 T233 V234 W258 F270 F271S228-P230 VanDerWaalsContact C-CD 3.48Å; P230-T233 PolarHBondContact O-N 2.97Å; P230-V234 WeakPolarHBondContact O-CG2 3.45Å; P230-V234 PolarHBondContact O-N 2.97Å; P230-W258 HydrophobicContact CB-CH2 3.47Å; P230-W258 VanDerWaalsContact CB-CH2 3.47Å; P230-W258 HydrophobicContact CB-CZ3 3.71Å; P230-F270 HydrophobicContact CB-CB 3.93Å; P230-F270 HydrophobicContact CB-CD1 4.08Å; P230-F270 HydrophobicContact CB-CG 4.16Å; P230-F270 HydrophobicContact CG-CB 4.03Å; P230-F271 HydrophobicContact CG-CE1 4.02Å; P230-F271 HydrophobicContact CG-CE2 4.14Å; P230-F271 HydrophobicContact CG-CZ 3.65Å
231F98.2Very high97.3Very high40 Ų4021.2 Ų21.218%0.17512%0.123CC..Hα-helixtrans-67.2-39.3175-67.2-97.6000112V179 Q182 I186 S228 Y229 T233 R235 W258V179-F231 HydrophobicContact CG1-CB 4.09Å; V179-F231 HydrophobicContact CG1-CD1 4.01Å; V179-F231 VanDerWaalsContact CG1-O 3.28Å; V179-F231 WeakPolarHBondContact CG1-O 3.27Å; Q182-F231 HydrophobicContact CB-CD1 3.88Å; Q182-F231 HydrophobicContact CB-CE1 3.81Å; I186-F231 HydrophobicContact CB-CE2 4.39Å; I186-F231 HydrophobicContact CG1-CE2 3.91Å; I186-F231 HydrophobicContact CG1-CZ 3.93Å; I186-F231 HydrophobicContact CG2-CE2 4.26Å; S228-F231 WeakPolarHBondContact O-CB 3.37Å; S228-F231 PolarHBondContact O-N 3.48Å; S228-F231 VanDerWaalsContact O-N 3.07Å; Y229-F231 PolarHBondContact O-N 2.93Å; F231-T233 VanDerWaalsContact C-N 3.35Å; F231-R235 WeakPolarHBondContact O-CB 3.41Å; F231-R235 PolarHBondContact O-N 3.43Å; F231-W258 HydrophobicContact CD1-CZ2 4.01Å; F231-W258 HydrophobicContact CD2-CH2 4.38Å; F231-W258 HydrophobicContact CD2-CZ2 4.44Å; F231-W258 HydrophobicContact CE1-CZ2 4.15Å; F231-W258 HydrophobicContact CE2-CH2 4.48Å; F231-W258 HydrophobicContact CG-CH2 4.48Å; F231-W258 HydrophobicContact CG-CZ2 4.15Å; F231-W258 HydrophobicContact CZ-CZ2 4.43Å
232D98.1Very high97.5Very high28 Ų2818.9 Ų18.915%0.1511%0.108CC..Hα-helixtrans-63.1-43173.4-173.252.9000110.4K33 Q37 S228 Y229 R235 R236K33-D232 WeakPolarHBondContact CE-OD2 3.41Å; K33-D232 IonicContact NZ-OD2 2.9Å; K33-D232 PolarHBondContact NZ-OD2 3.18Å; Q37-D232 PolarHBondContact NE2-OD2 2.93Å; Q37-D232 PolarHBondContact OE1-OD2 3.44Å; S228-D232 PolarHBondContact O-N 2.87Å; Y229-D232 WeakPolarHBondContact O-CA 3.26Å; Y229-D232 WeakPolarHBondContact O-CB 3.13Å; Y229-D232 PolarHBondContact O-N 2.98Å; D232-R235 WeakPolarHBondContact O-CB 3.24Å; D232-R235 PolarHBondContact O-N 3.23Å; D232-R236 VanDerWaalsContact O-CG 3.27Å; D232-R236 WeakPolarHBondContact O-CG 3.47Å; D232-R236 PolarHBondContact O-N 3.04Å; D232-R236 IonicContact OD1-CZ 2.78Å; D232-R236 IonicContact OD1-NE 3.49Å; D232-R236 PolarHBondContact OD1-NE 3.46Å; D232-R236 IonicContact OD1-NH2 3.6Å; D232-R236 PolarHBondContact OD1-NH2 3.3Å
233T98.4Very high97.5Very high0 Ų018.6 Ų18.60%011%0.108CC..Hα-helixtrans-61.5-51177.9-63.70000111.9Q37 Y229 P230 F231 R235 R236 R237 F270Q37-T233 HydrophobicContact CG-CG2 4.05Å; Q37-T233 VanDerWaalsContact NE2-CA 3.29Å; Q37-T233 PolarHBondContact NE2-OG1 3.33Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.23Å; Y229-T233 PolarHBondContact O-N 3.31Å; Y229-T233 PolarHBondContact O-OG1 3.38Å; P230-T233 PolarHBondContact O-N 2.97Å; F231-T233 VanDerWaalsContact C-N 3.35Å; T233-R235 VanDerWaalsContact C-N 3.31Å; T233-R235 PolarHBondContact O-N 2.89Å; T233-R236 PolarHBondContact O-N 3.27Å; T233-R237 HydrophobicContact CG2-CG 4.29Å; T233-R237 WeakPolarHBondContact O-CB 3.28Å; T233-R237 WeakPolarHBondContact O-CG 3.46Å; T233-R237 PolarHBondContact O-N 3.12Å; T233-F270 WeakPolarHBondContact CB-O 3.27Å; T233-F270 PolarHBondContact OG1-O 3.42Å
234V98.4Very high97.4Very high0 Ų017 Ų170%010%0.096CC..Hα-helixtrans-60.7-42.8177.2173.70000111.2V179 P230 R236 R237 M238 T254 C257 W258 I261 F270V179-V234 HydrophobicContact CG1-CB 4.14Å; V179-V234 HydrophobicContact CG1-CG1 4.12Å; V179-V234 HydrophobicContact CG2-CG1 4.19Å; P230-V234 WeakPolarHBondContact O-CG2 3.45Å; P230-V234 PolarHBondContact O-N 2.97Å; V234-R236 PolarHBondContact O-N 3.26Å; V234-R237 PolarHBondContact O-N 3.39Å; V234-M238 HydrophobicContact CG1-CG 4.19Å; V234-M238 WeakPolarHBondContact O-CB 3.39Å; V234-M238 VanDerWaalsContact O-CG 3.25Å; V234-M238 WeakPolarHBondContact O-CG 3.48Å; V234-M238 PolarHBondContact O-N 3.41Å; V234-T254 HydrophobicContact CG1-CG2 4.31Å; V234-C257 HydrophobicContact CG1-CB 4.15Å; V234-W258 HydrophobicContact CB-CD2 4.48Å; V234-W258 HydrophobicContact CB-CZ2 4.24Å; V234-W258 HydrophobicContact CG1-CG 4.46Å; V234-W258 HydrophobicContact CG2-CD2 3.52Å; V234-W258 VanDerWaalsContact CG2-CE2 3.48Å; V234-W258 HydrophobicContact CG2-CE3 3.86Å; V234-W258 HydrophobicContact CG2-CG 3.99Å; V234-W258 HydrophobicContact CG2-CH2 4.13Å; V234-W258 HydrophobicContact CG2-CZ2 3.8Å; V234-W258 HydrophobicContact CG2-CZ3 4.15Å; V234-I261 HydrophobicContact CG2-CD1 4.03Å; V234-F270 HydrophobicContact CG2-CD1 4.17Å; V234-F270 HydrophobicContact CG2-CE1 3.76Å
235R98.3Very high97.2Very high23 Ų2324.2 Ų24.29%0.08713%0.128CC..Hα-helixtrans-53.6-53.8173.7172.1-168.2-171.1-165.32.8111.3Y132 D135 V179 S180 F231 D232 T233 R237 M238 M239Y132-R235 PolarHBondContact OH-NE 3.27Å; D135-R235 IonicContact OD2-CZ 2.96Å; D135-R235 IonicContact OD2-NH1 3.37Å; D135-R235 PolarHBondContact OD2-NH1 2.91Å; D135-R235 IonicContact OD2-NH2 2.79Å; D135-R235 PolarHBondContact OD2-NH2 3.26Å; V179-R235 HydrophobicContact CB-CB 4.45Å; V179-R235 HydrophobicContact CG1-CB 4.33Å; S180-R235 WeakPolarHBondContact OG-CD 3.38Å; S180-R235 VanDerWaalsContact OG-CG 3.26Å; S180-R235 WeakPolarHBondContact OG-CG 3.49Å; S180-R235 PolarHBondContact OG-NE 3.4Å; F231-R235 WeakPolarHBondContact O-CB 3.41Å; F231-R235 PolarHBondContact O-N 3.43Å; D232-R235 WeakPolarHBondContact O-CB 3.24Å; D232-R235 PolarHBondContact O-N 3.23Å; T233-R235 VanDerWaalsContact C-N 3.31Å; T233-R235 PolarHBondContact O-N 2.89Å; R235-R237 VanDerWaalsContact C-N 3.33Å; R235-R237 PolarHBondContact O-N 3.31Å; R235-M238 PolarHBondContact O-N 2.95Å; R235-M239 HydrophobicContact CG-CE 4Å; R235-M239 WeakPolarHBondContact O-CG 3.3Å; R235-M239 PolarHBondContact O-N 3.47Å
236R98.3Very high96.8Very high10 Ų1026.7 Ų26.74%0.03815%0.153CC..Hα-helixtrans-65.5-37.2-177.2-59.8-39.9175.5159.9-6.6111.7L34 Q37 V38 D135 T139 D232 T233 V234 M239 M240L34-R236 HydrophobicContact CD2-CG 4.24Å; Q37-R236 VanDerWaalsContact OE1-CG 3.28Å; V38-R236 HydrophobicContact CG1-CB 3.5Å; V38-R236 VanDerWaalsContact CG1-CB 3.5Å; D135-R236 VanDerWaalsContact CG-NH1 3.28Å; D135-R236 IonicContact OD1-CZ 2.76Å; D135-R236 IonicContact OD1-NH1 3.63Å; D135-R236 PolarHBondContact OD1-NH1 3.02Å; D135-R236 IonicContact OD1-NH2 2.77Å; D135-R236 PolarHBondContact OD1-NH2 3.22Å; D135-R236 IonicContact OD2-CZ 3.92Å; D135-R236 IonicContact OD2-NH1 3.74Å; D135-R236 PolarHBondContact OD2-NH1 3.4Å; D135-R236 IonicContact OD2-NH2 2.97Å; D135-R236 PolarHBondContact OD2-NH2 3.34Å; T139-R236 HydrophobicContact CG2-CB 4.19Å; T139-R236 HydrophobicContact CG2-CG 4.43Å; T139-R236 WeakPolarHBondContact OG1-CD 3.42Å; T139-R236 PolarHBondContact OG1-NH1 2.96Å; D232-R236 VanDerWaalsContact O-CG 3.27Å; D232-R236 WeakPolarHBondContact O-CG 3.47Å; D232-R236 PolarHBondContact O-N 3.04Å; D232-R236 IonicContact OD1-CZ 2.78Å; D232-R236 IonicContact OD1-NE 3.49Å; D232-R236 PolarHBondContact OD1-NE 3.46Å; D232-R236 IonicContact OD1-NH2 3.6Å; D232-R236 PolarHBondContact OD1-NH2 3.3Å; T233-R236 PolarHBondContact O-N 3.27Å; V234-R236 PolarHBondContact O-N 3.26Å; R236-M239 WeakPolarHBondContact O-CB 3.48Å; R236-M239 PolarHBondContact O-N 3.01Å; R236-M240 WeakPolarHBondContact O-CG 3.4Å; R236-M240 PolarHBondContact O-N 3.08Å
237R98.1Very high96.5Very high0 Ų028.5 Ų28.50%018%0.178CC..Hα-helixtrans-65-38174.6-70-64.4-171.1105.74.2112.9Q37 T233 V234 R235 M240 Q241 Y251 I261 E265Q37-R237 PolarHBondContact O-NE 3.31Å; Q37-R237 PolarHBondContact O-NH2 3.4Å; T233-R237 HydrophobicContact CG2-CG 4.29Å; T233-R237 WeakPolarHBondContact O-CB 3.28Å; T233-R237 WeakPolarHBondContact O-CG 3.46Å; T233-R237 PolarHBondContact O-N 3.12Å; V234-R237 PolarHBondContact O-N 3.39Å; R235-R237 VanDerWaalsContact C-N 3.33Å; R235-R237 PolarHBondContact O-N 3.31Å; R237-M240 PolarHBondContact O-N 3.29Å; R237-Q241 PolarHBondContact O-NE2 2.88Å; R237-Y251 HydrophobicContact CB-CE2 3.84Å; R237-Y251 PolarHBondContact NH1-OH 3.47Å; R237-I261 HydrophobicContact CB-CD1 4.36Å; R237-I261 HydrophobicContact CG-CD1 4.03Å; R237-E265 IonicContact CZ-OE1 3.41Å; R237-E265 IonicContact CZ-OE2 3.84Å; R237-E265 IonicContact NH1-OE1 3.79Å; R237-E265 PolarHBondContact NH1-OE1 3.39Å; R237-E265 IonicContact NH1-OE2 2.91Å; R237-E265 IonicContact NH2-OE1 3.63Å; R237-E265 PolarHBondContact NH2-OE1 2.94Å; R237-E265 IonicContact NH2-OE2 2.79Å; R237-E265 PolarHBondContact NH2-OE2 2.9Å
238M98.1Very high96.2Very high3 Ų328.9 Ų28.92%0.01518%0.178CC..Hα-helixtrans-65.7-42.7173.3-73.7-56.9-65.100111.6Q175 V234 R235 M240 Q241 Y251 C257Q175-M238 HydrophobicContact CG-CB 4.34Å; Q175-M238 HydrophobicContact CG-CE 4.34Å; Q175-M238 WeakPolarHBondContact CG-O 3.41Å; Q175-M238 VanDerWaalsContact NE2-CE 3.33Å; V234-M238 HydrophobicContact CG1-CG 4.19Å; V234-M238 WeakPolarHBondContact O-CB 3.39Å; V234-M238 VanDerWaalsContact O-CG 3.25Å; V234-M238 WeakPolarHBondContact O-CG 3.48Å; V234-M238 PolarHBondContact O-N 3.41Å; R235-M238 PolarHBondContact O-N 2.95Å; M238-M240 PolarHBondContact O-N 2.98Å; M238-Q241 WeakPolarHBondContact O-CB 3.32Å; M238-Q241 PolarHBondContact O-N 3.06Å; M238-Y251 HydrophobicContact SD-CD2 4.46Å; M238-C257 HydrophobicContact CG-CB 4.27Å; M238-C257 HydrophobicContact SD-CB 3.6Å; M238-C257 VanDerWaalsContact SD-CB 3.6Å
239M98.1Very high96Very high0 Ų031.8 Ų31.80%019%0.191CC..Hα-helixtrans-56.1-34175.2-66.6173.516600112.4Y132 F136 T139 R140 Q175 R235 R236 Q241 S242Y132-M239 HydrophobicContact CD1-CE 4.49Å; Y132-M239 HydrophobicContact CE1-CE 3.63Å; Y132-M239 HydrophobicContact CE2-CE 4.16Å; Y132-M239 VanDerWaalsContact CZ-CE 3.44Å; Y132-M239 VanDerWaalsContact OH-CE 3.26Å; Y132-M239 WeakPolarHBondContact OH-CE 3.48Å; F136-M239 HydrophobicContact CB-CE 4.4Å; F136-M239 HydrophobicContact CD2-CB 3.85Å; F136-M239 HydrophobicContact CD2-CG 3.86Å; F136-M239 HydrophobicContact CE2-CB 4.02Å; F136-M239 HydrophobicContact CE2-CG 4.49Å; F136-M239 WeakPolarHBondContact CE2-O 3.44Å; T139-M239 HydrophobicContact CG2-CB 4.4Å; T139-M239 HydrophobicContact CG2-SD 3.94Å; R140-M239 WeakPolarHBondContact CD-O 3.25Å; Q175-M239 WeakPolarHBondContact O-CG 3.46Å; R235-M239 HydrophobicContact CG-CE 4Å; R235-M239 WeakPolarHBondContact O-CG 3.3Å; R235-M239 PolarHBondContact O-N 3.47Å; R236-M239 WeakPolarHBondContact O-CB 3.48Å; R236-M239 PolarHBondContact O-N 3.01Å; M239-Q241 PolarHBondContact O-N 2.96Å; M239-S242 PolarHBondContact O-N 3.34Å
240M97.5Very high95.9Very high4 Ų434.5 Ų34.52%0.0221%0.205CC..THydrogen-bonded Turntrans-71.6-7.1178.3-62.6-58.6-71.200114.5V38 A41 R140 A143 R236 R237 M238 R244V38-M240 HydrophobicContact CB-CG 3.95Å; V38-M240 HydrophobicContact CB-SD 4.46Å; V38-M240 HydrophobicContact CG1-CG 4.3Å; V38-M240 HydrophobicContact CG2-CE 4.41Å; V38-M240 HydrophobicContact CG2-CG 4.4Å; V38-M240 HydrophobicContact CG2-SD 4.29Å; A41-M240 HydrophobicContact CB-CB 4Å; A41-M240 HydrophobicContact CB-CG 4.42Å; A41-M240 WeakPolarHBondContact O-CB 3.24Å; R140-M240 PolarHBondContact NH1-SD 2.87Å; R140-M240 VanDerWaalsContact NH1-SD 3.41Å; A143-M240 HydrophobicContact CB-CE 3.49Å; A143-M240 VanDerWaalsContact CB-CE 3.49Å; A143-M240 HydrophobicContact CB-SD 3.6Å; A143-M240 VanDerWaalsContact CB-SD 3.6Å; R236-M240 WeakPolarHBondContact O-CG 3.4Å; R236-M240 PolarHBondContact O-N 3.08Å; R237-M240 PolarHBondContact O-N 3.29Å; M238-M240 PolarHBondContact O-N 2.98Å; M240-R244 PolarHBondContact O-NE 3.12Å
241Q96.8Very high95.7Very high9 Ų934 Ų344%0.04220%0.201CC..THydrogen-bonded Turntrans-81.7-19.8175.3-57.6-49.6-64.400112.8R237 M238 M239 R244 Y251R237-Q241 PolarHBondContact O-NE2 2.88Å; M238-Q241 WeakPolarHBondContact O-CB 3.32Å; M238-Q241 PolarHBondContact O-N 3.06Å; M239-Q241 PolarHBondContact O-N 2.96Å; Q241-R244 VanDerWaalsContact O-CB 3.27Å; Q241-R244 WeakPolarHBondContact O-CB 3.38Å; Q241-R244 VanDerWaalsContact O-CG 3.28Å; Q241-R244 WeakPolarHBondContact O-CG 3.23Å; Q241-R244 PolarHBondContact O-N 3.35Å; Q241-Y251 VanDerWaalsContact CD-CD2 3.49Å; Q241-Y251 HydrophobicContact CG-CD2 3.78Å; Q241-Y251 HydrophobicContact CG-CG 4.48Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.27Å
242S96.4Very high95.5Very high1 Ų137.9 Ų37.91%0.00723%0.228CC..THydrogen-bonded Turntrans-71.5135.8179.6-540000111.3R140 D168 G172 Q175 M239R140-S242 PolarHBondContact NH2-O 3.13Å; D168-S242 WeakPolarHBondContact OD2-CA 2.9Å; D168-S242 WeakPolarHBondContact OD2-CB 3.25Å; G172-S242 WeakPolarHBondContact O-CB 3.37Å; G172-S242 PolarHBondContact O-OG 3.37Å; Q175-S242 VanDerWaalsContact CB-OG 3.3Å; Q175-S242 WeakPolarHBondContact CB-OG 3.41Å; M239-S242 PolarHBondContact O-N 3.34Å
243G94.5Very high95.4Very high23 Ų2337.6 Ų37.624%0.23723%0.232CC..THydrogen-bonded Turntrans84.29-171.100000114D168D168-G243 PolarHBondContact OD1-N 3.08Å; D168-G243 PolarHBondContact OD2-N 2.91Å
244R94.6Very high95.3Very high22 Ų2239.4 Ų39.48%0.08324%0.243CC..  trans-101.4148.3174.9-54-164.7176.8-150.3-3.2111.1A41 M240 Q241 D248 I249 M250A41-R244 PolarHBondContact O-NH2 2.87Å; M240-R244 PolarHBondContact O-NE 3.12Å; Q241-R244 VanDerWaalsContact O-CB 3.27Å; Q241-R244 WeakPolarHBondContact O-CB 3.38Å; Q241-R244 VanDerWaalsContact O-CG 3.28Å; Q241-R244 WeakPolarHBondContact O-CG 3.23Å; Q241-R244 PolarHBondContact O-N 3.35Å; R244-D248 HydrophobicContact CB-CB 4.08Å; R244-D248 WeakPolarHBondContact CD-O 3.34Å; R244-D248 PolarHBondContact NH1-O 3.36Å; R244-I249 HydrophobicContact CB-CG1 3.97Å; R244-M250 VanDerWaalsContact NH1-CG 3.27Å; R244-M250 PolarHBondContact NH1-SD 3.11Å
245K91Very high95.3Very high152 Ų15245.2 Ų45.266%0.66128%0.278SS*.  trans-136.1149.3179.2-63.2-173179.4-174.60110.5A247 D248K245-A247 PolarHBondContact O-N 2.96Å; K245-D248 WeakPolarHBondContact O-CB 3.21Å; K245-D248 PolarHBondContact O-N 3.46Å; K245-D248 VanDerWaalsContact O-N 3.16Å
246G90.1Very high95.2Very high62 Ų6244.8 Ų44.864%0.63928%0.277SS*.G310 helixtrans53.1-129.6174.200000113.1D248 I249G246-D248 PolarHBondContact O-N 3.26Å; G246-D248 VanDerWaalsContact O-N 3.13Å; G246-I249 PolarHBondContact O-N 2.83Å; G246-I249 VanDerWaalsContact O-N 3.16Å
247A89.3Confident95.2Very high109 Ų10944.3 Ų44.390%0.90128%0.276SS*.G310 helixtrans-62.4-16.5-177.300000114.7K245 I249K245-A247 PolarHBondContact O-N 2.96Å; A247-I249 VanDerWaalsContact C-N 3.26Å; A247-I249 PolarHBondContact O-N 3.32Å
248D91.2Very high95.2Very high85 Ų8547.5 Ų47.546%0.45529%0.288SS..G310 helixtrans-72.2-19.7176.6-73.4-20.3000113.1K43 R244 K245 G246 M250K43-D248 WeakPolarHBondContact CE-OD2 3.39Å; K43-D248 IonicContact NZ-OD2 3.43Å; K43-D248 PolarHBondContact NZ-OD2 2.93Å; R244-D248 HydrophobicContact CB-CB 4.08Å; R244-D248 WeakPolarHBondContact CD-O 3.34Å; R244-D248 PolarHBondContact NH1-O 3.36Å; K245-D248 WeakPolarHBondContact O-CB 3.21Å; K245-D248 PolarHBondContact O-N 3.46Å; K245-D248 VanDerWaalsContact O-N 3.16Å; G246-D248 PolarHBondContact O-N 3.26Å; G246-D248 VanDerWaalsContact O-N 3.13Å; D248-M250 PolarHBondContact O-N 3.49Å
249I94.5Very high95.2Very high75 Ų7555 Ų5539%0.38532%0.316SS..  trans-71.8116.6-177.3-61.8173.1000109R244 G246 A247 Y251R244-I249 HydrophobicContact CB-CG1 3.97Å; G246-I249 PolarHBondContact O-N 2.83Å; G246-I249 VanDerWaalsContact O-N 3.16Å; A247-I249 VanDerWaalsContact C-N 3.26Å; A247-I249 PolarHBondContact O-N 3.32Å; I249-Y251 WeakPolarHBondContact CG2-O 3.46Å
250M94.8Very high95.2Very high61 Ų6157.9 Ų57.930%0.333%0.328SS..  trans-85.8-34.7-179.5-70.9177.770.800112.9H40 A41 R244 D248 K260H40-M250 WeakPolarHBondContact O-CE 3.35Å; A41-M250 HydrophobicContact CB-SD 4.16Å; R244-M250 VanDerWaalsContact NH1-CG 3.27Å; R244-M250 PolarHBondContact NH1-SD 3.11Å; D248-M250 PolarHBondContact O-N 3.49Å; M250-K260 WeakPolarHBondContact O-CD 3.44Å; M250-K260 PolarHBondContact O-NZ 2.79Å
251Y96Very high95.2Very high7 Ų757.7 Ų57.73%0.02733%0.327CS..  trans-126.3120.3-176.5-45.4-59.7000109.5A41 R237 M238 Q241 I249 G253 C257 K260A41-Y251 HydrophobicContact CB-CE2 4.16Å; R237-Y251 HydrophobicContact CB-CE2 3.84Å; R237-Y251 PolarHBondContact NH1-OH 3.47Å; M238-Y251 HydrophobicContact SD-CD2 4.46Å; Q241-Y251 VanDerWaalsContact CD-CD2 3.49Å; Q241-Y251 HydrophobicContact CG-CD2 3.78Å; Q241-Y251 HydrophobicContact CG-CG 4.48Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.27Å; I249-Y251 WeakPolarHBondContact CG2-O 3.46Å; Y251-G253 PolarHBondContact O-N 3.45Å; Y251-C257 HydrophobicContact CD1-CB 3.93Å; Y251-C257 HydrophobicContact CD2-CB 4.13Å; Y251-C257 HydrophobicContact CG-CB 3.7Å; Y251-K260 HydrophobicContact CD1-CB 4.21Å; Y251-K260 HydrophobicContact CD1-CD 3.97Å; Y251-K260 HydrophobicContact CE1-CB 4Å; Y251-K260 HydrophobicContact CE1-CD 4.36Å
252T93.8Very high95.3Very high121 Ų12159.4 Ų59.474%0.74234%0.344SS*.SBendtrans-73.4-20.9178.457.40000112.2D256T252-D256 PolarHBondContact N-OD2 3.03Å; T252-D256 WeakPolarHBondContact OG1-CB 3.46Å; T252-D256 PolarHBondContact OG1-OD2 3.4Å
253G94.7Very high95.3Very high22 Ų2267.7 Ų67.723%0.22738%0.379CS..SBendtrans-173.7-179176.500000111.9Y251 V255 D256 C257Y251-G253 PolarHBondContact O-N 3.45Å; G253-V255 PolarHBondContact O-N 3.22Å; G253-D256 PolarHBondContact O-N 2.98Å; G253-C257 WeakPolarHBondContact O-CB 3.3Å; G253-C257 PolarHBondContact O-N 2.93Å
254T96.7Very high95.3Very high39 Ų3971.8 Ų71.824%0.23940%0.396CS..Hα-helixtrans-55.6-47.5-178.6-66.40000113V179 V234 C257 W258V179-T254 HydrophobicContact CG2-CG2 3.25Å; V179-T254 WeakPolarHBondContact CG2-OG1 3.41Å; V234-T254 HydrophobicContact CG1-CG2 4.31Å; T254-C257 WeakPolarHBondContact O-CB 3.37Å; T254-C257 PolarHBondContact O-N 3.43Å; T254-W258 PolarHBondContact O-N 3.42Å
255V97.7Very high95.4Very high121 Ų12173 Ų7373%0.73340%0.402SS*.Hα-helixtrans-66.2-40.9-177.7178.30000110.9G253 C257 W258 R259G253-V255 PolarHBondContact O-N 3.22Å; V255-C257 VanDerWaalsContact C-N 3.31Å; V255-C257 PolarHBondContact O-N 2.85Å; V255-W258 PolarHBondContact O-N 3.16Å; V255-R259 WeakPolarHBondContact O-CB 3.48Å; V255-R259 PolarHBondContact O-N 3.12Å
256D97.6Very high95.6Very high14 Ų1466.7 Ų66.78%0.07538%0.381CS..Hα-helixtrans-63.8-37.8174.4-173.153.7000111.5T252 G253 R259 K260T252-D256 PolarHBondContact N-OD2 3.03Å; T252-D256 WeakPolarHBondContact OG1-CB 3.46Å; T252-D256 PolarHBondContact OG1-OD2 3.4Å; G253-D256 PolarHBondContact O-N 2.98Å; D256-R259 PolarHBondContact O-N 2.89Å; D256-R259 IonicContact OD1-CZ 3.35Å; D256-R259 IonicContact OD1-NE 2.7Å; D256-R259 IonicContact OD1-NH2 3.93Å; D256-R259 PolarHBondContact OD1-NH2 3.14Å; D256-K260 WeakPolarHBondContact O-CB 3.49Å; D256-K260 WeakPolarHBondContact O-CG 3.21Å; D256-K260 PolarHBondContact O-N 2.73Å; D256-K260 WeakPolarHBondContact OD1-CE 3.33Å; D256-K260 IonicContact OD1-NZ 2.67Å; D256-K260 WeakPolarHBondContact OD2-CD 3.43Å; D256-K260 VanDerWaalsContact OD2-CE 3.29Å; D256-K260 WeakPolarHBondContact OD2-CE 3.28Å; D256-K260 IonicContact OD2-NZ 3.62Å; D256-K260 PolarHBondContact OD2-NZ 3.36Å
257C98.1Very high95.9Very high0 Ų068.4 Ų68.40%038%0.381CS..Hα-helixtrans-60.2-48.9173.7-1720000112.1V234 M238 Y251 G253 T254 V255 R259 K260 I261V234-C257 HydrophobicContact CG1-CB 4.15Å; M238-C257 HydrophobicContact CG-CB 4.27Å; M238-C257 HydrophobicContact SD-CB 3.6Å; M238-C257 VanDerWaalsContact SD-CB 3.6Å; Y251-C257 HydrophobicContact CD1-CB 3.93Å; Y251-C257 HydrophobicContact CD2-CB 4.13Å; Y251-C257 HydrophobicContact CG-CB 3.7Å; G253-C257 WeakPolarHBondContact O-CB 3.3Å; G253-C257 PolarHBondContact O-N 2.93Å; T254-C257 WeakPolarHBondContact O-CB 3.37Å; T254-C257 PolarHBondContact O-N 3.43Å; V255-C257 VanDerWaalsContact C-N 3.31Å; V255-C257 PolarHBondContact O-N 2.85Å; C257-R259 PolarHBondContact O-N 2.9Å; C257-K260 PolarHBondContact O-N 3.43Å; C257-I261 WeakPolarHBondContact O-CB 3.11Å; C257-I261 WeakPolarHBondContact O-CD1 3.37Å; C257-I261 VanDerWaalsContact O-CG1 3.22Å; C257-I261 WeakPolarHBondContact O-CG1 3.49Å; C257-I261 PolarHBondContact O-N 3.42Å
258W98.3Very high96.2Very high67 Ų6771.9 Ų71.925%0.25438%0.375SS..Hα-helixtrans-55.2-51.1173.3-81105.7000111.8P230 F231 V234 T254 V255 A262 F270P230-W258 HydrophobicContact CB-CH2 3.47Å; P230-W258 VanDerWaalsContact CB-CH2 3.47Å; P230-W258 HydrophobicContact CB-CZ3 3.71Å; F231-W258 HydrophobicContact CD1-CZ2 4.01Å; F231-W258 HydrophobicContact CD2-CH2 4.38Å; F231-W258 HydrophobicContact CD2-CZ2 4.44Å; F231-W258 HydrophobicContact CE1-CZ2 4.15Å; F231-W258 HydrophobicContact CE2-CH2 4.48Å; F231-W258 HydrophobicContact CG-CH2 4.48Å; F231-W258 HydrophobicContact CG-CZ2 4.15Å; F231-W258 HydrophobicContact CZ-CZ2 4.43Å; V234-W258 HydrophobicContact CB-CD2 4.48Å; V234-W258 HydrophobicContact CB-CZ2 4.24Å; V234-W258 HydrophobicContact CG1-CG 4.46Å; V234-W258 HydrophobicContact CG2-CD2 3.52Å; V234-W258 VanDerWaalsContact CG2-CE2 3.48Å; V234-W258 HydrophobicContact CG2-CE3 3.86Å; V234-W258 HydrophobicContact CG2-CG 3.99Å; V234-W258 HydrophobicContact CG2-CH2 4.13Å; V234-W258 HydrophobicContact CG2-CZ2 3.8Å; V234-W258 HydrophobicContact CG2-CZ3 4.15Å; T254-W258 PolarHBondContact O-N 3.42Å; V255-W258 PolarHBondContact O-N 3.16Å; W258-A262 WeakPolarHBondContact O-CB 3.4Å; W258-A262 PolarHBondContact O-N 3.38Å; W258-F270 HydrophobicContact CD2-CE1 4.15Å; W258-F270 HydrophobicContact CE3-CD1 4.02Å; W258-F270 AromaticContact CE3-CE1 3.22Å; W258-F270 HydrophobicContact CE3-CE1 3.22Å; W258-F270 HydrophobicContact CE3-CE2 4.46Å; W258-F270 AromaticContact CE3-CZ 3.5Å; W258-F270 HydrophobicContact CE3-CZ 3.5Å; W258-F270 VanDerWaalsContact CE3-CZ 3.5Å; W258-F270 HydrophobicContact CH2-CE1 4.47Å; W258-F270 AromaticContact CZ3-CD1 3.72Å; W258-F270 HydrophobicContact CZ3-CD1 3.72Å; W258-F270 AromaticContact CZ3-CE1 3.42Å; W258-F270 HydrophobicContact CZ3-CE1 3.42Å; W258-F270 VanDerWaalsContact CZ3-CE1 3.42Å; W258-F270 HydrophobicContact CZ3-CG 4.43Å; W258-F270 AromaticContact CZ3-CZ 3.91Å; W258-F270 HydrophobicContact CZ3-CZ 3.91Å
259R98.1Very high96.5Very high161 Ų16167.9 Ų67.961%0.60835%0.354SS*.Hα-helixtrans-61.3-48.5-177.5-175.6-178.464.8163-1.1112V255 D256 C257 A262 K263V255-R259 WeakPolarHBondContact O-CB 3.48Å; V255-R259 PolarHBondContact O-N 3.12Å; D256-R259 PolarHBondContact O-N 2.89Å; D256-R259 IonicContact OD1-CZ 3.35Å; D256-R259 IonicContact OD1-NE 2.7Å; D256-R259 IonicContact OD1-NH2 3.93Å; D256-R259 PolarHBondContact OD1-NH2 3.14Å; C257-R259 PolarHBondContact O-N 2.9Å; R259-A262 PolarHBondContact O-N 3Å; R259-K263 VanDerWaalsContact O-CB 3.22Å; R259-K263 WeakPolarHBondContact O-CB 3.07Å; R259-K263 PolarHBondContact O-N 3.23Å
260K97.8Very high96.6Very high60 Ų6065.2 Ų65.226%0.26134%0.34SS..Hα-helixtrans-67.5-40.6-178.6-77176.8171.1161.80112.4M250 Y251 D256 C257 A262 K263 D264M250-K260 WeakPolarHBondContact O-CD 3.44Å; M250-K260 PolarHBondContact O-NZ 2.79Å; Y251-K260 HydrophobicContact CD1-CB 4.21Å; Y251-K260 HydrophobicContact CD1-CD 3.97Å; Y251-K260 HydrophobicContact CE1-CB 4Å; Y251-K260 HydrophobicContact CE1-CD 4.36Å; D256-K260 WeakPolarHBondContact O-CB 3.49Å; D256-K260 WeakPolarHBondContact O-CG 3.21Å; D256-K260 PolarHBondContact O-N 2.73Å; D256-K260 WeakPolarHBondContact OD1-CE 3.33Å; D256-K260 IonicContact OD1-NZ 2.67Å; D256-K260 WeakPolarHBondContact OD2-CD 3.43Å; D256-K260 VanDerWaalsContact OD2-CE 3.29Å; D256-K260 WeakPolarHBondContact OD2-CE 3.28Å; D256-K260 IonicContact OD2-NZ 3.62Å; D256-K260 PolarHBondContact OD2-NZ 3.36Å; C257-K260 PolarHBondContact O-N 3.43Å; K260-A262 VanDerWaalsContact C-N 3.34Å; K260-A262 PolarHBondContact O-N 2.94Å; K260-K263 PolarHBondContact O-N 3.49Å; K260-D264 WeakPolarHBondContact O-CA 3.36Å; K260-D264 WeakPolarHBondContact O-CB 3.23Å; K260-D264 VanDerWaalsContact O-CG 3.26Å; K260-D264 PolarHBondContact O-N 2.7Å
261I97.8Very high96.8Very high0 Ų066.5 Ų66.50%034%0.344CS..Iπ-helixtrans-60.3-47.4174.3-67.2165.9000110.3V234 R237 C257 E265 G266 A269 F270V234-I261 HydrophobicContact CG2-CD1 4.03Å; R237-I261 HydrophobicContact CB-CD1 4.36Å; R237-I261 HydrophobicContact CG-CD1 4.03Å; C257-I261 WeakPolarHBondContact O-CB 3.11Å; C257-I261 WeakPolarHBondContact O-CD1 3.37Å; C257-I261 VanDerWaalsContact O-CG1 3.22Å; C257-I261 WeakPolarHBondContact O-CG1 3.49Å; C257-I261 PolarHBondContact O-N 3.42Å; I261-E265 WeakPolarHBondContact O-CB 3.49Å; I261-E265 PolarHBondContact O-N 2.83Å; I261-E265 VanDerWaalsContact O-N 3.09Å; I261-G266 PolarHBondContact O-N 3.34Å; I261-G266 VanDerWaalsContact O-N 3.14Å; I261-A269 HydrophobicContact CG2-CB 3.74Å; I261-F270 HydrophobicContact CB-CE1 3.84Å; I261-F270 HydrophobicContact CB-CE2 4.48Å; I261-F270 HydrophobicContact CB-CZ 3.76Å; I261-F270 HydrophobicContact CD1-CE1 4.13Å; I261-F270 HydrophobicContact CG2-CD1 3.87Å; I261-F270 HydrophobicContact CG2-CD2 4.19Å; I261-F270 HydrophobicContact CG2-CE1 3.54Å; I261-F270 HydrophobicContact CG2-CE2 3.89Å; I261-F270 HydrophobicContact CG2-CG 4.17Å; I261-F270 HydrophobicContact CG2-CZ 3.55Å
262A97.8Very high96.7Very high46 Ų4668.8 Ų68.838%0.3835%0.354SS..Iπ-helixtrans-64.7-42.1-179.800000112.7W258 R259 K260 G266 F270W258-A262 WeakPolarHBondContact O-CB 3.4Å; W258-A262 PolarHBondContact O-N 3.38Å; R259-A262 PolarHBondContact O-N 3Å; K260-A262 VanDerWaalsContact C-N 3.34Å; K260-A262 PolarHBondContact O-N 2.94Å; A262-G266 VanDerWaalsContact O-CA 3.25Å; A262-G266 WeakPolarHBondContact O-CA 3.34Å; A262-G266 PolarHBondContact O-N 2.85Å; A262-F270 HydrophobicContact CB-CE2 3.93Å; A262-F270 HydrophobicContact CB-CZ 4.13Å
263K97.1Very high96.8Very high174 Ų17463.5 Ų63.576%0.75732%0.323SS*.Iπ-helixtrans-76.6-46-176.7-174.5-177.1176.4-1760112.8R259 K260R259-K263 VanDerWaalsContact O-CB 3.22Å; R259-K263 WeakPolarHBondContact O-CB 3.07Å; R259-K263 PolarHBondContact O-N 3.23Å; K260-K263 PolarHBondContact O-N 3.49Å
264D95.6Very high96.9Very high110 Ų11062.8 Ų62.859%0.58832%0.315SS*.Iπ-helixtrans-93.9-30.4-167.4-50.7-24.6000112K260K260-D264 WeakPolarHBondContact O-CA 3.36Å; K260-D264 WeakPolarHBondContact O-CB 3.23Å; K260-D264 VanDerWaalsContact O-CG 3.26Å; K260-D264 PolarHBondContact O-N 2.7Å
265E95.1Very high96.8Very high47 Ų4768.5 Ų68.522%0.2233%0.333CS..Iπ-helixtrans-113.3-12.7-179.5-56.7-179.1-126.800113.8H40 R237 I261 A269 K272H40-E265 IonicContact CD2-OE1 2.79Å; H40-E265 IonicContact CD2-OE2 3.22Å; H40-E265 PolarHBondContact CD2-OE2 3.29Å; H40-E265 IonicContact CE1-OE2 2.82Å; H40-E265 IonicContact CG-OE1 3.99Å; H40-E265 IonicContact CG-OE2 2.75Å; H40-E265 VanDerWaalsContact CG-OE2 3.27Å; H40-E265 IonicContact ND1-OE2 3.91Å; H40-E265 IonicContact NE2-OE2 3.45Å; H40-E265 PolarHBondContact NE2-OE2 3.49Å; R237-E265 IonicContact CZ-OE1 3.41Å; R237-E265 IonicContact CZ-OE2 3.84Å; R237-E265 IonicContact NH1-OE1 3.79Å; R237-E265 PolarHBondContact NH1-OE1 3.39Å; R237-E265 IonicContact NH1-OE2 2.91Å; R237-E265 IonicContact NH2-OE1 3.63Å; R237-E265 PolarHBondContact NH2-OE1 2.94Å; R237-E265 IonicContact NH2-OE2 2.79Å; R237-E265 PolarHBondContact NH2-OE2 2.9Å; I261-E265 WeakPolarHBondContact O-CB 3.49Å; I261-E265 PolarHBondContact O-N 2.83Å; I261-E265 VanDerWaalsContact O-N 3.09Å; E265-A269 HydrophobicContact CB-CB 3.34Å; E265-A269 HydrophobicContact CG-CB 4.31Å; E265-K272 IonicContact OE2-NZ 2.8Å; E265-K272 PolarHBondContact OE2-NZ 3.34Å
266G96.3Very high96.7Very high20 Ų2062.8 Ų62.821%0.20630%0.298CS..  trans79.9167.7-176.500000114.7I261 A262 K268 A269I261-G266 PolarHBondContact O-N 3.34Å; I261-G266 VanDerWaalsContact O-N 3.14Å; A262-G266 VanDerWaalsContact O-CA 3.25Å; A262-G266 WeakPolarHBondContact O-CA 3.34Å; A262-G266 PolarHBondContact O-N 2.85Å; G266-K268 VanDerWaalsContact C-N 3.26Å; G266-K268 PolarHBondContact O-N 2.89Å; G266-A269 WeakPolarHBondContact O-CB 3.21Å; G266-A269 PolarHBondContact O-N 2.85Å
267P95.3Very high96.6Very high98 Ų9863.3 Ų63.364%0.63630%0.301SS*.G310 helixtrans-63.7-26.6-173.123.8-34.2000114.1A269 F270P267-A269 PolarHBondContact O-N 3.29Å; P267-F270 WeakPolarHBondContact O-CD2 3.1Å; P267-F270 PolarHBondContact O-N 3.01Å
268K96Very high96.4Very high182 Ų18264.3 Ų64.379%0.79131%0.307SS*.G310 helixtrans-65-23.4176.1-66.8-176.8-179.2177.90112.4G266 F270 F271G266-K268 VanDerWaalsContact C-N 3.26Å; G266-K268 PolarHBondContact O-N 2.89Å; K268-F270 PolarHBondContact O-N 3.35Å; K268-F271 PolarHBondContact O-N 3.38Å
269A96.6Very high96.2Very high1 Ų164.1 Ų64.11%0.00831%0.311CS..G310 helixtrans-62.9-30.6-179.400000113.1I261 E265 G266 P267 F271 K272I261-A269 HydrophobicContact CG2-CB 3.74Å; E265-A269 HydrophobicContact CB-CB 3.34Å; E265-A269 HydrophobicContact CG-CB 4.31Å; G266-A269 WeakPolarHBondContact O-CB 3.21Å; G266-A269 PolarHBondContact O-N 2.85Å; P267-A269 PolarHBondContact O-N 3.29Å; A269-F271 PolarHBondContact O-N 2.96Å; A269-F271 VanDerWaalsContact O-N 3.14Å; A269-K272 PolarHBondContact O-N 3.41Å
270F98Very high95.9Very high18 Ų1859.8 Ų59.88%0.07929%0.294CS..G310 helixtrans-60.5-22.7174.7-68.8-69.9000113.1Y229 P230 T233 V234 W258 I261 A262 P267 K268Y229-F270 WeakPolarHBondContact CD1-O 2.99Å; P230-F270 HydrophobicContact CB-CB 3.93Å; P230-F270 HydrophobicContact CB-CD1 4.08Å; P230-F270 HydrophobicContact CB-CG 4.16Å; P230-F270 HydrophobicContact CG-CB 4.03Å; T233-F270 WeakPolarHBondContact CB-O 3.27Å; T233-F270 PolarHBondContact OG1-O 3.42Å; V234-F270 HydrophobicContact CG2-CD1 4.17Å; V234-F270 HydrophobicContact CG2-CE1 3.76Å; W258-F270 HydrophobicContact CD2-CE1 4.15Å; W258-F270 HydrophobicContact CE3-CD1 4.02Å; W258-F270 AromaticContact CE3-CE1 3.22Å; W258-F270 HydrophobicContact CE3-CE1 3.22Å; W258-F270 HydrophobicContact CE3-CE2 4.46Å; W258-F270 AromaticContact CE3-CZ 3.5Å; W258-F270 HydrophobicContact CE3-CZ 3.5Å; W258-F270 VanDerWaalsContact CE3-CZ 3.5Å; W258-F270 HydrophobicContact CH2-CE1 4.47Å; W258-F270 AromaticContact CZ3-CD1 3.72Å; W258-F270 HydrophobicContact CZ3-CD1 3.72Å; W258-F270 AromaticContact CZ3-CE1 3.42Å; W258-F270 HydrophobicContact CZ3-CE1 3.42Å; W258-F270 VanDerWaalsContact CZ3-CE1 3.42Å; W258-F270 HydrophobicContact CZ3-CG 4.43Å; W258-F270 AromaticContact CZ3-CZ 3.91Å; W258-F270 HydrophobicContact CZ3-CZ 3.91Å; I261-F270 HydrophobicContact CB-CE1 3.84Å; I261-F270 HydrophobicContact CB-CE2 4.48Å; I261-F270 HydrophobicContact CB-CZ 3.76Å; I261-F270 HydrophobicContact CD1-CE1 4.13Å; I261-F270 HydrophobicContact CG2-CD1 3.87Å; I261-F270 HydrophobicContact CG2-CD2 4.19Å; I261-F270 HydrophobicContact CG2-CE1 3.54Å; I261-F270 HydrophobicContact CG2-CE2 3.89Å; I261-F270 HydrophobicContact CG2-CG 4.17Å; I261-F270 HydrophobicContact CG2-CZ 3.55Å; A262-F270 HydrophobicContact CB-CE2 3.93Å; A262-F270 HydrophobicContact CB-CZ 4.13Å; P267-F270 WeakPolarHBondContact O-CD2 3.1Å; P267-F270 PolarHBondContact O-N 3.01Å; K268-F270 PolarHBondContact O-N 3.35Å
271F97.9Very high95.5Very high89 Ų8958.1 Ų58.139%0.3929%0.294SS..G310 helixtrans-105.911.2-175.9-60.6-87.5000113.6L226 Y229 P230 K268 A269 G273 A274L226-F271 WeakPolarHBondContact O-CE1 3.43Å; Y229-F271 HydrophobicContact CD1-CD1 4.4Å; P230-F271 HydrophobicContact CG-CE1 4.02Å; P230-F271 HydrophobicContact CG-CE2 4.14Å; P230-F271 HydrophobicContact CG-CZ 3.65Å; K268-F271 PolarHBondContact O-N 3.38Å; A269-F271 PolarHBondContact O-N 2.96Å; A269-F271 VanDerWaalsContact O-N 3.14Å; F271-G273 PolarHBondContact O-N 3.48Å; F271-A274 HydrophobicContact CB-CB 4.15Å; F271-A274 WeakPolarHBondContact O-CB 3.47Å; F271-A274 PolarHBondContact O-N 3.44Å
272K95.6Very high95Very high55 Ų5561.7 Ų61.724%0.23931%0.312CS..THydrogen-bonded Turntrans-60123.1174.5-76174.8-178.8160.20110.4L36 H40 Y229 E265 A269 A274L36-K272 WeakPolarHBondContact O-CB 3.36Å; H40-K272 PolarHBondContact CE1-NZ 2.95Å; H40-K272 PolarHBondContact NE2-NZ 2.85Å; Y229-K272 WeakPolarHBondContact CE1-O 3.39Å; Y229-K272 PolarHBondContact OH-O 2.9Å; E265-K272 IonicContact OE2-NZ 2.8Å; E265-K272 PolarHBondContact OE2-NZ 3.34Å; A269-K272 PolarHBondContact O-N 3.41Å; K272-A274 VanDerWaalsContact C-N 3.33Å
273G95.4Very high94.5Very high9 Ų960.7 Ų60.79%0.09331%0.306CS..THydrogen-bonded Turntrans82.3-0-175.200000115.2Y229 F271 W275 S276 N277Y229-G273 PolarHBondContact OH-O 2.79Å; F271-G273 PolarHBondContact O-N 3.48Å; G273-W275 VanDerWaalsContact C-N 3.28Å; G273-W275 PolarHBondContact O-N 3.24Å; G273-S276 WeakPolarHBondContact O-CB 3.17Å; G273-S276 PolarHBondContact O-N 3.03Å; G273-N277 PolarHBondContact O-N 3.41Å
274A96.3Very high94Very high8 Ų853 Ų537%0.06628%0.275CS..Hα-helixtrans-57.7-41.5-178.500000112.2L226 Y229 F271 K272 N277 V278L226-A274 HydrophobicContact CD2-CB 3.89Å; Y229-A274 HydrophobicContact CD1-CB 3.91Å; Y229-A274 HydrophobicContact CD2-CB 4.23Å; Y229-A274 HydrophobicContact CE1-CB 3.85Å; Y229-A274 HydrophobicContact CE2-CB 4.17Å; Y229-A274 HydrophobicContact CG-CB 4.11Å; Y229-A274 VanDerWaalsContact CZ-CA 3.47Å; Y229-A274 PolarHBondContact OH-N 2.87Å; F271-A274 HydrophobicContact CB-CB 4.15Å; F271-A274 WeakPolarHBondContact O-CB 3.47Å; F271-A274 PolarHBondContact O-N 3.44Å; K272-A274 VanDerWaalsContact C-N 3.33Å; A274-N277 VanDerWaalsContact O-CB 3.32Å; A274-N277 WeakPolarHBondContact O-CB 3.4Å; A274-N277 PolarHBondContact O-N 3.49Å; A274-N277 VanDerWaalsContact O-N 3.13Å; A274-V278 PolarHBondContact O-N 2.88Å
275W95.3Very high93.5Very high159 Ų15948.9 Ų48.960%0.60226%0.257SS*.Hα-helixtrans-64-41.9175.5-173.1-127.4000112.7I54 G273 N277 V278 L279I54-W275 HydrophobicContact CD1-CB 4.21Å; I54-W275 HydrophobicContact CD1-CG 4.25Å; G273-W275 VanDerWaalsContact C-N 3.28Å; G273-W275 PolarHBondContact O-N 3.24Å; W275-N277 PolarHBondContact O-N 2.89Å; W275-V278 HydrophobicContact CE3-CB 4.03Å; W275-V278 HydrophobicContact CE3-CG1 4.23Å; W275-V278 HydrophobicContact CE3-CG2 4.4Å; W275-V278 HydrophobicContact CZ3-CB 4.18Å; W275-V278 HydrophobicContact CZ3-CG1 3.85Å; W275-V278 PolarHBondContact O-N 3.24Å; W275-V278 VanDerWaalsContact O-N 3.12Å; W275-L279 HydrophobicContact CD2-CG 4.48Å; W275-L279 HydrophobicContact CZ2-CD2 3.98Å; W275-L279 HydrophobicContact CZ2-CG 4.39Å; W275-L279 WeakPolarHBondContact O-CG 3.41Å; W275-L279 PolarHBondContact O-N 3.18Å
276S95.7Very high92.9Very high0 Ų052.4 Ų52.40%027%0.271CS..Hα-helixtrans-59.3-35.6172.3-530000112.2I29 I54 G273 R280I29-S276 WeakPolarHBondContact CG1-O 3.42Å; I54-S276 WeakPolarHBondContact CD1-OG 3.38Å; I54-S276 WeakPolarHBondContact CG1-OG 3.35Å; G273-S276 WeakPolarHBondContact O-CB 3.17Å; G273-S276 PolarHBondContact O-N 3.03Å; S276-R280 WeakPolarHBondContact O-CB 3Å; S276-R280 PolarHBondContact O-N 2.9Å
277N94.9Very high92.3Very high26 Ų2652.9 Ų52.914%0.13927%0.27CS..Hα-helixtrans-67.1-38.2175.5-176.575.2000112.7K33 Y229 G273 A274 W275 R280 G281K33-N277 HydrophobicContact CD-CB 3.84Å; K33-N277 HydrophobicContact CG-CB 4.28Å; K33-N277 PolarHBondContact NZ-OD1 2.81Å; Y229-N277 HydrophobicContact CD2-CB 4.49Å; Y229-N277 HydrophobicContact CE2-CB 3.69Å; G273-N277 PolarHBondContact O-N 3.41Å; A274-N277 VanDerWaalsContact O-CB 3.32Å; A274-N277 WeakPolarHBondContact O-CB 3.4Å; A274-N277 PolarHBondContact O-N 3.49Å; A274-N277 VanDerWaalsContact O-N 3.13Å; W275-N277 PolarHBondContact O-N 2.89Å; N277-R280 PolarHBondContact OD1-NH2 3.41Å; N277-G281 PolarHBondContact O-N 2.98Å; N277-G281 VanDerWaalsContact O-N 3.08Å
278V94.5Very high91.7Very high21 Ų2151.6 Ų51.613%0.12726%0.258CS..Hα-helixtrans-65-51.2174.7175.40000110.3A222 A274 W275 R280 G281 M282A222-V278 HydrophobicContact CB-CG1 4.38Å; A222-V278 HydrophobicContact CB-CG2 4.39Å; A274-V278 PolarHBondContact O-N 2.88Å; W275-V278 HydrophobicContact CE3-CB 4.03Å; W275-V278 HydrophobicContact CE3-CG1 4.23Å; W275-V278 HydrophobicContact CE3-CG2 4.4Å; W275-V278 HydrophobicContact CZ3-CB 4.18Å; W275-V278 HydrophobicContact CZ3-CG1 3.85Å; W275-V278 PolarHBondContact O-N 3.24Å; W275-V278 VanDerWaalsContact O-N 3.12Å; V278-R280 VanDerWaalsContact C-N 3.28Å; V278-R280 PolarHBondContact O-N 3.35Å; V278-G281 WeakPolarHBondContact O-CA 3.47Å; V278-G281 PolarHBondContact O-N 3.23Å; V278-M282 HydrophobicContact CG1-SD 4.09Å; V278-M282 PolarHBondContact O-N 3.49Å
279L92.9Very high90.8Very high63 Ų6346.5 Ų46.533%0.3324%0.242SC..Hα-helixtrans-56.9-41.2177.5-68.7176.7000112.2I29 W275 G281 M282 G283I29-L279 HydrophobicContact CD1-CD1 4.38Å; I29-L279 HydrophobicContact CG1-CB 4.17Å; W275-L279 HydrophobicContact CD2-CG 4.48Å; W275-L279 HydrophobicContact CZ2-CD2 3.98Å; W275-L279 HydrophobicContact CZ2-CG 4.39Å; W275-L279 WeakPolarHBondContact O-CG 3.41Å; W275-L279 PolarHBondContact O-N 3.18Å; L279-G281 VanDerWaalsContact C-N 3.34Å; L279-G281 PolarHBondContact O-N 3.42Å; L279-M282 PolarHBondContact O-N 2.88Å; L279-G283 PolarHBondContact O-N 2.91Å
280R92.5Very high89.9Confident69 Ų6950 Ų5026%0.2626%0.26SS..Hα-helixtrans-59.8-43.5173.3-177-170.562.570.15.2112.2V26 I29 E30 S276 N277 V278 G284V26-R280 HydrophobicContact CB-CG 3.92Å; V26-R280 HydrophobicContact CG2-CG 3.68Å; I29-R280 HydrophobicContact CG2-CB 3.86Å; I29-R280 HydrophobicContact CG2-CG 4.27Å; E30-R280 VanDerWaalsContact CD-CD 3.49Å; E30-R280 WeakPolarHBondContact OE2-CD 3.05Å; E30-R280 IonicContact OE2-NE 2.73Å; E30-R280 PolarHBondContact OE2-NE 2.92Å; S276-R280 WeakPolarHBondContact O-CB 3Å; S276-R280 PolarHBondContact O-N 2.9Å; N277-R280 PolarHBondContact OD1-NH2 3.41Å; V278-R280 VanDerWaalsContact C-N 3.28Å; V278-R280 PolarHBondContact O-N 3.35Å; R280-G284 PolarHBondContact O-N 2.98Å
281G88.9Confident88.9Confident25 Ų2552.2 Ų52.226%0.25827%0.268SS..Hα-helixtrans-60-48.3178.500000111.7N277 V278 L279 G284 A285N277-G281 PolarHBondContact O-N 2.98Å; N277-G281 VanDerWaalsContact O-N 3.08Å; V278-G281 WeakPolarHBondContact O-CA 3.47Å; V278-G281 PolarHBondContact O-N 3.23Å; L279-G281 VanDerWaalsContact C-N 3.34Å; L279-G281 PolarHBondContact O-N 3.42Å; G281-G284 PolarHBondContact O-N 2.91Å; G281-A285 PolarHBondContact O-N 3.11Å; G281-A285 VanDerWaalsContact O-N 3.12Å
282M88.6Confident88Confident76 Ų7652.4 Ų52.437%0.37427%0.273SS..Hα-helixtrans-62.2-49.2177.7-64.8172.768.500111.8V278 L279 G284 A285 F286V278-M282 HydrophobicContact CG1-SD 4.09Å; V278-M282 PolarHBondContact O-N 3.49Å; L279-M282 PolarHBondContact O-N 2.88Å; M282-G284 VanDerWaalsContact C-N 3.31Å; M282-G284 PolarHBondContact O-N 2.82Å; M282-A285 PolarHBondContact O-N 2.94Å; M282-F286 WeakPolarHBondContact O-CB 3.48Å; M282-F286 PolarHBondContact O-N 3.34Å
283G87.2Confident87.1Confident25 Ų2553.9 Ų53.926%0.25828%0.281SS..Hα-helixtrans-62-38.1178.800000112.8L279 F286 V287L279-G283 PolarHBondContact O-N 2.91Å; G283-F286 PolarHBondContact O-N 3.34Å; G283-V287 VanDerWaalsContact O-CG2 3.28Å; G283-V287 WeakPolarHBondContact O-CG2 3.46Å; G283-V287 PolarHBondContact O-N 3.06Å
284G85.2Confident86.2Confident11 Ų1158.5 Ų58.511%0.11330%0.303CS..Hα-helixtrans-66-41.4178.400000112.2S22 R280 G281 M282 L288S22-G284 PolarHBondContact OG-O 2.97Å; R280-G284 PolarHBondContact O-N 2.98Å; G281-G284 PolarHBondContact O-N 2.91Å; M282-G284 VanDerWaalsContact C-N 3.31Å; M282-G284 PolarHBondContact O-N 2.82Å; G284-L288 WeakPolarHBondContact O-CG 3.48Å; G284-L288 PolarHBondContact O-N 3.06Å
285A84.7Confident85.2Confident24 Ų2463.7 Ų63.720%0.19832%0.324CS..Hα-helixtrans-65.6-43.9175.300000111.7G281 M282 V287 L288 V289G281-A285 PolarHBondContact O-N 3.11Å; G281-A285 VanDerWaalsContact O-N 3.12Å; M282-A285 PolarHBondContact O-N 2.94Å; A285-V287 PolarHBondContact O-N 3.48Å; A285-L288 PolarHBondContact O-N 3.44Å; A285-V289 WeakPolarHBondContact O-CG2 3.45Å; A285-V289 PolarHBondContact O-N 3.38Å
286F83.9Confident84.3Confident121 Ų12162.8 Ų62.853%0.53132%0.324SS..Hα-helixtrans-59.3-45.3177.5-178.9-108.9000112.3M282 G283 L288 V289 L290M282-F286 WeakPolarHBondContact O-CB 3.48Å; M282-F286 PolarHBondContact O-N 3.34Å; G283-F286 PolarHBondContact O-N 3.34Å; F286-L288 VanDerWaalsContact C-N 3.32Å; F286-L288 PolarHBondContact O-N 3.46Å; F286-V289 PolarHBondContact O-N 3.49Å; F286-L290 HydrophobicContact CD1-CD1 3.84Å; F286-L290 HydrophobicContact CD1-CG 4.39Å; F286-L290 HydrophobicContact CE1-CD1 3.3Å; F286-L290 HydrophobicContact CE1-CG 4.04Å; F286-L290 HydrophobicContact CE2-CD1 4.39Å; F286-L290 HydrophobicContact CE2-CD2 4.43Å; F286-L290 HydrophobicContact CE2-CG 4.29Å; F286-L290 HydrophobicContact CZ-CD1 3.62Å; F286-L290 HydrophobicContact CZ-CD2 4.16Å; F286-L290 HydrophobicContact CZ-CG 3.98Å; F286-L290 WeakPolarHBondContact O-CG 3.42Å; F286-L290 PolarHBondContact O-N 2.88Å
287V83.4Confident83.5Confident30 Ų3071.3 Ų71.318%0.18236%0.361CS..Hα-helixtrans-63.3-37.6178.5173.60000112.1I21 A25 G283 A285 Y291I21-V287 HydrophobicContact CG2-CG1 4.16Å; A25-V287 HydrophobicContact CB-CG2 3.94Å; G283-V287 VanDerWaalsContact O-CG2 3.28Å; G283-V287 WeakPolarHBondContact O-CG2 3.46Å; G283-V287 PolarHBondContact O-N 3.06Å; A285-V287 PolarHBondContact O-N 3.48Å; V287-Y291 WeakPolarHBondContact O-CB 3.48Å; V287-Y291 PolarHBondContact O-N 3.2Å
288L81.8Confident82.4Confident72 Ų7278.2 Ų78.238%0.37740%0.404SS..Hα-helixtrans-67.5-42.5176.7-69.6173.5000111.7A18 G284 A285 F286 L290 Y291 D292A18-L288 HydrophobicContact CB-CD2 4.33Å; G284-L288 WeakPolarHBondContact O-CG 3.48Å; G284-L288 PolarHBondContact O-N 3.06Å; A285-L288 PolarHBondContact O-N 3.44Å; F286-L288 VanDerWaalsContact C-N 3.32Å; F286-L288 PolarHBondContact O-N 3.46Å; L288-L290 PolarHBondContact O-N 2.8Å; L288-Y291 WeakPolarHBondContact O-CB 3.32Å; L288-Y291 PolarHBondContact O-N 3.36Å; L288-D292 PolarHBondContact O-N 3.15Å
289V78.9Confident81.7Confident74 Ų7481.1 Ų81.145%0.44842%0.418SS..Hα-helixtrans-61.3-45.1175.5172.60000110.9A285 F286 Y291 D292 E293A285-V289 WeakPolarHBondContact O-CG2 3.45Å; A285-V289 PolarHBondContact O-N 3.38Å; F286-V289 PolarHBondContact O-N 3.49Å; V289-Y291 VanDerWaalsContact C-N 3.32Å; V289-Y291 PolarHBondContact O-N 3.15Å; V289-D292 PolarHBondContact O-N 3.29Å; V289-E293 WeakPolarHBondContact O-CB 3.34Å; V289-E293 PolarHBondContact O-N 2.92Å
290L77.2Confident81.2Confident76 Ų7682.1 Ų82.140%0.39842%0.423SS..Hα-helixtrans-61-40.7175.7-73.5-178.9000112.5F286 L288 E293 I294F286-L290 HydrophobicContact CD1-CD1 3.84Å; F286-L290 HydrophobicContact CD1-CG 4.39Å; F286-L290 HydrophobicContact CE1-CD1 3.3Å; F286-L290 HydrophobicContact CE1-CG 4.04Å; F286-L290 HydrophobicContact CE2-CD1 4.39Å; F286-L290 HydrophobicContact CE2-CD2 4.43Å; F286-L290 HydrophobicContact CE2-CG 4.29Å; F286-L290 HydrophobicContact CZ-CD1 3.62Å; F286-L290 HydrophobicContact CZ-CD2 4.16Å; F286-L290 HydrophobicContact CZ-CG 3.98Å; F286-L290 WeakPolarHBondContact O-CG 3.42Å; F286-L290 PolarHBondContact O-N 2.88Å; L288-L290 PolarHBondContact O-N 2.8Å; L290-E293 PolarHBondContact O-N 3.35Å; L290-I294 WeakPolarHBondContact O-CB 3.4Å; L290-I294 VanDerWaalsContact O-CG1 3.24Å; L290-I294 WeakPolarHBondContact O-CG1 3.24Å; L290-I294 PolarHBondContact O-N 2.9Å
291Y77Confident80.5Confident64 Ų6482.8 Ų82.825%0.25143%0.432SS..Hα-helixtrans-61.7-46.1176.6175.9-93.3000111.7A18 V287 L288 V289 E293 I294 K295A18-Y291 HydrophobicContact CB-CD1 3.91Å; A18-Y291 HydrophobicContact CB-CE1 3.76Å; A18-Y291 HydrophobicContact CB-CE2 4.39Å; A18-Y291 HydrophobicContact CB-CG 4.28Å; V287-Y291 WeakPolarHBondContact O-CB 3.48Å; V287-Y291 PolarHBondContact O-N 3.2Å; L288-Y291 WeakPolarHBondContact O-CB 3.32Å; L288-Y291 PolarHBondContact O-N 3.36Å; V289-Y291 VanDerWaalsContact C-N 3.32Å; V289-Y291 PolarHBondContact O-N 3.15Å; Y291-E293 VanDerWaalsContact C-N 3.27Å; Y291-E293 PolarHBondContact O-N 2.94Å; Y291-I294 PolarHBondContact O-N 2.92Å; Y291-K295 HydrophobicContact CE1-CD 4.45Å; Y291-K295 WeakPolarHBondContact O-CB 3.36Å; Y291-K295 PolarHBondContact O-N 3.28Å
292D77.9Confident80Confident93 Ų9386.2 Ų86.250%0.49744%0.442SS..Hα-helixtrans-63.2-36.8177.2-70.4-22.2000111.4L288 V289 K295 K296L288-D292 PolarHBondContact O-N 3.15Å; V289-D292 PolarHBondContact O-N 3.29Å; D292-K295 PolarHBondContact O-N 3.46Å; D292-K296 PolarHBondContact O-N 2.94Å
293E77.5Confident79.5Confident85 Ų8586.8 Ų86.840%0.39745%0.446SS..Hα-helixtrans-69.5-43.6177.6-142.263-165.300112V289 L290 Y291 K295 K296 F297V289-E293 WeakPolarHBondContact O-CB 3.34Å; V289-E293 PolarHBondContact O-N 2.92Å; L290-E293 PolarHBondContact O-N 3.35Å; Y291-E293 VanDerWaalsContact C-N 3.27Å; Y291-E293 PolarHBondContact O-N 2.94Å; E293-K295 VanDerWaalsContact C-N 3.29Å; E293-K295 PolarHBondContact O-N 3.34Å; E293-K296 WeakPolarHBondContact O-CB 3.46Å; E293-K296 PolarHBondContact O-N 2.93Å; E293-K296 VanDerWaalsContact O-N 3.16Å; E293-K296 IonicContact OE1-NZ 3.03Å; E293-K296 PolarHBondContact OE1-NZ 3.15Å; E293-K296 WeakPolarHBondContact OE2-CE 3.25Å; E293-K296 IonicContact OE2-NZ 3.11Å; E293-K296 PolarHBondContact OE2-NZ 3.17Å; E293-F297 WeakPolarHBondContact O-CD2 3.37Å; E293-F297 WeakPolarHBondContact O-CE2 3.48Å
294I76Confident79Confident107 Ų10790.9 Ų90.955%0.54946%0.459SS..Hα-helixtrans-61.5-40.3174.6-69164.5000110.6L290 Y291 K296 F297L290-I294 WeakPolarHBondContact O-CB 3.4Å; L290-I294 VanDerWaalsContact O-CG1 3.24Å; L290-I294 WeakPolarHBondContact O-CG1 3.24Å; L290-I294 PolarHBondContact O-N 2.9Å; Y291-I294 PolarHBondContact O-N 2.92Å; I294-K296 PolarHBondContact O-N 3.2Å; I294-F297 PolarHBondContact O-N 2.77Å
295K75.7Confident78.6Confident117 Ų11796.6 Ų96.651%0.50948%0.483SS..Hα-helixtrans-61.6-22.6178.3-171.5-179.9175.8-171.80113Y291 D292 E293 F297Y291-K295 HydrophobicContact CE1-CD 4.45Å; Y291-K295 WeakPolarHBondContact O-CB 3.36Å; Y291-K295 PolarHBondContact O-N 3.28Å; D292-K295 PolarHBondContact O-N 3.46Å; E293-K295 VanDerWaalsContact C-N 3.29Å; E293-K295 PolarHBondContact O-N 3.34Å; K295-F297 PolarHBondContact O-N 3.45Å
296K76.6Confident78.1Confident140 Ų140102.2 Ų102.261%0.60951%0.505SS*.THydrogen-bonded Turntrans-70.8-19.5173.9-66170.4-178.2167.90113.2D292 E293 I294D292-K296 PolarHBondContact O-N 2.94Å; E293-K296 WeakPolarHBondContact O-CB 3.46Å; E293-K296 PolarHBondContact O-N 2.93Å; E293-K296 VanDerWaalsContact O-N 3.16Å; E293-K296 IonicContact OE1-NZ 3.03Å; E293-K296 PolarHBondContact OE1-NZ 3.15Å; E293-K296 WeakPolarHBondContact OE2-CE 3.25Å; E293-K296 IonicContact OE2-NZ 3.11Å; E293-K296 PolarHBondContact OE2-NZ 3.17Å; I294-K296 PolarHBondContact O-N 3.2Å
297F78.1Confident77.6Confident178 Ų178100.7 Ų100.778%0.78150%0.503SS*.THydrogen-bonded Turntrans-99.7-1.6-177.8-61.8-80.5000113.8E293 I294 K295E293-F297 WeakPolarHBondContact O-CD2 3.37Å; E293-F297 WeakPolarHBondContact O-CE2 3.48Å; I294-F297 PolarHBondContact O-N 2.77Å; K295-F297 PolarHBondContact O-N 3.45Å
298V71.1Confident77.1Confident172 Ų172107.1 Ų107.1100%1.04253%0.533SS*.  trans-116.60178.9-176.10000109.3

Retrieved 298 of 298 residues in 113.8 ms (Link to these results)