IPO7_HUMAN Loading...

Importin-7

Functions in nuclear protein import, either by acting as autonomous nuclear transport receptor or as an adapter-like protein in association with the importin-beta subunit KPNB1. Acting autonomously, is thought to serve itself as receptor for nuclear localization signals (NLS) and to promote translocation of import substrates through the nuclear pore complex (NPC) by an energy requiring, Ran-dependent mechanism. At the nucleoplasmic side of the NPC, Ran binds to importin, the importin/substrate complex dissociates and importin is re-exported from the nucleus to the cytoplasm where GTP hydrolysis releases Ran. The directionality of nuclear import is thought to be conferred by an asymmetric distribution of the GTP- and GDP-bound forms of Ran between the cytoplasm and nucleus. Mediates autonomously the nuclear import of ribosomal proteins RPL23A, RPS7 and RPL51. In association with KPNB1 mediates the nuclear import of H1 histone and the Ran-binding site of IPO7 is not required but synergizes with that of KPNB1 in importin/substrate complex dissociation. Promotes odontoblast differentiation via promoting nuclear translocation of DLX3, KLF4, SMAD2, thereby facilitating the transcription of target genes that play a role in odontoblast differentiation (By similarity). Facilitates BMP4-induced translocation of SMAD1 to the nucleus and recruitment to the MSX1 gene promoter, thereby promotes the expression of the odontogenic regulator MSX1 in dental mesenchymal cells (By similarity). Also promotes odontoblast differentiation by facilitating the nuclear translocation of HDAC6 and subsequent repression of RUNX2 expression (By similarity). Inhibits osteoblast differentiation by inhibiting nuclear translocation of RUNX2 and therefore inhibition of RUNX2 target gene transcription (By similarity). In vitro, mediates nuclear import of H2A, H2B, H3 and H4 histones. (Microbial infection) Mediates the nuclear import of HIV-1 reverse transcription complex (RTC) integrase. Binds and mediates the nuclear import of HIV-1 Rev.

AlphaFold DB , UniProt , Accession O95373, Species HUMAN (Homo sapiens, Human), Gene IPO7, Length 1,038 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M63.9Low86.5Confident117 Ų11761.5 Ų61.558%0.57631%0.308SS*.  0161.30-136.2-175.9-157.400108.7I6 A29M1-I6 HydrophobicContact CB-CD1 4.45Å; M1-I6 HydrophobicContact SD-CG1 4.2Å; M1-A29 HydrophobicContact CE-CB 3.66Å; M1-A29 HydrophobicContact SD-CB 3.51Å; M1-A29 VanDerWaalsContact SD-CB 3.51Å
2D79.7Confident86.8Confident85 Ų8556.8 Ų56.846%0.45529%0.286SS..  trans-71.2125.6170.3-179.6-3.1000109.1N4 T5D2-N4 PolarHBondContact O-N 3.3Å; D2-N4 VanDerWaalsContact O-N 3.13Å; D2-N4 PolarHBondContact OD1-N 3.15Å; D2-N4 VanDerWaalsContact OD1-N 3.09Å; D2-N4 PolarHBondContact OD1-ND2 3.46Å; D2-N4 VanDerWaalsContact OD1-ND2 3.13Å; D2-T5 WeakPolarHBondContact O-CB 3.36Å; D2-T5 PolarHBondContact O-N 3.02Å
3P84.8Confident86.9Confident54 Ų5454.5 Ų54.535%0.35128%0.277SS..Hα-helixtrans-51.1-32.2176.3-28.334.9000114.1T5 I6 I7 T38P3-T5 VanDerWaalsContact C-N 3.31Å; P3-T5 PolarHBondContact O-N 2.93Å; P3-I6 PolarHBondContact O-N 3.25Å; P3-I7 WeakPolarHBondContact O-CD1 3.23Å; P3-I7 VanDerWaalsContact O-CG1 3.31Å; P3-I7 WeakPolarHBondContact O-CG1 3.42Å; P3-I7 PolarHBondContact O-N 3.02Å; P3-T38 HydrophobicContact CB-CG2 4.12Å; P3-T38 HydrophobicContact CG-CG2 3.99Å
4N88.2Confident86.9Confident97 Ų9757.3 Ų57.352%0.51929%0.29SS..Hα-helixtrans-63.3-36.6179.1-65.9-53.8000112.7D2 I6 I7 E8D2-N4 PolarHBondContact O-N 3.3Å; D2-N4 VanDerWaalsContact O-N 3.13Å; D2-N4 PolarHBondContact OD1-N 3.15Å; D2-N4 VanDerWaalsContact OD1-N 3.09Å; D2-N4 PolarHBondContact OD1-ND2 3.46Å; D2-N4 VanDerWaalsContact OD1-ND2 3.13Å; N4-I6 VanDerWaalsContact C-N 3.32Å; N4-I6 PolarHBondContact O-N 3.01Å; N4-I7 PolarHBondContact O-N 3.34Å; N4-E8 WeakPolarHBondContact O-CG 3.27Å; N4-E8 PolarHBondContact O-N 3.19Å
5T88Confident86.8Confident40 Ų4058.3 Ų58.325%0.24530%0.297CS..Hα-helixtrans-65.1-38.6177.8-51.40000111.5D2 P3 A9D2-T5 WeakPolarHBondContact O-CB 3.36Å; D2-T5 PolarHBondContact O-N 3.02Å; P3-T5 VanDerWaalsContact C-N 3.31Å; P3-T5 PolarHBondContact O-N 2.93Å; T5-A9 WeakPolarHBondContact O-CB 3.16Å; T5-A9 PolarHBondContact O-N 3.27Å
6I90.2Very high86.5Confident3 Ų362.1 Ų62.12%0.01533%0.326CS..Hα-helixtrans-68.1-41.4176.4-58.2173.7000109.9M1 P3 N4 E8 A9 L10 L26 F35 T38 L39 I42M1-I6 HydrophobicContact CB-CD1 4.45Å; M1-I6 HydrophobicContact SD-CG1 4.2Å; P3-I6 PolarHBondContact O-N 3.25Å; N4-I6 VanDerWaalsContact C-N 3.32Å; N4-I6 PolarHBondContact O-N 3.01Å; I6-E8 PolarHBondContact O-N 2.64Å; I6-A9 PolarHBondContact O-N 3.23Å; I6-L10 HydrophobicContact CG2-CD1 4.08Å; I6-L10 HydrophobicContact CG2-CG 4.33Å; I6-L10 WeakPolarHBondContact O-CB 3.46Å; I6-L10 VanDerWaalsContact O-CG 3.29Å; I6-L10 WeakPolarHBondContact O-CG 3.49Å; I6-L10 PolarHBondContact O-N 3.47Å; I6-L26 HydrophobicContact CG2-CD2 4.22Å; I6-F35 HydrophobicContact CD1-CD2 3.77Å; I6-F35 HydrophobicContact CD1-CE2 3.74Å; I6-F35 HydrophobicContact CG1-CE2 4.05Å; I6-F35 HydrophobicContact CG2-CE2 4.42Å; I6-T38 HydrophobicContact CD1-CG2 3.86Å; I6-L39 HydrophobicContact CG2-CD2 3.75Å; I6-I42 HydrophobicContact CB-CD1 3.73Å; I6-I42 HydrophobicContact CD1-CD1 4.39Å; I6-I42 HydrophobicContact CG2-CD1 3.6Å
7I91.8Very high86.4Confident22 Ų2263.6 Ų63.611%0.11335%0.35CS..Hα-helixtrans-61.1-43.9177-68.6160.9000111.4P3 N4 L10 R11 I42 L48 V52P3-I7 WeakPolarHBondContact O-CD1 3.23Å; P3-I7 VanDerWaalsContact O-CG1 3.31Å; P3-I7 WeakPolarHBondContact O-CG1 3.42Å; P3-I7 PolarHBondContact O-N 3.02Å; N4-I7 PolarHBondContact O-N 3.34Å; I7-L10 PolarHBondContact O-N 2.79Å; I7-R11 WeakPolarHBondContact O-CG 3.39Å; I7-R11 PolarHBondContact O-N 3.02Å; I7-I42 HydrophobicContact CD1-CG1 4.37Å; I7-I42 HydrophobicContact CG1-CD1 4.03Å; I7-I42 HydrophobicContact CG1-CG1 4.09Å; I7-I42 HydrophobicContact CG1-CG2 4Å; I7-L48 HydrophobicContact CD1-CD1 3.93Å; I7-L48 HydrophobicContact CD1-CD2 4.05Å; I7-L48 HydrophobicContact CG1-CD1 3.96Å; I7-L48 HydrophobicContact CG1-CD2 4.43Å; I7-L48 HydrophobicContact CG2-CD2 4.01Å; I7-V52 HydrophobicContact CG2-CG1 4.27Å
8E90.8Very high86.4Confident134 Ų13465.2 Ų65.263%0.62636%0.357SS*.Hα-helixtrans-64.7-41.8176.4-74.2-177.617100111.9N4 I6 R11 G12N4-E8 WeakPolarHBondContact O-CG 3.27Å; N4-E8 PolarHBondContact O-N 3.19Å; I6-E8 PolarHBondContact O-N 2.64Å; E8-R11 WeakPolarHBondContact O-CB 3.32Å; E8-R11 PolarHBondContact O-N 2.98Å; E8-G12 PolarHBondContact O-N 3.41Å
9A90.6Very high86.4Confident3 Ų369.2 Ų69.23%0.02537%0.366CS..Hα-helixtrans-63.3-46.7175.400000111.3T5 I6 R11 G12 T13 A22 Q25 L26T5-A9 WeakPolarHBondContact O-CB 3.16Å; T5-A9 PolarHBondContact O-N 3.27Å; I6-A9 PolarHBondContact O-N 3.23Å; A9-R11 VanDerWaalsContact C-N 3.28Å; A9-R11 PolarHBondContact O-N 2.83Å; A9-G12 CarbonylContact O-C 3.59Å; A9-G12 WeakPolarHBondContact O-CA 3.37Å; A9-G12 PolarHBondContact O-N 3.49Å; A9-T13 WeakPolarHBondContact O-CG2 3.46Å; A9-T13 PolarHBondContact O-N 2.86Å; A9-A22 VanDerWaalsContact O-CB 3.24Å; A9-A22 WeakPolarHBondContact O-CB 3.46Å; A9-Q25 HydrophobicContact CB-CG 4.49Å; A9-L26 HydrophobicContact CB-CD1 4.47Å; A9-L26 HydrophobicContact CB-CD2 3.86Å; A9-L26 HydrophobicContact CB-CG 3.88Å
10L91.6Very high86.2Confident1 Ų172.1 Ų72.11%0.00538%0.378CS..Hα-helixtrans-58.4-39.2174.8-70.8172.4000112I6 I7 T13 L26 L39 I42 V52 A55I6-L10 HydrophobicContact CG2-CD1 4.08Å; I6-L10 HydrophobicContact CG2-CG 4.33Å; I6-L10 WeakPolarHBondContact O-CB 3.46Å; I6-L10 VanDerWaalsContact O-CG 3.29Å; I6-L10 WeakPolarHBondContact O-CG 3.49Å; I6-L10 PolarHBondContact O-N 3.47Å; I7-L10 PolarHBondContact O-N 2.79Å; L10-T13 PolarHBondContact O-N 3.14Å; L10-T13 PolarHBondContact O-OG1 3.24Å; L10-L26 HydrophobicContact CD2-CD1 4.05Å; L10-L26 HydrophobicContact CD2-CD2 4.42Å; L10-L39 HydrophobicContact CD1-CD2 4.2Å; L10-I42 HydrophobicContact CD1-CG2 3.98Å; L10-V52 HydrophobicContact CB-CG1 4.23Å; L10-A55 HydrophobicContact CB-CB 4.44Å; L10-A55 HydrophobicContact CD2-CB 4.28Å
11R91.5Very high86.2Confident120 Ų12071.7 Ų71.745%0.45339%0.385SS..Hα-helixtrans-61.7-43.3171.7-79.1177.5173.1-173-5112.3I7 E8 A9 T13 M14 D49 V52I7-R11 WeakPolarHBondContact O-CG 3.39Å; I7-R11 PolarHBondContact O-N 3.02Å; E8-R11 WeakPolarHBondContact O-CB 3.32Å; E8-R11 PolarHBondContact O-N 2.98Å; A9-R11 VanDerWaalsContact C-N 3.28Å; A9-R11 PolarHBondContact O-N 2.83Å; R11-T13 VanDerWaalsContact C-N 3.26Å; R11-T13 PolarHBondContact O-N 3.44Å; R11-M14 HydrophobicContact CG-CE 4.36Å; R11-M14 PolarHBondContact O-N 3.46Å; R11-D49 IonicContact NH2-OD2 3.19Å; R11-D49 PolarHBondContact NH2-OD2 2.79Å; R11-V52 HydrophobicContact CG-CG1 4.31Å; R11-V52 HydrophobicContact CG-CG2 3.54Å
12G90.1Very high87.3Confident5 Ų566.3 Ų66.35%0.05236%0.359CS..Hα-helixtrans-62-29.9177.100000113.7E8 A9 M14 D15 L18 R19E8-G12 PolarHBondContact O-N 3.41Å; A9-G12 CarbonylContact O-C 3.59Å; A9-G12 WeakPolarHBondContact O-CA 3.37Å; A9-G12 PolarHBondContact O-N 3.49Å; G12-M14 PolarHBondContact O-N 3.38Å; G12-D15 PolarHBondContact O-N 3.23Å; G12-D15 VanDerWaalsContact O-N 3.14Å; G12-D15 VanDerWaalsContact O-O 3.1Å; G12-L18 CarbonylContact O-C 3.56Å; G12-R19 WeakPolarHBondContact O-CA 3.32Å; G12-R19 PolarHBondContact O-N 3.09Å
13T88.4Confident87.7Confident28 Ų2866.1 Ų66.117%0.17236%0.356CS..THydrogen-bonded Turntrans-65.5-19.6176.365.60000114A9 L10 R11 A22 E23 L26A9-T13 WeakPolarHBondContact O-CG2 3.46Å; A9-T13 PolarHBondContact O-N 2.86Å; L10-T13 PolarHBondContact O-N 3.14Å; L10-T13 PolarHBondContact O-OG1 3.24Å; R11-T13 VanDerWaalsContact C-N 3.26Å; R11-T13 PolarHBondContact O-N 3.44Å; T13-A22 HydrophobicContact CG2-CB 3.87Å; T13-E23 HydrophobicContact CG2-CG 4.29Å; T13-L26 HydrophobicContact CG2-CD1 3.62Å
14M86.4Confident87.7Confident93 Ų9371 Ų7146%0.45837%0.367SS..THydrogen-bonded Turntrans-92.4-11.3177.4-55.7-175.6-65.600112.9R11 G12 P51 V52R11-M14 HydrophobicContact CG-CE 4.36Å; R11-M14 PolarHBondContact O-N 3.46Å; G12-M14 PolarHBondContact O-N 3.38Å; M14-P51 HydrophobicContact CE-CB 4.14Å; M14-P51 HydrophobicContact SD-CB 3.62Å; M14-V52 HydrophobicContact CE-CG2 3.89Å
15D85.5Confident87.7Confident72 Ų7270 Ų7039%0.38536%0.359SS..SBendtrans-101.3116.1178.1-175.5-20.4000109.3G12 A17 L18 R19G12-D15 PolarHBondContact O-N 3.23Å; G12-D15 VanDerWaalsContact O-N 3.14Å; G12-D15 VanDerWaalsContact O-O 3.1Å; D15-A17 PolarHBondContact O-N 3Å; D15-A17 WeakPolarHBondContact OD1-CB 3.46Å; D15-A17 PolarHBondContact OD1-N 3.24Å; D15-L18 HydrophobicContact CB-CB 4.24Å; D15-L18 HydrophobicContact CB-CD1 4.34Å; D15-L18 HydrophobicContact CB-CG 4.4Å; D15-L18 PolarHBondContact O-N 3.33Å; D15-R19 PolarHBondContact O-N 3.17Å
16P82Confident87.7Confident119 Ų11968.1 Ų68.177%0.77335%0.348SS*.THydrogen-bonded Turntrans-51.4-31.9178.9-27.134.5000114.1L18P16-L18 VanDerWaalsContact C-N 3.35Å
17A85.6Confident87.4Confident88 Ų8872.1 Ų72.173%0.72737%0.369SS*.THydrogen-bonded Turntrans-76.2-20.9-179.700000113.7D15D15-A17 PolarHBondContact O-N 3Å; D15-A17 WeakPolarHBondContact OD1-CB 3.46Å; D15-A17 PolarHBondContact OD1-N 3.24Å
18L85.7Confident87Confident92 Ų9278.5 Ų78.548%0.48240%0.399SS..THydrogen-bonded Turntrans-112.3-10.4-176.1-61.6176.6000113.3G12 D15 P16 E20 A21 A22G12-L18 CarbonylContact O-C 3.56Å; D15-L18 HydrophobicContact CB-CB 4.24Å; D15-L18 HydrophobicContact CB-CD1 4.34Å; D15-L18 HydrophobicContact CB-CG 4.4Å; D15-L18 PolarHBondContact O-N 3.33Å; P16-L18 VanDerWaalsContact C-N 3.35Å; L18-E20 PolarHBondContact O-N 3.43Å; L18-A21 PolarHBondContact O-N 3.48Å; L18-A21 VanDerWaalsContact O-N 3.15Å; L18-A22 WeakPolarHBondContact O-CB 3.47Å; L18-A22 PolarHBondContact O-N 3.3Å
19R86Confident86.6Confident141 Ų14172.4 Ų72.453%0.53237%0.371SS..Hα-helixtrans-51.8-55.1-170.5-169.1175.8-162.7159.19113.9G12 D15 A21 A22 E23G12-R19 WeakPolarHBondContact O-CA 3.32Å; G12-R19 PolarHBondContact O-N 3.09Å; D15-R19 PolarHBondContact O-N 3.17Å; R19-A21 VanDerWaalsContact C-N 3.32Å; R19-A21 PolarHBondContact O-N 2.75Å; R19-A22 PolarHBondContact O-N 3.47Å; R19-E23 HydrophobicContact CG-CG 4.46Å; R19-E23 WeakPolarHBondContact CG-OE1 3.37Å; R19-E23 IonicContact NE-OE1 2.96Å; R19-E23 PolarHBondContact NE-OE1 3.08Å; R19-E23 WeakPolarHBondContact O-CB 3.42Å; R19-E23 WeakPolarHBondContact O-CG 3.41Å; R19-E23 PolarHBondContact O-N 2.97Å
20E83.2Confident86.2Confident128 Ų12872.8 Ų72.860%0.59837%0.372SS*.Hα-helixtrans-59.9-41.7-179.6-75.4-171.4-163.300112.7L18 R24L18-E20 PolarHBondContact O-N 3.43Å; E20-R24 WeakPolarHBondContact O-CG 3.3Å; E20-R24 PolarHBondContact O-N 3.11Å; E20-R24 IonicContact OE2-CZ 3.97Å; E20-R24 IonicContact OE2-NH2 2.68Å; E20-R24 PolarHBondContact OE2-NH2 3.34Å
21A86.5Confident85.7Confident63 Ų6379.5 Ų79.552%0.52140%0.401SS..Hα-helixtrans-68-41.3-179.400000111L18 R19 Q25L18-A21 PolarHBondContact O-N 3.48Å; L18-A21 VanDerWaalsContact O-N 3.15Å; R19-A21 VanDerWaalsContact C-N 3.32Å; R19-A21 PolarHBondContact O-N 2.75Å; A21-Q25 WeakPolarHBondContact O-CB 3.44Å; A21-Q25 PolarHBondContact O-N 3.09Å
22A87.3Confident85.3Confident5 Ų575.6 Ų75.64%0.04139%0.392CS..Hα-helixtrans-65.1-44176.200000112.5A9 T13 L18 R19 Q25 L26A9-A22 VanDerWaalsContact O-CB 3.24Å; A9-A22 WeakPolarHBondContact O-CB 3.46Å; T13-A22 HydrophobicContact CG2-CB 3.87Å; L18-A22 WeakPolarHBondContact O-CB 3.47Å; L18-A22 PolarHBondContact O-N 3.3Å; R19-A22 PolarHBondContact O-N 3.47Å; A22-Q25 PolarHBondContact O-N 3.29Å; A22-L26 WeakPolarHBondContact O-CG 3.45Å; A22-L26 PolarHBondContact O-N 2.95Å
23E86.6Confident84.9Confident81 Ų8180 Ų8038%0.37941%0.414SS..Hα-helixtrans-64-42.7177.4-75.3175.1-174.700111.5T13 R19 Q25 L26 N27T13-E23 HydrophobicContact CG2-CG 4.29Å; R19-E23 HydrophobicContact CG-CG 4.46Å; R19-E23 WeakPolarHBondContact CG-OE1 3.37Å; R19-E23 IonicContact NE-OE1 2.96Å; R19-E23 PolarHBondContact NE-OE1 3.08Å; R19-E23 WeakPolarHBondContact O-CB 3.42Å; R19-E23 WeakPolarHBondContact O-CG 3.41Å; R19-E23 PolarHBondContact O-N 2.97Å; E23-Q25 VanDerWaalsContact C-N 3.32Å; E23-Q25 PolarHBondContact O-N 3.06Å; E23-L26 PolarHBondContact O-N 2.99Å; E23-N27 VanDerWaalsContact O-CB 3.29Å; E23-N27 WeakPolarHBondContact O-CB 3.49Å; E23-N27 PolarHBondContact O-N 3.32Å; E23-N27 PolarHBondContact O-ND2 3.41Å
24R85.7Confident84.8Confident155 Ų15581.8 Ų81.859%0.58542%0.423SS*.Hα-helixtrans-59.2-44172.1-74.4-179-162.8147.517111.6E20 N27 E28E20-R24 WeakPolarHBondContact O-CG 3.3Å; E20-R24 PolarHBondContact O-N 3.11Å; E20-R24 IonicContact OE2-CZ 3.97Å; E20-R24 IonicContact OE2-NH2 2.68Å; E20-R24 PolarHBondContact OE2-NH2 3.34Å; R24-N27 PolarHBondContact O-N 3.25Å; R24-E28 WeakPolarHBondContact O-CG 3.42Å; R24-E28 PolarHBondContact O-N 3.48Å
25Q87.2Confident85Confident76 Ų7677.4 Ų77.436%0.35540%0.401SS..Hα-helixtrans-64.6-41.1179.9-169.8175.59.700112.5A9 A21 A22 E23 E28 A29A9-Q25 HydrophobicContact CB-CG 4.49Å; A21-Q25 WeakPolarHBondContact O-CB 3.44Å; A21-Q25 PolarHBondContact O-N 3.09Å; A22-Q25 PolarHBondContact O-N 3.29Å; E23-Q25 VanDerWaalsContact C-N 3.32Å; E23-Q25 PolarHBondContact O-N 3.06Å; Q25-E28 PolarHBondContact O-N 3.11Å; Q25-A29 VanDerWaalsContact O-CB 3.25Å; Q25-A29 WeakPolarHBondContact O-CB 3.5Å; Q25-A29 PolarHBondContact O-N 2.99Å
26L88.2Confident85.3Confident1 Ų174 Ų741%0.00538%0.383CS..Hα-helixtrans-66.8-38.9174.3-69.1169.9000111.5I6 A9 L10 T13 A22 E23 E28 A29 H30 F35 Y59I6-L26 HydrophobicContact CG2-CD2 4.22Å; A9-L26 HydrophobicContact CB-CD1 4.47Å; A9-L26 HydrophobicContact CB-CD2 3.86Å; A9-L26 HydrophobicContact CB-CG 3.88Å; L10-L26 HydrophobicContact CD2-CD1 4.05Å; L10-L26 HydrophobicContact CD2-CD2 4.42Å; T13-L26 HydrophobicContact CG2-CD1 3.62Å; A22-L26 WeakPolarHBondContact O-CG 3.45Å; A22-L26 PolarHBondContact O-N 2.95Å; E23-L26 PolarHBondContact O-N 2.99Å; L26-E28 VanDerWaalsContact C-N 3.34Å; L26-E28 PolarHBondContact O-N 3.06Å; L26-A29 PolarHBondContact O-N 3.49Å; L26-H30 PolarHBondContact O-N 3.43Å; L26-F35 HydrophobicContact CD2-CZ 4.27Å; L26-Y59 HydrophobicContact CB-CE2 3.67Å; L26-Y59 HydrophobicContact CD1-CD2 3.95Å; L26-Y59 HydrophobicContact CD1-CE2 3.86Å; L26-Y59 HydrophobicContact CG-CE2 4.31Å; L26-Y59 PolarHBondContact O-OH 3.17Å
27N83.8Confident85.8Confident87 Ų8768.7 Ų68.747%0.46535%0.349SS..Hα-helixtrans-67.3-30.8175.8-80.2-26.2000113.1E23 R24 H30 Y59E23-N27 VanDerWaalsContact O-CB 3.29Å; E23-N27 WeakPolarHBondContact O-CB 3.49Å; E23-N27 PolarHBondContact O-N 3.32Å; E23-N27 PolarHBondContact O-ND2 3.41Å; R24-N27 PolarHBondContact O-N 3.25Å; N27-H30 PolarHBondContact O-CE1 3.45Å; N27-H30 PolarHBondContact O-ND1 2.94Å; N27-Y59 PolarHBondContact OD1-OH 2.95Å
28E83.6Confident86.1Confident157 Ų15765.4 Ų65.473%0.73432%0.32SS*.Hα-helixtrans-75.3-36170.6-71.9177.6-176.100111.6R24 Q25 L26R24-E28 WeakPolarHBondContact O-CG 3.42Å; R24-E28 PolarHBondContact O-N 3.48Å; Q25-E28 PolarHBondContact O-N 3.11Å; L26-E28 VanDerWaalsContact C-N 3.34Å; L26-E28 PolarHBondContact O-N 3.06Å
29A82.7Confident86.5Confident5 Ų561 Ų614%0.04130%0.297CS..Hα-helixtrans-74.3-31-176.200000114.2M1 Q25 L26 K31 S32 F35M1-A29 HydrophobicContact CE-CB 3.66Å; M1-A29 HydrophobicContact SD-CB 3.51Å; M1-A29 VanDerWaalsContact SD-CB 3.51Å; Q25-A29 VanDerWaalsContact O-CB 3.25Å; Q25-A29 WeakPolarHBondContact O-CB 3.5Å; Q25-A29 PolarHBondContact O-N 2.99Å; L26-A29 PolarHBondContact O-N 3.49Å; A29-K31 PolarHBondContact O-N 3.34Å; A29-K31 VanDerWaalsContact O-N 3.09Å; A29-S32 WeakPolarHBondContact O-CB 3.49Å; A29-S32 PolarHBondContact O-N 3.31Å; A29-S32 PolarHBondContact O-OG 2.85Å; A29-F35 HydrophobicContact CB-CD2 4.01Å; A29-F35 HydrophobicContact CB-CE2 3.57Å; A29-F35 HydrophobicContact CB-CZ 4.33Å; A29-F35 WeakPolarHBondContact O-CD2 3.39Å
30H82.9Confident87Confident12 Ų1254.9 Ų54.96%0.05627%0.274CS..THydrogen-bonded Turntrans-63-24.3-168.579.4-90.4000114.2L26 N27 S32 F35 M63 Y81L26-H30 PolarHBondContact O-N 3.43Å; N27-H30 PolarHBondContact O-CE1 3.45Å; N27-H30 PolarHBondContact O-ND1 2.94Å; H30-S32 PolarHBondContact O-N 3.12Å; H30-F35 HydrophobicContact CB-CD1 3.95Å; H30-F35 HydrophobicContact CB-CE1 3.72Å; H30-F35 HydrophobicContact CB-CZ 4.29Å; H30-M63 HydrophobicContact CB-CE 4.04Å; H30-M63 HydrophobicContact CB-SD 3.71Å; H30-Y81 AromaticContact CD2-CD1 3.94Å; H30-Y81 AromaticContact CD2-CE1 3.7Å; H30-Y81 PolarHBondContact O-OH 2.63Å
31K81.8Confident87.5Confident141 Ų14154.9 Ų54.961%0.61327%0.274SS*.THydrogen-bonded Turntrans-76.1-6.4177.3-61.8-175.3179.71790113.8A29 Y81A29-K31 PolarHBondContact O-N 3.34Å; A29-K31 VanDerWaalsContact O-N 3.09Å; K31-Y81 HydrophobicContact CB-CE2 4.26Å; K31-Y81 HydrophobicContact CG-CD2 4.1Å; K31-Y81 HydrophobicContact CG-CE2 4.22Å
32S83.1Confident87.8Confident38 Ų3852.2 Ų52.227%0.26625%0.251SS..SBendtrans-76.2142.8179.2660000112.1A29 H30 F35A29-S32 WeakPolarHBondContact O-CB 3.49Å; A29-S32 PolarHBondContact O-N 3.31Å; A29-S32 PolarHBondContact O-OG 2.85Å; H30-S32 PolarHBondContact O-N 3.12Å; S32-F35 VanDerWaalsContact O-CB 3.25Å; S32-F35 WeakPolarHBondContact O-CB 3.5Å; S32-F35 PolarHBondContact O-N 2.86Å
33L79.9Confident88.2Confident97 Ų9752 Ų5251%0.50825%0.249SC..THydrogen-bonded Turntrans-59.2140.2174.3-16085.8000110F35 P84L33-F35 PolarHBondContact O-N 2.8Å; L33-P84 HydrophobicContact CD1-CB 4.15Å; L33-P84 HydrophobicContact CD1-CG 4.23Å
34N86.9Confident88.6Confident66 Ų6650.4 Ų50.435%0.35324%0.243SC..THydrogen-bonded Turntrans71.17.2-179.1-56.3-47.1000115.3T38 D87N34-T38 WeakPolarHBondContact O-CB 3.39Å; N34-T38 PolarHBondContact O-N 2.88Å; N34-T38 PolarHBondContact O-OG1 2.91Å; N34-D87 WeakPolarHBondContact CA-OD1 3.44Å; N34-D87 WeakPolarHBondContact CA-OD2 3.45Å; N34-D87 PolarHBondContact N-OD2 2.86Å
35F90.7Very high89Confident2 Ų244.7 Ų44.71%0.00923%0.226CC..Hα-helixtrans-63.3-48.2-178.8179.9-97.7000111.9I6 L26 A29 H30 S32 L33 S37 T38 L39 Y59I6-F35 HydrophobicContact CD1-CD2 3.77Å; I6-F35 HydrophobicContact CD1-CE2 3.74Å; I6-F35 HydrophobicContact CG1-CE2 4.05Å; I6-F35 HydrophobicContact CG2-CE2 4.42Å; L26-F35 HydrophobicContact CD2-CZ 4.27Å; A29-F35 HydrophobicContact CB-CD2 4.01Å; A29-F35 HydrophobicContact CB-CE2 3.57Å; A29-F35 HydrophobicContact CB-CZ 4.33Å; A29-F35 WeakPolarHBondContact O-CD2 3.39Å; H30-F35 HydrophobicContact CB-CD1 3.95Å; H30-F35 HydrophobicContact CB-CE1 3.72Å; H30-F35 HydrophobicContact CB-CZ 4.29Å; S32-F35 VanDerWaalsContact O-CB 3.25Å; S32-F35 WeakPolarHBondContact O-CB 3.5Å; S32-F35 PolarHBondContact O-N 2.86Å; L33-F35 PolarHBondContact O-N 2.8Å; F35-S37 VanDerWaalsContact C-N 3.35Å; F35-S37 PolarHBondContact O-N 2.95Å; F35-T38 PolarHBondContact O-N 3.18Å; F35-T38 VanDerWaalsContact O-N 3.16Å; F35-L39 HydrophobicContact CD1-CD1 3.79Å; F35-L39 HydrophobicContact CD1-CG 4.3Å; F35-L39 HydrophobicContact CE1-CD1 3.24Å; F35-L39 HydrophobicContact CE1-CG 3.92Å; F35-L39 HydrophobicContact CZ-CD1 3.81Å; F35-L39 HydrophobicContact CZ-CD2 4.39Å; F35-L39 HydrophobicContact CZ-CG 4.11Å; F35-L39 PolarHBondContact O-N 3.43Å; F35-Y59 HydrophobicContact CE1-CD1 4.24Å; F35-Y59 AromaticContact CE1-CE1 3.74Å; F35-Y59 HydrophobicContact CE1-CE1 3.74Å; F35-Y59 HydrophobicContact CZ-CE1 4.04Å
36V92.1Very high89.2Confident0 Ų049.2 Ų49.20%025%0.247CC..Hα-helixtrans-65-41.5-179.3-175.20000110.4T38 L39 L40 L60 I83 D87 I91V36-T38 VanDerWaalsContact C-N 3.34Å; V36-T38 PolarHBondContact O-N 3.36Å; V36-L39 WeakPolarHBondContact O-CB 3.41Å; V36-L39 PolarHBondContact O-N 3.13Å; V36-L40 PolarHBondContact O-N 3.25Å; V36-L40 VanDerWaalsContact O-N 3.11Å; V36-L60 HydrophobicContact CG1-CD1 3.48Å; V36-L60 VanDerWaalsContact CG1-CD1 3.48Å; V36-I83 HydrophobicContact CB-CG2 4.41Å; V36-I83 HydrophobicContact CG2-CD1 4.22Å; V36-I83 HydrophobicContact CG2-CG1 4.16Å; V36-I83 HydrophobicContact CG2-CG2 4Å; V36-D87 HydrophobicContact CB-CB 4.33Å; V36-I91 HydrophobicContact CG1-CD1 3.94Å; V36-I91 HydrophobicContact CG1-CG1 3.82Å
37S92.4Very high89.4Confident8 Ų858 Ų586%0.05629%0.288CS..Hα-helixtrans-59.4-42.5172.7-62.40000112.6F35 L40 Q41 D87 C90F35-S37 VanDerWaalsContact C-N 3.35Å; F35-S37 PolarHBondContact O-N 2.95Å; S37-L40 PolarHBondContact O-N 3.46Å; S37-Q41 WeakPolarHBondContact O-CG 3.45Å; S37-Q41 PolarHBondContact O-N 3.33Å; S37-Q41 VanDerWaalsContact O-N 3.14Å; S37-D87 VanDerWaalsContact CB-OD1 3.27Å; S37-D87 WeakPolarHBondContact CB-OD1 3.36Å; S37-D87 PolarHBondContact N-OD1 3.44Å; S37-D87 VanDerWaalsContact N-OD1 3.07Å; S37-D87 PolarHBondContact OG-OD1 3.24Å; S37-C90 VanDerWaalsContact OG-CB 3.26Å; S37-C90 WeakPolarHBondContact OG-CB 3.23Å; S37-C90 PolarHBondContact OG-SG 3.06Å
38T92.7Very high89.8Confident19 Ų1955 Ų5512%0.11727%0.272CS..Hα-helixtrans-67.5-38.3178.4-54.70000111.1P3 I6 N34 F35 V36 L40 Q41 I42P3-T38 HydrophobicContact CB-CG2 4.12Å; P3-T38 HydrophobicContact CG-CG2 3.99Å; I6-T38 HydrophobicContact CD1-CG2 3.86Å; N34-T38 WeakPolarHBondContact O-CB 3.39Å; N34-T38 PolarHBondContact O-N 2.88Å; N34-T38 PolarHBondContact O-OG1 2.91Å; F35-T38 PolarHBondContact O-N 3.18Å; F35-T38 VanDerWaalsContact O-N 3.16Å; V36-T38 VanDerWaalsContact C-N 3.34Å; V36-T38 PolarHBondContact O-N 3.36Å; T38-L40 VanDerWaalsContact C-N 3.34Å; T38-L40 PolarHBondContact O-N 3.38Å; T38-Q41 WeakPolarHBondContact O-CB 3.23Å; T38-Q41 PolarHBondContact O-N 3.05Å; T38-I42 HydrophobicContact CG2-CD1 3.95Å; T38-I42 HydrophobicContact CG2-CG1 4.41Å; T38-I42 VanDerWaalsContact O-CG1 3.3Å; T38-I42 WeakPolarHBondContact O-CG1 3.38Å; T38-I42 PolarHBondContact O-N 3.39Å
39L93.6Very high90.2Very high0 Ų052.2 Ų52.20%026%0.262CS..Hα-helixtrans-61.2-40.7174.3-80.8177.1000112.6I6 L10 F35 V36 I42 T43 Y59 L60I6-L39 HydrophobicContact CG2-CD2 3.75Å; L10-L39 HydrophobicContact CD1-CD2 4.2Å; F35-L39 HydrophobicContact CD1-CD1 3.79Å; F35-L39 HydrophobicContact CD1-CG 4.3Å; F35-L39 HydrophobicContact CE1-CD1 3.24Å; F35-L39 HydrophobicContact CE1-CG 3.92Å; F35-L39 HydrophobicContact CZ-CD1 3.81Å; F35-L39 HydrophobicContact CZ-CD2 4.39Å; F35-L39 HydrophobicContact CZ-CG 4.11Å; F35-L39 PolarHBondContact O-N 3.43Å; V36-L39 WeakPolarHBondContact O-CB 3.41Å; V36-L39 PolarHBondContact O-N 3.13Å; L39-I42 PolarHBondContact O-N 2.76Å; L39-T43 WeakPolarHBondContact O-CB 3.39Å; L39-T43 PolarHBondContact O-N 2.99Å; L39-T43 PolarHBondContact O-OG1 3.42Å; L39-Y59 HydrophobicContact CD1-CD1 3.64Å; L39-Y59 HydrophobicContact CD1-CE1 4.28Å; L39-L60 HydrophobicContact CB-CD1 4.41Å
40L95.3Very high90.6Very high11 Ų1155.2 Ų55.26%0.05828%0.277CS..Hα-helixtrans-63.5-42.4174.5-17862.6000111.2V36 S37 T38 T43 M44 L60 I91 N94 A98 L110V36-L40 PolarHBondContact O-N 3.25Å; V36-L40 VanDerWaalsContact O-N 3.11Å; S37-L40 PolarHBondContact O-N 3.46Å; T38-L40 VanDerWaalsContact C-N 3.34Å; T38-L40 PolarHBondContact O-N 3.38Å; L40-T43 WeakPolarHBondContact O-CB 3.43Å; L40-T43 PolarHBondContact O-N 2.71Å; L40-M44 HydrophobicContact CD1-CG 4.27Å; L40-M44 WeakPolarHBondContact O-CG 3.25Å; L40-M44 PolarHBondContact O-N 2.99Å; L40-L60 HydrophobicContact CB-CD2 4.16Å; L40-L60 HydrophobicContact CD1-CD2 3.92Å; L40-I91 HydrophobicContact CB-CD1 3.78Å; L40-I91 HydrophobicContact CD2-CD1 3.63Å; L40-I91 HydrophobicContact CG-CD1 4.29Å; L40-N94 HydrophobicContact CD2-CB 3.84Å; L40-A98 HydrophobicContact CD1-CB 3.94Å; L40-L110 HydrophobicContact CD1-CD2 4.01Å
41Q94.3Very high91.1Very high129 Ų12957.7 Ų57.760%0.60329%0.294SS*.Hα-helixtrans-62.2-43.8176.2-69.3176.60.900112.4S37 T38 M44 S45S37-Q41 WeakPolarHBondContact O-CG 3.45Å; S37-Q41 PolarHBondContact O-N 3.33Å; S37-Q41 VanDerWaalsContact O-N 3.14Å; T38-Q41 WeakPolarHBondContact O-CB 3.23Å; T38-Q41 PolarHBondContact O-N 3.05Å; Q41-M44 PolarHBondContact O-N 3.32Å; Q41-S45 PolarHBondContact O-N 2.85Å
42I93.7Very high91.7Very high7 Ų751.1 Ų51.14%0.03627%0.266CS..Hα-helixtrans-60.8-48.1175.9-71.8168000110I6 I7 L10 T38 L39 M44 S45 L48I6-I42 HydrophobicContact CB-CD1 3.73Å; I6-I42 HydrophobicContact CD1-CD1 4.39Å; I6-I42 HydrophobicContact CG2-CD1 3.6Å; I7-I42 HydrophobicContact CD1-CG1 4.37Å; I7-I42 HydrophobicContact CG1-CD1 4.03Å; I7-I42 HydrophobicContact CG1-CG1 4.09Å; I7-I42 HydrophobicContact CG1-CG2 4Å; L10-I42 HydrophobicContact CD1-CG2 3.98Å; T38-I42 HydrophobicContact CG2-CD1 3.95Å; T38-I42 HydrophobicContact CG2-CG1 4.41Å; T38-I42 VanDerWaalsContact O-CG1 3.3Å; T38-I42 WeakPolarHBondContact O-CG1 3.38Å; T38-I42 PolarHBondContact O-N 3.39Å; L39-I42 PolarHBondContact O-N 2.76Å; I42-M44 PolarHBondContact O-N 3Å; I42-S45 WeakPolarHBondContact O-CB 3.41Å; I42-S45 PolarHBondContact O-N 2.92Å; I42-S45 VanDerWaalsContact O-N 3.12Å; I42-L48 HydrophobicContact CB-CD1 4.45Å; I42-L48 HydrophobicContact CG2-CD1 3.65Å
43T94.2Very high92.3Very high0 Ų050.6 Ų50.60%026%0.258CS..Hα-helixtrans-56.6-38.6178.7-64.10000112.3L39 L40 R53 V57 I106L39-T43 WeakPolarHBondContact O-CB 3.39Å; L39-T43 PolarHBondContact O-N 2.99Å; L39-T43 PolarHBondContact O-OG1 3.42Å; L40-T43 WeakPolarHBondContact O-CB 3.43Å; L40-T43 PolarHBondContact O-N 2.71Å; T43-R53 PolarHBondContact O-NE 3.42Å; T43-R53 PolarHBondContact O-NH2 3.3Å; T43-V57 HydrophobicContact CG2-CB 3.62Å; T43-V57 HydrophobicContact CG2-CG2 3.91Å; T43-V57 PolarHBondContact OG1-N 3.48Å; T43-I106 HydrophobicContact CG2-CG2 3.58Å
44M94.8Very high92.9Very high48 Ų4848.6 Ų48.624%0.23625%0.246CC..Hα-helixtrans-90.1-2.3-178-65.2-55.2-60.100114.1L40 Q41 I42 E46 A98 H101 L110L40-M44 HydrophobicContact CD1-CG 4.27Å; L40-M44 WeakPolarHBondContact O-CG 3.25Å; L40-M44 PolarHBondContact O-N 2.99Å; Q41-M44 PolarHBondContact O-N 3.32Å; I42-M44 PolarHBondContact O-N 3Å; M44-E46 PolarHBondContact O-N 3.41Å; M44-A98 HydrophobicContact CE-CB 4.26Å; M44-A98 HydrophobicContact CG-CB 3.95Å; M44-A98 HydrophobicContact SD-CB 3.8Å; M44-H101 HydrophobicContact CE-CB 4.19Å; M44-L110 HydrophobicContact SD-CD1 4.2Å
45S94.4Very high93.2Very high34 Ų3446.2 Ų46.224%0.23824%0.236CC..  trans-73.8112.6179.2-176.80000111.7Q41 I42 Q47 L48 R53Q41-S45 PolarHBondContact O-N 2.85Å; I42-S45 WeakPolarHBondContact O-CB 3.41Å; I42-S45 PolarHBondContact O-N 2.92Å; I42-S45 VanDerWaalsContact O-N 3.12Å; S45-Q47 PolarHBondContact O-N 3.46Å; S45-L48 PolarHBondContact O-N 3.48Å; S45-R53 WeakPolarHBondContact O-CD 3.33Å
46E91.2Very high93.4Very high171 Ų17146.1 Ų46.180%0.79924%0.235SC*.THydrogen-bonded Turntrans-67.4-12.5175.4-63.8-176.8171.900113.6M44 L48M44-E46 PolarHBondContact O-N 3.41Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 3.33Å
47Q92.4Very high93.6Very high185 Ų18546.1 Ų46.186%0.86424%0.235SC*.THydrogen-bonded Turntrans-78-12.1176.7-61.5-178.9-6.100112.9S45S45-Q47 PolarHBondContact O-N 3.46Å
48L92.5Very high93.7Very high26 Ų2649.2 Ų49.214%0.13625%0.25CS..SBendtrans-100.2144.4-179.9-62.8177.4000111.1I7 I42 S45 E46 R53I7-L48 HydrophobicContact CD1-CD1 3.93Å; I7-L48 HydrophobicContact CD1-CD2 4.05Å; I7-L48 HydrophobicContact CG1-CD1 3.96Å; I7-L48 HydrophobicContact CG1-CD2 4.43Å; I7-L48 HydrophobicContact CG2-CD2 4.01Å; I42-L48 HydrophobicContact CB-CD1 4.45Å; I42-L48 HydrophobicContact CG2-CD1 3.65Å; S45-L48 PolarHBondContact O-N 3.48Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 3.33Å; L48-R53 HydrophobicContact CB-CG 3.89Å; L48-R53 VanDerWaalsContact O-CD 3.22Å; L48-R53 WeakPolarHBondContact O-CD 3.49Å
49D92.6Very high93.7Very high97 Ų9749.9 Ų49.952%0.51925%0.251SS..  trans-62.1144.7175.9-48.5-57.9000110.7R11 P51 V52 R53R11-D49 IonicContact NH2-OD2 3.19Å; R11-D49 PolarHBondContact NH2-OD2 2.79Å; D49-P51 VanDerWaalsContact C-CD 3.45Å; D49-P51 VanDerWaalsContact C-N 3.35Å; D49-V52 PolarHBondContact O-N 3.39Å; D49-V52 VanDerWaalsContact O-N 3.11Å; D49-R53 PolarHBondContact O-N 2.99Å
50L91.6Very high93.8Very high69 Ų6949.9 Ų49.936%0.36125%0.251SS..Hα-helixtrans-53.5-40.8-176.7-175.263000114V52 R53 Q54 P103 L105 I106L50-V52 VanDerWaalsContact C-N 3.33Å; L50-V52 PolarHBondContact O-N 2.82Å; L50-R53 PolarHBondContact O-N 3.01Å; L50-Q54 HydrophobicContact CD1-CG 4.35Å; L50-Q54 HydrophobicContact CG-CG 4.31Å; L50-Q54 WeakPolarHBondContact O-CG 3.27Å; L50-Q54 PolarHBondContact O-N 3.31Å; L50-P103 HydrophobicContact CD1-CG 4.04Å; L50-L105 HydrophobicContact CD2-CD1 4.35Å; L50-I106 HydrophobicContact CD1-CD1 3.95Å; L50-I106 HydrophobicContact CD1-CG1 4.23Å
51P93.1Very high93.8Very high63 Ų6351.8 Ų51.841%0.40926%0.259SS..Hα-helixtrans-59.9-39.1177.9-26.536.6000113.8M14 D49 R53 Q54 A55M14-P51 HydrophobicContact CE-CB 4.14Å; M14-P51 HydrophobicContact SD-CB 3.62Å; D49-P51 VanDerWaalsContact C-CD 3.45Å; D49-P51 VanDerWaalsContact C-N 3.35Å; P51-R53 VanDerWaalsContact C-N 3.34Å; P51-Q54 WeakPolarHBondContact O-CB 3.36Å; P51-Q54 PolarHBondContact O-N 3.18Å; P51-A55 PolarHBondContact O-N 3.24Å
52V93.6Very high93.7Very high3 Ų349.3 Ų49.32%0.01825%0.25CC..Hα-helixtrans-67.7-39.7177.9-176.50000110.7I7 L10 R11 M14 D49 L50 Q54 A55 G56I7-V52 HydrophobicContact CG2-CG1 4.27Å; L10-V52 HydrophobicContact CB-CG1 4.23Å; R11-V52 HydrophobicContact CG-CG1 4.31Å; R11-V52 HydrophobicContact CG-CG2 3.54Å; M14-V52 HydrophobicContact CE-CG2 3.89Å; D49-V52 PolarHBondContact O-N 3.39Å; D49-V52 VanDerWaalsContact O-N 3.11Å; L50-V52 VanDerWaalsContact C-N 3.33Å; L50-V52 PolarHBondContact O-N 2.82Å; V52-Q54 VanDerWaalsContact C-N 3.33Å; V52-A55 PolarHBondContact O-N 3.44Å; V52-G56 PolarHBondContact O-N 3.17Å
53R95.9Very high93.7Very high27 Ų2749.3 Ų49.310%0.10225%0.25CC..Hα-helixtrans-67.2-36.3176.5-61.7169.662.1-179.42.4111.5T43 S45 L48 D49 L50 P51 G56 V57 I106T43-R53 PolarHBondContact O-NE 3.42Å; T43-R53 PolarHBondContact O-NH2 3.3Å; S45-R53 WeakPolarHBondContact O-CD 3.33Å; L48-R53 HydrophobicContact CB-CG 3.89Å; L48-R53 VanDerWaalsContact O-CD 3.22Å; L48-R53 WeakPolarHBondContact O-CD 3.49Å; D49-R53 PolarHBondContact O-N 2.99Å; L50-R53 PolarHBondContact O-N 3.01Å; P51-R53 VanDerWaalsContact C-N 3.34Å; R53-G56 PolarHBondContact O-N 3.17Å; R53-V57 PolarHBondContact O-N 3.43Å; R53-I106 HydrophobicContact CB-CD1 3.63Å
54Q93.7Very high93.7Very high55 Ų5549.3 Ų49.326%0.25725%0.25SC..Hα-helixtrans-64.3-47.8173.2-75.5173.6-3900111.6L50 P51 V52 G56 V57 I58L50-Q54 HydrophobicContact CD1-CG 4.35Å; L50-Q54 HydrophobicContact CG-CG 4.31Å; L50-Q54 WeakPolarHBondContact O-CG 3.27Å; L50-Q54 PolarHBondContact O-N 3.31Å; P51-Q54 WeakPolarHBondContact O-CB 3.36Å; P51-Q54 PolarHBondContact O-N 3.18Å; V52-Q54 VanDerWaalsContact C-N 3.33Å; Q54-G56 VanDerWaalsContact C-N 3.27Å; Q54-G56 PolarHBondContact O-N 3.37Å; Q54-V57 VanDerWaalsContact O-CG1 3.3Å; Q54-V57 WeakPolarHBondContact O-CG1 3.37Å; Q54-V57 PolarHBondContact O-N 2.96Å; Q54-I58 WeakPolarHBondContact O-CB 3.26Å; Q54-I58 WeakPolarHBondContact O-CD1 3.44Å; Q54-I58 VanDerWaalsContact O-CG1 3.23Å; Q54-I58 WeakPolarHBondContact O-CG1 3.36Å; Q54-I58 PolarHBondContact O-N 3.4Å
55A92.6Very high93.6Very high16 Ų1649.5 Ų49.513%0.13225%0.254CS..Hα-helixtrans-57.5-43.5173.700000111.2L10 P51 V52 I58 Y59L10-A55 HydrophobicContact CB-CB 4.44Å; L10-A55 HydrophobicContact CD2-CB 4.28Å; P51-A55 PolarHBondContact O-N 3.24Å; V52-A55 PolarHBondContact O-N 3.44Å; A55-I58 PolarHBondContact O-N 3.18Å; A55-Y59 PolarHBondContact O-N 2.95Å
56G94.8Very high93.3Very high0 Ų052.1 Ų52.10%026%0.262CS..Hα-helixtrans-59.8-46.6176.600000113.8V52 R53 Q54 Y59 L60V52-G56 PolarHBondContact O-N 3.17Å; R53-G56 PolarHBondContact O-N 3.17Å; Q54-G56 VanDerWaalsContact C-N 3.27Å; Q54-G56 PolarHBondContact O-N 3.37Å; G56-Y59 PolarHBondContact O-N 3.49Å; G56-L60 WeakPolarHBondContact O-CB 3.38Å; G56-L60 PolarHBondContact O-N 3.35Å
57V96.2Very high93.3Very high0 Ų045.9 Ų45.90%023%0.232CC..Hα-helixtrans-72.1-32.718076.10000112.6T43 R53 Q54 L60 K61 I106 Q109 L110T43-V57 HydrophobicContact CG2-CB 3.62Å; T43-V57 HydrophobicContact CG2-CG2 3.91Å; T43-V57 PolarHBondContact OG1-N 3.48Å; R53-V57 PolarHBondContact O-N 3.43Å; Q54-V57 VanDerWaalsContact O-CG1 3.3Å; Q54-V57 WeakPolarHBondContact O-CG1 3.37Å; Q54-V57 PolarHBondContact O-N 2.96Å; V57-L60 PolarHBondContact O-N 2.94Å; V57-K61 WeakPolarHBondContact O-CB 3.48Å; V57-K61 PolarHBondContact O-N 2.83Å; V57-I106 HydrophobicContact CB-CG2 4.28Å; V57-I106 HydrophobicContact CG1-CG1 4.48Å; V57-I106 HydrophobicContact CG1-CG2 4.41Å; V57-I106 HydrophobicContact CG2-CG2 4.09Å; V57-Q109 HydrophobicContact CB-CB 4.23Å; V57-Q109 HydrophobicContact CG1-CB 3.65Å; V57-Q109 HydrophobicContact CG1-CG 3.74Å; V57-Q109 HydrophobicContact CG2-CB 3.58Å; V57-L110 HydrophobicContact CG2-CD2 3.71Å; V57-L110 HydrophobicContact CG2-CG 3.82Å
58I93.9Very high93.3Very high73 Ų7337.2 Ų37.237%0.37419%0.191SC..Hα-helixtrans-64.4-45.4174.5-70165.7000109.5Q54 A55 K61 N62Q54-I58 WeakPolarHBondContact O-CB 3.26Å; Q54-I58 WeakPolarHBondContact O-CD1 3.44Å; Q54-I58 VanDerWaalsContact O-CG1 3.23Å; Q54-I58 WeakPolarHBondContact O-CG1 3.36Å; Q54-I58 PolarHBondContact O-N 3.4Å; A55-I58 PolarHBondContact O-N 3.18Å; I58-K61 WeakPolarHBondContact O-CB 3.49Å; I58-K61 PolarHBondContact O-N 2.89Å; I58-N62 VanDerWaalsContact O-CG 3.29Å; I58-N62 PolarHBondContact O-N 2.9Å; I58-N62 PolarHBondContact O-OD1 2.87Å
59Y93.8Very high93.1Very high34 Ų3437.4 Ų37.413%0.13319%0.194CC..Hα-helixtrans-63.6-42.4175.7-160.4-79.6000111.7L26 N27 F35 L39 A55 G56 K61 N62 M63L26-Y59 HydrophobicContact CB-CE2 3.67Å; L26-Y59 HydrophobicContact CD1-CD2 3.95Å; L26-Y59 HydrophobicContact CD1-CE2 3.86Å; L26-Y59 HydrophobicContact CG-CE2 4.31Å; L26-Y59 PolarHBondContact O-OH 3.17Å; N27-Y59 PolarHBondContact OD1-OH 2.95Å; F35-Y59 HydrophobicContact CE1-CD1 4.24Å; F35-Y59 AromaticContact CE1-CE1 3.74Å; F35-Y59 HydrophobicContact CE1-CE1 3.74Å; F35-Y59 HydrophobicContact CZ-CE1 4.04Å; L39-Y59 HydrophobicContact CD1-CD1 3.64Å; L39-Y59 HydrophobicContact CD1-CE1 4.28Å; A55-Y59 PolarHBondContact O-N 2.95Å; G56-Y59 PolarHBondContact O-N 3.49Å; Y59-K61 PolarHBondContact O-N 3.29Å; Y59-N62 PolarHBondContact O-N 3.37Å; Y59-M63 HydrophobicContact CD1-CG 3.7Å; Y59-M63 HydrophobicContact CE1-CE 3.96Å; Y59-M63 HydrophobicContact CE1-CG 3.6Å; Y59-M63 HydrophobicContact CE1-SD 3.96Å; Y59-M63 WeakPolarHBondContact O-CB 3.47Å; Y59-M63 VanDerWaalsContact O-CG 3.3Å; Y59-M63 WeakPolarHBondContact O-CG 3.47Å; Y59-M63 PolarHBondContact O-N 2.84Å
60L95.5Very high92.5Very high0 Ų036.7 Ų36.70%019%0.19CC..Hα-helixtrans-59.5-44.2174.7178.162.3000111.9V36 L39 L40 G56 V57 M63 I64 L110V36-L60 HydrophobicContact CG1-CD1 3.48Å; V36-L60 VanDerWaalsContact CG1-CD1 3.48Å; L39-L60 HydrophobicContact CB-CD1 4.41Å; L40-L60 HydrophobicContact CB-CD2 4.16Å; L40-L60 HydrophobicContact CD1-CD2 3.92Å; G56-L60 WeakPolarHBondContact O-CB 3.38Å; G56-L60 PolarHBondContact O-N 3.35Å; V57-L60 PolarHBondContact O-N 2.94Å; L60-M63 WeakPolarHBondContact O-CB 3.45Å; L60-M63 PolarHBondContact O-N 3.26Å; L60-I64 HydrophobicContact CD1-CD1 3.84Å; L60-I64 HydrophobicContact CD1-CG1 4.26Å; L60-I64 HydrophobicContact CG-CD1 3.98Å; L60-I64 WeakPolarHBondContact O-CG1 3.38Å; L60-I64 PolarHBondContact O-N 3.48Å; L60-L110 HydrophobicContact CD2-CD2 4.09Å
61K95.8Very high91.6Very high51 Ų5139.8 Ų39.822%0.22220%0.197CC..Hα-helixtrans-59-49.2175.1178.3-154.765.6178.90110.9V57 I58 Y59 M63 I64 T65 T112 C113V57-K61 WeakPolarHBondContact O-CB 3.48Å; V57-K61 PolarHBondContact O-N 2.83Å; I58-K61 WeakPolarHBondContact O-CB 3.49Å; I58-K61 PolarHBondContact O-N 2.89Å; Y59-K61 PolarHBondContact O-N 3.29Å; K61-M63 VanDerWaalsContact C-N 3.3Å; K61-M63 PolarHBondContact O-N 3.48Å; K61-I64 PolarHBondContact O-N 3.46Å; K61-T65 VanDerWaalsContact O-CB 3.31Å; K61-T65 WeakPolarHBondContact O-CB 3.38Å; K61-T65 PolarHBondContact O-N 3.08Å; K61-T65 PolarHBondContact O-OG1 2.92Å; K61-T112 HydrophobicContact CD-CG2 4.02Å; K61-T112 HydrophobicContact CG-CG2 4Å; K61-C113 VanDerWaalsContact CA-SG 3.5Å
62N92.4Very high90Very high77 Ų7746.2 Ų46.241%0.41222%0.221SC..Hα-helixtrans-61.1-42.2179.8-67.1-5.4000110.9I58 Y59 T65 Q66I58-N62 VanDerWaalsContact O-CG 3.29Å; I58-N62 PolarHBondContact O-N 2.9Å; I58-N62 PolarHBondContact O-OD1 2.87Å; Y59-N62 PolarHBondContact O-N 3.37Å; N62-T65 PolarHBondContact O-N 2.9Å; N62-Q66 VanDerWaalsContact O-CB 3.23Å; N62-Q66 WeakPolarHBondContact O-CB 3.38Å; N62-Q66 PolarHBondContact O-N 2.83Å
63M92.9Very high88.3Confident6 Ų649 Ų493%0.0324%0.238CC..Hα-helixtrans-58-50.9174.4-75.7-82.1104.100112.7H30 Y59 L60 K61 Q66 Y67H30-M63 HydrophobicContact CB-CE 4.04Å; H30-M63 HydrophobicContact CB-SD 3.71Å; Y59-M63 HydrophobicContact CD1-CG 3.7Å; Y59-M63 HydrophobicContact CE1-CE 3.96Å; Y59-M63 HydrophobicContact CE1-CG 3.6Å; Y59-M63 HydrophobicContact CE1-SD 3.96Å; Y59-M63 WeakPolarHBondContact O-CB 3.47Å; Y59-M63 VanDerWaalsContact O-CG 3.3Å; Y59-M63 WeakPolarHBondContact O-CG 3.47Å; Y59-M63 PolarHBondContact O-N 2.84Å; L60-M63 WeakPolarHBondContact O-CB 3.45Å; L60-M63 PolarHBondContact O-N 3.26Å; K61-M63 VanDerWaalsContact C-N 3.3Å; K61-M63 PolarHBondContact O-N 3.48Å; M63-Q66 PolarHBondContact O-N 3.27Å; M63-Y67 HydrophobicContact CE-CD2 3.48Å; M63-Y67 VanDerWaalsContact CE-CD2 3.48Å; M63-Y67 HydrophobicContact CE-CE2 3.15Å; M63-Y67 WeakPolarHBondContact O-CB 3.42Å; M63-Y67 WeakPolarHBondContact O-CD2 3.2Å; M63-Y67 PolarHBondContact O-N 2.88Å; M63-Y67 HydrophobicContact SD-CD2 4.06Å; M63-Y67 HydrophobicContact SD-CE2 4.3Å
64I94.4Very high86.4Confident0 Ų050.3 Ų50.30%026%0.255CS..Hα-helixtrans-65.8-43.7-179.5-70171.8000110.5L60 K61 Q66 W68 I83 I91 C113 H116 I117L60-I64 HydrophobicContact CD1-CD1 3.84Å; L60-I64 HydrophobicContact CD1-CG1 4.26Å; L60-I64 HydrophobicContact CG-CD1 3.98Å; L60-I64 WeakPolarHBondContact O-CG1 3.38Å; L60-I64 PolarHBondContact O-N 3.48Å; K61-I64 PolarHBondContact O-N 3.46Å; I64-Q66 VanDerWaalsContact C-N 3.32Å; I64-Q66 PolarHBondContact O-N 2.96Å; I64-W68 HydrophobicContact CB-CE3 4.46Å; I64-W68 HydrophobicContact CG1-CE3 4.05Å; I64-W68 HydrophobicContact CG1-CZ3 4.35Å; I64-W68 HydrophobicContact CG2-CB 4.24Å; I64-W68 HydrophobicContact CG2-CD2 4.36Å; I64-W68 HydrophobicContact CG2-CE3 4.06Å; I64-W68 HydrophobicContact CG2-CG 4.47Å; I64-W68 WeakPolarHBondContact O-CB 3.47Å; I64-W68 PolarHBondContact O-N 3.46Å; I64-W68 VanDerWaalsContact O-N 3.16Å; I64-I83 HydrophobicContact CG1-CD1 4.38Å; I64-I91 HydrophobicContact CD1-CG2 4.22Å; I64-C113 HydrophobicContact CD1-CB 3.67Å; I64-C113 HydrophobicContact CG2-CB 4.44Å; I64-H116 HydrophobicContact CG2-CB 4.05Å; I64-I117 HydrophobicContact CD1-CD1 4.41Å; I64-I117 HydrophobicContact CG2-CG1 4.01Å
65T91.4Very high84.3Confident53 Ų5354.5 Ų54.533%0.32529%0.287SS..Hα-helixtrans-61.1-42.7179.9-54.70000111.4K61 N62K61-T65 VanDerWaalsContact O-CB 3.31Å; K61-T65 WeakPolarHBondContact O-CB 3.38Å; K61-T65 PolarHBondContact O-N 3.08Å; K61-T65 PolarHBondContact O-OG1 2.92Å; N62-T65 PolarHBondContact O-N 2.9Å
66Q89Confident82.8Confident88 Ų8857.6 Ų57.641%0.41132%0.321SS..Hα-helixtrans-86.6-37.6-172.4-170.1175.415.200114N62 M63 I64 R71N62-Q66 VanDerWaalsContact O-CB 3.23Å; N62-Q66 WeakPolarHBondContact O-CB 3.38Å; N62-Q66 PolarHBondContact O-N 2.83Å; M63-Q66 PolarHBondContact O-N 3.27Å; I64-Q66 VanDerWaalsContact C-N 3.32Å; I64-Q66 PolarHBondContact O-N 2.96Å; Q66-R71 PolarHBondContact O-NH2 3.4Å
67Y91.4Very high81.2Confident41 Ų4163.4 Ų63.416%0.16135%0.352CS..Hα-helixtrans-120.85.5-166.4-53.3-72000114.6M63 Y81 I83M63-Y67 HydrophobicContact CE-CD2 3.48Å; M63-Y67 VanDerWaalsContact CE-CD2 3.48Å; M63-Y67 HydrophobicContact CE-CE2 3.15Å; M63-Y67 WeakPolarHBondContact O-CB 3.42Å; M63-Y67 WeakPolarHBondContact O-CD2 3.2Å; M63-Y67 PolarHBondContact O-N 2.88Å; M63-Y67 HydrophobicContact SD-CD2 4.06Å; M63-Y67 HydrophobicContact SD-CE2 4.3Å; Y67-Y81 AromaticContact CD1-CD1 3.69Å; Y67-Y81 HydrophobicContact CD1-CD1 3.69Å; Y67-Y81 HydrophobicContact CD1-CE1 4.46Å; Y67-Y81 VanDerWaalsContact CD1-O 3.29Å; Y67-Y81 WeakPolarHBondContact CD1-O 3.45Å; Y67-Y81 HydrophobicContact CD2-CD1 4.48Å; Y67-Y81 HydrophobicContact CE1-CD1 4.13Å; Y67-Y81 AromaticContact CG-CD1 3.85Å; Y67-Y81 HydrophobicContact CG-CD1 3.85Å; Y67-Y81 HydrophobicContact CG-CE1 4.17Å; Y67-I83 PolarHBondContact O-N 2.99Å
68W93Very high79.6Confident2 Ų271 Ų711%0.00839%0.391CS..SBendtrans-75.2-42.2170.5-160.6-84.5000114.2I64 I83 R88 I91 R92 I117 D121I64-W68 HydrophobicContact CB-CE3 4.46Å; I64-W68 HydrophobicContact CG1-CE3 4.05Å; I64-W68 HydrophobicContact CG1-CZ3 4.35Å; I64-W68 HydrophobicContact CG2-CB 4.24Å; I64-W68 HydrophobicContact CG2-CD2 4.36Å; I64-W68 HydrophobicContact CG2-CE3 4.06Å; I64-W68 HydrophobicContact CG2-CG 4.47Å; I64-W68 WeakPolarHBondContact O-CB 3.47Å; I64-W68 PolarHBondContact O-N 3.46Å; I64-W68 VanDerWaalsContact O-N 3.16Å; W68-I83 HydrophobicContact CE3-CD1 3.91Å; W68-R88 HydrophobicContact CD2-CG 4.35Å; W68-R88 HydrophobicContact CE3-CG 4.15Å; W68-R88 VanDerWaalsContact CH2-CA 3.49Å; W68-R88 HydrophobicContact CH2-CB 3.62Å; W68-R88 HydrophobicContact CH2-CG 3.8Å; W68-R88 HydrophobicContact CZ2-CB 3.85Å; W68-R88 HydrophobicContact CZ2-CG 3.97Å; W68-R88 HydrophobicContact CZ3-CB 4.15Å; W68-R88 HydrophobicContact CZ3-CG 3.88Å; W68-R88 VanDerWaalsContact O-CZ 3.3Å; W68-R88 PolarHBondContact O-NH2 3.03Å; W68-I91 HydrophobicContact CH2-CB 4.08Å; W68-I91 HydrophobicContact CH2-CG2 4.13Å; W68-I91 HydrophobicContact CZ3-CB 4.14Å; W68-I91 HydrophobicContact CZ3-CG1 4.5Å; W68-I91 HydrophobicContact CZ3-CG2 4.11Å; W68-R92 HydrophobicContact CH2-CG 4.38Å; W68-R92 HydrophobicContact CZ2-CG 4.23Å; W68-I117 HydrophobicContact CD2-CG1 3.97Å; W68-I117 HydrophobicContact CE3-CG1 4.16Å; W68-I117 HydrophobicContact CH2-CD1 3.95Å; W68-I117 HydrophobicContact CH2-CG1 3.9Å; W68-I117 HydrophobicContact CH2-CG2 4.31Å; W68-I117 HydrophobicContact CZ2-CB 4.19Å; W68-I117 HydrophobicContact CZ2-CD1 4.22Å; W68-I117 HydrophobicContact CZ2-CG1 3.73Å; W68-I117 HydrophobicContact CZ2-CG2 3.58Å; W68-I117 HydrophobicContact CZ3-CD1 4.2Å; W68-I117 HydrophobicContact CZ3-CG1 4.13Å; W68-D121 WeakPolarHBondContact CZ2-OD2 3.39Å; W68-D121 PolarHBondContact NE1-OD2 3.17Å
69P87.4Confident78.3Confident30 Ų3071.6 Ų71.620%0.19540%0.402CS..SBendtrans-63.7138.1177.8-14.827.1000111.2R71P69-R71 PolarHBondContact O-N 2.89Å
70D80.4Confident77.5Confident83 Ų8372 Ų7244%0.44441%0.409SS..  trans-72.8111.4167-63.7-27.2000107.3R88 R125D70-R88 IonicContact OD1-CZ 3.19Å; D70-R88 VanDerWaalsContact OD1-CZ 3.28Å; D70-R88 IonicContact OD1-NH1 2.76Å; D70-R88 PolarHBondContact OD1-NH1 3.25Å; D70-R88 IonicContact OD1-NH2 3.72Å; D70-R88 PolarHBondContact OD1-NH2 3.03Å; D70-R88 IonicContact OD2-NH1 3.5Å; D70-R125 IonicContact OD1-NH1 3.28Å; D70-R125 IonicContact OD2-CZ 2.62Å; D70-R125 IonicContact OD2-NH1 2.72Å; D70-R125 PolarHBondContact OD2-NH1 3.17Å; D70-R125 IonicContact OD2-NH2 2.76Å; D70-R125 PolarHBondContact OD2-NH2 3.28Å
71R72.2Confident76.9Confident133 Ų13374.4 Ų74.450%0.50242%0.418SS..PPolyproline II helixtrans-86.3130.5177.2-64.9-177.4-172.9-155.8-1.3108.9Q66 P69 T73 P80Q66-R71 PolarHBondContact O-NH2 3.4Å; P69-R71 PolarHBondContact O-N 2.89Å; R71-T73 PolarHBondContact O-N 3.49Å; R71-P80 HydrophobicContact CB-CB 4.39Å; R71-P80 HydrophobicContact CB-CG 3.56Å; R71-P80 HydrophobicContact CG-CG 4.45Å
72E60.6Low76.5Confident198 Ų19874.3 Ų74.393%0.92542%0.422SS*.PPolyproline II helixtrans-63.4128.3174.5-70.7-173.8164.400110
73T56.6Low76.4Confident61 Ų6170.7 Ų70.737%0.37440%0.402SS..PPolyproline II helixtrans-85.1116.3175.2-38.10000108.5R71 D77 S79R71-T73 PolarHBondContact O-N 3.49Å; T73-D77 HydrophobicContact CG2-CB 4.27Å; T73-D77 WeakPolarHBondContact CG2-O 3.42Å; T73-S79 PolarHBondContact OG1-OG 3.4Å
74A57.3Low76.3Confident55 Ų5572.2 Ų72.246%0.45541%0.413SS..PPolyproline II helixtrans-57.7144.8167.800000110G76 D77A74-G76 PolarHBondContact O-N 3.18Å; A74-D77 PolarHBondContact O-N 2.99Å
75P49.8Very low76.1Confident143 Ų14376.8 Ų76.893%0.92943%0.434SS*.THydrogen-bonded Turntrans-61.2106-178-16.427.5000111.2
76G60.6Low76.1Confident82 Ų8279.9 Ų79.985%0.84545%0.445SS*.THydrogen-bonded Turntrans122.7-18.3177.900000114.8A74A74-G76 PolarHBondContact O-N 3.18Å
77D60.6Low76.2Confident121 Ų12175.7 Ų75.765%0.64743%0.425SS*.SBendtrans-85153179.5-91.2-30.6000113.4T73 A74 S79T73-D77 HydrophobicContact CG2-CB 4.27Å; T73-D77 WeakPolarHBondContact CG2-O 3.42Å; A74-D77 PolarHBondContact O-N 2.99Å; D77-S79 PolarHBondContact O-N 3.39Å
78I62.9Low76.3Confident160 Ų16074.1 Ų74.182%0.82142%0.419SS*.PPolyproline II helixtrans-65.2122.9171.9-57.9171.3000107P80I78-P80 VanDerWaalsContact O-N 3.1Å
79S66Low76.3Confident85 Ų8579.1 Ų79.159%0.59444%0.442SS*.PPolyproline II helixtrans-48.8122.2177.5-640000110.5T73 D77T73-S79 PolarHBondContact OG1-OG 3.4Å; D77-S79 PolarHBondContact O-N 3.39Å
80P77.5Confident76.6Confident44 Ų4479.4 Ų79.429%0.28645%0.445SS..PPolyproline II helixtrans-58.5146.5-17922.4-32.2000109.8R71 I78 T82R71-P80 HydrophobicContact CB-CB 4.39Å; R71-P80 HydrophobicContact CB-CG 3.56Å; R71-P80 HydrophobicContact CG-CG 4.45Å; I78-P80 VanDerWaalsContact O-N 3.1Å; P80-T82 PolarHBondContact O-N 3.34Å
81Y82.8Confident77.4Confident50 Ų5075.5 Ų75.520%0.19642%0.424CS..PPolyproline II helixtrans-61.5127.7177.2173.4-96.9000109.5H30 K31 Y67H30-Y81 AromaticContact CD2-CD1 3.94Å; H30-Y81 AromaticContact CD2-CE1 3.7Å; H30-Y81 PolarHBondContact O-OH 2.63Å; K31-Y81 HydrophobicContact CB-CE2 4.26Å; K31-Y81 HydrophobicContact CG-CD2 4.1Å; K31-Y81 HydrophobicContact CG-CE2 4.22Å; Y67-Y81 AromaticContact CD1-CD1 3.69Å; Y67-Y81 HydrophobicContact CD1-CD1 3.69Å; Y67-Y81 HydrophobicContact CD1-CE1 4.46Å; Y67-Y81 VanDerWaalsContact CD1-O 3.29Å; Y67-Y81 WeakPolarHBondContact CD1-O 3.45Å; Y67-Y81 HydrophobicContact CD2-CD1 4.48Å; Y67-Y81 HydrophobicContact CE1-CD1 4.13Å; Y67-Y81 AromaticContact CG-CD1 3.85Å; Y67-Y81 HydrophobicContact CG-CD1 3.85Å; Y67-Y81 HydrophobicContact CG-CE1 4.17Å
82T88.4Confident78.5Confident49 Ų4969.5 Ų69.530%0.30140%0.401SS..  trans-123.6147.3171.855.90000108.7P80P80-T82 PolarHBondContact O-N 3.34Å
83I90.2Very high80.1Confident1 Ų164 Ų641%0.00538%0.375CS..  trans-59127176.8-62.9169.4000108.9V36 I64 Y67 W68 D87 R88V36-I83 HydrophobicContact CB-CG2 4.41Å; V36-I83 HydrophobicContact CG2-CD1 4.22Å; V36-I83 HydrophobicContact CG2-CG1 4.16Å; V36-I83 HydrophobicContact CG2-CG2 4Å; I64-I83 HydrophobicContact CG1-CD1 4.38Å; Y67-I83 PolarHBondContact O-N 2.99Å; W68-I83 HydrophobicContact CE3-CD1 3.91Å; I83-D87 HydrophobicContact CG2-CB 3.6Å; I83-R88 HydrophobicContact CB-CG 4.12Å; I83-R88 HydrophobicContact CG2-CG 3.85Å; I83-R88 PolarHBondContact O-NE 3Å; I83-R88 VanDerWaalsContact O-NE 3.11Å
84P90Very high82Confident37 Ų3764.8 Ų64.824%0.2438%0.377CS..  trans-55.5144179.4-2634.3000112.3L33 E86 D87 R88L33-P84 HydrophobicContact CD1-CB 4.15Å; L33-P84 HydrophobicContact CD1-CG 4.23Å; P84-E86 PolarHBondContact O-N 2.9Å; P84-E86 VanDerWaalsContact O-N 3.16Å; P84-D87 WeakPolarHBondContact O-CA 3.48Å; P84-D87 WeakPolarHBondContact O-CB 3.39Å; P84-D87 PolarHBondContact O-N 3.43Å; P84-R88 PolarHBondContact O-N 3.27Å
85E90.4Very high83.9Confident96 Ų9662.2 Ų62.245%0.44936%0.356SS..Hα-helixtrans-61-29-177.1-172.256.9-15000113.1R88 H89 R92E85-R88 PolarHBondContact O-N 3.22Å; E85-R88 WeakPolarHBondContact OE2-CD 3.23Å; E85-R88 IonicContact OE2-NH1 2.9Å; E85-H89 WeakPolarHBondContact O-CB 3.45Å; E85-H89 PolarHBondContact O-N 3.37Å; E85-R92 IonicContact OE1-CZ 2.75Å; E85-R92 IonicContact OE1-NH1 2.93Å; E85-R92 PolarHBondContact OE1-NH1 3.24Å; E85-R92 IonicContact OE1-NH2 3.9Å; E85-R92 PolarHBondContact OE1-NH2 3.43Å; E85-R92 IonicContact OE2-NH2 3.44Å
86E90Very high86.1Confident118 Ų11855.4 Ų55.455%0.55131%0.311SS*.Hα-helixtrans-62-44.2172.3-174.7175-171.900111.8P84 C90P84-E86 PolarHBondContact O-N 2.9Å; P84-E86 VanDerWaalsContact O-N 3.16Å; E86-C90 WeakPolarHBondContact O-CB 3.39Å; E86-C90 PolarHBondContact O-N 3.44Å
87D92Very high87.8Confident0 Ų053.4 Ų53.40%028%0.28CS..Hα-helixtrans-67-43.5174-89.9-54.8000110.9N34 V36 S37 I83 P84 H89 C90 I91N34-D87 WeakPolarHBondContact CA-OD1 3.44Å; N34-D87 WeakPolarHBondContact CA-OD2 3.45Å; N34-D87 PolarHBondContact N-OD2 2.86Å; V36-D87 HydrophobicContact CB-CB 4.33Å; S37-D87 VanDerWaalsContact CB-OD1 3.27Å; S37-D87 WeakPolarHBondContact CB-OD1 3.36Å; S37-D87 PolarHBondContact N-OD1 3.44Å; S37-D87 VanDerWaalsContact N-OD1 3.07Å; S37-D87 PolarHBondContact OG-OD1 3.24Å; I83-D87 HydrophobicContact CG2-CB 3.6Å; P84-D87 WeakPolarHBondContact O-CA 3.48Å; P84-D87 WeakPolarHBondContact O-CB 3.39Å; P84-D87 PolarHBondContact O-N 3.43Å; D87-H89 VanDerWaalsContact C-N 3.34Å; D87-H89 PolarHBondContact O-N 3.31Å; D87-C90 WeakPolarHBondContact O-CB 3.39Å; D87-C90 PolarHBondContact O-N 2.99Å; D87-I91 WeakPolarHBondContact O-CG1 3.41Å; D87-I91 PolarHBondContact O-N 3.1Å
88R93.8Very high89.5Confident9 Ų947.9 Ų47.93%0.03425%0.251CS..Hα-helixtrans-58.6-45.9176.8-67.2-177.9177.4165.5-2.8111.4W68 D70 I83 P84 E85 I91 R92W68-R88 HydrophobicContact CD2-CG 4.35Å; W68-R88 HydrophobicContact CE3-CG 4.15Å; W68-R88 VanDerWaalsContact CH2-CA 3.49Å; W68-R88 HydrophobicContact CH2-CB 3.62Å; W68-R88 HydrophobicContact CH2-CG 3.8Å; W68-R88 HydrophobicContact CZ2-CB 3.85Å; W68-R88 HydrophobicContact CZ2-CG 3.97Å; W68-R88 HydrophobicContact CZ3-CB 4.15Å; W68-R88 HydrophobicContact CZ3-CG 3.88Å; W68-R88 VanDerWaalsContact O-CZ 3.3Å; W68-R88 PolarHBondContact O-NH2 3.03Å; D70-R88 IonicContact OD1-CZ 3.19Å; D70-R88 VanDerWaalsContact OD1-CZ 3.28Å; D70-R88 IonicContact OD1-NH1 2.76Å; D70-R88 PolarHBondContact OD1-NH1 3.25Å; D70-R88 IonicContact OD1-NH2 3.72Å; D70-R88 PolarHBondContact OD1-NH2 3.03Å; D70-R88 IonicContact OD2-NH1 3.5Å; I83-R88 HydrophobicContact CB-CG 4.12Å; I83-R88 HydrophobicContact CG2-CG 3.85Å; I83-R88 PolarHBondContact O-NE 3Å; I83-R88 VanDerWaalsContact O-NE 3.11Å; P84-R88 PolarHBondContact O-N 3.27Å; E85-R88 PolarHBondContact O-N 3.22Å; E85-R88 WeakPolarHBondContact OE2-CD 3.23Å; E85-R88 IonicContact OE2-NH1 2.9Å; R88-I91 PolarHBondContact O-N 3.26Å; R88-R92 WeakPolarHBondContact O-CG 3.09Å; R88-R92 PolarHBondContact O-N 3.06Å
89H93.5Very high91.1Very high106 Ų10640.3 Ų40.349%0.49121%0.212SC..Hα-helixtrans-61.1-45.9176.6-177.964.5000111.8E85 D87 I91 R92 E93E85-H89 WeakPolarHBondContact O-CB 3.45Å; E85-H89 PolarHBondContact O-N 3.37Å; D87-H89 VanDerWaalsContact C-N 3.34Å; D87-H89 PolarHBondContact O-N 3.31Å; H89-I91 VanDerWaalsContact C-N 3.33Å; H89-I91 PolarHBondContact O-N 3.01Å; H89-R92 PolarHBondContact O-N 2.88Å; H89-E93 IonicContact CE1-OE1 3.07Å; H89-E93 WeakPolarHBondContact O-CG 3.39Å; H89-E93 PolarHBondContact O-N 3.35Å
90C93.9Very high92.5Very high37 Ų3736.9 Ų36.925%0.2519%0.188CC..Hα-helixtrans-58.2-43.8175.9-177.70000112.3S37 E86 D87 E93 N94S37-C90 VanDerWaalsContact OG-CB 3.26Å; S37-C90 WeakPolarHBondContact OG-CB 3.23Å; S37-C90 PolarHBondContact OG-SG 3.06Å; E86-C90 WeakPolarHBondContact O-CB 3.39Å; E86-C90 PolarHBondContact O-N 3.44Å; D87-C90 WeakPolarHBondContact O-CB 3.39Å; D87-C90 PolarHBondContact O-N 2.99Å; C90-E93 PolarHBondContact O-N 3.33Å; C90-N94 PolarHBondContact O-N 3.27Å; C90-N94 PolarHBondContact O-ND2 2.87Å
91I96.1Very high93.3Very high0 Ų040.8 Ų40.80%020%0.201CC..Hα-helixtrans-64.5-47.3177-64.2-58.9000111V36 L40 I64 W68 D87 R88 H89 E93 N94 I95 I117V36-I91 HydrophobicContact CG1-CD1 3.94Å; V36-I91 HydrophobicContact CG1-CG1 3.82Å; L40-I91 HydrophobicContact CB-CD1 3.78Å; L40-I91 HydrophobicContact CD2-CD1 3.63Å; L40-I91 HydrophobicContact CG-CD1 4.29Å; I64-I91 HydrophobicContact CD1-CG2 4.22Å; W68-I91 HydrophobicContact CH2-CB 4.08Å; W68-I91 HydrophobicContact CH2-CG2 4.13Å; W68-I91 HydrophobicContact CZ3-CB 4.14Å; W68-I91 HydrophobicContact CZ3-CG1 4.5Å; W68-I91 HydrophobicContact CZ3-CG2 4.11Å; D87-I91 WeakPolarHBondContact O-CG1 3.41Å; D87-I91 PolarHBondContact O-N 3.1Å; R88-I91 PolarHBondContact O-N 3.26Å; H89-I91 VanDerWaalsContact C-N 3.33Å; H89-I91 PolarHBondContact O-N 3.01Å; I91-E93 PolarHBondContact O-N 3.02Å; I91-N94 PolarHBondContact O-N 3.39Å; I91-N94 VanDerWaalsContact O-N 3.09Å; I91-I95 HydrophobicContact CG2-CB 4.26Å; I91-I95 HydrophobicContact CG2-CD1 4.02Å; I91-I95 VanDerWaalsContact O-CB 3.25Å; I91-I95 WeakPolarHBondContact O-CB 3.37Å; I91-I95 WeakPolarHBondContact O-CG2 3.46Å; I91-I95 PolarHBondContact O-N 3.36Å; I91-I117 HydrophobicContact CG2-CD1 3.66Å
92R95.2Very high93.8Very high8 Ų838.5 Ų38.53%0.0319%0.193CC..Hα-helixtrans-56-39.6175.9-72.8-178.4-155.4118.5-2.4112.3W68 E85 R88 H89 N94 I117 D121 W126W68-R92 HydrophobicContact CH2-CG 4.38Å; W68-R92 HydrophobicContact CZ2-CG 4.23Å; E85-R92 IonicContact OE1-CZ 2.75Å; E85-R92 IonicContact OE1-NH1 2.93Å; E85-R92 PolarHBondContact OE1-NH1 3.24Å; E85-R92 IonicContact OE1-NH2 3.9Å; E85-R92 PolarHBondContact OE1-NH2 3.43Å; E85-R92 IonicContact OE2-NH2 3.44Å; R88-R92 WeakPolarHBondContact O-CG 3.09Å; R88-R92 PolarHBondContact O-N 3.06Å; H89-R92 PolarHBondContact O-N 2.88Å; R92-N94 VanDerWaalsContact C-N 3.31Å; R92-N94 PolarHBondContact O-N 2.94Å; R92-I117 HydrophobicContact CG-CG2 4.16Å; R92-D121 IonicContact CZ-OD2 2.85Å; R92-D121 IonicContact NE-OD2 3.08Å; R92-D121 PolarHBondContact NE-OD2 3.28Å; R92-D121 IonicContact NH2-OD1 2.9Å; R92-D121 IonicContact NH2-OD2 3.93Å; R92-D121 PolarHBondContact NH2-OD2 3Å; R92-W126 HydrophobicContact CB-CD2 4.25Å; R92-W126 HydrophobicContact CB-CZ2 3.95Å; R92-W126 HydrophobicContact CG-CD2 3.86Å; R92-W126 HydrophobicContact CG-CE3 4.33Å; R92-W126 HydrophobicContact CG-CG 4.1Å; R92-W126 HydrophobicContact CG-CZ2 4.23Å; R92-W126 VanDerWaalsContact O-CZ2 3.29Å; R92-W126 WeakPolarHBondContact O-CZ2 3.23Å
93E94.4Very high94.1Very high82 Ų8238.3 Ų38.338%0.38319%0.193SC..Hα-helixtrans-70.6-20.6179.3-76.9-58.413200114.3H89 C90 I91 K132H89-E93 IonicContact CE1-OE1 3.07Å; H89-E93 WeakPolarHBondContact O-CG 3.39Å; H89-E93 PolarHBondContact O-N 3.35Å; C90-E93 PolarHBondContact O-N 3.33Å; I91-E93 PolarHBondContact O-N 3.02Å; E93-K132 PolarHBondContact O-NZ 2.73Å
94N96.1Very high94.1Very high78 Ų7845 Ų4542%0.41722%0.224SC..Hα-helixtrans-124.5-17-171-66.2-80000115L40 C90 I91 R92 V96 E97 A98L40-N94 HydrophobicContact CD2-CB 3.84Å; C90-N94 PolarHBondContact O-N 3.27Å; C90-N94 PolarHBondContact O-ND2 2.87Å; I91-N94 PolarHBondContact O-N 3.39Å; I91-N94 VanDerWaalsContact O-N 3.09Å; R92-N94 VanDerWaalsContact C-N 3.31Å; R92-N94 PolarHBondContact O-N 2.94Å; N94-V96 VanDerWaalsContact C-N 3.31Å; N94-V96 PolarHBondContact O-N 2.89Å; N94-E97 PolarHBondContact O-N 3.17Å; N94-A98 WeakPolarHBondContact O-CB 3.41Å; N94-A98 PolarHBondContact O-N 3.39Å
95I97Very high94.2Very high0 Ų048 Ų480%024%0.238CC..Hα-helixtrans-63-35.5-172.5-165.992.9000112.4I91 A98 I99 L110 C113 I114 W126I91-I95 HydrophobicContact CG2-CB 4.26Å; I91-I95 HydrophobicContact CG2-CD1 4.02Å; I91-I95 VanDerWaalsContact O-CB 3.25Å; I91-I95 WeakPolarHBondContact O-CB 3.37Å; I91-I95 WeakPolarHBondContact O-CG2 3.46Å; I91-I95 PolarHBondContact O-N 3.36Å; I95-A98 WeakPolarHBondContact O-CB 3.43Å; I95-A98 PolarHBondContact O-N 3.26Å; I95-I99 HydrophobicContact CG1-CD1 4.26Å; I95-I99 VanDerWaalsContact O-CG1 3.3Å; I95-I99 WeakPolarHBondContact O-CG1 3.32Å; I95-I99 PolarHBondContact O-N 3.42Å; I95-L110 HydrophobicContact CD1-CD2 3.94Å; I95-C113 HydrophobicContact CD1-CB 4.02Å; I95-I114 HydrophobicContact CG1-CB 4.34Å; I95-I114 HydrophobicContact CG2-CD1 4.06Å; I95-I114 HydrophobicContact CG2-CG1 4.2Å; I95-W126 HydrophobicContact CG2-CH2 3.74Å; I95-W126 HydrophobicContact CG2-CZ2 4.23Å
96V96.6Very high94.5Very high0 Ų043.5 Ų43.50%022%0.216CC..Hα-helixtrans-65.5-48.4-179.8174.90000110.5N94 A98 I99 I100 I114 I129 K132 Y136 I148N94-V96 VanDerWaalsContact C-N 3.31Å; N94-V96 PolarHBondContact O-N 2.89Å; V96-A98 VanDerWaalsContact C-N 3.29Å; V96-A98 PolarHBondContact O-N 2.87Å; V96-I99 PolarHBondContact O-N 3.3Å; V96-I100 HydrophobicContact CG1-CD1 4.15Å; V96-I100 WeakPolarHBondContact O-CG1 3.4Å; V96-I100 PolarHBondContact O-N 2.91Å; V96-I114 HydrophobicContact CG2-CD1 4.05Å; V96-I129 HydrophobicContact CG2-CD1 3.52Å; V96-K132 HydrophobicContact CB-CD 4.26Å; V96-K132 HydrophobicContact CG2-CD 4.14Å; V96-Y136 HydrophobicContact CG1-CD2 4.29Å; V96-Y136 HydrophobicContact CG1-CE2 4.45Å; V96-I148 HydrophobicContact CG1-CD1 3.48Å; V96-I148 VanDerWaalsContact CG1-CD1 3.48Å
97E95.6Very high94.8Very high41 Ų4140.4 Ų40.419%0.19220%0.199CC..Hα-helixtrans-65.3-35.2176.7-65.577.4-173.700110.9N94 I100 H101 K132 Y136N94-E97 PolarHBondContact O-N 3.17Å; E97-I100 PolarHBondContact O-N 3.4Å; E97-H101 PolarHBondContact O-N 3.26Å; E97-H101 VanDerWaalsContact O-N 3.11Å; E97-H101 PolarHBondContact O-ND1 3.04Å; E97-K132 VanDerWaalsContact CD-NZ 3.3Å; E97-K132 IonicContact OE1-NZ 2.74Å; E97-K132 PolarHBondContact OE1-NZ 2.87Å; E97-K132 IonicContact OE2-NZ 3.2Å; E97-K132 PolarHBondContact OE2-NZ 2.76Å; E97-Y136 HydrophobicContact CG-CE2 4.39Å; E97-Y136 WeakPolarHBondContact CG-OH 3.28Å; E97-Y136 PolarHBondContact OE1-OH 3.19Å
98A96.7Very high94.8Very high5 Ų544.1 Ų44.14%0.04122%0.222CC..Hα-helixtrans-62.7-42.6173.100000112.1L40 M44 N94 I95 V96 I100 H101 S102 L110L40-A98 HydrophobicContact CD1-CB 3.94Å; M44-A98 HydrophobicContact CE-CB 4.26Å; M44-A98 HydrophobicContact CG-CB 3.95Å; M44-A98 HydrophobicContact SD-CB 3.8Å; N94-A98 WeakPolarHBondContact O-CB 3.41Å; N94-A98 PolarHBondContact O-N 3.39Å; I95-A98 WeakPolarHBondContact O-CB 3.43Å; I95-A98 PolarHBondContact O-N 3.26Å; V96-A98 VanDerWaalsContact C-N 3.29Å; V96-A98 PolarHBondContact O-N 2.87Å; A98-I100 PolarHBondContact O-N 2.77Å; A98-H101 PolarHBondContact O-N 3.4Å; A98-S102 WeakPolarHBondContact O-CB 3.28Å; A98-S102 PolarHBondContact O-N 3.37Å; A98-S102 PolarHBondContact O-OG 3.15Å; A98-L110 HydrophobicContact CB-CD1 3.78Å
99I97Very high94.9Very high0 Ų046 Ų460%023%0.231CC..Hα-helixtrans-64-40.3175.7-70165.5000111.2I95 V96 S102 R107 L110 I114 G147 C151I95-I99 HydrophobicContact CG1-CD1 4.26Å; I95-I99 VanDerWaalsContact O-CG1 3.3Å; I95-I99 WeakPolarHBondContact O-CG1 3.32Å; I95-I99 PolarHBondContact O-N 3.42Å; V96-I99 PolarHBondContact O-N 3.3Å; I99-S102 PolarHBondContact O-OG 3.29Å; I99-R107 HydrophobicContact CG2-CG 3.92Å; I99-R107 WeakPolarHBondContact O-CD 3.46Å; I99-R107 WeakPolarHBondContact O-CG 3.36Å; I99-R107 PolarHBondContact O-NE 2.97Å; I99-L110 HydrophobicContact CD1-CB 4.35Å; I99-L110 HydrophobicContact CG1-CB 3.59Å; I99-L110 HydrophobicContact CG1-CD1 4.35Å; I99-I114 HydrophobicContact CD1-CB 3.95Å; I99-I114 HydrophobicContact CD1-CD1 3.99Å; I99-I114 HydrophobicContact CD1-CG2 3.73Å; I99-G147 WeakPolarHBondContact CG2-O 3.42Å; I99-C151 VanDerWaalsContact CD1-SG 3.59Å
100I95.2Very high95.1Very high14 Ų1440.9 Ų40.97%0.07221%0.208CC..Hα-helixtrans-61.8-46.2178.9-73.5167.4000111.9V96 E97 A98 Y136 C144V96-I100 HydrophobicContact CG1-CD1 4.15Å; V96-I100 WeakPolarHBondContact O-CG1 3.4Å; V96-I100 PolarHBondContact O-N 2.91Å; E97-I100 PolarHBondContact O-N 3.4Å; A98-I100 PolarHBondContact O-N 2.77Å; I100-Y136 HydrophobicContact CD1-CD1 3.81Å; I100-Y136 HydrophobicContact CD1-CD2 3.93Å; I100-Y136 HydrophobicContact CD1-CE1 4.03Å; I100-Y136 HydrophobicContact CD1-CE2 4.15Å; I100-Y136 HydrophobicContact CD1-CG 3.76Å; I100-C144 HydrophobicContact CD1-CB 4.25Å; I100-C144 HydrophobicContact CG1-CB 4.42Å; I100-C144 HydrophobicContact CG2-CB 3.9Å
101H93.9Very high95.3Very high125 Ų12539.7 Ų39.758%0.57920%0.199SC*.Hα-helixtrans-95.6-10.8-170.6-57.599.4000114.2M44 E97 A98M44-H101 HydrophobicContact CE-CB 4.19Å; E97-H101 PolarHBondContact O-N 3.26Å; E97-H101 VanDerWaalsContact O-N 3.11Å; E97-H101 PolarHBondContact O-ND1 3.04Å; A98-H101 PolarHBondContact O-N 3.4Å
102S94.5Very high95.2Very high2 Ų242 Ų421%0.01421%0.214CC..SBendtrans-74.9149.5-177.750.10000112.9A98 I99 R107A98-S102 WeakPolarHBondContact O-CB 3.28Å; A98-S102 PolarHBondContact O-N 3.37Å; A98-S102 PolarHBondContact O-OG 3.15Å; I99-S102 PolarHBondContact O-OG 3.29Å; S102-R107 VanDerWaalsContact O-CZ 3.27Å; S102-R107 PolarHBondContact O-NE 3.28Å; S102-R107 VanDerWaalsContact O-NE 3.13Å; S102-R107 PolarHBondContact O-NH2 2.97Å; S102-R107 WeakPolarHBondContact OG-CA 3.21Å; S102-R107 WeakPolarHBondContact OG-CB 3.44Å
103P93.3Very high95.3Very high46 Ų4641.7 Ų41.730%0.29921%0.212SC..  trans-67.8159.7168.230.5-35.7000111.2L50 L105 I106 R107L50-P103 HydrophobicContact CD1-CG 4.04Å; P103-L105 PolarHBondContact O-N 3.46Å; P103-I106 HydrophobicContact CG-CB 4.17Å; P103-I106 HydrophobicContact CG-CD1 3.77Å; P103-I106 HydrophobicContact CG-CG1 4.02Å; P103-I106 PolarHBondContact O-N 3.27Å; P103-R107 WeakPolarHBondContact O-CB 3.31Å; P103-R107 PolarHBondContact O-N 2.8Å
104E91.2Very high95.4Very high141 Ų14137.8 Ų37.866%0.65919%0.194SC*.Hα-helixtrans-49.7-49.8-172.3-178.4168.5-164.600114.1I106 R107 V108E104-I106 PolarHBondContact O-N 3.19Å; E104-R107 WeakPolarHBondContact O-CB 3.38Å; E104-R107 PolarHBondContact O-N 2.93Å; E104-V108 HydrophobicContact CG-CG2 4.47Å; E104-V108 WeakPolarHBondContact O-CG2 3.46Å; E104-V108 PolarHBondContact O-N 3.46Å
105L91.6Very high95.4Very high101 Ų10136 Ų3653%0.52918%0.183SC..Hα-helixtrans-62-30.1-177.9-62.2172.9000113.3L50 P103L50-L105 HydrophobicContact CD2-CD1 4.35Å; P103-L105 PolarHBondContact O-N 3.46Å
106I96.3Very high95.4Very high0 Ų037.9 Ų37.90%019%0.192CC..Hα-helixtrans-83.1-40.3173.7-64.9178.4000110.1T43 L50 R53 V57 P103 E104 V108 Q109 L110T43-I106 HydrophobicContact CG2-CG2 3.58Å; L50-I106 HydrophobicContact CD1-CD1 3.95Å; L50-I106 HydrophobicContact CD1-CG1 4.23Å; R53-I106 HydrophobicContact CB-CD1 3.63Å; V57-I106 HydrophobicContact CB-CG2 4.28Å; V57-I106 HydrophobicContact CG1-CG1 4.48Å; V57-I106 HydrophobicContact CG1-CG2 4.41Å; V57-I106 HydrophobicContact CG2-CG2 4.09Å; P103-I106 HydrophobicContact CG-CB 4.17Å; P103-I106 HydrophobicContact CG-CD1 3.77Å; P103-I106 HydrophobicContact CG-CG1 4.02Å; P103-I106 PolarHBondContact O-N 3.27Å; E104-I106 PolarHBondContact O-N 3.19Å; I106-V108 VanDerWaalsContact C-N 3.34Å; I106-V108 PolarHBondContact O-N 3.32Å; I106-Q109 PolarHBondContact O-N 3.44Å; I106-Q109 VanDerWaalsContact O-N 3.16Å; I106-L110 HydrophobicContact CG2-CD1 3.87Å; I106-L110 HydrophobicContact CG2-CG 4.13Å; I106-L110 PolarHBondContact O-N 3.12Å
107R96Very high95.4Very high53 Ų5337.9 Ų37.920%0.219%0.192CC..Hα-helixtrans-60.4-40.8-176.7-164.8-176.6-50.7135-0.4112.5I99 S102 P103 E104 Q109 L110 T111 L150I99-R107 HydrophobicContact CG2-CG 3.92Å; I99-R107 WeakPolarHBondContact O-CD 3.46Å; I99-R107 WeakPolarHBondContact O-CG 3.36Å; I99-R107 PolarHBondContact O-NE 2.97Å; S102-R107 VanDerWaalsContact O-CZ 3.27Å; S102-R107 PolarHBondContact O-NE 3.28Å; S102-R107 VanDerWaalsContact O-NE 3.13Å; S102-R107 PolarHBondContact O-NH2 2.97Å; S102-R107 WeakPolarHBondContact OG-CA 3.21Å; S102-R107 WeakPolarHBondContact OG-CB 3.44Å; P103-R107 WeakPolarHBondContact O-CB 3.31Å; P103-R107 PolarHBondContact O-N 2.8Å; E104-R107 WeakPolarHBondContact O-CB 3.38Å; E104-R107 PolarHBondContact O-N 2.93Å; R107-Q109 VanDerWaalsContact C-N 3.32Å; R107-Q109 PolarHBondContact O-N 3.44Å; R107-L110 PolarHBondContact O-N 3.29Å; R107-T111 WeakPolarHBondContact O-CB 3.5Å; R107-T111 PolarHBondContact O-N 2.99Å; R107-T111 PolarHBondContact O-OG1 2.86Å; R107-L150 VanDerWaalsContact CD-CD1 3.48Å; R107-L150 HydrophobicContact CG-CD1 3.99Å
108V93.8Very high95.4Very high79 Ų7935.9 Ų35.948%0.47918%0.183SC..Hα-helixtrans-58.3-46.5176.2174.80000110.4E104 I106 T111 T112E104-V108 HydrophobicContact CG-CG2 4.47Å; E104-V108 WeakPolarHBondContact O-CG2 3.46Å; E104-V108 PolarHBondContact O-N 3.46Å; I106-V108 VanDerWaalsContact C-N 3.34Å; I106-V108 PolarHBondContact O-N 3.32Å; V108-T111 WeakPolarHBondContact O-CB 3.42Å; V108-T111 PolarHBondContact O-N 3.31Å; V108-T112 PolarHBondContact O-N 3.26Å; V108-T112 VanDerWaalsContact O-N 3.14Å; V108-T112 PolarHBondContact O-OG1 3.17Å
109Q96.1Very high95.3Very high47 Ų4741.2 Ų41.222%0.2221%0.205CC..Hα-helixtrans-67.3-42.4-179.6-54-61.9-32.500111.8V57 I106 R107 T111 T112 C113V57-Q109 HydrophobicContact CB-CB 4.23Å; V57-Q109 HydrophobicContact CG1-CB 3.65Å; V57-Q109 HydrophobicContact CG1-CG 3.74Å; V57-Q109 HydrophobicContact CG2-CB 3.58Å; I106-Q109 PolarHBondContact O-N 3.44Å; I106-Q109 VanDerWaalsContact O-N 3.16Å; R107-Q109 VanDerWaalsContact C-N 3.32Å; R107-Q109 PolarHBondContact O-N 3.44Å; Q109-T111 VanDerWaalsContact C-N 3.26Å; Q109-T111 PolarHBondContact O-N 2.94Å; Q109-T112 WeakPolarHBondContact O-CB 3.35Å; Q109-T112 PolarHBondContact O-N 3.01Å; Q109-T112 VanDerWaalsContact O-N 3.15Å; Q109-C113 PolarHBondContact O-N 2.92Å; Q109-C113 PolarHBondContact O-SG 3.46Å
110L97.7Very high95.1Very high0 Ų044.7 Ų44.70%022%0.221CC..Hα-helixtrans-64-31.4174.1-67.9176.6000112.8L40 M44 V57 L60 I95 A98 I99 I106 R107 T112 C113 I114L40-L110 HydrophobicContact CD1-CD2 4.01Å; M44-L110 HydrophobicContact SD-CD1 4.2Å; V57-L110 HydrophobicContact CG2-CD2 3.71Å; V57-L110 HydrophobicContact CG2-CG 3.82Å; L60-L110 HydrophobicContact CD2-CD2 4.09Å; I95-L110 HydrophobicContact CD1-CD2 3.94Å; A98-L110 HydrophobicContact CB-CD1 3.78Å; I99-L110 HydrophobicContact CD1-CB 4.35Å; I99-L110 HydrophobicContact CG1-CB 3.59Å; I99-L110 HydrophobicContact CG1-CD1 4.35Å; I106-L110 HydrophobicContact CG2-CD1 3.87Å; I106-L110 HydrophobicContact CG2-CG 4.13Å; I106-L110 PolarHBondContact O-N 3.12Å; R107-L110 PolarHBondContact O-N 3.29Å; L110-T112 VanDerWaalsContact C-N 3.31Å; L110-C113 WeakPolarHBondContact O-CB 3.35Å; L110-C113 PolarHBondContact O-N 3.13Å; L110-I114 PolarHBondContact O-N 3.01Å
111T96.6Very high95.1Very high11 Ų1144.1 Ų44.17%0.06722%0.218CC..Hα-helixtrans-67.4-35.1175-58.10000110.9R107 V108 Q109 I114 H115 L150 Q154R107-T111 WeakPolarHBondContact O-CB 3.5Å; R107-T111 PolarHBondContact O-N 2.99Å; R107-T111 PolarHBondContact O-OG1 2.86Å; V108-T111 WeakPolarHBondContact O-CB 3.42Å; V108-T111 PolarHBondContact O-N 3.31Å; Q109-T111 VanDerWaalsContact C-N 3.26Å; Q109-T111 PolarHBondContact O-N 2.94Å; T111-I114 WeakPolarHBondContact O-CG2 3.17Å; T111-H115 PolarHBondContact O-N 2.92Å; T111-L150 HydrophobicContact CG2-CB 4.3Å; T111-Q154 HydrophobicContact CG2-CG 3.58Å
112T94.8Very high95.1Very high50 Ų5039.2 Ų39.231%0.30720%0.195SC..Hα-helixtrans-65.4-42.9169.4-52.90000111.2K61 V108 Q109 L110 I114 H115 H116K61-T112 HydrophobicContact CD-CG2 4.02Å; K61-T112 HydrophobicContact CG-CG2 4Å; V108-T112 PolarHBondContact O-N 3.26Å; V108-T112 VanDerWaalsContact O-N 3.14Å; V108-T112 PolarHBondContact O-OG1 3.17Å; Q109-T112 WeakPolarHBondContact O-CB 3.35Å; Q109-T112 PolarHBondContact O-N 3.01Å; Q109-T112 VanDerWaalsContact O-N 3.15Å; L110-T112 VanDerWaalsContact C-N 3.31Å; T112-I114 PolarHBondContact O-N 3.34Å; T112-H115 WeakPolarHBondContact O-CB 3.33Å; T112-H115 PolarHBondContact O-N 3.39Å; T112-H116 PolarHBondContact O-CD2 3.16Å; T112-H116 PolarHBondContact O-N 3.47Å
113C97.2Very high94.9Very high0 Ų041.7 Ų41.70%021%0.211CC..Hα-helixtrans-56.5-51.3176-60.20000112.1K61 I64 I95 Q109 L110 H115 H116 I117K61-C113 VanDerWaalsContact CA-SG 3.5Å; I64-C113 HydrophobicContact CD1-CB 3.67Å; I64-C113 HydrophobicContact CG2-CB 4.44Å; I95-C113 HydrophobicContact CD1-CB 4.02Å; Q109-C113 PolarHBondContact O-N 2.92Å; Q109-C113 PolarHBondContact O-SG 3.46Å; L110-C113 WeakPolarHBondContact O-CB 3.35Å; L110-C113 PolarHBondContact O-N 3.13Å; C113-H115 VanDerWaalsContact C-N 3.26Å; C113-H115 PolarHBondContact O-N 3.43Å; C113-H116 PolarHBondContact O-N 3.15Å; C113-I117 WeakPolarHBondContact O-CG1 3.43Å; C113-I117 PolarHBondContact O-N 2.74Å; C113-I117 VanDerWaalsContact O-N 3.07Å
114I96.9Very high94.7Very high0 Ų044 Ų440%023%0.228CC..Hα-helixtrans-65.7-30.1-178-157.8174.8000112.2I95 V96 I99 L110 T111 T112 I117 I118 W126 I129 C151 Q154I95-I114 HydrophobicContact CG1-CB 4.34Å; I95-I114 HydrophobicContact CG2-CD1 4.06Å; I95-I114 HydrophobicContact CG2-CG1 4.2Å; V96-I114 HydrophobicContact CG2-CD1 4.05Å; I99-I114 HydrophobicContact CD1-CB 3.95Å; I99-I114 HydrophobicContact CD1-CD1 3.99Å; I99-I114 HydrophobicContact CD1-CG2 3.73Å; L110-I114 PolarHBondContact O-N 3.01Å; T111-I114 WeakPolarHBondContact O-CG2 3.17Å; T112-I114 PolarHBondContact O-N 3.34Å; I114-I117 PolarHBondContact O-N 3.22Å; I114-I118 HydrophobicContact CG1-CD1 4.07Å; I114-I118 HydrophobicContact CG1-CG1 4.31Å; I114-I118 WeakPolarHBondContact O-CB 3.34Å; I114-I118 VanDerWaalsContact O-CG1 3.25Å; I114-I118 WeakPolarHBondContact O-CG1 3.43Å; I114-I118 PolarHBondContact O-N 3.43Å; I114-W126 HydrophobicContact CD1-CH2 4Å; I114-W126 HydrophobicContact CD1-CZ3 4.43Å; I114-W126 HydrophobicContact CG1-CH2 3.93Å; I114-W126 HydrophobicContact CG1-CZ3 3.97Å; I114-I129 HydrophobicContact CD1-CD1 3.96Å; I114-C151 HydrophobicContact CD1-CB 4.02Å; I114-Q154 HydrophobicContact CG2-CB 4.18Å; I114-Q154 HydrophobicContact CG2-CG 3.87Å
115H96.4Very high94.6Very high41 Ų4143.6 Ų43.619%0.1922%0.22CC..Hα-helixtrans-59.2-50.3173-179.774.5000111.7T111 T112 C113 I117 I118 K119 Q154T111-H115 PolarHBondContact O-N 2.92Å; T112-H115 WeakPolarHBondContact O-CB 3.33Å; T112-H115 PolarHBondContact O-N 3.39Å; C113-H115 VanDerWaalsContact C-N 3.26Å; C113-H115 PolarHBondContact O-N 3.43Å; H115-I117 VanDerWaalsContact C-N 3.34Å; H115-I117 PolarHBondContact O-N 3.13Å; H115-I118 PolarHBondContact O-N 3.07Å; H115-K119 WeakPolarHBondContact O-CB 3.09Å; H115-K119 PolarHBondContact O-N 2.74Å; H115-Q154 HydrophobicContact CB-CB 4.15Å; H115-Q154 HydrophobicContact CB-CG 4.05Å; H115-Q154 PolarHBondContact ND1-OE1 3.39Å; H115-Q154 VanDerWaalsContact ND1-OE1 3.14Å
116H95.7Very high94.7Very high39 Ų3939.2 Ų39.218%0.18120%0.196CC..Hα-helixtrans-63-38.8176.5-76.3-78.9000112.4I64 T112 C113 K119 H120I64-H116 HydrophobicContact CG2-CB 4.05Å; T112-H116 PolarHBondContact O-CD2 3.16Å; T112-H116 PolarHBondContact O-N 3.47Å; C113-H116 PolarHBondContact O-N 3.15Å; H116-K119 PolarHBondContact O-N 3.4Å; H116-H120 PolarHBondContact O-CD2 2.56Å; H116-H120 PolarHBondContact O-N 3.44Å
117I96.8Very high94.4Very high0 Ų043.4 Ų43.40%022%0.222CC..Hα-helixtrans-63.5-48.3176.8-61.3167.8000110.5I64 W68 I91 R92 C113 I114 H115 K119 H120 D121 W126I64-I117 HydrophobicContact CD1-CD1 4.41Å; I64-I117 HydrophobicContact CG2-CG1 4.01Å; W68-I117 HydrophobicContact CD2-CG1 3.97Å; W68-I117 HydrophobicContact CE3-CG1 4.16Å; W68-I117 HydrophobicContact CH2-CD1 3.95Å; W68-I117 HydrophobicContact CH2-CG1 3.9Å; W68-I117 HydrophobicContact CH2-CG2 4.31Å; W68-I117 HydrophobicContact CZ2-CB 4.19Å; W68-I117 HydrophobicContact CZ2-CD1 4.22Å; W68-I117 HydrophobicContact CZ2-CG1 3.73Å; W68-I117 HydrophobicContact CZ2-CG2 3.58Å; W68-I117 HydrophobicContact CZ3-CD1 4.2Å; W68-I117 HydrophobicContact CZ3-CG1 4.13Å; I91-I117 HydrophobicContact CG2-CD1 3.66Å; R92-I117 HydrophobicContact CG-CG2 4.16Å; C113-I117 WeakPolarHBondContact O-CG1 3.43Å; C113-I117 PolarHBondContact O-N 2.74Å; C113-I117 VanDerWaalsContact O-N 3.07Å; I114-I117 PolarHBondContact O-N 3.22Å; H115-I117 VanDerWaalsContact C-N 3.34Å; H115-I117 PolarHBondContact O-N 3.13Å; I117-K119 VanDerWaalsContact C-N 3.3Å; I117-K119 PolarHBondContact O-N 3.17Å; I117-H120 PolarHBondContact O-N 2.91Å; I117-D121 VanDerWaalsContact O-CB 3.32Å; I117-D121 WeakPolarHBondContact O-CB 3.46Å; I117-D121 PolarHBondContact O-N 2.72Å; I117-W126 HydrophobicContact CB-CZ3 4.12Å; I117-W126 HydrophobicContact CG2-CD2 4.42Å; I117-W126 HydrophobicContact CG2-CE3 3.48Å; I117-W126 VanDerWaalsContact CG2-CE3 3.48Å; I117-W126 HydrophobicContact CG2-CH2 4.3Å; I117-W126 HydrophobicContact CG2-CZ3 3.4Å; I117-W126 VanDerWaalsContact CG2-CZ3 3.4Å
118I96Very high94.3Very high0 Ų042.5 Ų42.50%023%0.226CC..Hα-helixtrans-58.5-44177.8-73.3168.8000110.7I114 H115 H120 D121 Y122 W126 Q154 L155 N158I114-I118 HydrophobicContact CG1-CD1 4.07Å; I114-I118 HydrophobicContact CG1-CG1 4.31Å; I114-I118 WeakPolarHBondContact O-CB 3.34Å; I114-I118 VanDerWaalsContact O-CG1 3.25Å; I114-I118 WeakPolarHBondContact O-CG1 3.43Å; I114-I118 PolarHBondContact O-N 3.43Å; H115-I118 PolarHBondContact O-N 3.07Å; I118-H120 PolarHBondContact O-N 2.89Å; I118-D121 PolarHBondContact O-N 2.93Å; I118-Y122 PolarHBondContact O-N 2.67Å; I118-W126 HydrophobicContact CG1-CZ3 4.16Å; I118-Q154 HydrophobicContact CD1-CB 4.01Å; I118-L155 HydrophobicContact CD1-CB 4.2Å; I118-L155 HydrophobicContact CG2-CD1 3.88Å; I118-N158 HydrophobicContact CG2-CB 3.93Å
119K94Very high94.4Very high117 Ų11738.8 Ų38.851%0.50920%0.204SC..Hα-helixtrans-54.1-40.5-179.6-178.6179.2178.8178.50113H115 H116 I117 N158H115-K119 WeakPolarHBondContact O-CB 3.09Å; H115-K119 PolarHBondContact O-N 2.74Å; H116-K119 PolarHBondContact O-N 3.4Å; I117-K119 VanDerWaalsContact C-N 3.3Å; I117-K119 PolarHBondContact O-N 3.17Å; K119-N158 WeakPolarHBondContact CA-OD1 3.35Å; K119-N158 WeakPolarHBondContact CB-OD1 3.31Å
120H92.7Very high94.3Very high72 Ų7237.9 Ų37.933%0.33320%0.201SC..Hα-helixtrans-96.3-28-176-67.9-68.6000114H116 I117 I118H116-H120 PolarHBondContact O-CD2 2.56Å; H116-H120 PolarHBondContact O-N 3.44Å; I117-H120 PolarHBondContact O-N 2.91Å; I118-H120 PolarHBondContact O-N 2.89Å
121D94.7Very high94.1Very high2 Ų243.4 Ų43.41%0.01123%0.231CC..Hα-helixtrans-110.1-18.8-169.7-68.1-19.9000115W68 R92 I117 I118 S124 R125 W126W68-D121 WeakPolarHBondContact CZ2-OD2 3.39Å; W68-D121 PolarHBondContact NE1-OD2 3.17Å; R92-D121 IonicContact CZ-OD2 2.85Å; R92-D121 IonicContact NE-OD2 3.08Å; R92-D121 PolarHBondContact NE-OD2 3.28Å; R92-D121 IonicContact NH2-OD1 2.9Å; R92-D121 IonicContact NH2-OD2 3.93Å; R92-D121 PolarHBondContact NH2-OD2 3Å; I117-D121 VanDerWaalsContact O-CB 3.32Å; I117-D121 WeakPolarHBondContact O-CB 3.46Å; I117-D121 PolarHBondContact O-N 2.72Å; I118-D121 PolarHBondContact O-N 2.93Å; D121-S124 PolarHBondContact O-N 3.03Å; D121-R125 HydrophobicContact CB-CB 3.99Å; D121-R125 CarbonylContact O-C 3.54Å; D121-R125 WeakPolarHBondContact O-CA 3.34Å; D121-R125 PolarHBondContact O-N 3.32Å; D121-W126 HydrophobicContact CB-CB 3.8Å; D121-W126 PolarHBondContact O-N 3.26Å
122Y93.9Very high94Very high23 Ų2344.3 Ų44.39%0.0923%0.234CC..THydrogen-bonded Turntrans-101.9129.1-179.4179.7-91.5000111.9I118 I129 V130 L155 Y159 P169I118-Y122 PolarHBondContact O-N 2.67Å; Y122-I129 HydrophobicContact CD2-CG2 3.71Å; Y122-I129 HydrophobicContact CE2-CG2 4.27Å; Y122-I129 HydrophobicContact CG-CG2 4.42Å; Y122-V130 HydrophobicContact CD2-CG2 4.43Å; Y122-V130 HydrophobicContact CE2-CG2 3.51Å; Y122-L155 HydrophobicContact CD1-CD1 3.43Å; Y122-L155 VanDerWaalsContact CD1-CD1 3.43Å; Y122-L155 HydrophobicContact CD2-CD1 4.43Å; Y122-L155 HydrophobicContact CE1-CD1 3.57Å; Y122-L155 HydrophobicContact CG-CD1 3.9Å; Y122-Y159 AromaticContact CD1-CE2 3.83Å; Y122-Y159 HydrophobicContact CD1-CE2 3.83Å; Y122-Y159 AromaticContact CD1-CZ 3.99Å; Y122-Y159 VanDerWaalsContact CD1-OH 3.31Å; Y122-Y159 WeakPolarHBondContact CD1-OH 3.18Å; Y122-Y159 AromaticContact CE1-CE2 3.97Å; Y122-Y159 HydrophobicContact CE1-CE2 3.97Å; Y122-Y159 PolarHBondContact O-OH 3.39Å; Y122-P169 HydrophobicContact CE1-CB 3.88Å; Y122-P169 PolarHBondContact OH-O 3.36Å; Y122-P169 VanDerWaalsContact OH-O 3.13Å
123P91.1Very high94.1Very high54 Ų5442 Ų4235%0.35122%0.219SC..THydrogen-bonded Turncis-94.2-2.59.338.2-37.7000114.9T127 Y159 P169P123-T127 WeakPolarHBondContact O-CG2 3.38Å; P123-Y159 WeakPolarHBondContact CD-OH 3.5Å; P123-P169 HydrophobicContact CB-CB 4.04Å; P123-P169 HydrophobicContact CB-CG 4.48Å; P123-P169 HydrophobicContact CG-CB 3.86Å; P123-P169 HydrophobicContact CG-CG 3.77Å
124S88.2Confident93.9Very high94 Ų9442.2 Ų42.266%0.65722%0.222SC*.THydrogen-bonded Turntrans-69.9-50.3-165.356.30000114.8D121D121-S124 PolarHBondContact O-N 3.03Å
125R89Confident93.8Very high132 Ų13248.9 Ų48.950%0.49825%0.251SS..THydrogen-bonded Turntrans-105.6-19.8-173.3-65.3-179.6179.2-1781.6113.7D70 D121D70-R125 IonicContact OD1-NH1 3.28Å; D70-R125 IonicContact OD2-CZ 2.62Å; D70-R125 IonicContact OD2-NH1 2.72Å; D70-R125 PolarHBondContact OD2-NH1 3.17Å; D70-R125 IonicContact OD2-NH2 2.76Å; D70-R125 PolarHBondContact OD2-NH2 3.28Å; D121-R125 HydrophobicContact CB-CB 3.99Å; D121-R125 CarbonylContact O-C 3.54Å; D121-R125 WeakPolarHBondContact O-CA 3.34Å; D121-R125 PolarHBondContact O-N 3.32Å
126W93.8Very high93.7Very high9 Ų949 Ų493%0.03425%0.25CS..  trans-138.366.7-173.5-167.435.1000114R92 I95 I114 I117 I118 D121 A128 I129R92-W126 HydrophobicContact CB-CD2 4.25Å; R92-W126 HydrophobicContact CB-CZ2 3.95Å; R92-W126 HydrophobicContact CG-CD2 3.86Å; R92-W126 HydrophobicContact CG-CE3 4.33Å; R92-W126 HydrophobicContact CG-CG 4.1Å; R92-W126 HydrophobicContact CG-CZ2 4.23Å; R92-W126 VanDerWaalsContact O-CZ2 3.29Å; R92-W126 WeakPolarHBondContact O-CZ2 3.23Å; I95-W126 HydrophobicContact CG2-CH2 3.74Å; I95-W126 HydrophobicContact CG2-CZ2 4.23Å; I114-W126 HydrophobicContact CD1-CH2 4Å; I114-W126 HydrophobicContact CD1-CZ3 4.43Å; I114-W126 HydrophobicContact CG1-CH2 3.93Å; I114-W126 HydrophobicContact CG1-CZ3 3.97Å; I117-W126 HydrophobicContact CB-CZ3 4.12Å; I117-W126 HydrophobicContact CG2-CD2 4.42Å; I117-W126 HydrophobicContact CG2-CE3 3.48Å; I117-W126 VanDerWaalsContact CG2-CE3 3.48Å; I117-W126 HydrophobicContact CG2-CH2 4.3Å; I117-W126 HydrophobicContact CG2-CZ3 3.4Å; I117-W126 VanDerWaalsContact CG2-CZ3 3.4Å; I118-W126 HydrophobicContact CG1-CZ3 4.16Å; D121-W126 HydrophobicContact CB-CB 3.8Å; D121-W126 PolarHBondContact O-N 3.26Å; W126-A128 VanDerWaalsContact C-N 3.33Å; W126-A128 PolarHBondContact O-N 3.26Å; W126-I129 HydrophobicContact CD2-CB 3.95Å; W126-I129 HydrophobicContact CD2-CG2 4.46Å; W126-I129 HydrophobicContact CE3-CB 4.09Å; W126-I129 HydrophobicContact CE3-CG1 4.48Å; W126-I129 HydrophobicContact CE3-CG2 4.48Å; W126-I129 HydrophobicContact CH2-CB 4.27Å; W126-I129 HydrophobicContact CH2-CD1 3.74Å; W126-I129 HydrophobicContact CH2-CG1 4.13Å; W126-I129 HydrophobicContact CZ2-CB 4.1Å; W126-I129 HydrophobicContact CZ2-CD1 3.92Å; W126-I129 HydrophobicContact CZ2-CG1 4.35Å; W126-I129 HydrophobicContact CZ3-CB 4.25Å; W126-I129 HydrophobicContact CZ3-CD1 4.27Å; W126-I129 HydrophobicContact CZ3-CG1 4.18Å; W126-I129 VanDerWaalsContact O-CG2 3.25Å; W126-I129 WeakPolarHBondContact O-CG2 3.49Å
127T91.2Very high93.6Very high89 Ų8947.3 Ų47.355%0.54624%0.243SC..THydrogen-bonded Turntrans-68.1-30174.553.50000113.5P123 I129 V130P123-T127 WeakPolarHBondContact O-CG2 3.38Å; T127-I129 PolarHBondContact O-N 2.64Å; T127-V130 PolarHBondContact O-N 3.47Å; T127-V130 VanDerWaalsContact O-N 3.1Å
128A93.3Very high93.3Very high34 Ų3451.9 Ų51.928%0.28126%0.264SS..Hα-helixtrans-60.2-16.7-17600000114.7W126 V130 D131 K132W126-A128 VanDerWaalsContact C-N 3.33Å; W126-A128 PolarHBondContact O-N 3.26Å; A128-V130 PolarHBondContact O-N 3.34Å; A128-D131 PolarHBondContact O-N 2.99Å; A128-K132 PolarHBondContact O-N 2.89Å
129I95.3Very high93.1Very high0 Ų053.3 Ų53.30%027%0.274CS..Hα-helixtrans-58.7-37.7173.4-173.652.1000111.9V96 I114 Y122 W126 T127 K132 I133V96-I129 HydrophobicContact CG2-CD1 3.52Å; I114-I129 HydrophobicContact CD1-CD1 3.96Å; Y122-I129 HydrophobicContact CD2-CG2 3.71Å; Y122-I129 HydrophobicContact CE2-CG2 4.27Å; Y122-I129 HydrophobicContact CG-CG2 4.42Å; W126-I129 HydrophobicContact CD2-CB 3.95Å; W126-I129 HydrophobicContact CD2-CG2 4.46Å; W126-I129 HydrophobicContact CE3-CB 4.09Å; W126-I129 HydrophobicContact CE3-CG1 4.48Å; W126-I129 HydrophobicContact CE3-CG2 4.48Å; W126-I129 HydrophobicContact CH2-CB 4.27Å; W126-I129 HydrophobicContact CH2-CD1 3.74Å; W126-I129 HydrophobicContact CH2-CG1 4.13Å; W126-I129 HydrophobicContact CZ2-CB 4.1Å; W126-I129 HydrophobicContact CZ2-CD1 3.92Å; W126-I129 HydrophobicContact CZ2-CG1 4.35Å; W126-I129 HydrophobicContact CZ3-CB 4.25Å; W126-I129 HydrophobicContact CZ3-CD1 4.27Å; W126-I129 HydrophobicContact CZ3-CG1 4.18Å; W126-I129 VanDerWaalsContact O-CG2 3.25Å; W126-I129 WeakPolarHBondContact O-CG2 3.49Å; T127-I129 PolarHBondContact O-N 2.64Å; I129-K132 PolarHBondContact O-N 3.15Å; I129-I133 HydrophobicContact CD1-CD1 4.1Å; I129-I133 HydrophobicContact CD1-CG1 4.2Å; I129-I133 HydrophobicContact CG1-CD1 3.9Å; I129-I133 HydrophobicContact CG1-CG1 4.45Å; I129-I133 WeakPolarHBondContact O-CB 3.34Å; I129-I133 VanDerWaalsContact O-CG1 3.23Å; I129-I133 WeakPolarHBondContact O-CG1 3.49Å; I129-I133 PolarHBondContact O-N 3.04Å
130V95.1Very high92.7Very high28 Ų2855.1 Ų55.117%0.1729%0.289CS..Hα-helixtrans-65.8-43.4177.6176.60000109.9Y122 T127 A128 K132 I133 G134 L155 A173 F177Y122-V130 HydrophobicContact CD2-CG2 4.43Å; Y122-V130 HydrophobicContact CE2-CG2 3.51Å; T127-V130 PolarHBondContact O-N 3.47Å; T127-V130 VanDerWaalsContact O-N 3.1Å; A128-V130 PolarHBondContact O-N 3.34Å; V130-K132 PolarHBondContact O-N 2.97Å; V130-I133 PolarHBondContact O-N 3.34Å; V130-G134 PolarHBondContact O-N 3.48Å; V130-L155 HydrophobicContact CG2-CD2 4.35Å; V130-A173 HydrophobicContact CG1-CB 4.44Å; V130-A173 HydrophobicContact CG2-CB 4.23Å; V130-F177 HydrophobicContact CB-CZ 4.33Å; V130-F177 HydrophobicContact CG1-CE2 3.89Å; V130-F177 HydrophobicContact CG1-CZ 3.6Å; V130-F177 WeakPolarHBondContact O-CZ 3.48Å
131D94.2Very high92.5Very high116 Ų11655.7 Ų55.762%0.6230%0.295SS*.Hα-helixtrans-63.2-43.5177.9-60.8-39.9000111.6A128 G134 F135A128-D131 PolarHBondContact O-N 2.99Å; D131-G134 PolarHBondContact O-N 3.48Å; D131-F135 WeakPolarHBondContact O-CB 3.39Å; D131-F135 PolarHBondContact O-N 2.92Å
132K94.2Very high92.1Very high31 Ų3158.2 Ų58.214%0.13531%0.312CS..Hα-helixtrans-62.8-44.2175.5-76.8-164.2172.6-152.10112.2E93 V96 E97 A128 I129 V130 G134 F135 Y136E93-K132 PolarHBondContact O-NZ 2.73Å; V96-K132 HydrophobicContact CB-CD 4.26Å; V96-K132 HydrophobicContact CG2-CD 4.14Å; E97-K132 VanDerWaalsContact CD-NZ 3.3Å; E97-K132 IonicContact OE1-NZ 2.74Å; E97-K132 PolarHBondContact OE1-NZ 2.87Å; E97-K132 IonicContact OE2-NZ 3.2Å; E97-K132 PolarHBondContact OE2-NZ 2.76Å; A128-K132 PolarHBondContact O-N 2.89Å; I129-K132 PolarHBondContact O-N 3.15Å; V130-K132 PolarHBondContact O-N 2.97Å; K132-G134 VanDerWaalsContact C-N 3.34Å; K132-G134 PolarHBondContact O-N 2.95Å; K132-F135 PolarHBondContact O-N 3.37Å; K132-Y136 WeakPolarHBondContact O-CD2 3.47Å; K132-Y136 PolarHBondContact O-N 3.38Å; K132-Y136 VanDerWaalsContact O-N 3.11Å
133I95.4Very high91.8Very high0 Ų060 Ų600%033%0.331CS..Hα-helixtrans-58.8-47.6175.5-69.8167.1000110.3I129 V130 F135 L137 I148 C151 L152 L155 F177I129-I133 HydrophobicContact CD1-CD1 4.1Å; I129-I133 HydrophobicContact CD1-CG1 4.2Å; I129-I133 HydrophobicContact CG1-CD1 3.9Å; I129-I133 HydrophobicContact CG1-CG1 4.45Å; I129-I133 WeakPolarHBondContact O-CB 3.34Å; I129-I133 VanDerWaalsContact O-CG1 3.23Å; I129-I133 WeakPolarHBondContact O-CG1 3.49Å; I129-I133 PolarHBondContact O-N 3.04Å; V130-I133 PolarHBondContact O-N 3.34Å; I133-F135 PolarHBondContact O-N 2.81Å; I133-L137 WeakPolarHBondContact O-CB 3.38Å; I133-L137 PolarHBondContact O-N 2.79Å; I133-I148 HydrophobicContact CB-CD1 4.32Å; I133-I148 HydrophobicContact CB-CG1 4.21Å; I133-I148 HydrophobicContact CG1-CD1 3.89Å; I133-I148 HydrophobicContact CG1-CG1 4.14Å; I133-I148 HydrophobicContact CG2-CG1 4.17Å; I133-C151 HydrophobicContact CD1-CB 4.37Å; I133-C151 HydrophobicContact CG1-CB 4.35Å; I133-L152 HydrophobicContact CD1-CB 4.34Å; I133-L152 HydrophobicContact CG2-CB 4.12Å; I133-L152 HydrophobicContact CG2-CD1 4.36Å; I133-L152 HydrophobicContact CG2-CD2 4.38Å; I133-L155 HydrophobicContact CD1-CD2 4.33Å; I133-F177 HydrophobicContact CB-CE1 4.15Å; I133-F177 HydrophobicContact CB-CE2 4.37Å; I133-F177 HydrophobicContact CB-CZ 3.72Å; I133-F177 HydrophobicContact CG2-CD1 4.15Å; I133-F177 HydrophobicContact CG2-CD2 4.45Å; I133-F177 HydrophobicContact CG2-CE1 3.62Å; I133-F177 HydrophobicContact CG2-CE2 3.93Å; I133-F177 HydrophobicContact CG2-CZ 3.48Å; I133-F177 VanDerWaalsContact CG2-CZ 3.48Å
134G93.9Very high91.8Very high5 Ų557.7 Ų57.75%0.05232%0.317CS..Hα-helixtrans-59.3-47.7177.600000112.8V130 D131 K132 Q138V130-G134 PolarHBondContact O-N 3.48Å; D131-G134 PolarHBondContact O-N 3.48Å; K132-G134 VanDerWaalsContact C-N 3.34Å; K132-G134 PolarHBondContact O-N 2.95Å; G134-Q138 VanDerWaalsContact O-CB 3.32Å; G134-Q138 WeakPolarHBondContact O-CB 3.27Å; G134-Q138 VanDerWaalsContact O-CG 3.27Å; G134-Q138 WeakPolarHBondContact O-CG 3.39Å; G134-Q138 PolarHBondContact O-N 3.25Å
135F94.6Very high92.1Very high140 Ų14053.7 Ų53.761%0.61429%0.287SS*.Hα-helixtrans-58-52-179.7177.5-99.6000112.6D131 K132 I133 S139D131-F135 WeakPolarHBondContact O-CB 3.39Å; D131-F135 PolarHBondContact O-N 2.92Å; K132-F135 PolarHBondContact O-N 3.37Å; I133-F135 PolarHBondContact O-N 2.81Å; F135-S139 PolarHBondContact O-N 3.26Å
136Y94.4Very high92.4Very high45 Ų4548.5 Ų48.518%0.17627%0.269CS..Hα-helixtrans-73.9-34.8-177.3-77.6-70.6000113V96 E97 I100 K132 Q138 S139 C144 I148V96-Y136 HydrophobicContact CG1-CD2 4.29Å; V96-Y136 HydrophobicContact CG1-CE2 4.45Å; E97-Y136 HydrophobicContact CG-CE2 4.39Å; E97-Y136 WeakPolarHBondContact CG-OH 3.28Å; E97-Y136 PolarHBondContact OE1-OH 3.19Å; I100-Y136 HydrophobicContact CD1-CD1 3.81Å; I100-Y136 HydrophobicContact CD1-CD2 3.93Å; I100-Y136 HydrophobicContact CD1-CE1 4.03Å; I100-Y136 HydrophobicContact CD1-CE2 4.15Å; I100-Y136 HydrophobicContact CD1-CG 3.76Å; K132-Y136 WeakPolarHBondContact O-CD2 3.47Å; K132-Y136 PolarHBondContact O-N 3.38Å; K132-Y136 VanDerWaalsContact O-N 3.11Å; Y136-Q138 VanDerWaalsContact C-N 3.33Å; Y136-S139 WeakPolarHBondContact O-CB 3.36Å; Y136-S139 PolarHBondContact O-N 3.12Å; Y136-S139 PolarHBondContact O-OG 3.37Å; Y136-C144 HydrophobicContact CD1-CB 4.26Å; Y136-I148 HydrophobicContact CD2-CD1 4.29Å
137L92.8Very high92.5Very high3 Ų348.2 Ų48.22%0.01627%0.269CS..Hα-helixtrans-68.4-34178-171.764.7000112I133 S139 I148 L149 F177 V180 L181 R184I133-L137 WeakPolarHBondContact O-CB 3.38Å; I133-L137 PolarHBondContact O-N 2.79Å; L137-S139 VanDerWaalsContact C-N 3.34Å; L137-I148 HydrophobicContact CB-CG2 4.19Å; L137-I148 HydrophobicContact CD1-CG2 4.05Å; L137-L149 HydrophobicContact CD1-CD2 3.96Å; L137-L149 HydrophobicContact CD1-CG 4.35Å; L137-F177 HydrophobicContact CD2-CD1 4.32Å; L137-V180 HydrophobicContact CD2-CB 4.17Å; L137-V180 HydrophobicContact CD2-CG1 3.69Å; L137-V180 HydrophobicContact CG-CG1 3.71Å; L137-L181 HydrophobicContact CD1-CD2 4.45Å; L137-L181 HydrophobicContact CD2-CD2 4.02Å; L137-R184 PolarHBondContact O-NE 3.4Å; L137-R184 PolarHBondContact O-NH2 3.44Å
138Q92Very high92.7Very high96 Ų9644 Ų4445%0.44924%0.243SC..Hα-helixtrans-81.5-11.9175.6-67.7175.724.500113.5G134 Y136 H176 V180 R184G134-Q138 VanDerWaalsContact O-CB 3.32Å; G134-Q138 WeakPolarHBondContact O-CB 3.27Å; G134-Q138 VanDerWaalsContact O-CG 3.27Å; G134-Q138 WeakPolarHBondContact O-CG 3.39Å; G134-Q138 PolarHBondContact O-N 3.25Å; Y136-Q138 VanDerWaalsContact C-N 3.33Å; Q138-H176 PolarHBondContact NE2-CE1 3.45Å; Q138-H176 PolarHBondContact NE2-NE2 3.17Å; Q138-V180 HydrophobicContact CG-CG1 4.25Å; Q138-R184 PolarHBondContact O-NH2 3.05Å
139S91.2Very high92.9Very high29 Ų2942.4 Ų42.420%0.20323%0.23CC..SBendtrans-65.1148.3176.580.10000112.5F135 Y136 L137 N141 W145 R184F135-S139 PolarHBondContact O-N 3.26Å; Y136-S139 WeakPolarHBondContact O-CB 3.36Å; Y136-S139 PolarHBondContact O-N 3.12Å; Y136-S139 PolarHBondContact O-OG 3.37Å; L137-S139 VanDerWaalsContact C-N 3.34Å; S139-N141 PolarHBondContact O-N 3.39Å; S139-W145 PolarHBondContact O-NE1 2.92Å; S139-W145 VanDerWaalsContact O-NE1 3.12Å; S139-R184 PolarHBondContact O-NH2 3.45Å
140D86.5Confident93Very high155 Ų15544 Ų4483%0.82924%0.238SC*.SBendtrans-73.1-4.4174.9-66.4-37.4000113.1S142D140-S142 PolarHBondContact O-N 3.01Å
141N87.8Confident93.1Very high85 Ų8542.6 Ų42.646%0.45523%0.23SC..  trans-87.296.8-178.5-174.55.7000111.4S139 A143 C144 W145S139-N141 PolarHBondContact O-N 3.39Å; N141-A143 PolarHBondContact O-N 2.58Å; N141-A143 VanDerWaalsContact O-N 3.15Å; N141-A143 VanDerWaalsContact OD1-CB 3.28Å; N141-A143 WeakPolarHBondContact OD1-CB 3.45Å; N141-A143 PolarHBondContact OD1-N 3.19Å; N141-A143 VanDerWaalsContact OD1-N 3.16Å; N141-C144 PolarHBondContact ND2-SG 2.96Å; N141-C144 PolarHBondContact O-N 2.94Å; N141-W145 PolarHBondContact O-NE1 3.17Å
142S86.5Confident93.3Very high55 Ų5537.1 Ų37.139%0.38520%0.2SC..G310 helixtrans-62-21.3179.463.60000114.4D140 C144 W145D140-S142 PolarHBondContact O-N 3.01Å; S142-C144 PolarHBondContact O-N 2.84Å; S142-W145 PolarHBondContact O-N 2.9Å
143A87.1Confident93.5Very high59 Ų5937 Ų3749%0.48820%0.199SC..G310 helixtrans-63-26177.500000112.6N141N141-A143 PolarHBondContact O-N 2.58Å; N141-A143 VanDerWaalsContact O-N 3.15Å; N141-A143 VanDerWaalsContact OD1-CB 3.28Å; N141-A143 WeakPolarHBondContact OD1-CB 3.45Å; N141-A143 PolarHBondContact OD1-N 3.19Å; N141-A143 VanDerWaalsContact OD1-N 3.16Å
144C92.4Very high93.6Very high7 Ų737.8 Ų37.85%0.04720%0.203CC..G310 helixtrans-85.8-16.2-179.6-57.60000113.9I100 Y136 N141 S142 L146 G147 I148I100-C144 HydrophobicContact CD1-CB 4.25Å; I100-C144 HydrophobicContact CG1-CB 4.42Å; I100-C144 HydrophobicContact CG2-CB 3.9Å; Y136-C144 HydrophobicContact CD1-CB 4.26Å; N141-C144 PolarHBondContact ND2-SG 2.96Å; N141-C144 PolarHBondContact O-N 2.94Å; S142-C144 PolarHBondContact O-N 2.84Å; C144-L146 PolarHBondContact O-N 2.92Å; C144-G147 PolarHBondContact O-N 3.35Å; C144-I148 PolarHBondContact O-N 3.08Å
145W94.3Very high93.7Very high9 Ų937.6 Ų37.63%0.03420%0.201CC..Hα-helixtrans-65.9-41.8-166.5-67.1-8000113.4S139 N141 S142 G147 I148 L149 L188 I199S139-W145 PolarHBondContact O-NE1 2.92Å; S139-W145 VanDerWaalsContact O-NE1 3.12Å; N141-W145 PolarHBondContact O-NE1 3.17Å; S142-W145 PolarHBondContact O-N 2.9Å; W145-G147 PolarHBondContact O-N 2.73Å; W145-I148 WeakPolarHBondContact O-CG2 3.45Å; W145-I148 PolarHBondContact O-N 3.01Å; W145-L149 WeakPolarHBondContact O-CB 3.31Å; W145-L149 WeakPolarHBondContact O-CD1 3.26Å; W145-L149 WeakPolarHBondContact O-CG 3.45Å; W145-L149 PolarHBondContact O-N 2.93Å; W145-L188 HydrophobicContact CE3-CD1 4.15Å; W145-L188 HydrophobicContact CE3-CD2 4.3Å; W145-L188 HydrophobicContact CZ3-CD1 4.13Å; W145-L188 HydrophobicContact CZ3-CD2 3.78Å; W145-L188 HydrophobicContact CZ3-CG 4.02Å; W145-I199 HydrophobicContact CB-CD1 4.07Å; W145-I199 HydrophobicContact CE3-CD1 4.24Å
146L94.3Very high93.9Very high24 Ų2430.9 Ų30.913%0.12617%0.171CC..Hα-helixtrans-62.1-46.8178.4-179.363.5000111.3C144 I148 L149 L150 L198 I199 Q202C144-L146 PolarHBondContact O-N 2.92Å; L146-I148 PolarHBondContact O-N 3.34Å; L146-L149 PolarHBondContact O-N 3.03Å; L146-L150 HydrophobicContact CG-CD1 4.41Å; L146-L150 WeakPolarHBondContact O-CG 3.42Å; L146-L150 PolarHBondContact O-N 3.49Å; L146-L198 HydrophobicContact CD1-CD2 4.34Å; L146-L198 HydrophobicContact CD1-CG 4.11Å; L146-L198 HydrophobicContact CD2-CD2 3.59Å; L146-L198 HydrophobicContact CD2-CG 4.27Å; L146-I199 HydrophobicContact CB-CG1 4.22Å; L146-Q202 HydrophobicContact CD1-CB 4.29Å; L146-Q202 HydrophobicContact CD1-CG 4.43Å
147G95.3Very high93.9Very high2 Ų232.6 Ų32.62%0.02118%0.18CC..Hα-helixtrans-59.3-45.917900000112.1I99 C144 W145 L149 L150 C151I99-G147 WeakPolarHBondContact CG2-O 3.42Å; C144-G147 PolarHBondContact O-N 3.35Å; W145-G147 PolarHBondContact O-N 2.73Å; G147-L149 PolarHBondContact O-N 3.3Å; G147-L150 WeakPolarHBondContact O-CB 3.32Å; G147-L150 PolarHBondContact O-N 3.37Å; G147-C151 PolarHBondContact O-N 3.42Å; G147-C151 PolarHBondContact O-SG 2.89Å; G147-C151 VanDerWaalsContact O-SG 3.4Å
148I96.7Very high93.9Very high0 Ų033.6 Ų33.60%019%0.185CC..Hα-helixtrans-70.8-32.5-179.6-155.464.2000113.1V96 I133 Y136 L137 C144 W145 L146 L150 C151 L152V96-I148 HydrophobicContact CG1-CD1 3.48Å; V96-I148 VanDerWaalsContact CG1-CD1 3.48Å; I133-I148 HydrophobicContact CB-CD1 4.32Å; I133-I148 HydrophobicContact CB-CG1 4.21Å; I133-I148 HydrophobicContact CG1-CD1 3.89Å; I133-I148 HydrophobicContact CG1-CG1 4.14Å; I133-I148 HydrophobicContact CG2-CG1 4.17Å; Y136-I148 HydrophobicContact CD2-CD1 4.29Å; L137-I148 HydrophobicContact CB-CG2 4.19Å; L137-I148 HydrophobicContact CD1-CG2 4.05Å; C144-I148 PolarHBondContact O-N 3.08Å; W145-I148 WeakPolarHBondContact O-CG2 3.45Å; W145-I148 PolarHBondContact O-N 3.01Å; L146-I148 PolarHBondContact O-N 3.34Å; I148-L150 VanDerWaalsContact C-N 3.32Å; I148-C151 HydrophobicContact CD1-CB 4.45Å; I148-C151 WeakPolarHBondContact O-CB 3.26Å; I148-C151 PolarHBondContact O-N 3.14Å; I148-L152 PolarHBondContact O-N 2.84Å
149L97.6Very high94.1Very high2 Ų229.2 Ų29.21%0.0116%0.164CC..Hα-helixtrans-69.9-29.3173.9-70.3169.8000112.3L137 W145 L146 G147 Y153 L181 I199 Q202 I203 I206L137-L149 HydrophobicContact CD1-CD2 3.96Å; L137-L149 HydrophobicContact CD1-CG 4.35Å; W145-L149 WeakPolarHBondContact O-CB 3.31Å; W145-L149 WeakPolarHBondContact O-CD1 3.26Å; W145-L149 WeakPolarHBondContact O-CG 3.45Å; W145-L149 PolarHBondContact O-N 2.93Å; L146-L149 PolarHBondContact O-N 3.03Å; G147-L149 PolarHBondContact O-N 3.3Å; L149-Y153 VanDerWaalsContact O-CB 3.25Å; L149-Y153 WeakPolarHBondContact O-CB 3.49Å; L149-Y153 PolarHBondContact O-N 2.93Å; L149-L181 HydrophobicContact CD2-CD2 3.29Å; L149-I199 HydrophobicContact CD1-CG2 3.58Å; L149-Q202 HydrophobicContact CB-CB 4.43Å; L149-Q202 HydrophobicContact CB-CG 3.71Å; L149-Q202 HydrophobicContact CD1-CB 4.48Å; L149-I203 HydrophobicContact CD1-CD1 4.43Å; L149-I203 HydrophobicContact CD1-CG1 3.82Å; L149-I203 HydrophobicContact CD2-CG1 4.05Å; L149-I206 HydrophobicContact CB-CD1 4.04Å; L149-I206 HydrophobicContact CD2-CD1 3.61Å; L149-I206 HydrophobicContact CG-CD1 4.42Å; L149-I206 WeakPolarHBondContact O-CD1 3.35Å
150L97.3Very high94Very high32 Ų3228.4 Ų28.417%0.16816%0.157CC..Hα-helixtrans-65.5-42.4170.1-69.7168.3000110.8R107 T111 L146 G147 I148 Y153 Q154R107-L150 VanDerWaalsContact CD-CD1 3.48Å; R107-L150 HydrophobicContact CG-CD1 3.99Å; T111-L150 HydrophobicContact CG2-CB 4.3Å; L146-L150 HydrophobicContact CG-CD1 4.41Å; L146-L150 WeakPolarHBondContact O-CG 3.42Å; L146-L150 PolarHBondContact O-N 3.49Å; G147-L150 WeakPolarHBondContact O-CB 3.32Å; G147-L150 PolarHBondContact O-N 3.37Å; I148-L150 VanDerWaalsContact C-N 3.32Å; L150-Y153 PolarHBondContact O-N 3.24Å; L150-Q154 WeakPolarHBondContact O-CG 3.43Å; L150-Q154 PolarHBondContact O-N 2.93Å; L150-Q154 VanDerWaalsContact O-N 3.08Å
151C97.6Very high94.2Very high0 Ų028.9 Ų28.90%015%0.149CC..Hα-helixtrans-61-48.2173.8-59.50000111.9I99 I114 I133 G147 I148 Y153 Q154 L155I99-C151 VanDerWaalsContact CD1-SG 3.59Å; I114-C151 HydrophobicContact CD1-CB 4.02Å; I133-C151 HydrophobicContact CD1-CB 4.37Å; I133-C151 HydrophobicContact CG1-CB 4.35Å; G147-C151 PolarHBondContact O-N 3.42Å; G147-C151 PolarHBondContact O-SG 2.89Å; G147-C151 VanDerWaalsContact O-SG 3.4Å; I148-C151 HydrophobicContact CD1-CB 4.45Å; I148-C151 WeakPolarHBondContact O-CB 3.26Å; I148-C151 PolarHBondContact O-N 3.14Å; C151-Y153 VanDerWaalsContact C-N 3.29Å; C151-Y153 PolarHBondContact O-N 2.75Å; C151-Q154 PolarHBondContact O-N 3.24Å; C151-Q154 VanDerWaalsContact O-N 3.15Å; C151-L155 PolarHBondContact O-N 3.32Å; C151-L155 VanDerWaalsContact O-N 3.08Å
152L97.9Very high94.3Very high1 Ų128.2 Ų28.21%0.00514%0.142CC..Hα-helixtrans-61.5-38.5177179.756.1000111.8I133 I148 Q154 L155 V156 M174 F177 L181 I206I133-L152 HydrophobicContact CD1-CB 4.34Å; I133-L152 HydrophobicContact CG2-CB 4.12Å; I133-L152 HydrophobicContact CG2-CD1 4.36Å; I133-L152 HydrophobicContact CG2-CD2 4.38Å; I148-L152 PolarHBondContact O-N 2.84Å; L152-Q154 VanDerWaalsContact C-N 3.32Å; L152-Q154 PolarHBondContact O-N 3.05Å; L152-L155 HydrophobicContact CD1-CB 4.49Å; L152-L155 HydrophobicContact CD1-CD2 4.13Å; L152-L155 WeakPolarHBondContact O-CB 3.38Å; L152-L155 PolarHBondContact O-N 3.32Å; L152-L155 VanDerWaalsContact O-N 3.15Å; L152-V156 HydrophobicContact CD1-CG2 4.3Å; L152-V156 WeakPolarHBondContact O-CG2 3.37Å; L152-V156 PolarHBondContact O-N 2.87Å; L152-M174 HydrophobicContact CD1-SD 4.01Å; L152-F177 HydrophobicContact CD1-CD2 3.58Å; L152-F177 HydrophobicContact CD1-CE2 3.96Å; L152-F177 HydrophobicContact CD1-CG 4.31Å; L152-F177 HydrophobicContact CD2-CB 4.14Å; L152-F177 HydrophobicContact CD2-CD2 4.33Å; L152-F177 HydrophobicContact CD2-CG 4.25Å; L152-L181 HydrophobicContact CD2-CD1 4.01Å; L152-L181 HydrophobicContact CD2-CD2 4.01Å; L152-L181 HydrophobicContact CD2-CG 4.33Å; L152-I206 HydrophobicContact CB-CD1 4.28Å; L152-I206 HydrophobicContact CD2-CD1 4.16Å; L152-I206 HydrophobicContact CD2-CG2 4.39Å; L152-I206 HydrophobicContact CG-CD1 4.18Å; L152-I206 HydrophobicContact CG-CG2 4.24Å
153Y98Very high94.3Very high27 Ų2732.4 Ų32.411%0.10615%0.153CC..Hα-helixtrans-61.3-40.6174.9179-116.5000112.1L149 L150 C151 L155 V156 K157 Q202 K205 I206 A209L149-Y153 VanDerWaalsContact O-CB 3.25Å; L149-Y153 WeakPolarHBondContact O-CB 3.49Å; L149-Y153 PolarHBondContact O-N 2.93Å; L150-Y153 PolarHBondContact O-N 3.24Å; C151-Y153 VanDerWaalsContact C-N 3.29Å; C151-Y153 PolarHBondContact O-N 2.75Å; Y153-L155 VanDerWaalsContact C-N 3.29Å; Y153-L155 PolarHBondContact O-N 2.98Å; Y153-V156 PolarHBondContact O-N 3.41Å; Y153-K157 HydrophobicContact CE1-CD 4.17Å; Y153-K157 WeakPolarHBondContact O-CB 3.35Å; Y153-K157 PolarHBondContact O-N 2.87Å; Y153-Q202 VanDerWaalsContact CB-NE2 3.28Å; Y153-K205 HydrophobicContact CD2-CB 4.26Å; Y153-K205 HydrophobicContact CE2-CB 4.1Å; Y153-K205 WeakPolarHBondContact OH-CE 3.48Å; Y153-I206 HydrophobicContact CD2-CG1 4.08Å; Y153-I206 HydrophobicContact CG-CG1 4.38Å; Y153-A209 HydrophobicContact CD2-CB 4.49Å; Y153-A209 HydrophobicContact CE2-CB 3.94Å
154Q97.7Very high94.1Very high18 Ų1832.8 Ų32.88%0.08415%0.15CC..Hα-helixtrans-65.5-34.5174.7-60.1-44.4-41.500112.6T111 I114 H115 I118 L150 C151 L152 N158T111-Q154 HydrophobicContact CG2-CG 3.58Å; I114-Q154 HydrophobicContact CG2-CB 4.18Å; I114-Q154 HydrophobicContact CG2-CG 3.87Å; H115-Q154 HydrophobicContact CB-CB 4.15Å; H115-Q154 HydrophobicContact CB-CG 4.05Å; H115-Q154 PolarHBondContact ND1-OE1 3.39Å; H115-Q154 VanDerWaalsContact ND1-OE1 3.14Å; I118-Q154 HydrophobicContact CD1-CB 4.01Å; L150-Q154 WeakPolarHBondContact O-CG 3.43Å; L150-Q154 PolarHBondContact O-N 2.93Å; L150-Q154 VanDerWaalsContact O-N 3.08Å; C151-Q154 PolarHBondContact O-N 3.24Å; C151-Q154 VanDerWaalsContact O-N 3.15Å; L152-Q154 VanDerWaalsContact C-N 3.32Å; L152-Q154 PolarHBondContact O-N 3.05Å; Q154-N158 WeakPolarHBondContact O-CB 3.46Å; Q154-N158 PolarHBondContact O-N 3.18Å; Q154-N158 VanDerWaalsContact O-N 3.1Å
155L97Very high93.8Very high0 Ų038.9 Ų38.90%018%0.178CC..Hα-helixtrans-61.4-49.4172.9-178.863.8000111.5I118 Y122 V130 I133 C151 L152 Y153 Y159 A173I118-L155 HydrophobicContact CD1-CB 4.2Å; I118-L155 HydrophobicContact CG2-CD1 3.88Å; Y122-L155 HydrophobicContact CD1-CD1 3.43Å; Y122-L155 VanDerWaalsContact CD1-CD1 3.43Å; Y122-L155 HydrophobicContact CD2-CD1 4.43Å; Y122-L155 HydrophobicContact CE1-CD1 3.57Å; Y122-L155 HydrophobicContact CG-CD1 3.9Å; V130-L155 HydrophobicContact CG2-CD2 4.35Å; I133-L155 HydrophobicContact CD1-CD2 4.33Å; C151-L155 PolarHBondContact O-N 3.32Å; C151-L155 VanDerWaalsContact O-N 3.08Å; L152-L155 HydrophobicContact CD1-CB 4.49Å; L152-L155 HydrophobicContact CD1-CD2 4.13Å; L152-L155 WeakPolarHBondContact O-CB 3.38Å; L152-L155 PolarHBondContact O-N 3.32Å; L152-L155 VanDerWaalsContact O-N 3.15Å; Y153-L155 VanDerWaalsContact C-N 3.29Å; Y153-L155 PolarHBondContact O-N 2.98Å; L155-Y159 HydrophobicContact CD1-CE2 4.41Å; L155-Y159 WeakPolarHBondContact O-CD2 3.38Å; L155-A173 HydrophobicContact CD2-CB 4.3Å
156V97.2Very high93.6Very high0 Ų042.9 Ų42.90%020%0.198CC..Hα-helixtrans-66.3-44.4178.5-177.40000111.3L152 Y153 N158 Y159 E160 L170 M174 I206 A209 L210L152-V156 HydrophobicContact CD1-CG2 4.3Å; L152-V156 WeakPolarHBondContact O-CG2 3.37Å; L152-V156 PolarHBondContact O-N 2.87Å; Y153-V156 PolarHBondContact O-N 3.41Å; V156-N158 PolarHBondContact O-N 3.38Å; V156-Y159 PolarHBondContact O-N 3.1Å; V156-E160 PolarHBondContact O-N 3.39Å; V156-L170 HydrophobicContact CB-CD1 4.31Å; V156-L170 HydrophobicContact CG1-CD1 4.46Å; V156-L170 HydrophobicContact CG1-CD2 4.37Å; V156-L170 HydrophobicContact CG2-CD1 3.92Å; V156-M174 HydrophobicContact CG2-SD 3.86Å; V156-I206 HydrophobicContact CG2-CG2 3.75Å; V156-A209 HydrophobicContact CG1-CB 3.94Å; V156-L210 HydrophobicContact CG1-CB 3.95Å
157K94Very high93.6Very high81 Ų8142 Ų4235%0.35219%0.192SC..Hα-helixtrans-58.8-33.7-179.3-167.1175-174.9-173.20112.7Y153 Y159 E160Y153-K157 HydrophobicContact CE1-CD 4.17Å; Y153-K157 WeakPolarHBondContact O-CB 3.35Å; Y153-K157 PolarHBondContact O-N 2.87Å; K157-Y159 PolarHBondContact O-N 3.08Å; K157-E160 WeakPolarHBondContact CG-OE2 3.42Å; K157-E160 VanDerWaalsContact O-CB 3.28Å; K157-E160 WeakPolarHBondContact O-CB 3.33Å; K157-E160 PolarHBondContact O-N 3.06Å
158N94.5Very high93.5Very high23 Ų2345.6 Ų45.612%0.12322%0.218CC..THydrogen-bonded Turntrans-61.8-21.6176.3-17664.3000114.1I118 K119 Q154 V156I118-N158 HydrophobicContact CG2-CB 3.93Å; K119-N158 WeakPolarHBondContact CA-OD1 3.35Å; K119-N158 WeakPolarHBondContact CB-OD1 3.31Å; Q154-N158 WeakPolarHBondContact O-CB 3.46Å; Q154-N158 PolarHBondContact O-N 3.18Å; Q154-N158 VanDerWaalsContact O-N 3.1Å; V156-N158 PolarHBondContact O-N 3.38Å
159Y94.8Very high93.3Very high5 Ų546.9 Ų46.92%0.0223%0.226CC..THydrogen-bonded Turntrans-112.18-179.7-69.4-96.4000112.3Y122 P123 L155 V156 K157 Y161 K162 E166 R167 P169 L170Y122-Y159 AromaticContact CD1-CE2 3.83Å; Y122-Y159 HydrophobicContact CD1-CE2 3.83Å; Y122-Y159 AromaticContact CD1-CZ 3.99Å; Y122-Y159 VanDerWaalsContact CD1-OH 3.31Å; Y122-Y159 WeakPolarHBondContact CD1-OH 3.18Å; Y122-Y159 AromaticContact CE1-CE2 3.97Å; Y122-Y159 HydrophobicContact CE1-CE2 3.97Å; Y122-Y159 PolarHBondContact O-OH 3.39Å; P123-Y159 WeakPolarHBondContact CD-OH 3.5Å; L155-Y159 HydrophobicContact CD1-CE2 4.41Å; L155-Y159 WeakPolarHBondContact O-CD2 3.38Å; V156-Y159 PolarHBondContact O-N 3.1Å; K157-Y159 PolarHBondContact O-N 3.08Å; Y159-Y161 PolarHBondContact O-N 2.96Å; Y159-K162 HydrophobicContact CD1-CD 3.77Å; Y159-K162 HydrophobicContact CE1-CD 4.21Å; Y159-K162 HydrophobicContact CG-CD 4.43Å; Y159-K162 PolarHBondContact O-N 2.69Å; Y159-E166 WeakPolarHBondContact CE1-O 3.42Å; Y159-R167 PolarHBondContact O-NH1 2.95Å; Y159-P169 HydrophobicContact CE1-CB 4.46Å; Y159-P169 HydrophobicContact CE1-CG 4.29Å; Y159-L170 HydrophobicContact CD1-CB 4.07Å; Y159-L170 HydrophobicContact CD2-CB 3.99Å; Y159-L170 HydrophobicContact CE2-CB 4.48Å; Y159-L170 HydrophobicContact CG-CB 3.78Å; Y159-L170 HydrophobicContact CG-CD2 4.21Å; Y159-L170 HydrophobicContact CG-CG 4.49Å
160E90.4Very high93.2Very high11 Ų1146.8 Ų46.85%0.05123%0.225CC..THydrogen-bonded Turntrans-60.2-44.9-174.9-179.7171.8-166.100111.8V156 K157 R167 Q212 Y213V156-E160 PolarHBondContact O-N 3.39Å; K157-E160 WeakPolarHBondContact CG-OE2 3.42Å; K157-E160 VanDerWaalsContact O-CB 3.28Å; K157-E160 WeakPolarHBondContact O-CB 3.33Å; K157-E160 PolarHBondContact O-N 3.06Å; E160-R167 PolarHBondContact O-NH1 3.48Å; E160-Q212 PolarHBondContact OE1-OE1 2.99Å; E160-Y213 HydrophobicContact CG-CD2 3.62Å; E160-Y213 HydrophobicContact CG-CE2 3.63Å; E160-Y213 WeakPolarHBondContact O-CD2 3.34Å
161Y89.2Confident93.1Very high166 Ų16646.4 Ų46.465%0.65122%0.224SC*.THydrogen-bonded Turntrans-98.45.6-177.6-57.9-83.9000114.1Y159 Y213Y159-Y161 PolarHBondContact O-N 2.96Å; Y161-Y213 HydrophobicContact CD1-CD2 4.42Å; Y161-Y213 AromaticContact CD1-CE2 3.89Å; Y161-Y213 HydrophobicContact CD1-CE2 3.89Å; Y161-Y213 HydrophobicContact CE1-CD2 4.43Å; Y161-Y213 HydrophobicContact CE1-CE1 4.41Å; Y161-Y213 AromaticContact CE1-CE2 3.5Å; Y161-Y213 HydrophobicContact CE1-CE2 3.5Å; Y161-Y213 VanDerWaalsContact CE1-CE2 3.5Å; Y161-Y213 AromaticContact CE1-CZ 3.48Å; Y161-Y213 VanDerWaalsContact CE1-CZ 3.48Å; Y161-Y213 VanDerWaalsContact CE1-OH 3.27Å; Y161-Y213 WeakPolarHBondContact CE1-OH 3.49Å; Y161-Y213 AromaticContact CZ-CE2 3.93Å
162K89.8Confident92.9Very high70 Ų7049.7 Ų49.730%0.30425%0.251SS..SBendtrans-82.1148.6-178.6-71.2-157.7169-142.40111.9Y159 E166 R167Y159-K162 HydrophobicContact CD1-CD 3.77Å; Y159-K162 HydrophobicContact CE1-CD 4.21Å; Y159-K162 HydrophobicContact CG-CD 4.43Å; Y159-K162 PolarHBondContact O-N 2.69Å; K162-E166 HydrophobicContact CB-CB 4.19Å; K162-E166 HydrophobicContact CD-CB 4.05Å; K162-E166 IonicContact NZ-OE1 2.95Å; K162-E166 PolarHBondContact NZ-OE1 2.84Å; K162-R167 HydrophobicContact CB-CG 4.22Å; K162-R167 WeakPolarHBondContact O-CD 3.26Å
163K86.6Confident92.8Very high143 Ų14349.9 Ų49.962%0.62225%0.253SS*.  trans-62.7152.4175.3-61.4-171.6177.9-174.90111.1E165 E166 R167K163-E165 WeakPolarHBondContact CB-OE2 3.3Å; K163-E165 PolarHBondContact O-N 2.95Å; K163-E165 VanDerWaalsContact O-N 3.11Å; K163-E166 PolarHBondContact O-N 3.02Å; K163-E166 VanDerWaalsContact O-N 3.08Å; K163-R167 WeakPolarHBondContact O-CG 3.47Å; K163-R167 PolarHBondContact O-N 3.48Å
164P84.3Confident92.7Very high67 Ų6748.6 Ų48.644%0.43525%0.248SC..G310 helixtrans-51-36.7-176.5-27.735.7000114.6E166 R167 T214P164-E166 VanDerWaalsContact C-N 3.32Å; P164-E166 PolarHBondContact O-N 2.94Å; P164-R167 WeakPolarHBondContact O-CB 3.36Å; P164-R167 PolarHBondContact O-N 3.35Å; P164-R167 VanDerWaalsContact O-N 3.15Å; P164-T214 HydrophobicContact CB-CG2 4.34Å; P164-T214 HydrophobicContact CG-CG2 3.99Å
165E86.3Confident92.6Very high136 Ų13652.9 Ų52.964%0.63627%0.268SS*.G310 helixtrans-67-34.4-177-53.668.9-141.700111.7K163 R167K163-E165 WeakPolarHBondContact CB-OE2 3.3Å; K163-E165 PolarHBondContact O-N 2.95Å; K163-E165 VanDerWaalsContact O-N 3.11Å; E165-R167 VanDerWaalsContact C-N 3.3Å; E165-R167 PolarHBondContact O-N 2.9Å
166E89.5Confident92.4Very high93 Ų9357.2 Ų57.244%0.43529%0.288SS..G310 helixtrans-80.3-10.5177.9-66.8-173.877.900113.2Y159 K162 K163 P164 S168 P169Y159-E166 WeakPolarHBondContact CE1-O 3.42Å; K162-E166 HydrophobicContact CB-CB 4.19Å; K162-E166 HydrophobicContact CD-CB 4.05Å; K162-E166 IonicContact NZ-OE1 2.95Å; K162-E166 PolarHBondContact NZ-OE1 2.84Å; K163-E166 PolarHBondContact O-N 3.02Å; K163-E166 VanDerWaalsContact O-N 3.08Å; P164-E166 VanDerWaalsContact C-N 3.32Å; P164-E166 PolarHBondContact O-N 2.94Å; E166-S168 VanDerWaalsContact C-N 3.32Å; E166-P169 WeakPolarHBondContact O-CD 3.45Å
167R93.3Very high92.3Very high4 Ų457.2 Ų57.22%0.01529%0.288CS..G310 helixtrans-85.5-2.1-176.4-65.6174.875.3134.25.2113.5Y159 E160 K162 K163 P164 E165 P169 L170 V171 L210 T214Y159-R167 PolarHBondContact O-NH1 2.95Å; E160-R167 PolarHBondContact O-NH1 3.48Å; K162-R167 HydrophobicContact CB-CG 4.22Å; K162-R167 WeakPolarHBondContact O-CD 3.26Å; K163-R167 WeakPolarHBondContact O-CG 3.47Å; K163-R167 PolarHBondContact O-N 3.48Å; P164-R167 WeakPolarHBondContact O-CB 3.36Å; P164-R167 PolarHBondContact O-N 3.35Å; P164-R167 VanDerWaalsContact O-N 3.15Å; E165-R167 VanDerWaalsContact C-N 3.3Å; E165-R167 PolarHBondContact O-N 2.9Å; R167-P169 VanDerWaalsContact C-N 3.32Å; R167-L170 WeakPolarHBondContact O-CA 3.34Å; R167-L170 WeakPolarHBondContact O-CB 3.43Å; R167-L170 PolarHBondContact O-N 3.48Å; R167-V171 HydrophobicContact CB-CG2 4.5Å; R167-V171 WeakPolarHBondContact O-CG2 3.25Å; R167-V171 PolarHBondContact O-N 3.36Å; R167-L210 PolarHBondContact NH2-O 2.85Å; R167-T214 PolarHBondContact NH1-OG1 2.98Å
168S92.9Very high92.4Very high79 Ų7953.6 Ų53.655%0.55227%0.273SS*.Hα-helixtrans-51.2-39.1-179.7620000114.7E166 V171 A172E166-S168 VanDerWaalsContact C-N 3.32Å; S168-V171 PolarHBondContact O-N 3.3Å; S168-A172 PolarHBondContact O-N 2.98Å
169P93.4Very high92.4Very high27 Ų2755.4 Ų55.418%0.17529%0.285CS..Hα-helixtrans-68.1-39.9176.5-17.934000112.4Y122 P123 Y159 E166 R167 A172 A173Y122-P169 HydrophobicContact CE1-CB 3.88Å; Y122-P169 PolarHBondContact OH-O 3.36Å; Y122-P169 VanDerWaalsContact OH-O 3.13Å; P123-P169 HydrophobicContact CB-CB 4.04Å; P123-P169 HydrophobicContact CB-CG 4.48Å; P123-P169 HydrophobicContact CG-CB 3.86Å; P123-P169 HydrophobicContact CG-CG 3.77Å; Y159-P169 HydrophobicContact CE1-CB 4.46Å; Y159-P169 HydrophobicContact CE1-CG 4.29Å; E166-P169 WeakPolarHBondContact O-CD 3.45Å; R167-P169 VanDerWaalsContact C-N 3.32Å; P169-A172 PolarHBondContact O-N 3Å; P169-A173 PolarHBondContact O-N 3.04Å; P169-A173 VanDerWaalsContact O-N 3.1Å
170L95.4Very high92.4Very high0 Ų056.3 Ų56.30%029%0.291CS..Hα-helixtrans-63-45.9175.217265.7000110.7V156 Y159 R167 A172 A173 M174 L210V156-L170 HydrophobicContact CB-CD1 4.31Å; V156-L170 HydrophobicContact CG1-CD1 4.46Å; V156-L170 HydrophobicContact CG1-CD2 4.37Å; V156-L170 HydrophobicContact CG2-CD1 3.92Å; Y159-L170 HydrophobicContact CD1-CB 4.07Å; Y159-L170 HydrophobicContact CD2-CB 3.99Å; Y159-L170 HydrophobicContact CE2-CB 4.48Å; Y159-L170 HydrophobicContact CG-CB 3.78Å; Y159-L170 HydrophobicContact CG-CD2 4.21Å; Y159-L170 HydrophobicContact CG-CG 4.49Å; R167-L170 WeakPolarHBondContact O-CA 3.34Å; R167-L170 WeakPolarHBondContact O-CB 3.43Å; R167-L170 PolarHBondContact O-N 3.48Å; L170-A172 VanDerWaalsContact C-N 3.31Å; L170-A172 PolarHBondContact O-N 3.47Å; L170-A173 PolarHBondContact O-N 3.34Å; L170-M174 HydrophobicContact CD1-CG 3.65Å; L170-M174 HydrophobicContact CD1-SD 4.42Å; L170-M174 HydrophobicContact CG-CG 4.18Å; L170-M174 WeakPolarHBondContact O-CB 3.44Å; L170-M174 WeakPolarHBondContact O-CG 3.45Å; L170-M174 PolarHBondContact O-N 2.79Å; L170-L210 HydrophobicContact CD2-CD1 3.91Å; L170-L210 HydrophobicContact CG-CD1 4.33Å
171V94.7Very high92.6Very high24 Ų2455.8 Ų55.815%0.14529%0.289CS..Hα-helixtrans-58.6-45.7179.8172.60000110.3R167 S168 A173 M174 Q175 P216 L219R167-V171 HydrophobicContact CB-CG2 4.5Å; R167-V171 WeakPolarHBondContact O-CG2 3.25Å; R167-V171 PolarHBondContact O-N 3.36Å; S168-V171 PolarHBondContact O-N 3.3Å; V171-A173 PolarHBondContact O-N 2.65Å; V171-M174 PolarHBondContact O-N 2.84Å; V171-Q175 PolarHBondContact O-N 3.39Å; V171-P216 HydrophobicContact CG2-CB 4.29Å; V171-L219 HydrophobicContact CB-CD1 4.48Å; V171-L219 HydrophobicContact CG1-CD1 4.16Å; V171-L219 HydrophobicContact CG1-CD2 4.38Å; V171-L219 HydrophobicContact CG1-CG 4.1Å; V171-L219 HydrophobicContact CG2-CD1 4.46Å
172A94.1Very high92.9Very high68 Ų6849.3 Ų49.356%0.56226%0.264SS*.Hα-helixtrans-59.9-42.6176.500000112.9S168 P169 L170S168-A172 PolarHBondContact O-N 2.98Å; P169-A172 PolarHBondContact O-N 3Å; L170-A172 VanDerWaalsContact C-N 3.31Å; L170-A172 PolarHBondContact O-N 3.47Å
173A95Very high93.2Very high5 Ų550.4 Ų50.44%0.04127%0.273CS..Hα-helixtrans-66-44.117600000112V130 L155 P169 L170 V171 Q175 H176 F177V130-A173 HydrophobicContact CG1-CB 4.44Å; V130-A173 HydrophobicContact CG2-CB 4.23Å; L155-A173 HydrophobicContact CD2-CB 4.3Å; P169-A173 PolarHBondContact O-N 3.04Å; P169-A173 VanDerWaalsContact O-N 3.1Å; L170-A173 PolarHBondContact O-N 3.34Å; V171-A173 PolarHBondContact O-N 2.65Å; A173-Q175 VanDerWaalsContact C-N 3.32Å; A173-Q175 PolarHBondContact O-N 3.37Å; A173-H176 PolarHBondContact O-N 3.03Å; A173-H176 VanDerWaalsContact O-N 3.13Å; A173-F177 HydrophobicContact CB-CD2 4.3Å; A173-F177 HydrophobicContact CB-CE2 4.1Å; A173-F177 VanDerWaalsContact O-CD2 3.23Å; A173-F177 WeakPolarHBondContact O-CD2 3.29Å; A173-F177 PolarHBondContact O-N 3.37Å; A173-F177 VanDerWaalsContact O-N 3.11Å
174M96.4Very high93.5Very high0 Ų045.3 Ų45.30%025%0.25CS..Hα-helixtrans-72.4-23.6-177.9-68.2-51.8-64.600113.2L152 V156 L170 V171 H176 F177 L178 L181 I206 L210 L219L152-M174 HydrophobicContact CD1-SD 4.01Å; V156-M174 HydrophobicContact CG2-SD 3.86Å; L170-M174 HydrophobicContact CD1-CG 3.65Å; L170-M174 HydrophobicContact CD1-SD 4.42Å; L170-M174 HydrophobicContact CG-CG 4.18Å; L170-M174 WeakPolarHBondContact O-CB 3.44Å; L170-M174 WeakPolarHBondContact O-CG 3.45Å; L170-M174 PolarHBondContact O-N 2.79Å; V171-M174 PolarHBondContact O-N 2.84Å; M174-H176 PolarHBondContact O-N 2.91Å; M174-F177 HydrophobicContact CE-CB 4.39Å; M174-F177 PolarHBondContact O-N 2.75Å; M174-F177 HydrophobicContact SD-CB 4.18Å; M174-F177 HydrophobicContact SD-CD2 4.24Å; M174-L178 HydrophobicContact CE-CB 4.44Å; M174-L178 HydrophobicContact CE-CD1 4.38Å; M174-L178 WeakPolarHBondContact O-CB 3.23Å; M174-L178 PolarHBondContact O-N 2.94Å; M174-L181 HydrophobicContact CE-CD1 3.94Å; M174-I206 HydrophobicContact CE-CG2 4.19Å; M174-L210 HydrophobicContact CB-CD2 4.47Å; M174-L210 HydrophobicContact CE-CD2 4.02Å; M174-L210 HydrophobicContact CG-CD1 4.07Å; M174-L210 HydrophobicContact CG-CD2 4.35Å; M174-L219 HydrophobicContact CB-CD1 3.66Å; M174-L219 HydrophobicContact CB-CD2 4.48Å
175Q94.8Very high94Very high109 Ų10942.1 Ų42.151%0.50923%0.23SC..Hα-helixtrans-55.4-34.4168.9-170.271.538.900111.6V171 A173 L219V171-Q175 PolarHBondContact O-N 3.39Å; A173-Q175 VanDerWaalsContact C-N 3.32Å; A173-Q175 PolarHBondContact O-N 3.37Å; Q175-L219 VanDerWaalsContact CA-CD2 3.46Å; Q175-L219 HydrophobicContact CB-CD2 3.9Å
176H92.8Very high94.4Very high91 Ų9139.7 Ų39.742%0.42122%0.22SC..Hα-helixtrans-85.6-43.9176.2-177.160.5000112.7Q138 A173 M174 V180Q138-H176 PolarHBondContact NE2-CE1 3.45Å; Q138-H176 PolarHBondContact NE2-NE2 3.17Å; A173-H176 PolarHBondContact O-N 3.03Å; A173-H176 VanDerWaalsContact O-N 3.13Å; M174-H176 PolarHBondContact O-N 2.91Å; H176-V180 WeakPolarHBondContact O-CG2 3.42Å
177F96.1Very high94.6Very high0 Ų040.1 Ų40.10%022%0.222CC..Hα-helixtrans-80.2-33.1-172.4-62.4-44.4000114.5V130 I133 L137 L152 A173 M174 V180 L181V130-F177 HydrophobicContact CB-CZ 4.33Å; V130-F177 HydrophobicContact CG1-CE2 3.89Å; V130-F177 HydrophobicContact CG1-CZ 3.6Å; V130-F177 WeakPolarHBondContact O-CZ 3.48Å; I133-F177 HydrophobicContact CB-CE1 4.15Å; I133-F177 HydrophobicContact CB-CE2 4.37Å; I133-F177 HydrophobicContact CB-CZ 3.72Å; I133-F177 HydrophobicContact CG2-CD1 4.15Å; I133-F177 HydrophobicContact CG2-CD2 4.45Å; I133-F177 HydrophobicContact CG2-CE1 3.62Å; I133-F177 HydrophobicContact CG2-CE2 3.93Å; I133-F177 HydrophobicContact CG2-CZ 3.48Å; I133-F177 VanDerWaalsContact CG2-CZ 3.48Å; L137-F177 HydrophobicContact CD2-CD1 4.32Å; L152-F177 HydrophobicContact CD1-CD2 3.58Å; L152-F177 HydrophobicContact CD1-CE2 3.96Å; L152-F177 HydrophobicContact CD1-CG 4.31Å; L152-F177 HydrophobicContact CD2-CB 4.14Å; L152-F177 HydrophobicContact CD2-CD2 4.33Å; L152-F177 HydrophobicContact CD2-CG 4.25Å; A173-F177 HydrophobicContact CB-CD2 4.3Å; A173-F177 HydrophobicContact CB-CE2 4.1Å; A173-F177 VanDerWaalsContact O-CD2 3.23Å; A173-F177 WeakPolarHBondContact O-CD2 3.29Å; A173-F177 PolarHBondContact O-N 3.37Å; A173-F177 VanDerWaalsContact O-N 3.11Å; M174-F177 HydrophobicContact CE-CB 4.39Å; M174-F177 PolarHBondContact O-N 2.75Å; M174-F177 HydrophobicContact SD-CB 4.18Å; M174-F177 HydrophobicContact SD-CD2 4.24Å; F177-V180 PolarHBondContact O-N 3.25Å; F177-V180 VanDerWaalsContact O-N 3.07Å; F177-L181 VanDerWaalsContact O-CG 3.31Å; F177-L181 WeakPolarHBondContact O-CG 3.46Å; F177-L181 PolarHBondContact O-N 2.92Å
178L95.2Very high94.6Very high5 Ų540.5 Ų40.53%0.02622%0.224CC..Hα-helixtrans-59.5-44-173.6-170.970.3000113M174 V180 L181 K182 F207 L210 L219 I220 W228M174-L178 HydrophobicContact CE-CB 4.44Å; M174-L178 HydrophobicContact CE-CD1 4.38Å; M174-L178 WeakPolarHBondContact O-CB 3.23Å; M174-L178 PolarHBondContact O-N 2.94Å; L178-V180 PolarHBondContact O-N 2.98Å; L178-L181 PolarHBondContact O-N 3.23Å; L178-K182 PolarHBondContact O-N 2.84Å; L178-K182 VanDerWaalsContact O-N 3.09Å; L178-F207 HydrophobicContact CD1-CD2 3.82Å; L178-F207 HydrophobicContact CD1-CE2 4.03Å; L178-L210 HydrophobicContact CD1-CD2 4.41Å; L178-L219 HydrophobicContact CD2-CB 4.3Å; L178-I220 HydrophobicContact CD2-CD1 3.59Å; L178-W228 HydrophobicContact CD1-CZ2 3.55Å; L178-W228 HydrophobicContact CG-CZ2 4.11Å
179P94.4Very high94.5Very high60 Ų6038.6 Ų38.639%0.3921%0.208SC..Hα-helixtrans-62.5-40.2173.2-22.434.5000113K182 D183P179-K182 WeakPolarHBondContact O-CB 3.48Å; P179-K182 PolarHBondContact O-N 2.76Å; P179-D183 PolarHBondContact O-N 3.05Å
180V94.7Very high94.4Very high24 Ų2442.4 Ų42.415%0.14524%0.235CC..Hα-helixtrans-65.6-41.8179.3-177.30000110.9L137 Q138 H176 F177 L178 K182 D183 R184L137-V180 HydrophobicContact CD2-CB 4.17Å; L137-V180 HydrophobicContact CD2-CG1 3.69Å; L137-V180 HydrophobicContact CG-CG1 3.71Å; Q138-V180 HydrophobicContact CG-CG1 4.25Å; H176-V180 WeakPolarHBondContact O-CG2 3.42Å; F177-V180 PolarHBondContact O-N 3.25Å; F177-V180 VanDerWaalsContact O-N 3.07Å; L178-V180 PolarHBondContact O-N 2.98Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 2.68Å; V180-D183 PolarHBondContact O-N 3.3Å; V180-R184 HydrophobicContact CG1-CG 4.35Å; V180-R184 WeakPolarHBondContact O-CB 3.07Å; V180-R184 VanDerWaalsContact O-CG 3.25Å; V180-R184 WeakPolarHBondContact O-CG 3.42Å; V180-R184 PolarHBondContact O-N 3Å
181L96.4Very high94.2Very high1 Ų145.9 Ų45.91%0.00525%0.253CS..Hα-helixtrans-59.8-44.3175.3-70.3177.5000111.3L137 L149 L152 M174 F177 L178 R184 F185 I203 I206 W228L137-L181 HydrophobicContact CD1-CD2 4.45Å; L137-L181 HydrophobicContact CD2-CD2 4.02Å; L149-L181 HydrophobicContact CD2-CD2 3.29Å; L152-L181 HydrophobicContact CD2-CD1 4.01Å; L152-L181 HydrophobicContact CD2-CD2 4.01Å; L152-L181 HydrophobicContact CD2-CG 4.33Å; M174-L181 HydrophobicContact CE-CD1 3.94Å; F177-L181 VanDerWaalsContact O-CG 3.31Å; F177-L181 WeakPolarHBondContact O-CG 3.46Å; F177-L181 PolarHBondContact O-N 2.92Å; L178-L181 PolarHBondContact O-N 3.23Å; L181-R184 PolarHBondContact O-N 3.38Å; L181-F185 WeakPolarHBondContact O-CB 3.28Å; L181-F185 PolarHBondContact O-N 3.32Å; L181-I203 HydrophobicContact CB-CG2 4.04Å; L181-I203 HydrophobicContact CD2-CG1 4.19Å; L181-I203 HydrophobicContact CD2-CG2 4.4Å; L181-I206 HydrophobicContact CD1-CG2 4.03Å; L181-W228 HydrophobicContact CB-CH2 4.2Å; L181-W228 HydrophobicContact CB-CZ2 4.44Å
182K95.4Very high93.9Very high29 Ų2948.2 Ų48.213%0.12626%0.263CS..Hα-helixtrans-59.4-52.2175.8-176.1-164.463.4172.10111.2L178 P179 V180 R184 F185 I186 E227 W228 I231L178-K182 PolarHBondContact O-N 2.84Å; L178-K182 VanDerWaalsContact O-N 3.09Å; P179-K182 WeakPolarHBondContact O-CB 3.48Å; P179-K182 PolarHBondContact O-N 2.76Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 2.68Å; K182-R184 VanDerWaalsContact C-N 3.31Å; K182-R184 PolarHBondContact O-N 2.91Å; K182-F185 WeakPolarHBondContact O-CB 3.2Å; K182-F185 PolarHBondContact O-N 3.32Å; K182-F185 VanDerWaalsContact O-N 3.1Å; K182-I186 HydrophobicContact CD-CD1 4.46Å; K182-I186 HydrophobicContact CG-CD1 4.03Å; K182-I186 WeakPolarHBondContact O-CG1 3.33Å; K182-I186 PolarHBondContact O-N 3.2Å; K182-E227 HydrophobicContact CD-CB 3.98Å; K182-E227 VanDerWaalsContact CD-OE2 3.23Å; K182-E227 WeakPolarHBondContact CD-OE2 3.22Å; K182-E227 WeakPolarHBondContact CE-OE2 3.5Å; K182-E227 IonicContact NZ-OE1 2.98Å; K182-E227 PolarHBondContact NZ-OE1 3.43Å; K182-E227 IonicContact NZ-OE2 2.72Å; K182-E227 PolarHBondContact NZ-OE2 3.42Å; K182-W228 HydrophobicContact CB-CH2 4.15Å; K182-W228 HydrophobicContact CB-CZ2 3.76Å; K182-I231 HydrophobicContact CG-CD1 3.67Å
183D94.5Very high93.7Very high93 Ų9347.2 Ų47.250%0.49725%0.252SS..Hα-helixtrans-61.7-40.5-177.9-70.1-11.1000111.7P179 V180 I186 Q187P179-D183 PolarHBondContact O-N 3.05Å; V180-D183 PolarHBondContact O-N 3.3Å; D183-I186 PolarHBondContact O-N 3.44Å; D183-Q187 WeakPolarHBondContact O-CB 3.45Å; D183-Q187 PolarHBondContact O-N 2.85Å
184R93.5Very high93.5Very high37 Ų3751 Ų5114%0.1427%0.271CS..Hα-helixtrans-64.6-40.9173.6-71.5-68.2179.1-1180.1112.2L137 Q138 S139 V180 L181 K182 Q187 L188L137-R184 PolarHBondContact O-NE 3.4Å; L137-R184 PolarHBondContact O-NH2 3.44Å; Q138-R184 PolarHBondContact O-NH2 3.05Å; S139-R184 PolarHBondContact O-NH2 3.45Å; V180-R184 HydrophobicContact CG1-CG 4.35Å; V180-R184 WeakPolarHBondContact O-CB 3.07Å; V180-R184 VanDerWaalsContact O-CG 3.25Å; V180-R184 WeakPolarHBondContact O-CG 3.42Å; V180-R184 PolarHBondContact O-N 3Å; L181-R184 PolarHBondContact O-N 3.38Å; K182-R184 VanDerWaalsContact C-N 3.31Å; K182-R184 PolarHBondContact O-N 2.91Å; R184-Q187 PolarHBondContact O-N 3.4Å; R184-L188 WeakPolarHBondContact O-CB 3.3Å; R184-L188 VanDerWaalsContact O-CG 3.31Å; R184-L188 WeakPolarHBondContact O-CG 3.21Å; R184-L188 PolarHBondContact O-N 2.78Å
185F95.6Very high93.3Very high0 Ų055.7 Ų55.70%029%0.293CS..Hα-helixtrans-59.9-49.1175.7-156.5-69.9000110.6L181 K182 Q187 L188 L189 Q200 I203 F204 I231 V235L181-F185 WeakPolarHBondContact O-CB 3.28Å; L181-F185 PolarHBondContact O-N 3.32Å; K182-F185 WeakPolarHBondContact O-CB 3.2Å; K182-F185 PolarHBondContact O-N 3.32Å; K182-F185 VanDerWaalsContact O-N 3.1Å; F185-Q187 VanDerWaalsContact C-N 3.31Å; F185-Q187 PolarHBondContact O-N 3.34Å; F185-L188 PolarHBondContact O-N 3.11Å; F185-L189 HydrophobicContact CD1-CD2 3.92Å; F185-L189 HydrophobicContact CD1-CG 4.05Å; F185-L189 HydrophobicContact CE1-CD2 3.63Å; F185-L189 HydrophobicContact CE1-CG 4.28Å; F185-L189 WeakPolarHBondContact O-CG 3.25Å; F185-L189 PolarHBondContact O-N 3.2Å; F185-Q200 HydrophobicContact CD1-CG 4.47Å; F185-Q200 HydrophobicContact CD2-CB 4.43Å; F185-Q200 HydrophobicContact CD2-CG 4.49Å; F185-Q200 HydrophobicContact CE1-CB 4.33Å; F185-Q200 HydrophobicContact CE1-CG 4.04Å; F185-Q200 HydrophobicContact CE2-CB 3.7Å; F185-Q200 HydrophobicContact CE2-CG 4.1Å; F185-Q200 VanDerWaalsContact CE2-O 3.3Å; F185-Q200 WeakPolarHBondContact CE2-O 3.41Å; F185-Q200 HydrophobicContact CZ-CB 3.61Å; F185-Q200 HydrophobicContact CZ-CG 3.83Å; F185-I203 HydrophobicContact CB-CD1 4.17Å; F185-I203 HydrophobicContact CD2-CB 3.83Å; F185-I203 HydrophobicContact CD2-CD1 3.87Å; F185-I203 HydrophobicContact CD2-CG1 4.44Å; F185-I203 HydrophobicContact CD2-CG2 3.75Å; F185-I203 HydrophobicContact CE2-CB 4.26Å; F185-I203 HydrophobicContact CE2-CG2 4.45Å; F185-I203 HydrophobicContact CG-CD1 4.45Å; F185-F204 HydrophobicContact CD2-CD1 4.39Å; F185-F204 HydrophobicContact CD2-CE1 4.1Å; F185-F204 HydrophobicContact CE1-CE1 4.39Å; F185-F204 AromaticContact CE1-CZ 3.98Å; F185-F204 HydrophobicContact CE1-CZ 3.98Å; F185-F204 AromaticContact CE2-CD1 3.66Å; F185-F204 HydrophobicContact CE2-CD1 3.66Å; F185-F204 HydrophobicContact CE2-CD2 4.14Å; F185-F204 AromaticContact CE2-CE1 3.36Å; F185-F204 HydrophobicContact CE2-CE1 3.36Å; F185-F204 AromaticContact CE2-CE2 3.88Å; F185-F204 HydrophobicContact CE2-CE2 3.88Å; F185-F204 HydrophobicContact CE2-CG 4.05Å; F185-F204 AromaticContact CE2-CZ 3.5Å; F185-F204 HydrophobicContact CE2-CZ 3.5Å; F185-F204 VanDerWaalsContact CE2-CZ 3.5Å; F185-F204 HydrophobicContact CZ-CD1 4.23Å; F185-F204 HydrophobicContact CZ-CD2 4.21Å; F185-F204 AromaticContact CZ-CE1 3.57Å; F185-F204 HydrophobicContact CZ-CE1 3.57Å; F185-F204 AromaticContact CZ-CE2 3.53Å; F185-F204 HydrophobicContact CZ-CE2 3.53Å; F185-F204 AromaticContact CZ-CZ 3.18Å; F185-F204 HydrophobicContact CZ-CZ 3.18Å; F185-I231 HydrophobicContact CD1-CG2 3.36Å; F185-I231 HydrophobicContact CD2-CG2 4.4Å; F185-I231 HydrophobicContact CE1-CG2 3.42Å; F185-I231 VanDerWaalsContact CE1-CG2 3.42Å; F185-I231 HydrophobicContact CE2-CG2 4.43Å; F185-I231 HydrophobicContact CG-CG2 3.91Å; F185-I231 HydrophobicContact CZ-CG2 3.99Å; F185-V235 HydrophobicContact CE1-CG2 3.66Å; F185-V235 HydrophobicContact CZ-CG2 3.71Å
186I94.7Very high93.3Very high84 Ų8450.6 Ų50.643%0.43127%0.269SS..Hα-helixtrans-59.4-43.1179.2-66.8168.3000110.8K182 D183 L188 L189 I231K182-I186 HydrophobicContact CD-CD1 4.46Å; K182-I186 HydrophobicContact CG-CD1 4.03Å; K182-I186 WeakPolarHBondContact O-CG1 3.33Å; K182-I186 PolarHBondContact O-N 3.2Å; D183-I186 PolarHBondContact O-N 3.44Å; I186-L188 VanDerWaalsContact C-N 3.26Å; I186-L188 PolarHBondContact O-N 3.09Å; I186-L189 WeakPolarHBondContact O-CB 3.25Å; I186-L189 PolarHBondContact O-N 3.23Å; I186-I231 HydrophobicContact CD1-CD1 4.36Å; I186-I231 HydrophobicContact CG1-CD1 4.03Å; I186-I231 HydrophobicContact CG1-CG1 4.38Å
187Q93Very high93.4Very high102 Ų10246.2 Ų46.248%0.47725%0.249SC..Hα-helixtrans-59.2-37.3175.7-178.1-179.5-0.700112.5D183 R184 F185D183-Q187 WeakPolarHBondContact O-CB 3.45Å; D183-Q187 PolarHBondContact O-N 2.85Å; R184-Q187 PolarHBondContact O-N 3.4Å; F185-Q187 VanDerWaalsContact C-N 3.31Å; F185-Q187 PolarHBondContact O-N 3.34Å
188L93.7Very high93.3Very high12 Ų1248.5 Ų48.56%0.06326%0.261CS..Hα-helixtrans-82.2-17-178-72.3167.7000113.8W145 R184 F185 I186 S190 D191 S196 I199 Q200W145-L188 HydrophobicContact CE3-CD1 4.15Å; W145-L188 HydrophobicContact CE3-CD2 4.3Å; W145-L188 HydrophobicContact CZ3-CD1 4.13Å; W145-L188 HydrophobicContact CZ3-CD2 3.78Å; W145-L188 HydrophobicContact CZ3-CG 4.02Å; R184-L188 WeakPolarHBondContact O-CB 3.3Å; R184-L188 VanDerWaalsContact O-CG 3.31Å; R184-L188 WeakPolarHBondContact O-CG 3.21Å; R184-L188 PolarHBondContact O-N 2.78Å; F185-L188 PolarHBondContact O-N 3.11Å; I186-L188 VanDerWaalsContact C-N 3.26Å; I186-L188 PolarHBondContact O-N 3.09Å; L188-S190 PolarHBondContact O-N 3.37Å; L188-S190 VanDerWaalsContact O-N 3.11Å; L188-D191 PolarHBondContact O-N 2.7Å; L188-S196 PolarHBondContact O-OG 3.39Å; L188-I199 HydrophobicContact CD1-CB 3.96Å; L188-I199 HydrophobicContact CD1-CG2 3.3Å; L188-Q200 HydrophobicContact CB-CG 4.06Å; L188-Q200 PolarHBondContact O-NE2 2.97Å; L188-Q200 VanDerWaalsContact O-NE2 3.13Å
189L91.6Very high93.4Very high40 Ų4048.5 Ų48.521%0.20926%0.261CS..THydrogen-bonded Turntrans-54.7-35.6-175.5-81.1174.3000113.6F185 I186 Q192 T234 V235F185-L189 HydrophobicContact CD1-CD2 3.92Å; F185-L189 HydrophobicContact CD1-CG 4.05Å; F185-L189 HydrophobicContact CE1-CD2 3.63Å; F185-L189 HydrophobicContact CE1-CG 4.28Å; F185-L189 WeakPolarHBondContact O-CG 3.25Å; F185-L189 PolarHBondContact O-N 3.2Å; I186-L189 WeakPolarHBondContact O-CB 3.25Å; I186-L189 PolarHBondContact O-N 3.23Å; L189-Q192 PolarHBondContact O-NE2 3.28Å; L189-T234 HydrophobicContact CD2-CG2 4.2Å; L189-V235 HydrophobicContact CD2-CG2 4.3Å
190S90.6Very high93.5Very high107 Ų10745.6 Ų45.675%0.74824%0.243SC*.THydrogen-bonded Turntrans-77.3-21.7179.554.40000114L188L188-S190 PolarHBondContact O-N 3.37Å; L188-S190 VanDerWaalsContact O-N 3.11Å
191D91.7Very high93.6Very high72 Ų7245.6 Ų45.639%0.38524%0.241SC..  trans-91112.6-179.8-177.73.6000110.2L188 S193 S196L188-D191 PolarHBondContact O-N 2.7Å; D191-S193 VanDerWaalsContact CG-OG 3.26Å; D191-S193 WeakPolarHBondContact OD1-CB 3.41Å; D191-S193 PolarHBondContact OD1-N 3.24Å; D191-S193 PolarHBondContact OD1-OG 3.33Å; D191-S193 PolarHBondContact OD2-OG 3.35Å; D191-S193 VanDerWaalsContact OD2-OG 3.05Å; D191-S196 VanDerWaalsContact O-CB 3.28Å; D191-S196 WeakPolarHBondContact O-CB 3.33Å; D191-S196 PolarHBondContact O-OG 3.4Å; D191-S196 WeakPolarHBondContact OD2-CB 3.46Å
192Q87.2Confident93.7Very high74 Ų7445.7 Ų45.735%0.34624%0.241SC..  trans-92.610.1179.5-57.2-53.9-4500113.4L189 W257L189-Q192 PolarHBondContact O-NE2 3.28Å; Q192-W257 WeakPolarHBondContact O-CZ2 3.46Å
193S91.5Very high93.8Very high47 Ų4744.3 Ų44.333%0.32924%0.235SC..SBendtrans-61.9149.7174.767.40000111.8D191 Q195 S196 V197D191-S193 VanDerWaalsContact CG-OG 3.26Å; D191-S193 WeakPolarHBondContact OD1-CB 3.41Å; D191-S193 PolarHBondContact OD1-N 3.24Å; D191-S193 PolarHBondContact OD1-OG 3.33Å; D191-S193 PolarHBondContact OD2-OG 3.35Å; D191-S193 VanDerWaalsContact OD2-OG 3.05Å; S193-Q195 VanDerWaalsContact C-N 3.26Å; S193-Q195 PolarHBondContact O-N 3.3Å; S193-S196 WeakPolarHBondContact O-CB 3.28Å; S193-S196 PolarHBondContact O-N 3.08Å; S193-S196 VanDerWaalsContact O-N 3.08Å; S193-S196 WeakPolarHBondContact OG-CB 3.19Å; S193-S196 PolarHBondContact OG-N 3.28Å; S193-V197 WeakPolarHBondContact O-CG2 3.49Å; S193-V197 PolarHBondContact O-N 3.2Å
194D90.3Very high94Very high83 Ų8339.9 Ų39.944%0.44421%0.211SC..Hα-helixtrans-50.2-47.5177.1-178.2-90.1000112S196 V197 L198 P256 W257D194-S196 PolarHBondContact O-N 3.09Å; D194-V197 PolarHBondContact O-N 3.3Å; D194-L198 WeakPolarHBondContact O-CB 3.39Å; D194-L198 PolarHBondContact O-N 3.43Å; D194-P256 WeakPolarHBondContact OD2-CD 3.48Å; D194-P256 VanDerWaalsContact OD2-CG 3.27Å; D194-P256 WeakPolarHBondContact OD2-CG 3.29Å; D194-W257 HydrophobicContact CB-CH2 4.14Å
195Q91.5Very high94.2Very high99 Ų9940.2 Ų40.246%0.46321%0.214SC..Hα-helixtrans-60.9-43.5178.2-173.8179.8-0.800112.7S193 L198 I199S193-Q195 VanDerWaalsContact C-N 3.26Å; S193-Q195 PolarHBondContact O-N 3.3Å; Q195-L198 PolarHBondContact O-N 2.81Å; Q195-I199 HydrophobicContact CG-CD1 4.33Å; Q195-I199 WeakPolarHBondContact O-CG1 3.49Å; Q195-I199 PolarHBondContact O-N 3.19Å; Q195-I199 VanDerWaalsContact O-N 3.11Å
196S94.6Very high94.3Very high2 Ų240.2 Ų40.21%0.01421%0.214CC..Hα-helixtrans-61.4-45.2176.9170.60000111.3L188 D191 S193 D194 L198 I199 Q200L188-S196 PolarHBondContact O-OG 3.39Å; D191-S196 VanDerWaalsContact O-CB 3.28Å; D191-S196 WeakPolarHBondContact O-CB 3.33Å; D191-S196 PolarHBondContact O-OG 3.4Å; D191-S196 WeakPolarHBondContact OD2-CB 3.46Å; S193-S196 WeakPolarHBondContact O-CB 3.28Å; S193-S196 PolarHBondContact O-N 3.08Å; S193-S196 VanDerWaalsContact O-N 3.08Å; S193-S196 WeakPolarHBondContact OG-CB 3.19Å; S193-S196 PolarHBondContact OG-N 3.28Å; D194-S196 PolarHBondContact O-N 3.09Å; S196-L198 VanDerWaalsContact C-N 3.35Å; S196-L198 PolarHBondContact O-N 3.12Å; S196-I199 WeakPolarHBondContact O-CB 3.33Å; S196-I199 PolarHBondContact O-N 3.03Å; S196-Q200 WeakPolarHBondContact O-CG 3.43Å; S196-Q200 PolarHBondContact O-N 3.42Å; S196-Q200 PolarHBondContact OG-NE2 2.72Å
197V95.7Very high94.4Very high0 Ų036.3 Ų36.30%019%0.193CC..Hα-helixtrans-70.6-33.3-178.7-178.40000111.6S193 D194 I199 Q200 K201 P256 W257 C260S193-V197 WeakPolarHBondContact O-CG2 3.49Å; S193-V197 PolarHBondContact O-N 3.2Å; D194-V197 PolarHBondContact O-N 3.3Å; V197-I199 VanDerWaalsContact C-N 3.32Å; V197-I199 PolarHBondContact O-N 2.69Å; V197-Q200 PolarHBondContact O-N 3.42Å; V197-K201 WeakPolarHBondContact O-CB 2.96Å; V197-K201 PolarHBondContact O-N 2.84Å; V197-P256 HydrophobicContact CB-CB 4.18Å; V197-P256 HydrophobicContact CG1-CB 3.9Å; V197-P256 WeakPolarHBondContact CG1-O 3.5Å; V197-W257 HydrophobicContact CG1-CG 4.17Å; V197-C260 HydrophobicContact CG1-CB 3.88Å
198L94Very high94.6Very high48 Ų4831.9 Ų31.925%0.25117%0.173SC..Hα-helixtrans-62.2-40172.4-173.962.6000111.9L146 D194 Q195 S196 Q202L146-L198 HydrophobicContact CD1-CD2 4.34Å; L146-L198 HydrophobicContact CD1-CG 4.11Å; L146-L198 HydrophobicContact CD2-CD2 3.59Å; L146-L198 HydrophobicContact CD2-CG 4.27Å; D194-L198 WeakPolarHBondContact O-CB 3.39Å; D194-L198 PolarHBondContact O-N 3.43Å; Q195-L198 PolarHBondContact O-N 2.81Å; S196-L198 VanDerWaalsContact C-N 3.35Å; S196-L198 PolarHBondContact O-N 3.12Å; L198-Q202 WeakPolarHBondContact O-CB 3.19Å; L198-Q202 PolarHBondContact O-N 3.37Å
199I96.6Very high94.7Very high4 Ų431.4 Ų31.42%0.02117%0.17CC..Hα-helixtrans-66.1-47.8174.3-67.9165.9000110.6W145 L146 L149 L188 Q195 S196 V197 K201 Q202 I203W145-I199 HydrophobicContact CB-CD1 4.07Å; W145-I199 HydrophobicContact CE3-CD1 4.24Å; L146-I199 HydrophobicContact CB-CG1 4.22Å; L149-I199 HydrophobicContact CD1-CG2 3.58Å; L188-I199 HydrophobicContact CD1-CB 3.96Å; L188-I199 HydrophobicContact CD1-CG2 3.3Å; Q195-I199 HydrophobicContact CG-CD1 4.33Å; Q195-I199 WeakPolarHBondContact O-CG1 3.49Å; Q195-I199 PolarHBondContact O-N 3.19Å; Q195-I199 VanDerWaalsContact O-N 3.11Å; S196-I199 WeakPolarHBondContact O-CB 3.33Å; S196-I199 PolarHBondContact O-N 3.03Å; V197-I199 VanDerWaalsContact C-N 3.32Å; V197-I199 PolarHBondContact O-N 2.69Å; I199-K201 VanDerWaalsContact C-N 3.33Å; I199-K201 PolarHBondContact O-N 2.9Å; I199-Q202 PolarHBondContact O-N 3.17Å; I199-I203 HydrophobicContact CG2-CD1 4.24Å; I199-I203 WeakPolarHBondContact O-CG1 3.2Å; I199-I203 PolarHBondContact O-N 2.62Å
200Q97.6Very high94.9Very high0 Ų029.5 Ų29.50%016%0.16CC..Hα-helixtrans-53.9-49.5174.7-71.5167.848.100111F185 L188 S196 V197 Q202 I203 F204F185-Q200 HydrophobicContact CD1-CG 4.47Å; F185-Q200 HydrophobicContact CD2-CB 4.43Å; F185-Q200 HydrophobicContact CD2-CG 4.49Å; F185-Q200 HydrophobicContact CE1-CB 4.33Å; F185-Q200 HydrophobicContact CE1-CG 4.04Å; F185-Q200 HydrophobicContact CE2-CB 3.7Å; F185-Q200 HydrophobicContact CE2-CG 4.1Å; F185-Q200 VanDerWaalsContact CE2-O 3.3Å; F185-Q200 WeakPolarHBondContact CE2-O 3.41Å; F185-Q200 HydrophobicContact CZ-CB 3.61Å; F185-Q200 HydrophobicContact CZ-CG 3.83Å; L188-Q200 HydrophobicContact CB-CG 4.06Å; L188-Q200 PolarHBondContact O-NE2 2.97Å; L188-Q200 VanDerWaalsContact O-NE2 3.13Å; S196-Q200 WeakPolarHBondContact O-CG 3.43Å; S196-Q200 PolarHBondContact O-N 3.42Å; S196-Q200 PolarHBondContact OG-NE2 2.72Å; V197-Q200 PolarHBondContact O-N 3.42Å; Q200-Q202 VanDerWaalsContact C-N 3.26Å; Q200-Q202 PolarHBondContact O-N 3.34Å; Q200-I203 PolarHBondContact O-N 3.08Å; Q200-I203 VanDerWaalsContact O-N 3.16Å; Q200-F204 PolarHBondContact O-N 2.98Å; Q200-F204 VanDerWaalsContact O-N 3.1Å
201K96.8Very high95.1Very high24 Ų2424.4 Ų24.410%0.10412%0.124CC..Hα-helixtrans-55.8-41.4175.7-178.5-117.968.8176.30111.8V197 I199 F204 K205 K259 C260V197-K201 WeakPolarHBondContact O-CB 2.96Å; V197-K201 PolarHBondContact O-N 2.84Å; I199-K201 VanDerWaalsContact C-N 3.33Å; I199-K201 PolarHBondContact O-N 2.9Å; K201-F204 PolarHBondContact O-N 2.93Å; K201-K205 PolarHBondContact O-N 3.4Å; K201-K259 HydrophobicContact CD-CB 4.18Å; K201-K259 HydrophobicContact CG-CB 4Å; K201-C260 HydrophobicContact CB-CB 3.99Å
202Q97.5Very high95.2Very high2 Ų221.9 Ų21.91%0.00911%0.11CC..Hα-helixtrans-70.3-35.6-178.7-169.358.630.700112L146 L149 Y153 L198 I199 Q200 K205 I206L146-Q202 HydrophobicContact CD1-CB 4.29Å; L146-Q202 HydrophobicContact CD1-CG 4.43Å; L149-Q202 HydrophobicContact CB-CB 4.43Å; L149-Q202 HydrophobicContact CB-CG 3.71Å; L149-Q202 HydrophobicContact CD1-CB 4.48Å; Y153-Q202 VanDerWaalsContact CB-NE2 3.28Å; L198-Q202 WeakPolarHBondContact O-CB 3.19Å; L198-Q202 PolarHBondContact O-N 3.37Å; I199-Q202 PolarHBondContact O-N 3.17Å; Q200-Q202 VanDerWaalsContact C-N 3.26Å; Q200-Q202 PolarHBondContact O-N 3.34Å; Q202-K205 WeakPolarHBondContact O-CB 3.29Å; Q202-K205 PolarHBondContact O-N 2.98Å; Q202-I206 WeakPolarHBondContact O-CG1 3.49Å; Q202-I206 PolarHBondContact O-N 3.15Å; Q202-I206 VanDerWaalsContact O-N 3.13Å
203I98.3Very high95.4Very high1 Ų121.8 Ų21.81%0.00511%0.108CC..Hα-helixtrans-61.6-44.6172.5-63.3169.6000110.6L149 L181 F185 I199 Q200 K205 I206 F207 W228L149-I203 HydrophobicContact CD1-CD1 4.43Å; L149-I203 HydrophobicContact CD1-CG1 3.82Å; L149-I203 HydrophobicContact CD2-CG1 4.05Å; L181-I203 HydrophobicContact CB-CG2 4.04Å; L181-I203 HydrophobicContact CD2-CG1 4.19Å; L181-I203 HydrophobicContact CD2-CG2 4.4Å; F185-I203 HydrophobicContact CB-CD1 4.17Å; F185-I203 HydrophobicContact CD2-CB 3.83Å; F185-I203 HydrophobicContact CD2-CD1 3.87Å; F185-I203 HydrophobicContact CD2-CG1 4.44Å; F185-I203 HydrophobicContact CD2-CG2 3.75Å; F185-I203 HydrophobicContact CE2-CB 4.26Å; F185-I203 HydrophobicContact CE2-CG2 4.45Å; F185-I203 HydrophobicContact CG-CD1 4.45Å; I199-I203 HydrophobicContact CG2-CD1 4.24Å; I199-I203 WeakPolarHBondContact O-CG1 3.2Å; I199-I203 PolarHBondContact O-N 2.62Å; Q200-I203 PolarHBondContact O-N 3.08Å; Q200-I203 VanDerWaalsContact O-N 3.16Å; I203-K205 PolarHBondContact O-N 3.27Å; I203-I206 WeakPolarHBondContact O-CB 3.19Å; I203-I206 PolarHBondContact O-N 2.64Å; I203-F207 PolarHBondContact O-N 3.21Å; I203-W228 HydrophobicContact CG2-CH2 4.01Å; I203-W228 HydrophobicContact CG2-CZ3 4.29Å
204F98.3Very high95.4Very high0 Ų020.6 Ų20.60%010%0.098CC..Hα-helixtrans-63.8-37.8175.3-72.7-22.7000113.2F185 Q200 K201 I206 F207 Y208 I231 L232 V235 W263 A264 I267F185-F204 HydrophobicContact CD2-CD1 4.39Å; F185-F204 HydrophobicContact CD2-CE1 4.1Å; F185-F204 HydrophobicContact CE1-CE1 4.39Å; F185-F204 AromaticContact CE1-CZ 3.98Å; F185-F204 HydrophobicContact CE1-CZ 3.98Å; F185-F204 AromaticContact CE2-CD1 3.66Å; F185-F204 HydrophobicContact CE2-CD1 3.66Å; F185-F204 HydrophobicContact CE2-CD2 4.14Å; F185-F204 AromaticContact CE2-CE1 3.36Å; F185-F204 HydrophobicContact CE2-CE1 3.36Å; F185-F204 AromaticContact CE2-CE2 3.88Å; F185-F204 HydrophobicContact CE2-CE2 3.88Å; F185-F204 HydrophobicContact CE2-CG 4.05Å; F185-F204 AromaticContact CE2-CZ 3.5Å; F185-F204 HydrophobicContact CE2-CZ 3.5Å; F185-F204 VanDerWaalsContact CE2-CZ 3.5Å; F185-F204 HydrophobicContact CZ-CD1 4.23Å; F185-F204 HydrophobicContact CZ-CD2 4.21Å; F185-F204 AromaticContact CZ-CE1 3.57Å; F185-F204 HydrophobicContact CZ-CE1 3.57Å; F185-F204 AromaticContact CZ-CE2 3.53Å; F185-F204 HydrophobicContact CZ-CE2 3.53Å; F185-F204 AromaticContact CZ-CZ 3.18Å; F185-F204 HydrophobicContact CZ-CZ 3.18Å; Q200-F204 PolarHBondContact O-N 2.98Å; Q200-F204 VanDerWaalsContact O-N 3.1Å; K201-F204 PolarHBondContact O-N 2.93Å; F204-I206 VanDerWaalsContact C-N 3.29Å; F204-I206 PolarHBondContact O-N 3.14Å; F204-F207 PolarHBondContact O-N 2.76Å; F204-Y208 WeakPolarHBondContact O-CB 3.44Å; F204-Y208 PolarHBondContact O-N 3.1Å; F204-I231 HydrophobicContact CE1-CG2 3.85Å; F204-I231 HydrophobicContact CZ-CG2 3.88Å; F204-L232 HydrophobicContact CD1-CD2 4.02Å; F204-L232 HydrophobicContact CE1-CD2 3.6Å; F204-L232 HydrophobicContact CE1-CG 4.3Å; F204-L232 HydrophobicContact CE2-CD2 4.3Å; F204-L232 HydrophobicContact CZ-CD2 3.74Å; F204-L232 HydrophobicContact CZ-CG 4.46Å; F204-V235 HydrophobicContact CE2-CB 3.99Å; F204-V235 HydrophobicContact CE2-CG1 3.97Å; F204-V235 HydrophobicContact CE2-CG2 3.82Å; F204-V235 HydrophobicContact CZ-CB 4.24Å; F204-V235 HydrophobicContact CZ-CG2 3.8Å; F204-W263 HydrophobicContact CB-CB 3.84Å; F204-A264 HydrophobicContact CD2-CB 3.98Å; F204-A264 HydrophobicContact CE2-CB 3.56Å; F204-A264 HydrophobicContact CZ-CB 4.19Å; F204-I267 HydrophobicContact CB-CD1 3.85Å; F204-I267 HydrophobicContact CD1-CD1 4.1Å; F204-I267 HydrophobicContact CG-CD1 4.1Å
205K97.1Very high95.5Very high43 Ų4316.8 Ų16.819%0.1878%0.078CC..Hα-helixtrans-58-41.4172.6-78.4-164.370177.30112.8Y153 K201 Q202 I203 A209 W263Y153-K205 HydrophobicContact CD2-CB 4.26Å; Y153-K205 HydrophobicContact CE2-CB 4.1Å; Y153-K205 WeakPolarHBondContact OH-CE 3.48Å; K201-K205 PolarHBondContact O-N 3.4Å; Q202-K205 WeakPolarHBondContact O-CB 3.29Å; Q202-K205 PolarHBondContact O-N 2.98Å; I203-K205 PolarHBondContact O-N 3.27Å; K205-A209 WeakPolarHBondContact O-CB 3.1Å; K205-A209 PolarHBondContact O-N 3.14Å; K205-W263 HydrophobicContact CD-CZ2 3.85Å; K205-W263 HydrophobicContact CG-CD2 3.73Å; K205-W263 HydrophobicContact CG-CE3 4.38Å; K205-W263 HydrophobicContact CG-CG 4.05Å; K205-W263 HydrophobicContact CG-CH2 4.39Å; K205-W263 HydrophobicContact CG-CZ2 3.75Å
206I98.2Very high95.5Very high0 Ų012.7 Ų12.70%06%0.06CC..Hα-helixtrans-64.7-48176.6-65.6159.6000110.2L149 L152 Y153 V156 M174 L181 Q202 I203 F204 Y208 A209 L210L149-I206 HydrophobicContact CB-CD1 4.04Å; L149-I206 HydrophobicContact CD2-CD1 3.61Å; L149-I206 HydrophobicContact CG-CD1 4.42Å; L149-I206 WeakPolarHBondContact O-CD1 3.35Å; L152-I206 HydrophobicContact CB-CD1 4.28Å; L152-I206 HydrophobicContact CD2-CD1 4.16Å; L152-I206 HydrophobicContact CD2-CG2 4.39Å; L152-I206 HydrophobicContact CG-CD1 4.18Å; L152-I206 HydrophobicContact CG-CG2 4.24Å; Y153-I206 HydrophobicContact CD2-CG1 4.08Å; Y153-I206 HydrophobicContact CG-CG1 4.38Å; V156-I206 HydrophobicContact CG2-CG2 3.75Å; M174-I206 HydrophobicContact CE-CG2 4.19Å; L181-I206 HydrophobicContact CD1-CG2 4.03Å; Q202-I206 WeakPolarHBondContact O-CG1 3.49Å; Q202-I206 PolarHBondContact O-N 3.15Å; Q202-I206 VanDerWaalsContact O-N 3.13Å; I203-I206 WeakPolarHBondContact O-CB 3.19Å; I203-I206 PolarHBondContact O-N 2.64Å; F204-I206 VanDerWaalsContact C-N 3.29Å; F204-I206 PolarHBondContact O-N 3.14Å; I206-Y208 VanDerWaalsContact C-N 3.33Å; I206-Y208 PolarHBondContact O-N 3.43Å; I206-A209 PolarHBondContact O-N 3.2Å; I206-L210 WeakPolarHBondContact O-CB 3.45Å; I206-L210 PolarHBondContact O-N 3.39Å
207F97.5Very high95.3Very high2 Ų215.9 Ų15.91%0.0098%0.076CC..Hα-helixtrans-60.9-43.1179.2-171-93.1000111.8L178 I203 F204 L210 V211 I220 W228 I267L178-F207 HydrophobicContact CD1-CD2 3.82Å; L178-F207 HydrophobicContact CD1-CE2 4.03Å; I203-F207 PolarHBondContact O-N 3.21Å; F204-F207 PolarHBondContact O-N 2.76Å; F207-L210 WeakPolarHBondContact O-CB 3.44Å; F207-L210 PolarHBondContact O-N 2.81Å; F207-V211 HydrophobicContact CD1-CG2 4.35Å; F207-V211 HydrophobicContact CE1-CG1 4.19Å; F207-V211 HydrophobicContact CE1-CG2 4.22Å; F207-V211 HydrophobicContact CZ-CG1 4.22Å; F207-V211 WeakPolarHBondContact O-CG2 3.46Å; F207-V211 PolarHBondContact O-N 3.37Å; F207-I220 HydrophobicContact CE2-CD1 3.77Å; F207-I220 HydrophobicContact CZ-CD1 4.05Å; F207-W228 HydrophobicContact CD2-CD2 4.07Å; F207-W228 HydrophobicContact CD2-CE3 4.32Å; F207-W228 HydrophobicContact CD2-CH2 4.48Å; F207-W228 HydrophobicContact CD2-CZ2 4.23Å; F207-W228 AromaticContact CE2-CD1 3.86Å; F207-W228 AromaticContact CE2-CD2 3.83Å; F207-W228 HydrophobicContact CE2-CD2 3.83Å; F207-W228 AromaticContact CE2-CE2 3.87Å; F207-W228 HydrophobicContact CE2-CE3 4.45Å; F207-W228 AromaticContact CE2-CG 3.86Å; F207-W228 HydrophobicContact CE2-CG 3.86Å; F207-W228 AromaticContact CE2-NE1 3.87Å; F207-W228 HydrophobicContact CZ-CB 4.35Å; F207-W228 HydrophobicContact CZ-CD2 4.41Å; F207-W228 HydrophobicContact CZ-CG 4.12Å; F207-I267 HydrophobicContact CB-CD1 4.36Å; F207-I267 HydrophobicContact CD1-CD1 3.86Å; F207-I267 HydrophobicContact CD1-CG1 4.16Å; F207-I267 HydrophobicContact CD1-CG2 3.69Å; F207-I267 HydrophobicContact CE1-CG2 3.61Å
208Y97.2Very high95Very high10 Ų1023.3 Ų23.34%0.03911%0.111CC..Hα-helixtrans-61.7-50.4177.3-177.8-102.8000112.2F204 I206 L210 V211 Q212 W263 H266 I267 R270F204-Y208 WeakPolarHBondContact O-CB 3.44Å; F204-Y208 PolarHBondContact O-N 3.1Å; I206-Y208 VanDerWaalsContact C-N 3.33Å; I206-Y208 PolarHBondContact O-N 3.43Å; Y208-L210 PolarHBondContact O-N 2.84Å; Y208-V211 PolarHBondContact O-N 2.87Å; Y208-Q212 HydrophobicContact CE1-CB 4.24Å; Y208-Q212 HydrophobicContact CE1-CG 4.24Å; Y208-Q212 HydrophobicContact CE2-CB 4.44Å; Y208-Q212 WeakPolarHBondContact O-CB 3.24Å; Y208-Q212 PolarHBondContact O-N 3.19Å; Y208-Q212 VanDerWaalsContact OH-CD 3.28Å; Y208-Q212 PolarHBondContact OH-OE1 3.49Å; Y208-W263 AromaticContact CD1-CE3 3.97Å; Y208-W263 HydrophobicContact CD1-CE3 3.97Å; Y208-W263 HydrophobicContact CD1-CH2 4.22Å; Y208-W263 AromaticContact CD1-CZ3 3.29Å; Y208-W263 HydrophobicContact CD1-CZ3 3.29Å; Y208-W263 HydrophobicContact CE1-CH2 4.41Å; Y208-W263 AromaticContact CE1-CZ3 3.6Å; Y208-W263 HydrophobicContact CE1-CZ3 3.6Å; Y208-W263 AromaticContact CG-CE3 3.99Å; Y208-W263 HydrophobicContact CG-CE3 3.99Å; Y208-W263 AromaticContact CG-CZ3 3.79Å; Y208-W263 HydrophobicContact CG-CZ3 3.79Å; Y208-H266 HydrophobicContact CD2-CB 4.46Å; Y208-H266 AromaticContact CE1-CE1 3.91Å; Y208-H266 AromaticContact CE1-ND1 3.86Å; Y208-H266 HydrophobicContact CE2-CB 4.25Å; Y208-H266 AromaticContact CE2-CD2 3.97Å; Y208-H266 AromaticContact CE2-CG 3.73Å; Y208-H266 AromaticContact CE2-ND1 3.86Å; Y208-H266 AromaticContact CZ-CE1 3.51Å; Y208-H266 AromaticContact CZ-CG 3.88Å; Y208-H266 AromaticContact CZ-ND1 3.57Å; Y208-H266 AromaticContact CZ-NE2 3.8Å; Y208-H266 PolarHBondContact OH-CE1 3.05Å; Y208-H266 VanDerWaalsContact OH-CE1 3.27Å; Y208-H266 PolarHBondContact OH-NE2 2.66Å; Y208-I267 HydrophobicContact CD2-CG1 3.77Å; Y208-I267 HydrophobicContact CG-CG1 4.21Å; Y208-R270 HydrophobicContact CE2-CB 3.96Å; Y208-R270 HydrophobicContact CE2-CG 4.17Å
209A95.9Very high94.9Very high1 Ų121.1 Ų21.11%0.00810%0.1CC..Hα-helixtrans-61.4-2817700000112.8Y153 V156 K205 I206Y153-A209 HydrophobicContact CD2-CB 4.49Å; Y153-A209 HydrophobicContact CE2-CB 3.94Å; V156-A209 HydrophobicContact CG1-CB 3.94Å; K205-A209 WeakPolarHBondContact O-CB 3.1Å; K205-A209 PolarHBondContact O-N 3.14Å; I206-A209 PolarHBondContact O-N 3.2Å
210L96Very high94.6Very high0 Ų021 Ų210%010%0.099CC..Hα-helixtrans-67.6-36.6174178.263.3000112V156 R167 L170 M174 L178 I206 F207 Y208 T214 P216 L219V156-L210 HydrophobicContact CG1-CB 3.95Å; R167-L210 PolarHBondContact NH2-O 2.85Å; L170-L210 HydrophobicContact CD2-CD1 3.91Å; L170-L210 HydrophobicContact CG-CD1 4.33Å; M174-L210 HydrophobicContact CB-CD2 4.47Å; M174-L210 HydrophobicContact CE-CD2 4.02Å; M174-L210 HydrophobicContact CG-CD1 4.07Å; M174-L210 HydrophobicContact CG-CD2 4.35Å; L178-L210 HydrophobicContact CD1-CD2 4.41Å; I206-L210 WeakPolarHBondContact O-CB 3.45Å; I206-L210 PolarHBondContact O-N 3.39Å; F207-L210 WeakPolarHBondContact O-CB 3.44Å; F207-L210 PolarHBondContact O-N 2.81Å; Y208-L210 PolarHBondContact O-N 2.84Å; L210-T214 VanDerWaalsContact O-O 3.09Å; L210-P216 HydrophobicContact CD1-CG 4.11Å; L210-P216 HydrophobicContact CG-CG 4.19Å; L210-L219 HydrophobicContact CD2-CD1 4.45Å
211V94.3Very high94Very high0 Ų024.4 Ų24.40%012%0.117CC..Hα-helixtrans-111.5-10.8-168.4-530000115.1F207 Y208 Y213 T214 L215 L271 Y275F207-V211 HydrophobicContact CD1-CG2 4.35Å; F207-V211 HydrophobicContact CE1-CG1 4.19Å; F207-V211 HydrophobicContact CE1-CG2 4.22Å; F207-V211 HydrophobicContact CZ-CG1 4.22Å; F207-V211 WeakPolarHBondContact O-CG2 3.46Å; F207-V211 PolarHBondContact O-N 3.37Å; Y208-V211 PolarHBondContact O-N 2.87Å; V211-Y213 PolarHBondContact O-N 3.38Å; V211-T214 WeakPolarHBondContact CA-O 3.37Å; V211-L215 HydrophobicContact CB-CD1 4Å; V211-L215 HydrophobicContact CG1-CD1 3.82Å; V211-L271 HydrophobicContact CG2-CD2 4.36Å; V211-Y275 WeakPolarHBondContact O-CE2 3.46Å; V211-Y275 VanDerWaalsContact O-CZ 3.31Å; V211-Y275 PolarHBondContact O-OH 3.38Å
212Q93.4Very high93.3Very high19 Ų1928.9 Ų28.99%0.08914%0.139CC..SBendtrans-58.4-41.8-170.9174.1177.6-24.700114.1E160 Y208 R274 Y275E160-Q212 PolarHBondContact OE1-OE1 2.99Å; Y208-Q212 HydrophobicContact CE1-CB 4.24Å; Y208-Q212 HydrophobicContact CE1-CG 4.24Å; Y208-Q212 HydrophobicContact CE2-CB 4.44Å; Y208-Q212 WeakPolarHBondContact O-CB 3.24Å; Y208-Q212 PolarHBondContact O-N 3.19Å; Y208-Q212 VanDerWaalsContact OH-CD 3.28Å; Y208-Q212 PolarHBondContact OH-OE1 3.49Å; Q212-R274 WeakPolarHBondContact O-CD 3.49Å; Q212-R274 PolarHBondContact O-NH1 3.42Å; Q212-Y275 PolarHBondContact O-OH 3.46Å
213Y91.4Very high92.6Very high73 Ų7335.5 Ų35.529%0.28617%0.169SC..SBendtrans-107.8-32.1-175.3-64.8-73.7000114.3E160 Y161 V211 R274 Y275E160-Y213 HydrophobicContact CG-CD2 3.62Å; E160-Y213 HydrophobicContact CG-CE2 3.63Å; E160-Y213 WeakPolarHBondContact O-CD2 3.34Å; Y161-Y213 HydrophobicContact CD1-CD2 4.42Å; Y161-Y213 AromaticContact CD1-CE2 3.89Å; Y161-Y213 HydrophobicContact CD1-CE2 3.89Å; Y161-Y213 HydrophobicContact CE1-CD2 4.43Å; Y161-Y213 HydrophobicContact CE1-CE1 4.41Å; Y161-Y213 AromaticContact CE1-CE2 3.5Å; Y161-Y213 HydrophobicContact CE1-CE2 3.5Å; Y161-Y213 VanDerWaalsContact CE1-CE2 3.5Å; Y161-Y213 AromaticContact CE1-CZ 3.48Å; Y161-Y213 VanDerWaalsContact CE1-CZ 3.48Å; Y161-Y213 VanDerWaalsContact CE1-OH 3.27Å; Y161-Y213 WeakPolarHBondContact CE1-OH 3.49Å; Y161-Y213 AromaticContact CZ-CE2 3.93Å; V211-Y213 PolarHBondContact O-N 3.38Å; Y213-R274 PolarHBondContact O-NE 3.18Å; Y213-R274 PolarHBondContact O-NH2 3.2Å; Y213-Y275 PolarHBondContact O-OH 2.92Å
214T90.8Very high92.2Very high21 Ų2137.5 Ų37.513%0.12918%0.18CC..  trans-138.7132.1176.6-46.80000108.3P164 R167 L210 V211 P216 Y275P164-T214 HydrophobicContact CB-CG2 4.34Å; P164-T214 HydrophobicContact CG-CG2 3.99Å; R167-T214 PolarHBondContact NH1-OG1 2.98Å; L210-T214 VanDerWaalsContact O-O 3.09Å; V211-T214 WeakPolarHBondContact CA-O 3.37Å; T214-P216 VanDerWaalsContact O-CD 3.24Å; T214-P216 WeakPolarHBondContact O-CD 3.35Å; T214-Y275 WeakPolarHBondContact CA-OH 3.32Å; T214-Y275 PolarHBondContact N-OH 3.33Å; T214-Y275 VanDerWaalsContact N-OH 3.14Å
215L92.4Very high91.8Very high3 Ų337.5 Ų37.52%0.01618%0.18CC..  trans-97104.8175.418070.9000109.4V211 L217 I220 L271 Y275 Y285 F288V211-L215 HydrophobicContact CB-CD1 4Å; V211-L215 HydrophobicContact CG1-CD1 3.82Å; L215-L217 HydrophobicContact CD2-CD2 4.05Å; L215-L217 HydrophobicContact CG-CD2 4.42Å; L215-L217 PolarHBondContact O-N 3.22Å; L215-I220 HydrophobicContact CD1-CB 4.07Å; L215-I220 HydrophobicContact CD1-CG1 3.97Å; L215-I220 HydrophobicContact CD1-CG2 4.16Å; L215-L271 HydrophobicContact CD1-CD2 4.12Å; L215-Y275 HydrophobicContact CB-CD1 3.9Å; L215-Y275 HydrophobicContact CB-CD2 4.12Å; L215-Y275 HydrophobicContact CB-CE1 3.73Å; L215-Y275 HydrophobicContact CB-CE2 3.96Å; L215-Y275 HydrophobicContact CB-CG 4.08Å; L215-Y275 HydrophobicContact CD2-CD1 4.38Å; L215-Y275 HydrophobicContact CD2-CD2 4.25Å; L215-Y275 HydrophobicContact CD2-CG 3.98Å; L215-Y285 HydrophobicContact CB-CD1 4.41Å; L215-Y285 HydrophobicContact CB-CE1 3.73Å; L215-Y285 HydrophobicContact CD2-CD1 4.32Å; L215-Y285 HydrophobicContact CD2-CE1 4.38Å; L215-Y285 HydrophobicContact CG-CE1 4.46Å; L215-Y285 PolarHBondContact N-OH 2.86Å; L215-Y285 WeakPolarHBondContact O-CE1 3.22Å; L215-F288 HydrophobicContact CD2-CD1 3.89Å; L215-F288 HydrophobicContact CD2-CD2 3.7Å; L215-F288 HydrophobicContact CD2-CE1 3.69Å; L215-F288 HydrophobicContact CD2-CE2 3.43Å; L215-F288 VanDerWaalsContact CD2-CE2 3.43Å; L215-F288 HydrophobicContact CD2-CG 3.92Å; L215-F288 HydrophobicContact CD2-CZ 3.45Å; L215-F288 VanDerWaalsContact CD2-CZ 3.45Å
216P92.4Very high91.7Very high14 Ų1438.1 Ų38.19%0.09119%0.187CC..  trans-71.695.2-179.528.1-33.9000110.8V171 L210 T214 E218 L219 I220V171-P216 HydrophobicContact CG2-CB 4.29Å; L210-P216 HydrophobicContact CD1-CG 4.11Å; L210-P216 HydrophobicContact CG-CG 4.19Å; T214-P216 VanDerWaalsContact O-CD 3.24Å; T214-P216 WeakPolarHBondContact O-CD 3.35Å; P216-E218 PolarHBondContact O-N 3.34Å; P216-L219 HydrophobicContact CB-CB 4.31Å; P216-L219 HydrophobicContact CB-CD1 3.93Å; P216-L219 HydrophobicContact CB-CG 4.23Å; P216-L219 HydrophobicContact CG-CB 4.18Å; P216-L219 HydrophobicContact CG-CD1 3.76Å; P216-L219 HydrophobicContact CG-CG 4.35Å; P216-L219 WeakPolarHBondContact O-CB 3.33Å; P216-L219 PolarHBondContact O-N 2.82Å; P216-I220 PolarHBondContact O-N 3.42Å
217L90.7Very high91.5Very high69 Ų6941.2 Ų41.236%0.36120%0.202SC..THydrogen-bonded Turntrans-59.4-27.5-176.8-67.4176000113.4L215 L219 I220 E284 Y285 F288L215-L217 HydrophobicContact CD2-CD2 4.05Å; L215-L217 HydrophobicContact CG-CD2 4.42Å; L215-L217 PolarHBondContact O-N 3.22Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 3.16Å; L217-I220 CarbonylContact O-C 3.6Å; L217-E284 WeakPolarHBondContact CD1-O 3.34Å; L217-Y285 HydrophobicContact CD1-CD1 4.05Å; L217-Y285 HydrophobicContact CD1-CE1 4.13Å; L217-Y285 HydrophobicContact CD2-CD1 4.04Å; L217-Y285 HydrophobicContact CD2-CE1 4.24Å; L217-Y285 HydrophobicContact CG-CD1 4.17Å; L217-Y285 HydrophobicContact CG-CE1 4.01Å; L217-F288 HydrophobicContact CD2-CB 4.1Å; L217-F288 HydrophobicContact CD2-CD2 3.96Å; L217-F288 HydrophobicContact CD2-CG 4.26Å
218E89.6Confident91.4Very high155 Ų15541.3 Ų41.372%0.72420%0.202SC*.THydrogen-bonded Turntrans-63-32.8173.9-57.5-177.7-179.200112.5P216P216-E218 PolarHBondContact O-N 3.34Å
219L91.6Very high91.4Very high3 Ų340.9 Ų40.92%0.01620%0.201CC..THydrogen-bonded Turntrans-90.6-41.4178.5-64.1175000112V171 M174 Q175 L178 L210 P216 L217 N224V171-L219 HydrophobicContact CB-CD1 4.48Å; V171-L219 HydrophobicContact CG1-CD1 4.16Å; V171-L219 HydrophobicContact CG1-CD2 4.38Å; V171-L219 HydrophobicContact CG1-CG 4.1Å; V171-L219 HydrophobicContact CG2-CD1 4.46Å; M174-L219 HydrophobicContact CB-CD1 3.66Å; M174-L219 HydrophobicContact CB-CD2 4.48Å; Q175-L219 VanDerWaalsContact CA-CD2 3.46Å; Q175-L219 HydrophobicContact CB-CD2 3.9Å; L178-L219 HydrophobicContact CD2-CB 4.3Å; L210-L219 HydrophobicContact CD2-CD1 4.45Å; P216-L219 HydrophobicContact CB-CB 4.31Å; P216-L219 HydrophobicContact CB-CD1 3.93Å; P216-L219 HydrophobicContact CB-CG 4.23Å; P216-L219 HydrophobicContact CG-CB 4.18Å; P216-L219 HydrophobicContact CG-CD1 3.76Å; P216-L219 HydrophobicContact CG-CG 4.35Å; P216-L219 WeakPolarHBondContact O-CB 3.33Å; P216-L219 PolarHBondContact O-N 2.82Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 3.16Å; L219-N224 PolarHBondContact O-ND2 3.02Å
220I90.9Very high91.4Very high1 Ų145 Ų451%0.00522%0.22CC..SBendtrans-103.973.6-175.1-49-60.8000109.9L178 F207 L215 P216 L217 L225 F288L178-I220 HydrophobicContact CD2-CD1 3.59Å; F207-I220 HydrophobicContact CE2-CD1 3.77Å; F207-I220 HydrophobicContact CZ-CD1 4.05Å; L215-I220 HydrophobicContact CD1-CB 4.07Å; L215-I220 HydrophobicContact CD1-CG1 3.97Å; L215-I220 HydrophobicContact CD1-CG2 4.16Å; P216-I220 PolarHBondContact O-N 3.42Å; L217-I220 CarbonylContact O-C 3.6Å; I220-L225 HydrophobicContact CG2-CB 4Å; I220-L225 HydrophobicContact CG2-CD1 3.9Å; I220-L225 HydrophobicContact CG2-CG 4.44Å; I220-F288 HydrophobicContact CG2-CE2 4.24Å
221N85Confident91.4Very high71 Ų7145.4 Ų45.438%0.3822%0.222SC..  trans-82.5170.2167.965.647.6000111.7Q223 N224 L225N221-Q223 VanDerWaalsContact C-N 3.27Å; N221-Q223 PolarHBondContact O-N 3.08Å; N221-Q223 PolarHBondContact OD1-N 2.98Å; N221-Q223 VanDerWaalsContact OD1-N 3.1Å; N221-N224 PolarHBondContact O-N 2.87Å; N221-N224 PolarHBondContact OD1-N 3.18Å; N221-L225 VanDerWaalsContact O-CB 3.26Å; N221-L225 WeakPolarHBondContact O-CB 3.41Å; N221-L225 PolarHBondContact O-N 3.07Å
222Q80.4Confident91.6Very high119 Ų11945.4 Ų45.456%0.55622%0.222SC*.Hα-helixtrans-53.5-38.9-178-174.5177.721.900114T226 V291Q222-T226 PolarHBondContact O-N 3.38Å; Q222-T226 VanDerWaalsContact O-N 3.08Å; Q222-T226 PolarHBondContact O-OG1 3.22Å; Q222-V291 HydrophobicContact CG-CG1 3.85Å
223Q83.9Confident91.7Very high140 Ų14046.2 Ų46.265%0.65423%0.225SC*.Hα-helixtrans-68.5-52.3-179.4-177.4179.4-2.300111.1N221 L225 T226 E227N221-Q223 VanDerWaalsContact C-N 3.27Å; N221-Q223 PolarHBondContact O-N 3.08Å; N221-Q223 PolarHBondContact OD1-N 2.98Å; N221-Q223 VanDerWaalsContact OD1-N 3.1Å; Q223-L225 VanDerWaalsContact C-N 3.31Å; Q223-L225 PolarHBondContact O-N 3.49Å; Q223-T226 WeakPolarHBondContact O-CB 3.44Å; Q223-T226 PolarHBondContact O-N 3.09Å; Q223-E227 PolarHBondContact O-N 3.5Å
224N88.5Confident92Very high43 Ų4346 Ų4623%0.2323%0.231CC..Hα-helixtrans-63.2-40.3179.8-70.4-4.1000111.1L219 N221 T226 E227 W228L219-N224 PolarHBondContact O-ND2 3.02Å; N221-N224 PolarHBondContact O-N 2.87Å; N221-N224 PolarHBondContact OD1-N 3.18Å; N224-T226 VanDerWaalsContact C-N 3.34Å; N224-T226 PolarHBondContact O-N 3.11Å; N224-E227 PolarHBondContact O-N 3.41Å; N224-W228 PolarHBondContact O-N 3.32Å; N224-W228 VanDerWaalsContact O-N 3.08Å
225L91.5Very high92.2Very high1 Ų145 Ų451%0.00523%0.226CC..Hα-helixtrans-60.3-43.9177-179.766.5000111.6I220 N221 Q223 E227 W228 I229 L271 F288 F296I220-L225 HydrophobicContact CG2-CB 4Å; I220-L225 HydrophobicContact CG2-CD1 3.9Å; I220-L225 HydrophobicContact CG2-CG 4.44Å; N221-L225 VanDerWaalsContact O-CB 3.26Å; N221-L225 WeakPolarHBondContact O-CB 3.41Å; N221-L225 PolarHBondContact O-N 3.07Å; Q223-L225 VanDerWaalsContact C-N 3.31Å; Q223-L225 PolarHBondContact O-N 3.49Å; L225-E227 VanDerWaalsContact C-N 3.28Å; L225-E227 PolarHBondContact O-N 3.23Å; L225-W228 PolarHBondContact O-N 3.06Å; L225-I229 HydrophobicContact CD1-CD1 4.3Å; L225-I229 HydrophobicContact CD1-CG1 3.96Å; L225-I229 HydrophobicContact CG-CG1 4.07Å; L225-I229 WeakPolarHBondContact O-CB 3.4Å; L225-I229 VanDerWaalsContact O-CG1 3.27Å; L225-I229 WeakPolarHBondContact O-CG1 3.5Å; L225-I229 PolarHBondContact O-N 3.48Å; L225-L271 HydrophobicContact CD1-CD1 4.35Å; L225-F288 HydrophobicContact CD1-CE2 4.35Å; L225-F288 HydrophobicContact CD1-CZ 4.23Å; L225-F288 HydrophobicContact CD2-CD2 4.32Å; L225-F288 HydrophobicContact CD2-CE2 3.42Å; L225-F288 VanDerWaalsContact CD2-CE2 3.42Å; L225-F288 HydrophobicContact CD2-CZ 3.65Å; L225-F288 HydrophobicContact CG-CE2 4.44Å; L225-F296 HydrophobicContact CD2-CD2 3.92Å; L225-F296 HydrophobicContact CD2-CE2 3.48Å; L225-F296 VanDerWaalsContact CD2-CE2 3.48Å; L225-F296 HydrophobicContact CD2-CZ 4.34Å; L225-F296 HydrophobicContact CG-CD2 4.34Å; L225-F296 HydrophobicContact CG-CE2 3.94Å; L225-F296 HydrophobicContact CG-CZ 4.43Å
226T94.1Very high92.4Very high55 Ų5545 Ų4534%0.33723%0.225SC..Hα-helixtrans-55.3-46.2178.4-58.80000111.1Q222 Q223 N224 I229 E230 F296Q222-T226 PolarHBondContact O-N 3.38Å; Q222-T226 VanDerWaalsContact O-N 3.08Å; Q222-T226 PolarHBondContact O-OG1 3.22Å; Q223-T226 WeakPolarHBondContact O-CB 3.44Å; Q223-T226 PolarHBondContact O-N 3.09Å; N224-T226 VanDerWaalsContact C-N 3.34Å; N224-T226 PolarHBondContact O-N 3.11Å; T226-I229 PolarHBondContact O-N 3.18Å; T226-E230 WeakPolarHBondContact O-CG 3.5Å; T226-E230 PolarHBondContact O-N 2.98Å; T226-F296 HydrophobicContact CG2-CE1 4.11Å; T226-F296 VanDerWaalsContact OG1-CZ 3.31Å; T226-F296 WeakPolarHBondContact OG1-CZ 3.46Å
227E94.3Very high92.5Very high66 Ų6647.7 Ų47.731%0.30824%0.239SC..Hα-helixtrans-65-43.7179-61.4176133.200112K182 Q223 N224 L225 E230 I231K182-E227 HydrophobicContact CD-CB 3.98Å; K182-E227 VanDerWaalsContact CD-OE2 3.23Å; K182-E227 WeakPolarHBondContact CD-OE2 3.22Å; K182-E227 WeakPolarHBondContact CE-OE2 3.5Å; K182-E227 IonicContact NZ-OE1 2.98Å; K182-E227 PolarHBondContact NZ-OE1 3.43Å; K182-E227 IonicContact NZ-OE2 2.72Å; K182-E227 PolarHBondContact NZ-OE2 3.42Å; Q223-E227 PolarHBondContact O-N 3.5Å; N224-E227 PolarHBondContact O-N 3.41Å; L225-E227 VanDerWaalsContact C-N 3.28Å; L225-E227 PolarHBondContact O-N 3.23Å; E227-E230 PolarHBondContact O-N 3.05Å; E227-I231 WeakPolarHBondContact O-CG1 3.32Å; E227-I231 PolarHBondContact O-N 3.22Å
228W96Very high92.6Very high4 Ų446.2 Ų46.22%0.01523%0.228CC..Hα-helixtrans-63.6-42.2176.8-80.4113.5000112.3L178 L181 K182 I203 F207 N224 L225 E230 I231 L232L178-W228 HydrophobicContact CD1-CZ2 3.55Å; L178-W228 HydrophobicContact CG-CZ2 4.11Å; L181-W228 HydrophobicContact CB-CH2 4.2Å; L181-W228 HydrophobicContact CB-CZ2 4.44Å; K182-W228 HydrophobicContact CB-CH2 4.15Å; K182-W228 HydrophobicContact CB-CZ2 3.76Å; I203-W228 HydrophobicContact CG2-CH2 4.01Å; I203-W228 HydrophobicContact CG2-CZ3 4.29Å; F207-W228 HydrophobicContact CD2-CD2 4.07Å; F207-W228 HydrophobicContact CD2-CE3 4.32Å; F207-W228 HydrophobicContact CD2-CH2 4.48Å; F207-W228 HydrophobicContact CD2-CZ2 4.23Å; F207-W228 AromaticContact CE2-CD1 3.86Å; F207-W228 AromaticContact CE2-CD2 3.83Å; F207-W228 HydrophobicContact CE2-CD2 3.83Å; F207-W228 AromaticContact CE2-CE2 3.87Å; F207-W228 HydrophobicContact CE2-CE3 4.45Å; F207-W228 AromaticContact CE2-CG 3.86Å; F207-W228 HydrophobicContact CE2-CG 3.86Å; F207-W228 AromaticContact CE2-NE1 3.87Å; F207-W228 HydrophobicContact CZ-CB 4.35Å; F207-W228 HydrophobicContact CZ-CD2 4.41Å; F207-W228 HydrophobicContact CZ-CG 4.12Å; N224-W228 PolarHBondContact O-N 3.32Å; N224-W228 VanDerWaalsContact O-N 3.08Å; L225-W228 PolarHBondContact O-N 3.06Å; W228-E230 VanDerWaalsContact C-N 3.33Å; W228-E230 PolarHBondContact O-N 2.92Å; W228-I231 HydrophobicContact CE3-CD1 4.19Å; W228-I231 HydrophobicContact CZ3-CD1 4.41Å; W228-I231 WeakPolarHBondContact O-CB 3.41Å; W228-I231 PolarHBondContact O-N 2.85Å; W228-L232 WeakPolarHBondContact O-CB 3.25Å; W228-L232 WeakPolarHBondContact O-CD1 3.46Å; W228-L232 WeakPolarHBondContact O-CG 3.26Å; W228-L232 PolarHBondContact O-N 3.08Å
229I96.2Very high92.6Very high1 Ų143.8 Ų43.81%0.00522%0.22CC..Hα-helixtrans-61.8-41.1175.9-68.1-66.3000111L225 T226 L232 K233 L268 L271 F292 F296 V300L225-I229 HydrophobicContact CD1-CD1 4.3Å; L225-I229 HydrophobicContact CD1-CG1 3.96Å; L225-I229 HydrophobicContact CG-CG1 4.07Å; L225-I229 WeakPolarHBondContact O-CB 3.4Å; L225-I229 VanDerWaalsContact O-CG1 3.27Å; L225-I229 WeakPolarHBondContact O-CG1 3.5Å; L225-I229 PolarHBondContact O-N 3.48Å; T226-I229 PolarHBondContact O-N 3.18Å; I229-L232 HydrophobicContact CD1-CD1 4.24Å; I229-L232 PolarHBondContact O-N 3.19Å; I229-K233 HydrophobicContact CG2-CD 3.77Å; I229-K233 HydrophobicContact CG2-CG 4.33Å; I229-K233 WeakPolarHBondContact O-CB 3.45Å; I229-K233 VanDerWaalsContact O-CG 3.29Å; I229-K233 WeakPolarHBondContact O-CG 3.47Å; I229-K233 PolarHBondContact O-N 2.65Å; I229-L268 HydrophobicContact CD1-CD2 3.68Å; I229-L271 HydrophobicContact CD1-CD1 4.2Å; I229-F292 HydrophobicContact CD1-CE2 4.12Å; I229-F296 HydrophobicContact CB-CD1 4.22Å; I229-F296 HydrophobicContact CB-CG 4.49Å; I229-F296 HydrophobicContact CG1-CB 4.44Å; I229-F296 HydrophobicContact CG1-CD1 4.26Å; I229-F296 HydrophobicContact CG1-CD2 4.4Å; I229-F296 HydrophobicContact CG1-CG 4.09Å; I229-F296 HydrophobicContact CG2-CB 4.12Å; I229-F296 HydrophobicContact CG2-CD1 3.92Å; I229-F296 HydrophobicContact CG2-CG 4.18Å; I229-V300 HydrophobicContact CG2-CG2 4.07Å
230E95.8Very high92.6Very high87 Ų8744.7 Ų44.741%0.40723%0.226SC..Hα-helixtrans-66.2-37.2175.7-71.3-53.6133.400112.5T226 E227 W228 K233 T234T226-E230 WeakPolarHBondContact O-CG 3.5Å; T226-E230 PolarHBondContact O-N 2.98Å; E227-E230 PolarHBondContact O-N 3.05Å; W228-E230 VanDerWaalsContact C-N 3.33Å; W228-E230 PolarHBondContact O-N 2.92Å; E230-K233 IonicContact OE1-NZ 3.19Å; E230-K233 PolarHBondContact OE1-NZ 3.27Å; E230-K233 IonicContact OE2-NZ 3.01Å; E230-K233 PolarHBondContact OE2-NZ 3.23Å; E230-T234 VanDerWaalsContact O-CB 3.29Å; E230-T234 WeakPolarHBondContact O-CB 3.33Å; E230-T234 PolarHBondContact O-N 3.4Å; E230-T234 PolarHBondContact O-OG1 2.68Å
231I96.8Very high92.6Very high8 Ų846.1 Ų46.14%0.04124%0.236CC..Hα-helixtrans-61.8-49.7172-69.9168.1000110.7K182 F185 I186 F204 E227 W228 K233 T234 V235K182-I231 HydrophobicContact CG-CD1 3.67Å; F185-I231 HydrophobicContact CD1-CG2 3.36Å; F185-I231 HydrophobicContact CD2-CG2 4.4Å; F185-I231 HydrophobicContact CE1-CG2 3.42Å; F185-I231 VanDerWaalsContact CE1-CG2 3.42Å; F185-I231 HydrophobicContact CE2-CG2 4.43Å; F185-I231 HydrophobicContact CG-CG2 3.91Å; F185-I231 HydrophobicContact CZ-CG2 3.99Å; I186-I231 HydrophobicContact CD1-CD1 4.36Å; I186-I231 HydrophobicContact CG1-CD1 4.03Å; I186-I231 HydrophobicContact CG1-CG1 4.38Å; F204-I231 HydrophobicContact CE1-CG2 3.85Å; F204-I231 HydrophobicContact CZ-CG2 3.88Å; E227-I231 WeakPolarHBondContact O-CG1 3.32Å; E227-I231 PolarHBondContact O-N 3.22Å; W228-I231 HydrophobicContact CE3-CD1 4.19Å; W228-I231 HydrophobicContact CZ3-CD1 4.41Å; W228-I231 WeakPolarHBondContact O-CB 3.41Å; W228-I231 PolarHBondContact O-N 2.85Å; I231-K233 PolarHBondContact O-N 3.46Å; I231-T234 WeakPolarHBondContact O-CB 3.33Å; I231-T234 PolarHBondContact O-N 2.69Å; I231-V235 PolarHBondContact O-N 3.15Å
232L97.7Very high92.8Very high0 Ų048.9 Ų48.90%025%0.25CS..Hα-helixtrans-58.4-50.7179.6-69163.2000110.7F204 W228 I229 T234 V235 V236 A264 I267 L268F204-L232 HydrophobicContact CD1-CD2 4.02Å; F204-L232 HydrophobicContact CE1-CD2 3.6Å; F204-L232 HydrophobicContact CE1-CG 4.3Å; F204-L232 HydrophobicContact CE2-CD2 4.3Å; F204-L232 HydrophobicContact CZ-CD2 3.74Å; F204-L232 HydrophobicContact CZ-CG 4.46Å; W228-L232 WeakPolarHBondContact O-CB 3.25Å; W228-L232 WeakPolarHBondContact O-CD1 3.46Å; W228-L232 WeakPolarHBondContact O-CG 3.26Å; W228-L232 PolarHBondContact O-N 3.08Å; I229-L232 HydrophobicContact CD1-CD1 4.24Å; I229-L232 PolarHBondContact O-N 3.19Å; L232-T234 VanDerWaalsContact C-N 3.31Å; L232-T234 PolarHBondContact O-N 3.01Å; L232-V235 PolarHBondContact O-N 3.35Å; L232-V236 WeakPolarHBondContact O-CG2 3.39Å; L232-V236 PolarHBondContact O-N 2.95Å; L232-A264 HydrophobicContact CD2-CB 3.85Å; L232-I267 HydrophobicContact CD1-CB 4.46Å; L232-I267 HydrophobicContact CD1-CG2 3.74Å; L232-I267 HydrophobicContact CD2-CB 4.13Å; L232-I267 HydrophobicContact CD2-CD1 3.79Å; L232-I267 HydrophobicContact CD2-CG2 4.2Å; L232-L268 HydrophobicContact CB-CD1 4.13Å; L232-L268 HydrophobicContact CB-CD2 4.05Å; L232-L268 HydrophobicContact CB-CG 4.11Å; L232-L268 HydrophobicContact CD1-CD2 3.92Å; L232-L268 HydrophobicContact CD1-CG 4.23Å
233K96.6Very high93.1Very high37 Ų3749.2 Ų49.216%0.16125%0.252CS..Hα-helixtrans-57.5-42.5176.1-76.2168.361.7-162.60112.3I229 E230 I231 V235 V236 N237 V300 V303I229-K233 HydrophobicContact CG2-CD 3.77Å; I229-K233 HydrophobicContact CG2-CG 4.33Å; I229-K233 WeakPolarHBondContact O-CB 3.45Å; I229-K233 VanDerWaalsContact O-CG 3.29Å; I229-K233 WeakPolarHBondContact O-CG 3.47Å; I229-K233 PolarHBondContact O-N 2.65Å; E230-K233 IonicContact OE1-NZ 3.19Å; E230-K233 PolarHBondContact OE1-NZ 3.27Å; E230-K233 IonicContact OE2-NZ 3.01Å; E230-K233 PolarHBondContact OE2-NZ 3.23Å; I231-K233 PolarHBondContact O-N 3.46Å; K233-V235 VanDerWaalsContact C-N 3.33Å; K233-V235 PolarHBondContact O-N 3.19Å; K233-V236 PolarHBondContact O-N 3.2Å; K233-N237 WeakPolarHBondContact O-CB 3.39Å; K233-N237 PolarHBondContact O-N 3.4Å; K233-V300 HydrophobicContact CD-CG2 4.08Å; K233-V300 HydrophobicContact CG-CG2 4.05Å; K233-V303 HydrophobicContact CB-CG2 4.31Å; K233-V303 HydrophobicContact CG-CG2 4.27Å
234T96.1Very high93.3Very high68 Ų6843 Ų4342%0.41722%0.223SC..Hα-helixtrans-60.7-43.9179.4-63.10000111L189 E230 I231 L232 R238L189-T234 HydrophobicContact CD2-CG2 4.2Å; E230-T234 VanDerWaalsContact O-CB 3.29Å; E230-T234 WeakPolarHBondContact O-CB 3.33Å; E230-T234 PolarHBondContact O-N 3.4Å; E230-T234 PolarHBondContact O-OG1 2.68Å; I231-T234 WeakPolarHBondContact O-CB 3.33Å; I231-T234 PolarHBondContact O-N 2.69Å; L232-T234 VanDerWaalsContact C-N 3.31Å; L232-T234 PolarHBondContact O-N 3.01Å; T234-R238 WeakPolarHBondContact O-CB 3.27Å; T234-R238 PolarHBondContact O-N 3.39Å; T234-R238 VanDerWaalsContact O-N 3.09Å
235V96.6Very high93.3Very high1 Ų145.3 Ų45.31%0.00624%0.235CC..Hα-helixtrans-68-42.7178.7175.50000112F185 L189 F204 I231 L232 K233 N237 R238 K261 A264F185-V235 HydrophobicContact CE1-CG2 3.66Å; F185-V235 HydrophobicContact CZ-CG2 3.71Å; L189-V235 HydrophobicContact CD2-CG2 4.3Å; F204-V235 HydrophobicContact CE2-CB 3.99Å; F204-V235 HydrophobicContact CE2-CG1 3.97Å; F204-V235 HydrophobicContact CE2-CG2 3.82Å; F204-V235 HydrophobicContact CZ-CB 4.24Å; F204-V235 HydrophobicContact CZ-CG2 3.8Å; I231-V235 PolarHBondContact O-N 3.15Å; L232-V235 PolarHBondContact O-N 3.35Å; K233-V235 VanDerWaalsContact C-N 3.33Å; K233-V235 PolarHBondContact O-N 3.19Å; V235-N237 VanDerWaalsContact C-N 3.34Å; V235-N237 PolarHBondContact O-N 3Å; V235-R238 PolarHBondContact O-N 3.11Å; V235-K261 HydrophobicContact CG1-CG 4.39Å; V235-A264 HydrophobicContact CB-CB 4.49Å; V235-A264 HydrophobicContact CG1-CB 4.39Å
236V96.2Very high93.2Very high2 Ų253.3 Ų53.31%0.01227%0.273CS..Hα-helixtrans-62.3-43.8177.6178.20000110.9L232 K233 R238 K261 A264 L265 L268 V303 L304 V307L232-V236 WeakPolarHBondContact O-CG2 3.39Å; L232-V236 PolarHBondContact O-N 2.95Å; K233-V236 PolarHBondContact O-N 3.2Å; V236-R238 VanDerWaalsContact C-N 3.33Å; V236-R238 PolarHBondContact O-N 3.29Å; V236-K261 WeakPolarHBondContact O-CE 3.3Å; V236-K261 PolarHBondContact O-NZ 3.2Å; V236-A264 HydrophobicContact CG2-CB 3.87Å; V236-L265 HydrophobicContact CG1-CD2 3.89Å; V236-L265 HydrophobicContact CG1-CG 4.42Å; V236-L265 HydrophobicContact CG2-CD2 3.78Å; V236-L265 HydrophobicContact CG2-CG 3.93Å; V236-L268 HydrophobicContact CG2-CD1 4.16Å; V236-V303 HydrophobicContact CB-CG1 4.02Å; V236-V303 HydrophobicContact CG1-CG1 3.74Å; V236-L304 HydrophobicContact CG1-CD2 3.91Å; V236-V307 HydrophobicContact CG1-CG2 3.87Å
237N94.3Very high93.1Very high70 Ų7052.9 Ų52.937%0.37427%0.27SS..Hα-helixtrans-73.6-19.7-176.9-170.637.1000114.3K233 V235 V303 K306K233-N237 WeakPolarHBondContact O-CB 3.39Å; K233-N237 PolarHBondContact O-N 3.4Å; V235-N237 VanDerWaalsContact C-N 3.34Å; V235-N237 PolarHBondContact O-N 3Å; N237-V303 HydrophobicContact CB-CG1 3.79Å; N237-K306 PolarHBondContact O-NZ 2.87Å; N237-K306 VanDerWaalsContact O-NZ 3.17Å; N237-K306 WeakPolarHBondContact OD1-CD 3.41Å; N237-K306 PolarHBondContact OD1-NZ 3.34Å
238R92.2Very high92.9Very high38 Ų3856.6 Ų56.614%0.14329%0.287CS..SBendtrans-66.7136.5-179.1-174.617772.4-167.73.3110.9T234 V235 V236 K261T234-R238 WeakPolarHBondContact O-CB 3.27Å; T234-R238 PolarHBondContact O-N 3.39Å; T234-R238 VanDerWaalsContact O-N 3.09Å; V235-R238 PolarHBondContact O-N 3.11Å; V236-R238 VanDerWaalsContact C-N 3.33Å; V236-R238 PolarHBondContact O-N 3.29Å; R238-K261 WeakPolarHBondContact O-CE 3.47Å; R238-K261 PolarHBondContact O-NZ 2.83Å
239D90.6Very high92.4Very high104 Ų10461.7 Ų61.756%0.55631%0.311SS*.PPolyproline II helixtrans-71.6148.8174.6-59.4-40.2000111K306 Q310D239-K306 IonicContact OD1-NZ 3.28Å; D239-Q310 PolarHBondContact OD1-NE2 3.22Å
240V91.5Very high92Very high23 Ų2368.4 Ų68.414%0.13935%0.347CS..PPolyproline II helixtrans-86.1138.4175.3-178.20000108.4N242 T244 W257 W258 K261V240-N242 PolarHBondContact O-N 2.91Å; V240-T244 HydrophobicContact CG1-CG2 3.82Å; V240-T244 WeakPolarHBondContact CG1-OG1 3.41Å; V240-W257 HydrophobicContact CG1-CB 3.86Å; V240-W257 HydrophobicContact CG1-CG 4.27Å; V240-W257 HydrophobicContact CG2-CB 4.34Å; V240-W258 HydrophobicContact CB-CZ2 4.11Å; V240-W258 HydrophobicContact CG1-CZ2 4.26Å; V240-W258 HydrophobicContact CG2-CD2 4.28Å; V240-W258 HydrophobicContact CG2-CE3 4.39Å; V240-W258 HydrophobicContact CG2-CH2 3.9Å; V240-W258 HydrophobicContact CG2-CZ2 3.77Å; V240-W258 HydrophobicContact CG2-CZ3 4.22Å; V240-K261 HydrophobicContact CG2-CD 4.27Å
241P90.3Very high91.7Very high31 Ų3168.7 Ų68.720%0.20135%0.351CS..PPolyproline II helixtrans-57.7137.7-178-23.433.1000112.7E243 T244 W257P241-E243 WeakPolarHBondContact CB-OE2 3.44Å; P241-E243 PolarHBondContact O-N 3.17Å; P241-E243 VanDerWaalsContact O-N 3.16Å; P241-T244 HydrophobicContact CB-CG2 4.46Å; P241-T244 WeakPolarHBondContact O-CB 3.46Å; P241-T244 WeakPolarHBondContact O-CG2 3.31Å; P241-T244 PolarHBondContact O-N 2.8Å; P241-T244 PolarHBondContact O-OG1 3.15Å; P241-W257 HydrophobicContact CG-CD2 4.38Å; P241-W257 HydrophobicContact CG-CZ2 4.19Å
242N88.3Confident91.6Very high128 Ų12869.8 Ų69.868%0.68436%0.355SS*.G310 helixtrans-64.4-22-175.9-72.1-24.3000112.9V240 T244 L245V240-N242 PolarHBondContact O-N 2.91Å; N242-T244 PolarHBondContact O-N 3.49Å; N242-L245 WeakPolarHBondContact O-CB 3.39Å; N242-L245 PolarHBondContact O-N 3.03Å; N242-L245 VanDerWaalsContact O-N 3.1Å
243E88.1Confident91.3Very high126 Ų12671.5 Ų71.559%0.58937%0.366SS*.G310 helixtrans-60.7-26.7175.1-59.277.8-170.800111.6P241 L245 Q246P241-E243 WeakPolarHBondContact CB-OE2 3.44Å; P241-E243 PolarHBondContact O-N 3.17Å; P241-E243 VanDerWaalsContact O-N 3.16Å; E243-L245 PolarHBondContact O-N 3.16Å; E243-Q246 WeakPolarHBondContact O-CB 3.32Å; E243-Q246 PolarHBondContact O-N 3.42Å; E243-Q246 VanDerWaalsContact O-N 3.13Å
244T87.8Confident91.1Very high9 Ų975.3 Ų75.36%0.05539%0.385CS..G310 helixtrans-65.4-20.3176.165.50000113.3V240 P241 N242 Q246 V247 L255 W257V240-T244 HydrophobicContact CG1-CG2 3.82Å; V240-T244 WeakPolarHBondContact CG1-OG1 3.41Å; P241-T244 HydrophobicContact CB-CG2 4.46Å; P241-T244 WeakPolarHBondContact O-CB 3.46Å; P241-T244 WeakPolarHBondContact O-CG2 3.31Å; P241-T244 PolarHBondContact O-N 2.8Å; P241-T244 PolarHBondContact O-OG1 3.15Å; N242-T244 PolarHBondContact O-N 3.49Å; T244-Q246 PolarHBondContact O-N 3.33Å; T244-V247 WeakPolarHBondContact O-CB 3.16Å; T244-V247 PolarHBondContact O-N 3.41Å; T244-L255 HydrophobicContact CG2-CD1 3.86Å; T244-W257 HydrophobicContact CG2-CD2 4.43Å; T244-W257 HydrophobicContact CG2-CE3 3.92Å; T244-W257 HydrophobicContact CG2-CZ3 4.16Å
245L88.6Confident91Very high92 Ų9273.5 Ų73.548%0.48237%0.372SS..G310 helixtrans-72.8-12.2175.9-59.9174.3000112.8N242 E243 V247 R252N242-L245 WeakPolarHBondContact O-CB 3.39Å; N242-L245 PolarHBondContact O-N 3.03Å; N242-L245 VanDerWaalsContact O-N 3.1Å; E243-L245 PolarHBondContact O-N 3.16Å; L245-V247 VanDerWaalsContact C-N 3.28Å; L245-R252 PolarHBondContact O-NH2 3.02Å
246Q89.6Confident90.9Very high169 Ų16974.1 Ų74.179%0.7938%0.377SS*.G310 helixtrans-80-13.9174.8-58.2175.61100112.4E243 T244E243-Q246 WeakPolarHBondContact O-CB 3.32Å; E243-Q246 PolarHBondContact O-N 3.42Å; E243-Q246 VanDerWaalsContact O-N 3.13Å; T244-Q246 PolarHBondContact O-N 3.33Å
247V91.1Very high90.9Very high47 Ų4775.5 Ų75.529%0.28538%0.382SS..SBendtrans-80.8143.1173.4-176.50000108.6T244 L245 D251 R252 L255T244-V247 WeakPolarHBondContact O-CB 3.16Å; T244-V247 PolarHBondContact O-N 3.41Å; L245-V247 VanDerWaalsContact C-N 3.28Å; V247-D251 HydrophobicContact CG1-CB 3.55Å; V247-R252 HydrophobicContact CB-CG 4.19Å; V247-R252 HydrophobicContact CG1-CG 4.39Å; V247-R252 PolarHBondContact O-NE 3.28Å; V247-R252 PolarHBondContact O-NH2 3.38Å; V247-R252 VanDerWaalsContact O-NH2 3.16Å; V247-L255 HydrophobicContact CB-CD1 4.37Å; V247-L255 HydrophobicContact CG2-CD1 4.2Å; V247-L255 HydrophobicContact CG2-CD2 4.29Å
248E90.2Very high90.9Very high144 Ų14472.8 Ų72.867%0.67337%0.366SS*.  trans-56.4145.4175-66.4-174.8177.200110.5D250 D251 R252E248-D250 PolarHBondContact O-N 3.14Å; E248-D251 PolarHBondContact O-N 2.86Å; E248-D251 VanDerWaalsContact O-N 3.15Å; E248-R252 WeakPolarHBondContact O-CG 3.16Å; E248-R252 PolarHBondContact O-N 3.36Å
249E86Confident91.1Very high111 Ų11173.6 Ų73.652%0.51937%0.37SS..G310 helixtrans-58.8-38.4-168.7-169.5145.3154.800112.7D251 R252 P253 Y316E249-D251 VanDerWaalsContact C-N 3.33Å; E249-D251 PolarHBondContact O-N 2.98Å; E249-R252 WeakPolarHBondContact O-CB 3.34Å; E249-R252 PolarHBondContact O-N 3.49Å; E249-R252 IonicContact OE2-CZ 3.79Å; E249-R252 IonicContact OE2-NH1 2.82Å; E249-R252 PolarHBondContact OE2-NH1 2.96Å; E249-P253 WeakPolarHBondContact O-CD 3.14Å; E249-Y316 HydrophobicContact CG-CD2 4.08Å; E249-Y316 HydrophobicContact CG-CE2 3.6Å
250D86.6Confident91.4Very high141 Ų14168.6 Ų68.675%0.75434%0.344SS*.G310 helixtrans-69.4-28.9-178.4-54.6-30.4000113E248 P253E248-D250 PolarHBondContact O-N 3.14Å; D250-P253 VanDerWaalsContact O-CD 3.31Å; D250-P253 WeakPolarHBondContact O-CD 3.37Å
251D91.5Very high91.7Very high93 Ų9367.9 Ų67.950%0.49734%0.339SS..G310 helixtrans-85.7-18.6177.2-78.8-30.6000112.8V247 E248 E249 P253 E254V247-D251 HydrophobicContact CG1-CB 3.55Å; E248-D251 PolarHBondContact O-N 2.86Å; E248-D251 VanDerWaalsContact O-N 3.15Å; E249-D251 VanDerWaalsContact C-N 3.33Å; E249-D251 PolarHBondContact O-N 2.98Å; D251-P253 VanDerWaalsContact C-CD 3.46Å; D251-E254 WeakPolarHBondContact O-CB 3.22Å; D251-E254 PolarHBondContact O-N 3.36Å; D251-E254 VanDerWaalsContact O-N 3.09Å
252R93.7Very high91.9Very high31 Ų3168.8 Ų68.812%0.11734%0.34CS..G310 helixtrans-58.4-42.1-177.6-72.4171.3-163.5153.98113.6L245 V247 E248 E249 E254 L255 Y316L245-R252 PolarHBondContact O-NH2 3.02Å; V247-R252 HydrophobicContact CB-CG 4.19Å; V247-R252 HydrophobicContact CG1-CG 4.39Å; V247-R252 PolarHBondContact O-NE 3.28Å; V247-R252 PolarHBondContact O-NH2 3.38Å; V247-R252 VanDerWaalsContact O-NH2 3.16Å; E248-R252 WeakPolarHBondContact O-CG 3.16Å; E248-R252 PolarHBondContact O-N 3.36Å; E249-R252 WeakPolarHBondContact O-CB 3.34Å; E249-R252 PolarHBondContact O-N 3.49Å; E249-R252 IonicContact OE2-CZ 3.79Å; E249-R252 IonicContact OE2-NH1 2.82Å; E249-R252 PolarHBondContact OE2-NH1 2.96Å; R252-E254 PolarHBondContact O-N 3.47Å; R252-E254 VanDerWaalsContact O-N 3.11Å; R252-L255 HydrophobicContact CB-CD1 4.37Å; R252-L255 HydrophobicContact CG-CD1 4.36Å; R252-L255 VanDerWaalsContact O-CB 3.31Å; R252-L255 WeakPolarHBondContact O-CB 3.46Å; R252-L255 WeakPolarHBondContact O-CG 3.32Å; R252-L255 PolarHBondContact O-N 2.99Å; R252-Y316 HydrophobicContact CB-CE1 3.59Å; R252-Y316 HydrophobicContact CG-CE1 4.23Å
253P92.2Very high92.4Very high37 Ų3764.4 Ų64.424%0.2431%0.313CS..G310 helixtrans-55.1-26.9177-25.335.7000113.4E249 D250 D251 L255 Y316E249-P253 WeakPolarHBondContact O-CD 3.14Å; D250-P253 VanDerWaalsContact O-CD 3.31Å; D250-P253 WeakPolarHBondContact O-CD 3.37Å; D251-P253 VanDerWaalsContact C-CD 3.46Å; P253-L255 VanDerWaalsContact C-N 3.3Å; P253-L255 PolarHBondContact O-N 3.2Å; P253-Y316 WeakPolarHBondContact CD-OH 3.25Å; P253-Y316 WeakPolarHBondContact CG-OH 3.42Å
254E91.4Very high92.8Very high116 Ų11658.4 Ų58.454%0.54229%0.285SS..G310 helixtrans-78.8-12.9-178.7-67.1-58.797.700114D251 R252 K259D251-E254 WeakPolarHBondContact O-CB 3.22Å; D251-E254 PolarHBondContact O-N 3.36Å; D251-E254 VanDerWaalsContact O-N 3.09Å; R252-E254 PolarHBondContact O-N 3.47Å; R252-E254 VanDerWaalsContact O-N 3.11Å; E254-K259 WeakPolarHBondContact O-CD 3.45Å; E254-K259 VanDerWaalsContact O-CE 3.26Å; E254-K259 WeakPolarHBondContact O-CE 3.13Å; E254-K259 PolarHBondContact O-NZ 3.36Å; E254-K259 WeakPolarHBondContact OE1-CE 3.45Å; E254-K259 IonicContact OE1-NZ 3.98Å; E254-K259 WeakPolarHBondContact OE2-CE 3.5Å; E254-K259 IonicContact OE2-NZ 2.81Å; E254-K259 PolarHBondContact OE2-NZ 2.87Å
255L94.1Very high93.3Very high30 Ų3058 Ų5816%0.15728%0.283CS..SBendtrans-66.3142.7178.7-61.4173.4000111.9T244 V247 R252 P253 W257 W258 K259T244-L255 HydrophobicContact CG2-CD1 3.86Å; V247-L255 HydrophobicContact CB-CD1 4.37Å; V247-L255 HydrophobicContact CG2-CD1 4.2Å; V247-L255 HydrophobicContact CG2-CD2 4.29Å; R252-L255 HydrophobicContact CB-CD1 4.37Å; R252-L255 HydrophobicContact CG-CD1 4.36Å; R252-L255 VanDerWaalsContact O-CB 3.31Å; R252-L255 WeakPolarHBondContact O-CB 3.46Å; R252-L255 WeakPolarHBondContact O-CG 3.32Å; R252-L255 PolarHBondContact O-N 2.99Å; P253-L255 VanDerWaalsContact C-N 3.3Å; P253-L255 PolarHBondContact O-N 3.2Å; L255-W257 VanDerWaalsContact C-N 3.27Å; L255-W257 HydrophobicContact CB-CE3 4.15Å; L255-W257 PolarHBondContact O-N 3.42Å; L255-W257 VanDerWaalsContact O-N 3.13Å; L255-W258 PolarHBondContact O-N 2.92Å; L255-W258 VanDerWaalsContact O-N 3.14Å; L255-K259 PolarHBondContact O-N 3.24Å
256P94.2Very high93.6Very high15 Ų1555 Ų5510%0.09727%0.267CS..Hα-helixtrans-57.3-33.9-175.7-31.740000114.9D194 V197 C260D194-P256 WeakPolarHBondContact OD2-CD 3.48Å; D194-P256 VanDerWaalsContact OD2-CG 3.27Å; D194-P256 WeakPolarHBondContact OD2-CG 3.29Å; V197-P256 HydrophobicContact CB-CB 4.18Å; V197-P256 HydrophobicContact CG1-CB 3.9Å; V197-P256 WeakPolarHBondContact CG1-O 3.5Å; P256-C260 WeakPolarHBondContact O-CB 3.43Å; P256-C260 PolarHBondContact O-N 3.31Å
257W95.7Very high94Very high31 Ų3147 Ų4712%0.11723%0.229CC..Hα-helixtrans-63-45.9178-60.6-95.1000112.4Q192 D194 V197 V240 P241 T244 L255 C260 K261Q192-W257 WeakPolarHBondContact O-CZ2 3.46Å; D194-W257 HydrophobicContact CB-CH2 4.14Å; V197-W257 HydrophobicContact CG1-CG 4.17Å; V240-W257 HydrophobicContact CG1-CB 3.86Å; V240-W257 HydrophobicContact CG1-CG 4.27Å; V240-W257 HydrophobicContact CG2-CB 4.34Å; P241-W257 HydrophobicContact CG-CD2 4.38Å; P241-W257 HydrophobicContact CG-CZ2 4.19Å; T244-W257 HydrophobicContact CG2-CD2 4.43Å; T244-W257 HydrophobicContact CG2-CE3 3.92Å; T244-W257 HydrophobicContact CG2-CZ3 4.16Å; L255-W257 VanDerWaalsContact C-N 3.27Å; L255-W257 HydrophobicContact CB-CE3 4.15Å; L255-W257 PolarHBondContact O-N 3.42Å; L255-W257 VanDerWaalsContact O-N 3.13Å; W257-C260 PolarHBondContact O-N 2.82Å; W257-K261 PolarHBondContact O-N 3.17Å
258W95.8Very high94.3Very high12 Ų1244.8 Ų44.85%0.04522%0.216CC..Hα-helixtrans-69-43.3177.7-70116.7000111.3V240 L255 C260 K261 K262 Y316 M317 A318 V321V240-W258 HydrophobicContact CB-CZ2 4.11Å; V240-W258 HydrophobicContact CG1-CZ2 4.26Å; V240-W258 HydrophobicContact CG2-CD2 4.28Å; V240-W258 HydrophobicContact CG2-CE3 4.39Å; V240-W258 HydrophobicContact CG2-CH2 3.9Å; V240-W258 HydrophobicContact CG2-CZ2 3.77Å; V240-W258 HydrophobicContact CG2-CZ3 4.22Å; L255-W258 PolarHBondContact O-N 2.92Å; L255-W258 VanDerWaalsContact O-N 3.14Å; W258-C260 VanDerWaalsContact C-N 3.31Å; W258-C260 PolarHBondContact O-N 3.45Å; W258-K261 HydrophobicContact CE3-CD 4.41Å; W258-K261 HydrophobicContact CZ3-CD 4.32Å; W258-K261 PolarHBondContact O-N 3.13Å; W258-K262 WeakPolarHBondContact O-CB 3.39Å; W258-K262 PolarHBondContact O-N 3.31Å; W258-Y316 HydrophobicContact CD2-CE1 4.45Å; W258-Y316 AromaticContact CE2-CD1 3.89Å; W258-Y316 AromaticContact CE2-CE1 3.76Å; W258-Y316 HydrophobicContact CH2-CD1 4.34Å; W258-Y316 WeakPolarHBondContact CH2-O 3.43Å; W258-Y316 AromaticContact CZ2-CD1 3.58Å; W258-Y316 HydrophobicContact CZ2-CD1 3.58Å; W258-Y316 AromaticContact CZ2-CE1 3.93Å; W258-Y316 HydrophobicContact CZ2-CE1 3.93Å; W258-Y316 AromaticContact NE1-CE1 3.73Å; W258-M317 HydrophobicContact CH2-SD 3.71Å; W258-M317 HydrophobicContact CZ3-SD 3.78Å; W258-A318 HydrophobicContact CB-CB 3.93Å; W258-A318 HydrophobicContact CD2-CB 3.73Å; W258-A318 HydrophobicContact CE3-CB 3.58Å; W258-A318 HydrophobicContact CG-CB 3.89Å; W258-A318 HydrophobicContact CZ3-CB 4.35Å; W258-V321 HydrophobicContact CE3-CG2 4.04Å; W258-V321 HydrophobicContact CZ3-CG1 4.45Å
259K95.6Very high94.6Very high55 Ų5538.2 Ų38.224%0.23919%0.186CC..Hα-helixtrans-58.3-41.4172.2-73.6178.2168.4149.20112.2K201 E254 L255 K262 W263K201-K259 HydrophobicContact CD-CB 4.18Å; K201-K259 HydrophobicContact CG-CB 4Å; E254-K259 WeakPolarHBondContact O-CD 3.45Å; E254-K259 VanDerWaalsContact O-CE 3.26Å; E254-K259 WeakPolarHBondContact O-CE 3.13Å; E254-K259 PolarHBondContact O-NZ 3.36Å; E254-K259 WeakPolarHBondContact OE1-CE 3.45Å; E254-K259 IonicContact OE1-NZ 3.98Å; E254-K259 WeakPolarHBondContact OE2-CE 3.5Å; E254-K259 IonicContact OE2-NZ 2.81Å; E254-K259 PolarHBondContact OE2-NZ 2.87Å; L255-K259 PolarHBondContact O-N 3.24Å; K259-K262 WeakPolarHBondContact O-CB 3.1Å; K259-K262 PolarHBondContact O-N 3.26Å; K259-W263 PolarHBondContact O-N 2.89Å
260C97.2Very high95Very high0 Ų035.5 Ų35.50%017%0.171CC..Hα-helixtrans-66.3-46.8179.7-1670000111.3V197 K201 P256 W257 W258 K262 W263 A264V197-C260 HydrophobicContact CG1-CB 3.88Å; K201-C260 HydrophobicContact CB-CB 3.99Å; P256-C260 WeakPolarHBondContact O-CB 3.43Å; P256-C260 PolarHBondContact O-N 3.31Å; W257-C260 PolarHBondContact O-N 2.82Å; W258-C260 VanDerWaalsContact C-N 3.31Å; W258-C260 PolarHBondContact O-N 3.45Å; C260-K262 PolarHBondContact O-N 3.22Å; C260-W263 PolarHBondContact O-N 3.44Å; C260-A264 PolarHBondContact O-N 3.35Å
261K97.1Very high95.5Very high8 Ų828.8 Ų28.84%0.03514%0.135CC..Hα-helixtrans-58.8-45.5173.2-77-167.2174.8-154.80112.3V235 V236 R238 V240 W257 W258 W263 A264 L265 V321V235-K261 HydrophobicContact CG1-CG 4.39Å; V236-K261 WeakPolarHBondContact O-CE 3.3Å; V236-K261 PolarHBondContact O-NZ 3.2Å; R238-K261 WeakPolarHBondContact O-CE 3.47Å; R238-K261 PolarHBondContact O-NZ 2.83Å; V240-K261 HydrophobicContact CG2-CD 4.27Å; W257-K261 PolarHBondContact O-N 3.17Å; W258-K261 HydrophobicContact CE3-CD 4.41Å; W258-K261 HydrophobicContact CZ3-CD 4.32Å; W258-K261 PolarHBondContact O-N 3.13Å; K261-W263 PolarHBondContact O-N 3.24Å; K261-A264 PolarHBondContact O-N 3.37Å; K261-L265 PolarHBondContact O-N 2.63Å; K261-V321 HydrophobicContact CB-CG2 3.89Å
262K95.7Very high95.7Very high49 Ų4924.4 Ų24.421%0.21311%0.111CC..Hα-helixtrans-52.7-52.9175.9179.9-166.276.51740110.9W258 K259 C260 A264 L265 H266 R320 V321W258-K262 WeakPolarHBondContact O-CB 3.39Å; W258-K262 PolarHBondContact O-N 3.31Å; K259-K262 WeakPolarHBondContact O-CB 3.1Å; K259-K262 PolarHBondContact O-N 3.26Å; C260-K262 PolarHBondContact O-N 3.22Å; K262-A264 VanDerWaalsContact C-N 3.35Å; K262-A264 PolarHBondContact O-N 3.16Å; K262-L265 PolarHBondContact O-N 2.89Å; K262-H266 WeakPolarHBondContact O-CB 3.44Å; K262-H266 PolarHBondContact O-N 2.9Å; K262-R320 HydrophobicContact CD-CB 3.73Å; K262-R320 HydrophobicContact CD-CG 4.17Å; K262-R320 HydrophobicContact CG-CB 3.82Å; K262-V321 HydrophobicContact CB-CG2 4.26Å
263W97.5Very high95.7Very high36 Ų3627.8 Ų27.814%0.13613%0.129CC..Hα-helixtrans-65.5-36.9-178.7-77.1111.8000112.9F204 K205 Y208 K259 C260 K261 H266 I267F204-W263 HydrophobicContact CB-CB 3.84Å; K205-W263 HydrophobicContact CD-CZ2 3.85Å; K205-W263 HydrophobicContact CG-CD2 3.73Å; K205-W263 HydrophobicContact CG-CE3 4.38Å; K205-W263 HydrophobicContact CG-CG 4.05Å; K205-W263 HydrophobicContact CG-CH2 4.39Å; K205-W263 HydrophobicContact CG-CZ2 3.75Å; Y208-W263 AromaticContact CD1-CE3 3.97Å; Y208-W263 HydrophobicContact CD1-CE3 3.97Å; Y208-W263 HydrophobicContact CD1-CH2 4.22Å; Y208-W263 AromaticContact CD1-CZ3 3.29Å; Y208-W263 HydrophobicContact CD1-CZ3 3.29Å; Y208-W263 HydrophobicContact CE1-CH2 4.41Å; Y208-W263 AromaticContact CE1-CZ3 3.6Å; Y208-W263 HydrophobicContact CE1-CZ3 3.6Å; Y208-W263 AromaticContact CG-CE3 3.99Å; Y208-W263 HydrophobicContact CG-CE3 3.99Å; Y208-W263 AromaticContact CG-CZ3 3.79Å; Y208-W263 HydrophobicContact CG-CZ3 3.79Å; K259-W263 PolarHBondContact O-N 2.89Å; C260-W263 PolarHBondContact O-N 3.44Å; K261-W263 PolarHBondContact O-N 3.24Å; W263-H266 HydrophobicContact CE3-CB 4.37Å; W263-H266 AromaticContact CE3-ND1 3.86Å; W263-H266 AromaticContact CZ3-ND1 3.55Å; W263-H266 PolarHBondContact O-N 2.77Å; W263-I267 WeakPolarHBondContact O-CD1 3.37Å; W263-I267 VanDerWaalsContact O-CG1 3.26Å; W263-I267 WeakPolarHBondContact O-CG1 3.5Å; W263-I267 PolarHBondContact O-N 3.09Å
264A98.2Very high95.7Very high0 Ų030.7 Ų30.70%014%0.135CC..Hα-helixtrans-59.1-46.9172.600000111.9F204 L232 V235 V236 C260 K261 K262 I267 L268F204-A264 HydrophobicContact CD2-CB 3.98Å; F204-A264 HydrophobicContact CE2-CB 3.56Å; F204-A264 HydrophobicContact CZ-CB 4.19Å; L232-A264 HydrophobicContact CD2-CB 3.85Å; V235-A264 HydrophobicContact CB-CB 4.49Å; V235-A264 HydrophobicContact CG1-CB 4.39Å; V236-A264 HydrophobicContact CG2-CB 3.87Å; C260-A264 PolarHBondContact O-N 3.35Å; K261-A264 PolarHBondContact O-N 3.37Å; K262-A264 VanDerWaalsContact C-N 3.35Å; K262-A264 PolarHBondContact O-N 3.16Å; A264-I267 PolarHBondContact O-N 2.96Å; A264-L268 WeakPolarHBondContact O-CG 3.39Å; A264-L268 PolarHBondContact O-N 2.75Å; A264-L268 VanDerWaalsContact O-N 3.08Å
265L97.6Very high95.8Very high1 Ų125.2 Ų25.21%0.00511%0.109CC..Hα-helixtrans-66.9-38.5177.3-71.4172.5000112.6V236 K261 K262 I267 L268 A269 L304 V321 Q324 T325V236-L265 HydrophobicContact CG1-CD2 3.89Å; V236-L265 HydrophobicContact CG1-CG 4.42Å; V236-L265 HydrophobicContact CG2-CD2 3.78Å; V236-L265 HydrophobicContact CG2-CG 3.93Å; K261-L265 PolarHBondContact O-N 2.63Å; K262-L265 PolarHBondContact O-N 2.89Å; L265-I267 VanDerWaalsContact C-N 3.29Å; L265-I267 PolarHBondContact O-N 2.76Å; L265-L268 HydrophobicContact CD2-CD1 4.47Å; L265-L268 PolarHBondContact O-N 3.04Å; L265-L268 VanDerWaalsContact O-N 3.14Å; L265-A269 WeakPolarHBondContact O-CB 3.41Å; L265-A269 PolarHBondContact O-N 3.39Å; L265-L304 HydrophobicContact CD2-CD2 3.27Å; L265-V321 HydrophobicContact CD1-CB 4.09Å; L265-V321 HydrophobicContact CD1-CG1 3.56Å; L265-V321 HydrophobicContact CD1-CG2 4.36Å; L265-V321 VanDerWaalsContact CD1-O 3.3Å; L265-V321 WeakPolarHBondContact CD1-O 3.12Å; L265-Q324 HydrophobicContact CB-CB 3.66Å; L265-Q324 HydrophobicContact CB-CG 4.49Å; L265-Q324 HydrophobicContact CD1-CB 4.43Å; L265-T325 WeakPolarHBondContact CD1-OG1 3.45Å
266H95.3Very high95.8Very high30 Ų3023.8 Ų23.814%0.13910%0.102CC..Hα-helixtrans-61.6-40.5178.3-154.1-172.9000111.4Y208 K262 W263 R270 Q324Y208-H266 HydrophobicContact CD2-CB 4.46Å; Y208-H266 AromaticContact CE1-CE1 3.91Å; Y208-H266 AromaticContact CE1-ND1 3.86Å; Y208-H266 HydrophobicContact CE2-CB 4.25Å; Y208-H266 AromaticContact CE2-CD2 3.97Å; Y208-H266 AromaticContact CE2-CG 3.73Å; Y208-H266 AromaticContact CE2-ND1 3.86Å; Y208-H266 AromaticContact CZ-CE1 3.51Å; Y208-H266 AromaticContact CZ-CG 3.88Å; Y208-H266 AromaticContact CZ-ND1 3.57Å; Y208-H266 AromaticContact CZ-NE2 3.8Å; Y208-H266 PolarHBondContact OH-CE1 3.05Å; Y208-H266 VanDerWaalsContact OH-CE1 3.27Å; Y208-H266 PolarHBondContact OH-NE2 2.66Å; K262-H266 WeakPolarHBondContact O-CB 3.44Å; K262-H266 PolarHBondContact O-N 2.9Å; W263-H266 HydrophobicContact CE3-CB 4.37Å; W263-H266 AromaticContact CE3-ND1 3.86Å; W263-H266 AromaticContact CZ3-ND1 3.55Å; W263-H266 PolarHBondContact O-N 2.77Å; H266-R270 WeakPolarHBondContact O-CB 3.41Å; H266-R270 PolarHBondContact O-N 3.3Å; H266-Q324 PolarHBondContact CD2-OE1 3.41Å
267I97.9Very high95.7Very high0 Ų023.1 Ų23.10%010%0.097CC..Hα-helixtrans-63.4-48.6172.3-65.7158.7000110.6F204 F207 Y208 L232 W263 A264 L265 R270 L271F204-I267 HydrophobicContact CB-CD1 3.85Å; F204-I267 HydrophobicContact CD1-CD1 4.1Å; F204-I267 HydrophobicContact CG-CD1 4.1Å; F207-I267 HydrophobicContact CB-CD1 4.36Å; F207-I267 HydrophobicContact CD1-CD1 3.86Å; F207-I267 HydrophobicContact CD1-CG1 4.16Å; F207-I267 HydrophobicContact CD1-CG2 3.69Å; F207-I267 HydrophobicContact CE1-CG2 3.61Å; Y208-I267 HydrophobicContact CD2-CG1 3.77Å; Y208-I267 HydrophobicContact CG-CG1 4.21Å; L232-I267 HydrophobicContact CD1-CB 4.46Å; L232-I267 HydrophobicContact CD1-CG2 3.74Å; L232-I267 HydrophobicContact CD2-CB 4.13Å; L232-I267 HydrophobicContact CD2-CD1 3.79Å; L232-I267 HydrophobicContact CD2-CG2 4.2Å; W263-I267 WeakPolarHBondContact O-CD1 3.37Å; W263-I267 VanDerWaalsContact O-CG1 3.26Å; W263-I267 WeakPolarHBondContact O-CG1 3.5Å; W263-I267 PolarHBondContact O-N 3.09Å; A264-I267 PolarHBondContact O-N 2.96Å; L265-I267 VanDerWaalsContact C-N 3.29Å; L265-I267 PolarHBondContact O-N 2.76Å; I267-R270 PolarHBondContact O-N 3.09Å; I267-L271 HydrophobicContact CG2-CD1 3.81Å; I267-L271 HydrophobicContact CG2-CG 4.17Å; I267-L271 WeakPolarHBondContact O-CB 3.11Å; I267-L271 VanDerWaalsContact O-CG 3.25Å; I267-L271 WeakPolarHBondContact O-CG 3.26Å; I267-L271 PolarHBondContact O-N 3.01Å
268L97.7Very high95.4Very high1 Ų122.4 Ų22.41%0.00510%0.097CC..Hα-helixtrans-61.9-47.1-178.1-71.4168.2000112I229 L232 V236 A264 L265 L271 F272 V300 Y328I229-L268 HydrophobicContact CD1-CD2 3.68Å; L232-L268 HydrophobicContact CB-CD1 4.13Å; L232-L268 HydrophobicContact CB-CD2 4.05Å; L232-L268 HydrophobicContact CB-CG 4.11Å; L232-L268 HydrophobicContact CD1-CD2 3.92Å; L232-L268 HydrophobicContact CD1-CG 4.23Å; V236-L268 HydrophobicContact CG2-CD1 4.16Å; A264-L268 WeakPolarHBondContact O-CG 3.39Å; A264-L268 PolarHBondContact O-N 2.75Å; A264-L268 VanDerWaalsContact O-N 3.08Å; L265-L268 HydrophobicContact CD2-CD1 4.47Å; L265-L268 PolarHBondContact O-N 3.04Å; L265-L268 VanDerWaalsContact O-N 3.14Å; L268-L271 PolarHBondContact O-N 2.74Å; L268-F272 PolarHBondContact O-N 2.83Å; L268-V300 HydrophobicContact CB-CG1 4.43Å; L268-V300 HydrophobicContact CD1-CG1 3.9Å; L268-V300 HydrophobicContact CD2-CG1 4.14Å; L268-V300 HydrophobicContact CD2-CG2 3.86Å; L268-V300 HydrophobicContact CG-CG1 4.39Å; L268-Y328 HydrophobicContact CB-CD2 4.04Å; L268-Y328 HydrophobicContact CB-CE2 4Å; L268-Y328 VanDerWaalsContact O-CE2 3.29Å; L268-Y328 WeakPolarHBondContact O-CE2 3.49Å
269A95.7Very high94.9Very high5 Ų522.4 Ų22.44%0.04110%0.1CC..Hα-helixtrans-60.1-50.417700000110.5L265 L271 F272 E273L265-A269 WeakPolarHBondContact O-CB 3.41Å; L265-A269 PolarHBondContact O-N 3.39Å; A269-L271 VanDerWaalsContact C-N 3.35Å; A269-L271 PolarHBondContact O-N 3.18Å; A269-F272 PolarHBondContact O-N 3.12Å; A269-F272 VanDerWaalsContact O-N 3.15Å; A269-E273 VanDerWaalsContact O-CB 3.27Å; A269-E273 WeakPolarHBondContact O-CB 3.42Å; A269-E273 PolarHBondContact O-N 2.94Å
270R95.3Very high94.4Very high54 Ų5421.8 Ų21.820%0.20410%0.1CC..Hα-helixtrans-60.5-41.6178.4-175.961.665166.52.5113Y208 H266 I267 F272 R274Y208-R270 HydrophobicContact CE2-CB 3.96Å; Y208-R270 HydrophobicContact CE2-CG 4.17Å; H266-R270 WeakPolarHBondContact O-CB 3.41Å; H266-R270 PolarHBondContact O-N 3.3Å; I267-R270 PolarHBondContact O-N 3.09Å; R270-F272 VanDerWaalsContact C-N 3.33Å; R270-R274 WeakPolarHBondContact O-CB 3.46Å; R270-R274 PolarHBondContact O-N 3.31Å
271L95.8Very high94Very high1 Ų122 Ų221%0.00510%0.101CC..Hα-helixtrans-62.9-40.7177.1-76.1176.9000111.4V211 L215 L225 I229 I267 L268 A269 Y275 G276 F288 F292V211-L271 HydrophobicContact CG2-CD2 4.36Å; L215-L271 HydrophobicContact CD1-CD2 4.12Å; L225-L271 HydrophobicContact CD1-CD1 4.35Å; I229-L271 HydrophobicContact CD1-CD1 4.2Å; I267-L271 HydrophobicContact CG2-CD1 3.81Å; I267-L271 HydrophobicContact CG2-CG 4.17Å; I267-L271 WeakPolarHBondContact O-CB 3.11Å; I267-L271 VanDerWaalsContact O-CG 3.25Å; I267-L271 WeakPolarHBondContact O-CG 3.26Å; I267-L271 PolarHBondContact O-N 3.01Å; L268-L271 PolarHBondContact O-N 2.74Å; A269-L271 VanDerWaalsContact C-N 3.35Å; A269-L271 PolarHBondContact O-N 3.18Å; L271-Y275 HydrophobicContact CD2-CD2 4.02Å; L271-Y275 CarbonylContact O-C 3.59Å; L271-Y275 PolarHBondContact O-N 3.14Å; L271-G276 WeakPolarHBondContact O-CA 3.42Å; L271-G276 PolarHBondContact O-N 3.18Å; L271-F288 HydrophobicContact CD2-CZ 4.49Å; L271-F292 HydrophobicContact CB-CE2 3.78Å; L271-F292 HydrophobicContact CB-CZ 4.07Å; L271-F292 HydrophobicContact CD1-CE2 4.39Å
272F96.2Very high93.5Very high0 Ų024 Ų240%012%0.116CC..Hα-helixtrans-74-47-178.8-167.4-168.4000112.3L268 A269 R270 G276 S277 F292 L293 A297 Y328 Q331 H335 T338L268-F272 PolarHBondContact O-N 2.83Å; A269-F272 PolarHBondContact O-N 3.12Å; A269-F272 VanDerWaalsContact O-N 3.15Å; R270-F272 VanDerWaalsContact C-N 3.33Å; F272-G276 WeakPolarHBondContact CD2-O 3.47Å; F272-G276 WeakPolarHBondContact CE2-O 3.39Å; F272-G276 CarbonylContact O-C 3.57Å; F272-G276 WeakPolarHBondContact O-CA 3.38Å; F272-G276 PolarHBondContact O-N 2.99Å; F272-S277 PolarHBondContact O-N 3.18Å; F272-S277 PolarHBondContact O-OG 3.42Å; F272-F292 HydrophobicContact CB-CE1 3.62Å; F272-F292 HydrophobicContact CB-CZ 3.93Å; F272-F292 HydrophobicContact CD2-CD1 4.05Å; F272-F292 AromaticContact CD2-CE1 3.61Å; F272-F292 HydrophobicContact CD2-CE1 3.61Å; F272-F292 HydrophobicContact CE2-CE1 4.45Å; F272-F292 AromaticContact CG-CE1 3.72Å; F272-F292 HydrophobicContact CG-CE1 3.72Å; F272-F292 HydrophobicContact CG-CZ 4.47Å; F272-L293 HydrophobicContact CE2-CD1 3.99Å; F272-L293 HydrophobicContact CZ-CD1 4.15Å; F272-A297 HydrophobicContact CE2-CB 4.38Å; F272-A297 HydrophobicContact CZ-CB 4.21Å; F272-Y328 HydrophobicContact CB-CD2 4.2Å; F272-Y328 HydrophobicContact CB-CE2 3.68Å; F272-Y328 HydrophobicContact CD1-CD1 4.01Å; F272-Y328 HydrophobicContact CD1-CD2 4.11Å; F272-Y328 AromaticContact CD1-CE1 3.63Å; F272-Y328 HydrophobicContact CD1-CE1 3.63Å; F272-Y328 AromaticContact CD1-CE2 3.71Å; F272-Y328 HydrophobicContact CD1-CE2 3.71Å; F272-Y328 HydrophobicContact CD1-CG 4.23Å; F272-Y328 AromaticContact CD1-CZ 3.44Å; F272-Y328 VanDerWaalsContact CD1-CZ 3.44Å; F272-Y328 HydrophobicContact CE1-CD1 4.4Å; F272-Y328 AromaticContact CE1-CE1 3.95Å; F272-Y328 HydrophobicContact CE1-CE1 3.95Å; F272-Y328 HydrophobicContact CG-CE2 4.09Å; F272-Q331 HydrophobicContact CB-CG 4.44Å; F272-Q331 HydrophobicContact CD1-CB 3.72Å; F272-Q331 HydrophobicContact CD1-CG 3.77Å; F272-Q331 HydrophobicContact CD2-CG 3.96Å; F272-Q331 HydrophobicContact CE1-CB 3.88Å; F272-Q331 HydrophobicContact CE1-CG 3.95Å; F272-Q331 HydrophobicContact CE2-CG 4.11Å; F272-Q331 HydrophobicContact CG-CB 4.21Å; F272-Q331 HydrophobicContact CG-CG 3.78Å; F272-Q331 HydrophobicContact CZ-CB 4.47Å; F272-Q331 HydrophobicContact CZ-CG 4.11Å; F272-H335 AromaticContact CE2-CD2 3.81Å; F272-H335 AromaticContact CZ-CD2 3.82Å; F272-T338 HydrophobicContact CZ-CG2 4.15Å
273E93.4Very high93.1Very high102 Ų10228 Ų2848%0.47713%0.134SC..Hα-helixtrans-60.2-54.7179.4179.8-172-158.200111.5A269A269-E273 VanDerWaalsContact O-CB 3.27Å; A269-E273 WeakPolarHBondContact O-CB 3.42Å; A269-E273 PolarHBondContact O-N 2.94Å
274R92.4Very high92.6Very high98 Ų9831.9 Ų31.937%0.3715%0.153SC..Hα-helixtrans-90.8-27.2-168.6-167.9172.2-177.114111.3115Q212 Y213 R270 V281Q212-R274 WeakPolarHBondContact O-CD 3.49Å; Q212-R274 PolarHBondContact O-NH1 3.42Å; Y213-R274 PolarHBondContact O-NE 3.18Å; Y213-R274 PolarHBondContact O-NH2 3.2Å; R270-R274 WeakPolarHBondContact O-CB 3.46Å; R270-R274 PolarHBondContact O-N 3.31Å; R274-V281 WeakPolarHBondContact O-CG1 3.31Å
275Y94Very high92.3Very high2 Ų232.6 Ų32.61%0.00816%0.156CC..THydrogen-bonded Turntrans-130.3-16.5-173-47-67.9000113.6V211 Q212 Y213 T214 L215 L271 Y285 F288 A289V211-Y275 WeakPolarHBondContact O-CE2 3.46Å; V211-Y275 VanDerWaalsContact O-CZ 3.31Å; V211-Y275 PolarHBondContact O-OH 3.38Å; Q212-Y275 PolarHBondContact O-OH 3.46Å; Y213-Y275 PolarHBondContact O-OH 2.92Å; T214-Y275 WeakPolarHBondContact CA-OH 3.32Å; T214-Y275 PolarHBondContact N-OH 3.33Å; T214-Y275 VanDerWaalsContact N-OH 3.14Å; L215-Y275 HydrophobicContact CB-CD1 3.9Å; L215-Y275 HydrophobicContact CB-CD2 4.12Å; L215-Y275 HydrophobicContact CB-CE1 3.73Å; L215-Y275 HydrophobicContact CB-CE2 3.96Å; L215-Y275 HydrophobicContact CB-CG 4.08Å; L215-Y275 HydrophobicContact CD2-CD1 4.38Å; L215-Y275 HydrophobicContact CD2-CD2 4.25Å; L215-Y275 HydrophobicContact CD2-CG 3.98Å; L271-Y275 HydrophobicContact CD2-CD2 4.02Å; L271-Y275 CarbonylContact O-C 3.59Å; L271-Y275 PolarHBondContact O-N 3.14Å; Y275-Y285 HydrophobicContact CD1-CD1 4.15Å; Y275-Y285 AromaticContact CD1-CD2 3.72Å; Y275-Y285 HydrophobicContact CD1-CD2 3.72Å; Y275-Y285 HydrophobicContact CD1-CE1 4.23Å; Y275-Y285 AromaticContact CD1-CE2 3.82Å; Y275-Y285 HydrophobicContact CD1-CE2 3.82Å; Y275-Y285 AromaticContact CD1-CG 3.93Å; Y275-Y285 HydrophobicContact CD1-CG 3.93Å; Y275-Y285 HydrophobicContact CE1-CD2 4.19Å; Y275-Y285 HydrophobicContact CE1-CE1 4.44Å; Y275-Y285 AromaticContact CE1-CE2 3.81Å; Y275-Y285 HydrophobicContact CE1-CE2 3.81Å; Y275-Y285 AromaticContact CE1-CZ 3.96Å; Y275-F288 VanDerWaalsContact O-CD1 3.29Å; Y275-F288 WeakPolarHBondContact O-CD1 3.31Å; Y275-A289 WeakPolarHBondContact O-CA 3.24Å; Y275-A289 WeakPolarHBondContact O-CB 3.41Å
276G93.3Very high92Very high0 Ų035.3 Ų35.30%017%0.171CC..SBendtrans-1039-167.200000114.8L271 F272 P278 F292L271-G276 WeakPolarHBondContact O-CA 3.42Å; L271-G276 PolarHBondContact O-N 3.18Å; F272-G276 WeakPolarHBondContact CD2-O 3.47Å; F272-G276 WeakPolarHBondContact CE2-O 3.39Å; F272-G276 CarbonylContact O-C 3.57Å; F272-G276 WeakPolarHBondContact O-CA 3.38Å; F272-G276 PolarHBondContact O-N 2.99Å; G276-P278 WeakPolarHBondContact O-CD 3.44Å; G276-F292 VanDerWaalsContact CA-CD1 3.49Å
277S91.9Very high91.8Very high0 Ų041.6 Ų41.60%020%0.2CC..SBendtrans-115.992.9-173.2-66.70000110.5F272 G279 N280 V281 Q331 H335F272-S277 PolarHBondContact O-N 3.18Å; F272-S277 PolarHBondContact O-OG 3.42Å; S277-G279 PolarHBondContact O-N 3.15Å; S277-N280 PolarHBondContact O-N 3Å; S277-V281 WeakPolarHBondContact O-CG1 3.44Å; S277-Q331 PolarHBondContact OG-NE2 3.18Å; S277-H335 VanDerWaalsContact CB-NE2 3.35Å; S277-H335 WeakPolarHBondContact CB-NE2 3.31Å; S277-H335 PolarHBondContact OG-NE2 3.05Å
278P89.5Confident91.6Very high16 Ų1642.5 Ų42.510%0.10420%0.204CC..THydrogen-bonded Turntrans-51.9138.7177.8-2534.2000111.4G276 N280 A289 E290 L293G276-P278 WeakPolarHBondContact O-CD 3.44Å; P278-N280 PolarHBondContact O-N 2.95Å; P278-A289 HydrophobicContact CB-CB 4.46Å; P278-A289 HydrophobicContact CG-CB 4Å; P278-E290 HydrophobicContact CB-CG 4.4Å; P278-E290 HydrophobicContact CG-CG 4.29Å; P278-L293 HydrophobicContact CG-CB 4.18Å; P278-L293 HydrophobicContact CG-CD2 3.82Å
279G85.3Confident91.4Very high12 Ų1242.4 Ų42.412%0.12420%0.204CC..THydrogen-bonded Turntrans85.1-23.1-174.400000114.4S277 Q913S277-G279 PolarHBondContact O-N 3.15Å; G279-Q913 VanDerWaalsContact O-CG 3.25Å; G279-Q913 WeakPolarHBondContact O-CG 3.26Å; G279-Q913 PolarHBondContact O-NE2 3.47Å
280N86.1Confident91.2Very high42 Ų4245.9 Ų45.923%0.22522%0.219CC..SBendtrans-117.930.7-176.1-55.1-19.9000111.7S277 P278 D907 D909S277-N280 PolarHBondContact O-N 3Å; P278-N280 PolarHBondContact O-N 2.95Å; N280-D907 PolarHBondContact ND2-O 3.01Å; N280-D907 VanDerWaalsContact ND2-O 3.15Å; N280-D909 PolarHBondContact OD1-N 3.22Å
281V88.9Confident91.1Very high5 Ų545 Ų453%0.0322%0.22CC..SBendtrans-131.9157.8179.5-63.30000110.6R274 S277 N286 A289R274-V281 WeakPolarHBondContact O-CG1 3.31Å; S277-V281 WeakPolarHBondContact O-CG1 3.44Å; V281-N286 WeakPolarHBondContact CG2-OD1 3.45Å; V281-A289 HydrophobicContact CG1-CB 4.32Å; V281-A289 HydrophobicContact CG2-CB 3.88Å
282S86.2Confident91.1Very high51 Ų5145 Ų4536%0.35722%0.219SC..  trans-63.1153.917263.30000111.6E284 Y285S282-E284 PolarHBondContact O-N 2.93Å; S282-E284 WeakPolarHBondContact OG-CG 3.44Å; S282-Y285 PolarHBondContact O-N 3.22Å; S282-Y285 WeakPolarHBondContact OG-CD2 3.34Å; S282-Y285 WeakPolarHBondContact OG-CE2 3.37Å
283K87.2Confident91Very high133 Ų13345.4 Ų45.458%0.57822%0.222SC*.G310 helixtrans-50.3-37.1-171.8-70.5179.8178.5169.10114.2Y285 N286 E917K283-Y285 VanDerWaalsContact C-N 3.29Å; K283-Y285 PolarHBondContact O-N 3.22Å; K283-N286 PolarHBondContact O-N 3.18Å; K283-E917 WeakPolarHBondContact CE-OE1 3.24Å; K283-E917 IonicContact NZ-OE1 2.61Å; K283-E917 PolarHBondContact NZ-OE1 3.37Å; K283-E917 IonicContact NZ-OE2 2.87Å; K283-E917 PolarHBondContact NZ-OE2 3.38Å
284E87.6Confident91Very high116 Ų11647.4 Ų47.454%0.54223%0.229SC..G310 helixtrans-66.1-25.3179.959.5-175.8-151.500114.2L217 S282L217-E284 WeakPolarHBondContact CD1-O 3.34Å; S282-E284 PolarHBondContact O-N 2.93Å; S282-E284 WeakPolarHBondContact OG-CG 3.44Å
285Y91.8Very high91.1Very high15 Ų1545.4 Ų45.46%0.05923%0.233CC..G310 helixtrans-98.2-1.3-178.7-59-56000114L215 L217 Y275 S282 K283 E287 F288 A289L215-Y285 HydrophobicContact CB-CD1 4.41Å; L215-Y285 HydrophobicContact CB-CE1 3.73Å; L215-Y285 HydrophobicContact CD2-CD1 4.32Å; L215-Y285 HydrophobicContact CD2-CE1 4.38Å; L215-Y285 HydrophobicContact CG-CE1 4.46Å; L215-Y285 PolarHBondContact N-OH 2.86Å; L215-Y285 WeakPolarHBondContact O-CE1 3.22Å; L217-Y285 HydrophobicContact CD1-CD1 4.05Å; L217-Y285 HydrophobicContact CD1-CE1 4.13Å; L217-Y285 HydrophobicContact CD2-CD1 4.04Å; L217-Y285 HydrophobicContact CD2-CE1 4.24Å; L217-Y285 HydrophobicContact CG-CD1 4.17Å; L217-Y285 HydrophobicContact CG-CE1 4.01Å; Y275-Y285 HydrophobicContact CD1-CD1 4.15Å; Y275-Y285 AromaticContact CD1-CD2 3.72Å; Y275-Y285 HydrophobicContact CD1-CD2 3.72Å; Y275-Y285 HydrophobicContact CD1-CE1 4.23Å; Y275-Y285 AromaticContact CD1-CE2 3.82Å; Y275-Y285 HydrophobicContact CD1-CE2 3.82Å; Y275-Y285 AromaticContact CD1-CG 3.93Å; Y275-Y285 HydrophobicContact CD1-CG 3.93Å; Y275-Y285 HydrophobicContact CE1-CD2 4.19Å; Y275-Y285 HydrophobicContact CE1-CE1 4.44Å; Y275-Y285 AromaticContact CE1-CE2 3.81Å; Y275-Y285 HydrophobicContact CE1-CE2 3.81Å; Y275-Y285 AromaticContact CE1-CZ 3.96Å; S282-Y285 PolarHBondContact O-N 3.22Å; S282-Y285 WeakPolarHBondContact OG-CD2 3.34Å; S282-Y285 WeakPolarHBondContact OG-CE2 3.37Å; K283-Y285 VanDerWaalsContact C-N 3.29Å; K283-Y285 PolarHBondContact O-N 3.22Å; Y285-E287 PolarHBondContact O-N 2.94Å; Y285-F288 CarbonylContact O-C 3.6Å; Y285-F288 WeakPolarHBondContact O-CA 3.25Å; Y285-F288 WeakPolarHBondContact O-CB 3.46Å; Y285-F288 PolarHBondContact O-N 2.93Å; Y285-A289 WeakPolarHBondContact O-CB 3.42Å; Y285-A289 PolarHBondContact O-N 3.01Å
286N90.5Very high91.2Very high59 Ų5945.9 Ų45.932%0.31624%0.235SC..Hα-helixtrans-55.1-46.3-176.9-82.8-29.4000113.3V281 K283 F288 A289 E290V281-N286 WeakPolarHBondContact CG2-OD1 3.45Å; K283-N286 PolarHBondContact O-N 3.18Å; N286-F288 VanDerWaalsContact C-N 3.33Å; N286-F288 PolarHBondContact O-N 3.06Å; N286-A289 PolarHBondContact O-N 3.26Å; N286-E290 WeakPolarHBondContact O-CG 3.41Å; N286-E290 PolarHBondContact O-N 3.13Å; N286-E290 VanDerWaalsContact O-N 3.11Å
287E90.8Very high91.3Very high161 Ų16145.9 Ų45.975%0.75224%0.235SC*.Hα-helixtrans-64.6-40.4176.8-174.7178.2-178.100111.5Y285 V291Y285-E287 PolarHBondContact O-N 2.94Å; E287-V291 WeakPolarHBondContact O-CG2 3.4Å; E287-V291 PolarHBondContact O-N 3.37Å; E287-V291 VanDerWaalsContact O-N 3.13Å
288F93.3Very high91.5Very high19 Ų1947.6 Ų47.68%0.08325%0.245CC..Hα-helixtrans-62.7-44.9176.7177.6-82.9000111.3L215 L217 I220 L225 L271 Y275 Y285 N286 E290 V291 F292L215-F288 HydrophobicContact CD2-CD1 3.89Å; L215-F288 HydrophobicContact CD2-CD2 3.7Å; L215-F288 HydrophobicContact CD2-CE1 3.69Å; L215-F288 HydrophobicContact CD2-CE2 3.43Å; L215-F288 VanDerWaalsContact CD2-CE2 3.43Å; L215-F288 HydrophobicContact CD2-CG 3.92Å; L215-F288 HydrophobicContact CD2-CZ 3.45Å; L215-F288 VanDerWaalsContact CD2-CZ 3.45Å; L217-F288 HydrophobicContact CD2-CB 4.1Å; L217-F288 HydrophobicContact CD2-CD2 3.96Å; L217-F288 HydrophobicContact CD2-CG 4.26Å; I220-F288 HydrophobicContact CG2-CE2 4.24Å; L225-F288 HydrophobicContact CD1-CE2 4.35Å; L225-F288 HydrophobicContact CD1-CZ 4.23Å; L225-F288 HydrophobicContact CD2-CD2 4.32Å; L225-F288 HydrophobicContact CD2-CE2 3.42Å; L225-F288 VanDerWaalsContact CD2-CE2 3.42Å; L225-F288 HydrophobicContact CD2-CZ 3.65Å; L225-F288 HydrophobicContact CG-CE2 4.44Å; L271-F288 HydrophobicContact CD2-CZ 4.49Å; Y275-F288 VanDerWaalsContact O-CD1 3.29Å; Y275-F288 WeakPolarHBondContact O-CD1 3.31Å; Y285-F288 CarbonylContact O-C 3.6Å; Y285-F288 WeakPolarHBondContact O-CA 3.25Å; Y285-F288 WeakPolarHBondContact O-CB 3.46Å; Y285-F288 PolarHBondContact O-N 2.93Å; N286-F288 VanDerWaalsContact C-N 3.33Å; N286-F288 PolarHBondContact O-N 3.06Å; F288-E290 PolarHBondContact O-N 2.96Å; F288-V291 PolarHBondContact O-N 3.3Å; F288-F292 HydrophobicContact CD1-CB 4.37Å; F288-F292 HydrophobicContact CE1-CB 4.06Å; F288-F292 HydrophobicContact CE1-CD2 4.1Å; F288-F292 HydrophobicContact CE1-CG 4.34Å; F288-F292 HydrophobicContact CZ-CD2 4.21Å; F288-F292 VanDerWaalsContact O-CB 3.29Å; F288-F292 WeakPolarHBondContact O-CB 3.23Å; F288-F292 PolarHBondContact O-N 3.07Å
289A93.6Very high91.7Very high0 Ų047.8 Ų47.80%025%0.25CS..Hα-helixtrans-60.9-45.9-17900000111.5Y275 P278 V281 Y285 N286 V291 F292 L293Y275-A289 WeakPolarHBondContact O-CA 3.24Å; Y275-A289 WeakPolarHBondContact O-CB 3.41Å; P278-A289 HydrophobicContact CB-CB 4.46Å; P278-A289 HydrophobicContact CG-CB 4Å; V281-A289 HydrophobicContact CG1-CB 4.32Å; V281-A289 HydrophobicContact CG2-CB 3.88Å; Y285-A289 WeakPolarHBondContact O-CB 3.42Å; Y285-A289 PolarHBondContact O-N 3.01Å; N286-A289 PolarHBondContact O-N 3.26Å; A289-V291 PolarHBondContact O-N 3.17Å; A289-F292 PolarHBondContact O-N 3.48Å; A289-L293 WeakPolarHBondContact O-CB 3.5Å; A289-L293 PolarHBondContact O-N 3.22Å
290E93.1Very high92.3Very high78 Ų7847.2 Ų47.236%0.36425%0.245SC..Hα-helixtrans-59.2-46.1176.6-79.2-70.1169.400112.1P278 N286 F288 K294P278-E290 HydrophobicContact CB-CG 4.4Å; P278-E290 HydrophobicContact CG-CG 4.29Å; N286-E290 WeakPolarHBondContact O-CG 3.41Å; N286-E290 PolarHBondContact O-N 3.13Å; N286-E290 VanDerWaalsContact O-N 3.11Å; F288-E290 PolarHBondContact O-N 2.96Å; E290-K294 WeakPolarHBondContact O-CB 3.33Å; E290-K294 WeakPolarHBondContact O-CG 3.41Å; E290-K294 PolarHBondContact O-N 3.07Å; E290-K294 VanDerWaalsContact O-N 3.17Å; E290-K294 WeakPolarHBondContact OE2-CE 3.34Å; E290-K294 IonicContact OE2-NZ 3.1Å; E290-K294 PolarHBondContact OE2-NZ 3.25Å
291V92.5Very high92.7Very high36 Ų3645.3 Ų45.322%0.21823%0.234CC..Hα-helixtrans-65.3-43.1176.1171.90000110.7Q222 E287 F288 A289 A295 F296Q222-V291 HydrophobicContact CG-CG1 3.85Å; E287-V291 WeakPolarHBondContact O-CG2 3.4Å; E287-V291 PolarHBondContact O-N 3.37Å; E287-V291 VanDerWaalsContact O-N 3.13Å; F288-V291 PolarHBondContact O-N 3.3Å; A289-V291 PolarHBondContact O-N 3.17Å; V291-A295 WeakPolarHBondContact O-CB 3.32Å; V291-A295 PolarHBondContact O-N 3.34Å; V291-F296 HydrophobicContact CG1-CE2 4.24Å
292F94.9Very high93.1Very high0 Ų050.4 Ų50.40%026%0.258CS..Hα-helixtrans-62.4-50.7-177.8-178.2-83.6000111.9I229 L271 F272 G276 F288 A289 K294 F296 A297I229-F292 HydrophobicContact CD1-CE2 4.12Å; L271-F292 HydrophobicContact CB-CE2 3.78Å; L271-F292 HydrophobicContact CB-CZ 4.07Å; L271-F292 HydrophobicContact CD1-CE2 4.39Å; F272-F292 HydrophobicContact CB-CE1 3.62Å; F272-F292 HydrophobicContact CB-CZ 3.93Å; F272-F292 HydrophobicContact CD2-CD1 4.05Å; F272-F292 AromaticContact CD2-CE1 3.61Å; F272-F292 HydrophobicContact CD2-CE1 3.61Å; F272-F292 HydrophobicContact CE2-CE1 4.45Å; F272-F292 AromaticContact CG-CE1 3.72Å; F272-F292 HydrophobicContact CG-CE1 3.72Å; F272-F292 HydrophobicContact CG-CZ 4.47Å; G276-F292 VanDerWaalsContact CA-CD1 3.49Å; F288-F292 HydrophobicContact CD1-CB 4.37Å; F288-F292 HydrophobicContact CE1-CB 4.06Å; F288-F292 HydrophobicContact CE1-CD2 4.1Å; F288-F292 HydrophobicContact CE1-CG 4.34Å; F288-F292 HydrophobicContact CZ-CD2 4.21Å; F288-F292 VanDerWaalsContact O-CB 3.29Å; F288-F292 WeakPolarHBondContact O-CB 3.23Å; F288-F292 PolarHBondContact O-N 3.07Å; A289-F292 PolarHBondContact O-N 3.48Å; F292-K294 PolarHBondContact O-N 3.17Å; F292-F296 HydrophobicContact CD2-CD2 4.13Å; F292-F296 PolarHBondContact O-N 2.92Å; F292-A297 HydrophobicContact CE1-CB 4.32Å; F292-A297 PolarHBondContact O-N 3.42Å; F292-A297 VanDerWaalsContact O-N 3.11Å
293L94.9Very high93.5Very high9 Ų948.9 Ų48.95%0.04725%0.246CC..Iπ-helixtrans-59.5-48.7179.6-177.664.2000110.8F272 P278 A289 A297 H335 L337 T338F272-L293 HydrophobicContact CE2-CD1 3.99Å; F272-L293 HydrophobicContact CZ-CD1 4.15Å; P278-L293 HydrophobicContact CG-CB 4.18Å; P278-L293 HydrophobicContact CG-CD2 3.82Å; A289-L293 WeakPolarHBondContact O-CB 3.5Å; A289-L293 PolarHBondContact O-N 3.22Å; L293-A297 HydrophobicContact CD1-CB 4.03Å; L293-A297 WeakPolarHBondContact O-CB 3.34Å; L293-H335 HydrophobicContact CD1-CB 3.83Å; L293-H335 HydrophobicContact CD2-CB 4.2Å; L293-L337 HydrophobicContact CG-CD2 4.19Å; L293-L337 WeakPolarHBondContact O-CD2 3.46Å; L293-T338 HydrophobicContact CD1-CG2 3.98Å
294K93.9Very high94Very high143 Ų14342.6 Ų42.662%0.62222%0.219SC*.Iπ-helixtrans-71.6-39.4-176.1-73.1170.1176.2151.90113.7E290 F292 L337E290-K294 WeakPolarHBondContact O-CB 3.33Å; E290-K294 WeakPolarHBondContact O-CG 3.41Å; E290-K294 PolarHBondContact O-N 3.07Å; E290-K294 VanDerWaalsContact O-N 3.17Å; E290-K294 WeakPolarHBondContact OE2-CE 3.34Å; E290-K294 IonicContact OE2-NZ 3.1Å; E290-K294 PolarHBondContact OE2-NZ 3.25Å; F292-K294 PolarHBondContact O-N 3.17Å; K294-L337 HydrophobicContact CG-CD2 4.38Å
295A93.9Very high94.4Very high56 Ų5638.4 Ų38.446%0.46320%0.2SC..Iπ-helixtrans-94.5-33.6-171.400000113.7V291V291-A295 WeakPolarHBondContact O-CB 3.32Å; V291-A295 PolarHBondContact O-N 3.34Å
296F95.5Very high94.6Very high12 Ų1241.3 Ų41.35%0.05321%0.213CC..Iπ-helixtrans-120-38.4-166.1-52.9-55000113.9L225 T226 I229 V291 F292 V298 G299 V300L225-F296 HydrophobicContact CD2-CD2 3.92Å; L225-F296 HydrophobicContact CD2-CE2 3.48Å; L225-F296 VanDerWaalsContact CD2-CE2 3.48Å; L225-F296 HydrophobicContact CD2-CZ 4.34Å; L225-F296 HydrophobicContact CG-CD2 4.34Å; L225-F296 HydrophobicContact CG-CE2 3.94Å; L225-F296 HydrophobicContact CG-CZ 4.43Å; T226-F296 HydrophobicContact CG2-CE1 4.11Å; T226-F296 VanDerWaalsContact OG1-CZ 3.31Å; T226-F296 WeakPolarHBondContact OG1-CZ 3.46Å; I229-F296 HydrophobicContact CB-CD1 4.22Å; I229-F296 HydrophobicContact CB-CG 4.49Å; I229-F296 HydrophobicContact CG1-CB 4.44Å; I229-F296 HydrophobicContact CG1-CD1 4.26Å; I229-F296 HydrophobicContact CG1-CD2 4.4Å; I229-F296 HydrophobicContact CG1-CG 4.09Å; I229-F296 HydrophobicContact CG2-CB 4.12Å; I229-F296 HydrophobicContact CG2-CD1 3.92Å; I229-F296 HydrophobicContact CG2-CG 4.18Å; V291-F296 HydrophobicContact CG1-CE2 4.24Å; F292-F296 HydrophobicContact CD2-CD2 4.13Å; F292-F296 PolarHBondContact O-N 2.92Å; F296-V298 PolarHBondContact O-N 3.07Å; F296-G299 PolarHBondContact O-N 3.42Å; F296-V300 WeakPolarHBondContact O-CG2 3.35Å; F296-V300 PolarHBondContact O-N 3.12Å
297A95.6Very high94.8Very high0 Ų038.6 Ų38.60%020%0.199CC..Iπ-helixtrans-57.3-46.8-167.400000113.6F272 F292 L293 G299 V300 Q301 Y328 T338F272-A297 HydrophobicContact CE2-CB 4.38Å; F272-A297 HydrophobicContact CZ-CB 4.21Å; F292-A297 HydrophobicContact CE1-CB 4.32Å; F292-A297 PolarHBondContact O-N 3.42Å; F292-A297 VanDerWaalsContact O-N 3.11Å; L293-A297 HydrophobicContact CD1-CB 4.03Å; L293-A297 WeakPolarHBondContact O-CB 3.34Å; A297-G299 PolarHBondContact O-N 3.02Å; A297-V300 PolarHBondContact O-N 3.15Å; A297-Q301 VanDerWaalsContact O-CB 3.3Å; A297-Q301 WeakPolarHBondContact O-CB 3.28Å; A297-Q301 PolarHBondContact O-N 2.89Å; A297-Y328 WeakPolarHBondContact CA-OH 3.3Å; A297-T338 HydrophobicContact CB-CG2 3.66Å
298V95.5Very high95.1Very high36 Ų3631.1 Ų31.122%0.21816%0.164CC..Hα-helixtrans-63.2-40.5177.5179.60000111.9F296 Q301 Q302 L337 T338 N341F296-V298 PolarHBondContact O-N 3.07Å; V298-Q301 WeakPolarHBondContact O-CB 3.43Å; V298-Q301 PolarHBondContact O-N 3.5Å; V298-Q302 WeakPolarHBondContact O-CG 3.5Å; V298-Q302 PolarHBondContact O-N 3.22Å; V298-Q302 VanDerWaalsContact O-N 3.09Å; V298-L337 HydrophobicContact CG2-CD1 4.4Å; V298-L337 HydrophobicContact CG2-CD2 4.22Å; V298-L337 HydrophobicContact CG2-CG 3.87Å; V298-T338 HydrophobicContact CG2-CG2 4.3Å; V298-N341 HydrophobicContact CG1-CB 4.36Å; V298-N341 WeakPolarHBondContact CG1-ND2 3.33Å
299G95.2Very high95.2Very high20 Ų2036.7 Ų36.721%0.20619%0.185CC..Hα-helixtrans-69.1-35.9-179.400000112.8F296 A297F296-G299 PolarHBondContact O-N 3.42Å; A297-G299 PolarHBondContact O-N 3.02Å
300V97.2Very high95.2Very high1 Ų137.4 Ų37.41%0.00619%0.189CC..Hα-helixtrans-68.1-48.3172.3174.50000109.8I229 K233 L268 F296 A297 Q302 V303 L304 Y328I229-V300 HydrophobicContact CG2-CG2 4.07Å; K233-V300 HydrophobicContact CD-CG2 4.08Å; K233-V300 HydrophobicContact CG-CG2 4.05Å; L268-V300 HydrophobicContact CB-CG1 4.43Å; L268-V300 HydrophobicContact CD1-CG1 3.9Å; L268-V300 HydrophobicContact CD2-CG1 4.14Å; L268-V300 HydrophobicContact CD2-CG2 3.86Å; L268-V300 HydrophobicContact CG-CG1 4.39Å; F296-V300 WeakPolarHBondContact O-CG2 3.35Å; F296-V300 PolarHBondContact O-N 3.12Å; A297-V300 PolarHBondContact O-N 3.15Å; V300-Q302 PolarHBondContact O-N 3.4Å; V300-V303 WeakPolarHBondContact O-CA 3.43Å; V300-V303 WeakPolarHBondContact O-CB 3.4Å; V300-V303 PolarHBondContact O-N 3.26Å; V300-L304 HydrophobicContact CG1-CD1 4.2Å; V300-L304 HydrophobicContact CG1-CG 4.18Å; V300-L304 WeakPolarHBondContact O-CG 3.45Å; V300-L304 PolarHBondContact O-N 3Å; V300-Y328 HydrophobicContact CB-CE1 4.12Å; V300-Y328 HydrophobicContact CB-CE2 4.44Å; V300-Y328 WeakPolarHBondContact CB-OH 3.13Å; V300-Y328 HydrophobicContact CG1-CD1 4.32Å; V300-Y328 HydrophobicContact CG1-CD2 4.28Å; V300-Y328 HydrophobicContact CG1-CE1 3.73Å; V300-Y328 HydrophobicContact CG1-CE2 3.72Å; V300-Y328 VanDerWaalsContact CG1-CZ 3.42Å
301Q95.5Very high95.3Very high1 Ų136.5 Ų36.51%0.00518%0.182CC..Hα-helixtrans-52.6-40.3178.3-172.5-173.84900112.6A297 V298 V303 L304 L305 I329 T338 N341A297-Q301 VanDerWaalsContact O-CB 3.3Å; A297-Q301 WeakPolarHBondContact O-CB 3.28Å; A297-Q301 PolarHBondContact O-N 2.89Å; V298-Q301 WeakPolarHBondContact O-CB 3.43Å; V298-Q301 PolarHBondContact O-N 3.5Å; Q301-V303 VanDerWaalsContact C-N 3.34Å; Q301-V303 PolarHBondContact O-N 3.25Å; Q301-L304 PolarHBondContact O-N 2.95Å; Q301-L305 WeakPolarHBondContact O-CG 3.32Å; Q301-L305 PolarHBondContact O-N 3.02Å; Q301-I329 HydrophobicContact CG-CD1 3.85Å; Q301-T338 PolarHBondContact NE2-O 3.07Å; Q301-T338 PolarHBondContact OE1-O 2.83Å; Q301-N341 PolarHBondContact OE1-ND2 2.86Å
302Q95.6Very high95.4Very high113 Ų11339 Ų3953%0.52819%0.19SC..Hα-helixtrans-61.7-38.6176-73.4174.6100113.4V298 V300 L304 K306V298-Q302 WeakPolarHBondContact O-CG 3.5Å; V298-Q302 PolarHBondContact O-N 3.22Å; V298-Q302 VanDerWaalsContact O-N 3.09Å; V300-Q302 PolarHBondContact O-N 3.4Å; Q302-L304 VanDerWaalsContact C-N 3.34Å; Q302-K306 PolarHBondContact O-N 2.91Å
303V96.2Very high95.4Very high19 Ų1943.8 Ų43.812%0.11521%0.213CC..Hα-helixtrans-67.1-40.1175.2177.50000110.2K233 V236 N237 V300 Q301 K306 V307K233-V303 HydrophobicContact CB-CG2 4.31Å; K233-V303 HydrophobicContact CG-CG2 4.27Å; V236-V303 HydrophobicContact CB-CG1 4.02Å; V236-V303 HydrophobicContact CG1-CG1 3.74Å; N237-V303 HydrophobicContact CB-CG1 3.79Å; V300-V303 WeakPolarHBondContact O-CA 3.43Å; V300-V303 WeakPolarHBondContact O-CB 3.4Å; V300-V303 PolarHBondContact O-N 3.26Å; Q301-V303 VanDerWaalsContact C-N 3.34Å; Q301-V303 PolarHBondContact O-N 3.25Å; V303-K306 WeakPolarHBondContact O-CB 3.23Å; V303-K306 PolarHBondContact O-N 3.36Å; V303-V307 PolarHBondContact O-N 3.48Å
304L97.1Very high95.1Very high0 Ų052.8 Ų52.80%025%0.252CS..Hα-helixtrans-67.8-37.7179.1-62.3-163.1000112.8V236 L265 V300 Q301 Q302 K306 V307 L308 T325 Y328 I329V236-L304 HydrophobicContact CG1-CD2 3.91Å; L265-L304 HydrophobicContact CD2-CD2 3.27Å; V300-L304 HydrophobicContact CG1-CD1 4.2Å; V300-L304 HydrophobicContact CG1-CG 4.18Å; V300-L304 WeakPolarHBondContact O-CG 3.45Å; V300-L304 PolarHBondContact O-N 3Å; Q301-L304 PolarHBondContact O-N 2.95Å; Q302-L304 VanDerWaalsContact C-N 3.34Å; L304-K306 PolarHBondContact O-N 2.88Å; L304-V307 WeakPolarHBondContact O-CA 3.49Å; L304-V307 WeakPolarHBondContact O-CB 3.42Å; L304-V307 PolarHBondContact O-N 3.03Å; L304-L308 PolarHBondContact O-N 2.65Å; L304-T325 HydrophobicContact CB-CG2 3.88Å; L304-T325 HydrophobicContact CD1-CG2 4.37Å; L304-T325 HydrophobicContact CD2-CG2 4.32Å; L304-T325 HydrophobicContact CG-CG2 4.39Å; L304-Y328 VanDerWaalsContact CD1-CB 3.44Å; L304-Y328 HydrophobicContact CD1-CD1 3.37Å; L304-Y328 HydrophobicContact CD1-CD2 4.22Å; L304-Y328 HydrophobicContact CD1-CE1 4.21Å; L304-Y328 HydrophobicContact CD1-CG 3.39Å; L304-I329 HydrophobicContact CB-CD1 4.13Å
305L96.4Very high95.1Very high28 Ų2850.7 Ų50.715%0.14724%0.244CC..Hα-helixtrans-59.5-33.6172.7-71.8173.2000112Q301 Y309 L342 H345 I349Q301-L305 WeakPolarHBondContact O-CG 3.32Å; Q301-L305 PolarHBondContact O-N 3.02Å; L305-Y309 WeakPolarHBondContact O-CB 3.36Å; L305-Y309 PolarHBondContact O-N 2.95Å; L305-L342 HydrophobicContact CD2-CD1 4.24Å; L305-H345 HydrophobicContact CD2-CB 4.15Å; L305-I349 HydrophobicContact CD2-CD1 3.76Å
306K95.2Very high95Very high76 Ų7649.9 Ų49.933%0.3323%0.229SC..Hα-helixtrans-65.7-41.7171.9-176.2-167.7167.1-166.10111.5N237 D239 Q302 V303 L304 L308 Y309 Q310N237-K306 PolarHBondContact O-NZ 2.87Å; N237-K306 VanDerWaalsContact O-NZ 3.17Å; N237-K306 WeakPolarHBondContact OD1-CD 3.41Å; N237-K306 PolarHBondContact OD1-NZ 3.34Å; D239-K306 IonicContact OD1-NZ 3.28Å; Q302-K306 PolarHBondContact O-N 2.91Å; V303-K306 WeakPolarHBondContact O-CB 3.23Å; V303-K306 PolarHBondContact O-N 3.36Å; L304-K306 PolarHBondContact O-N 2.88Å; K306-L308 VanDerWaalsContact C-N 3.35Å; K306-Y309 WeakPolarHBondContact O-CB 2.75Å; K306-Y309 PolarHBondContact O-N 3.14Å; K306-Q310 WeakPolarHBondContact O-CG 3.4Å; K306-Q310 PolarHBondContact O-N 3.32Å
307V95.7Very high94.9Very high3 Ų350.1 Ų50.12%0.01823%0.23CC..Hα-helixtrans-60.2-46.2176.4177.80000110.5V236 V303 L304 Y309 Q310 Y311 M317 V321 T325V236-V307 HydrophobicContact CG1-CG2 3.87Å; V303-V307 PolarHBondContact O-N 3.48Å; L304-V307 WeakPolarHBondContact O-CA 3.49Å; L304-V307 WeakPolarHBondContact O-CB 3.42Å; L304-V307 PolarHBondContact O-N 3.03Å; V307-Y309 VanDerWaalsContact C-N 3.33Å; V307-Y309 PolarHBondContact O-N 3.47Å; V307-Q310 WeakPolarHBondContact O-CB 3.45Å; V307-Q310 PolarHBondContact O-N 2.95Å; V307-Y311 PolarHBondContact O-N 3.4Å; V307-M317 HydrophobicContact CG1-CE 4.32Å; V307-M317 HydrophobicContact CG1-SD 4.12Å; V307-V321 HydrophobicContact CG1-CG1 4.32Å; V307-T325 HydrophobicContact CB-CG2 4.38Å; V307-T325 HydrophobicContact CG1-CG2 4.4Å
308L96.8Very high94.8Very high4 Ų450.3 Ų50.32%0.02123%0.232CC..Hα-helixtrans-62.8-38.6175.8-63.3-172000112.4L304 K306 Y311 K312 L322 T325 L326 I329 I349 V353L304-L308 PolarHBondContact O-N 2.65Å; K306-L308 VanDerWaalsContact C-N 3.35Å; L308-Y311 PolarHBondContact O-N 2.98Å; L308-K312 PolarHBondContact O-N 3.15Å; L308-L322 HydrophobicContact CD2-CD1 3.78Å; L308-T325 HydrophobicContact CD2-CG2 3.63Å; L308-T325 HydrophobicContact CG-CG2 3.89Å; L308-L326 HydrophobicContact CD2-CD2 4.23Å; L308-I329 HydrophobicContact CD1-CG1 4.23Å; L308-I349 HydrophobicContact CD1-CD1 4.04Å; L308-I349 HydrophobicContact CD1-CG1 4.12Å; L308-I349 HydrophobicContact CD1-CG2 4.18Å; L308-V353 HydrophobicContact CB-CG2 4.3Å; L308-V353 HydrophobicContact CD2-CG1 4.18Å
309Y95.3Very high94.7Very high135 Ų13551.3 Ų51.353%0.52924%0.24SC..Hα-helixtrans-64.2-40.9174.4-175.5-89000112.2L305 K306 V307 K312 E313L305-Y309 WeakPolarHBondContact O-CB 3.36Å; L305-Y309 PolarHBondContact O-N 2.95Å; K306-Y309 WeakPolarHBondContact O-CB 2.75Å; K306-Y309 PolarHBondContact O-N 3.14Å; V307-Y309 VanDerWaalsContact C-N 3.33Å; V307-Y309 PolarHBondContact O-N 3.47Å; Y309-K312 WeakPolarHBondContact O-CB 3.25Å; Y309-K312 PolarHBondContact O-N 3.29Å; Y309-E313 HydrophobicContact CD1-CG 4.04Å; Y309-E313 HydrophobicContact CE1-CG 3.53Å; Y309-E313 WeakPolarHBondContact O-CG 3.35Å; Y309-E313 PolarHBondContact O-N 3.49Å; Y309-E313 PolarHBondContact OH-OE1 2.91Å
310Q94.2Very high94.6Very high16 Ų1653.2 Ų53.28%0.07524%0.241CC..Hα-helixtrans-63.2-41.5175.8-74.2175-4600111.6D239 K306 V307 E313 K314 Q315 M317D239-Q310 PolarHBondContact OD1-NE2 3.22Å; K306-Q310 WeakPolarHBondContact O-CG 3.4Å; K306-Q310 PolarHBondContact O-N 3.32Å; V307-Q310 WeakPolarHBondContact O-CB 3.45Å; V307-Q310 PolarHBondContact O-N 2.95Å; Q310-E313 CarbonylContact O-C 3.58Å; Q310-E313 PolarHBondContact O-N 2.95Å; Q310-K314 PolarHBondContact O-N 2.91Å; Q310-Q315 HydrophobicContact CB-CB 4.32Å; Q310-Q315 VanDerWaalsContact O-CB 3.29Å; Q310-Q315 WeakPolarHBondContact O-CB 3.4Å; Q310-Q315 PolarHBondContact O-N 2.72Å; Q310-M317 HydrophobicContact CB-CE 3.24Å; Q310-M317 HydrophobicContact CG-CE 4.16Å
311Y94.8Very high94.6Very high58 Ų5853.3 Ų53.323%0.22724%0.241CC..Hα-helixtrans-60-46.6172.9177.2-99.4000111.7V307 L308 E313 K314 M317 L322 V353 L357V307-Y311 PolarHBondContact O-N 3.4Å; L308-Y311 PolarHBondContact O-N 2.98Å; Y311-E313 PolarHBondContact O-N 2.82Å; Y311-K314 WeakPolarHBondContact O-CA 3.44Å; Y311-K314 PolarHBondContact O-N 3.18Å; Y311-M317 HydrophobicContact CD2-CB 4.34Å; Y311-M317 HydrophobicContact CD2-CG 4.42Å; Y311-L322 HydrophobicContact CD1-CD2 4.45Å; Y311-L322 HydrophobicContact CD2-CD1 4.5Å; Y311-L322 HydrophobicContact CD2-CD2 3.74Å; Y311-L322 HydrophobicContact CE1-CD2 4.3Å; Y311-L322 HydrophobicContact CE2-CD2 3.55Å; Y311-L322 HydrophobicContact CG-CD1 4.26Å; Y311-L322 HydrophobicContact CG-CD2 4.19Å; Y311-V353 HydrophobicContact CD1-CB 4.43Å; Y311-V353 HydrophobicContact CD1-CG1 3.91Å; Y311-V353 HydrophobicContact CD1-CG2 4.3Å; Y311-V353 HydrophobicContact CE1-CG1 4.09Å; Y311-L357 HydrophobicContact CE1-CG 4.4Å; Y311-L357 VanDerWaalsContact OH-CD2 3.27Å; Y311-L357 WeakPolarHBondContact OH-CD2 3.45Å
312K93.7Very high94.6Very high88 Ų8853.4 Ų53.438%0.38324%0.242SC..Hα-helixtrans-54.6-39.7173.8166.5179.8177.5164.20112.6L308 Y309 K314 D352L308-K312 PolarHBondContact O-N 3.15Å; Y309-K312 WeakPolarHBondContact O-CB 3.25Å; Y309-K312 PolarHBondContact O-N 3.29Å; K312-K314 PolarHBondContact O-N 3.3Å; K312-K314 VanDerWaalsContact O-N 3.14Å; K312-D352 HydrophobicContact CB-CB 4.41Å; K312-D352 HydrophobicContact CD-CB 3.72Å; K312-D352 WeakPolarHBondContact CE-OD2 3.36Å; K312-D352 HydrophobicContact CG-CB 3.96Å; K312-D352 IonicContact NZ-OD2 2.61Å; K312-D352 PolarHBondContact NZ-OD2 2.93Å
313E94.5Very high94.6Very high101 Ų10148.4 Ų48.447%0.47222%0.218SC..THydrogen-bonded Turntrans-76.313.5176.1-65.8-67.5149.900113.4Y309 Q310 Y311 Q315Y309-E313 HydrophobicContact CD1-CG 4.04Å; Y309-E313 HydrophobicContact CE1-CG 3.53Å; Y309-E313 WeakPolarHBondContact O-CG 3.35Å; Y309-E313 PolarHBondContact O-N 3.49Å; Y309-E313 PolarHBondContact OH-OE1 2.91Å; Q310-E313 CarbonylContact O-C 3.58Å; Q310-E313 PolarHBondContact O-N 2.95Å; Y311-E313 PolarHBondContact O-N 2.82Å; E313-Q315 PolarHBondContact O-N 3.04Å
314K90.3Very high94.7Very high199 Ų19948 Ų4887%0.86522%0.215SC*.THydrogen-bonded Turntrans60.427.9-179.4-54-173.4174.5-166.50113.9Q310 Y311 K312Q310-K314 PolarHBondContact O-N 2.91Å; Y311-K314 WeakPolarHBondContact O-CA 3.44Å; Y311-K314 PolarHBondContact O-N 3.18Å; K312-K314 PolarHBondContact O-N 3.3Å; K312-K314 VanDerWaalsContact O-N 3.14Å
315Q92.6Very high94.7Very high98 Ų9848 Ų4846%0.45822%0.215SC..  trans-77.2132.6166.8-58.3-175.95.100108.6Q310 E313 M317Q310-Q315 HydrophobicContact CB-CB 4.32Å; Q310-Q315 VanDerWaalsContact O-CB 3.29Å; Q310-Q315 WeakPolarHBondContact O-CB 3.4Å; Q310-Q315 PolarHBondContact O-N 2.72Å; E313-Q315 PolarHBondContact O-N 3.04Å; Q315-M317 PolarHBondContact O-N 3.48Å
316Y91.9Very high94.8Very high40 Ų4046.7 Ų46.716%0.15721%0.208CC..  trans-56133.5177.6175.6-98.9000110.7E249 R252 P253 W258E249-Y316 HydrophobicContact CG-CD2 4.08Å; E249-Y316 HydrophobicContact CG-CE2 3.6Å; R252-Y316 HydrophobicContact CB-CE1 3.59Å; R252-Y316 HydrophobicContact CG-CE1 4.23Å; P253-Y316 WeakPolarHBondContact CD-OH 3.25Å; P253-Y316 WeakPolarHBondContact CG-OH 3.42Å; W258-Y316 HydrophobicContact CD2-CE1 4.45Å; W258-Y316 AromaticContact CE2-CD1 3.89Å; W258-Y316 AromaticContact CE2-CE1 3.76Å; W258-Y316 HydrophobicContact CH2-CD1 4.34Å; W258-Y316 WeakPolarHBondContact CH2-O 3.43Å; W258-Y316 AromaticContact CZ2-CD1 3.58Å; W258-Y316 HydrophobicContact CZ2-CD1 3.58Å; W258-Y316 AromaticContact CZ2-CE1 3.93Å; W258-Y316 HydrophobicContact CZ2-CE1 3.93Å; W258-Y316 AromaticContact NE1-CE1 3.73Å
317M93Very high94.8Very high16 Ų1645.5 Ų45.58%0.07921%0.206CC..  trans-132.3127.8173.9-70.2-62.7171.200108.4W258 V307 Q310 Y311 Q315W258-M317 HydrophobicContact CH2-SD 3.71Å; W258-M317 HydrophobicContact CZ3-SD 3.78Å; V307-M317 HydrophobicContact CG1-CE 4.32Å; V307-M317 HydrophobicContact CG1-SD 4.12Å; Q310-M317 HydrophobicContact CB-CE 3.24Å; Q310-M317 HydrophobicContact CG-CE 4.16Å; Y311-M317 HydrophobicContact CD2-CB 4.34Å; Y311-M317 HydrophobicContact CD2-CG 4.42Å; Q315-M317 PolarHBondContact O-N 3.48Å
318A93.8Very high94.9Very high4 Ų445.5 Ų45.53%0.03321%0.205CC..  trans-58.2136.7175.300000110.3W258 R320 V321 L322W258-A318 HydrophobicContact CB-CB 3.93Å; W258-A318 HydrophobicContact CD2-CB 3.73Å; W258-A318 HydrophobicContact CE3-CB 3.58Å; W258-A318 HydrophobicContact CG-CB 3.89Å; W258-A318 HydrophobicContact CZ3-CB 4.35Å; A318-R320 VanDerWaalsContact C-N 3.32Å; A318-R320 PolarHBondContact O-N 3.45Å; A318-V321 HydrophobicContact CB-CB 4.46Å; A318-V321 HydrophobicContact CB-CG2 4.24Å; A318-V321 WeakPolarHBondContact O-CA 3.01Å; A318-V321 WeakPolarHBondContact O-CB 3.49Å; A318-V321 PolarHBondContact O-N 3.46Å; A318-L322 PolarHBondContact O-N 3Å
319P93.1Very high95Very high58 Ų5845.3 Ų45.338%0.37720%0.204SC..Hα-helixtrans-50.6-48.5-174.7-31.335.6000113.2V321 L322 Q323 P389P319-V321 VanDerWaalsContact C-N 3.25Å; P319-V321 PolarHBondContact O-N 2.81Å; P319-L322 WeakPolarHBondContact O-CB 3.4Å; P319-L322 PolarHBondContact O-N 3.09Å; P319-Q323 WeakPolarHBondContact O-CB 3.48Å; P319-Q323 PolarHBondContact O-N 3.02Å; P319-P389 HydrophobicContact CB-CG 3.78Å; P319-P389 WeakPolarHBondContact O-CG 3.47Å
320R94.1Very high95Very high60 Ų6040 Ų4023%0.22619%0.185CC..Hα-helixtrans-63.1-26.3178.8-62.5-68.2-67.9158.3-7.4114.3K262 A318 Q324 F386K262-R320 HydrophobicContact CD-CB 3.73Å; K262-R320 HydrophobicContact CD-CG 4.17Å; K262-R320 HydrophobicContact CG-CB 3.82Å; A318-R320 VanDerWaalsContact C-N 3.32Å; A318-R320 PolarHBondContact O-N 3.45Å; R320-Q324 WeakPolarHBondContact O-CB 3.28Å; R320-Q324 VanDerWaalsContact O-CG 3.23Å; R320-Q324 WeakPolarHBondContact O-CG 3.34Å; R320-Q324 PolarHBondContact O-N 3.2Å; R320-F386 PolarHBondContact NH1-O 3.46Å
321V96.4Very high95Very high2 Ų241 Ų411%0.01219%0.189CC..Hα-helixtrans-73.2-43.7173.9167.70000109.7W258 K261 K262 L265 V307 A318 P319 T325W258-V321 HydrophobicContact CE3-CG2 4.04Å; W258-V321 HydrophobicContact CZ3-CG1 4.45Å; K261-V321 HydrophobicContact CB-CG2 3.89Å; K262-V321 HydrophobicContact CB-CG2 4.26Å; L265-V321 HydrophobicContact CD1-CB 4.09Å; L265-V321 HydrophobicContact CD1-CG1 3.56Å; L265-V321 HydrophobicContact CD1-CG2 4.36Å; L265-V321 VanDerWaalsContact CD1-O 3.3Å; L265-V321 WeakPolarHBondContact CD1-O 3.12Å; V307-V321 HydrophobicContact CG1-CG1 4.32Å; A318-V321 HydrophobicContact CB-CB 4.46Å; A318-V321 HydrophobicContact CB-CG2 4.24Å; A318-V321 WeakPolarHBondContact O-CA 3.01Å; A318-V321 WeakPolarHBondContact O-CB 3.49Å; A318-V321 PolarHBondContact O-N 3.46Å; P319-V321 VanDerWaalsContact C-N 3.25Å; P319-V321 PolarHBondContact O-N 2.81Å; V321-T325 VanDerWaalsContact O-CB 3.32Å; V321-T325 WeakPolarHBondContact O-CB 3.27Å; V321-T325 PolarHBondContact O-N 3.22Å; V321-T325 PolarHBondContact O-OG1 3.35Å
322L96.2Very high95Very high4 Ų438.2 Ų38.22%0.02118%0.179CC..Hα-helixtrans-65-46.4176.9-172.956.7000111.2L308 Y311 A318 P319 Q324 T325 L326 V353 L357 P389L308-L322 HydrophobicContact CD2-CD1 3.78Å; Y311-L322 HydrophobicContact CD1-CD2 4.45Å; Y311-L322 HydrophobicContact CD2-CD1 4.5Å; Y311-L322 HydrophobicContact CD2-CD2 3.74Å; Y311-L322 HydrophobicContact CE1-CD2 4.3Å; Y311-L322 HydrophobicContact CE2-CD2 3.55Å; Y311-L322 HydrophobicContact CG-CD1 4.26Å; Y311-L322 HydrophobicContact CG-CD2 4.19Å; A318-L322 PolarHBondContact O-N 3Å; P319-L322 WeakPolarHBondContact O-CB 3.4Å; P319-L322 PolarHBondContact O-N 3.09Å; L322-Q324 PolarHBondContact O-N 3.49Å; L322-T325 WeakPolarHBondContact O-CB 3.46Å; L322-T325 PolarHBondContact O-N 3.03Å; L322-T325 VanDerWaalsContact O-N 3.15Å; L322-L326 HydrophobicContact CG-CD1 4.27Å; L322-L326 WeakPolarHBondContact O-CG 3.32Å; L322-L326 PolarHBondContact O-N 3.19Å; L322-V353 HydrophobicContact CD1-CG1 4.43Å; L322-L357 HydrophobicContact CD2-CD1 3.96Å; L322-L357 HydrophobicContact CD2-CD2 3.82Å; L322-L357 HydrophobicContact CD2-CG 4.39Å; L322-L357 HydrophobicContact CG-CD1 4.4Å; L322-P389 HydrophobicContact CB-CB 4.45Å; L322-P389 HydrophobicContact CD2-CB 4.2Å; L322-P389 HydrophobicContact CG-CB 4.28Å
323Q96.2Very high95.1Very high8 Ų834 Ų344%0.03716%0.161CC..Hα-helixtrans-56.2-52.7177.4-177.2-102.3-2.900112.4P319 T325 L326 N327 F386 S388 P389 A392P319-Q323 WeakPolarHBondContact O-CB 3.48Å; P319-Q323 PolarHBondContact O-N 3.02Å; Q323-T325 VanDerWaalsContact C-N 3.28Å; Q323-T325 PolarHBondContact O-N 3.07Å; Q323-L326 PolarHBondContact O-N 3.2Å; Q323-N327 PolarHBondContact NE2-ND2 3.41Å; Q323-N327 PolarHBondContact O-N 3.03Å; Q323-N327 PolarHBondContact O-OD1 3.08Å; Q323-F386 PolarHBondContact NE2-O 2.68Å; Q323-S388 WeakPolarHBondContact CG-O 3.47Å; Q323-P389 HydrophobicContact CB-CB 4.46Å; Q323-P389 HydrophobicContact CB-CG 4.31Å; Q323-A392 HydrophobicContact CG-CB 3.92Å
324Q96.6Very high94.9Very high10 Ų1029.5 Ų29.55%0.04714%0.14CC..Hα-helixtrans-66.3-30.2177.6-66.2-65.6-41.300113.2L265 H266 R320 L322 Y328L265-Q324 HydrophobicContact CB-CB 3.66Å; L265-Q324 HydrophobicContact CB-CG 4.49Å; L265-Q324 HydrophobicContact CD1-CB 4.43Å; H266-Q324 PolarHBondContact CD2-OE1 3.41Å; R320-Q324 WeakPolarHBondContact O-CB 3.28Å; R320-Q324 VanDerWaalsContact O-CG 3.23Å; R320-Q324 WeakPolarHBondContact O-CG 3.34Å; R320-Q324 PolarHBondContact O-N 3.2Å; L322-Q324 PolarHBondContact O-N 3.49Å; Q324-Y328 PolarHBondContact O-N 3.42Å; Q324-Y328 VanDerWaalsContact O-N 3.12Å
325T97.9Very high94.9Very high0 Ų020 Ų200%010%0.099CC..Hα-helixtrans-64-46.3173.3-60.10000110.2L265 L304 V307 L308 V321 L322 Q323 Y328 I329L265-T325 WeakPolarHBondContact CD1-OG1 3.45Å; L304-T325 HydrophobicContact CB-CG2 3.88Å; L304-T325 HydrophobicContact CD1-CG2 4.37Å; L304-T325 HydrophobicContact CD2-CG2 4.32Å; L304-T325 HydrophobicContact CG-CG2 4.39Å; V307-T325 HydrophobicContact CB-CG2 4.38Å; V307-T325 HydrophobicContact CG1-CG2 4.4Å; L308-T325 HydrophobicContact CD2-CG2 3.63Å; L308-T325 HydrophobicContact CG-CG2 3.89Å; V321-T325 VanDerWaalsContact O-CB 3.32Å; V321-T325 WeakPolarHBondContact O-CB 3.27Å; V321-T325 PolarHBondContact O-N 3.22Å; V321-T325 PolarHBondContact O-OG1 3.35Å; L322-T325 WeakPolarHBondContact O-CB 3.46Å; L322-T325 PolarHBondContact O-N 3.03Å; L322-T325 VanDerWaalsContact O-N 3.15Å; Q323-T325 VanDerWaalsContact C-N 3.28Å; Q323-T325 PolarHBondContact O-N 3.07Å; T325-Y328 PolarHBondContact O-N 3.15Å; T325-I329 VanDerWaalsContact O-CG1 3.3Å; T325-I329 WeakPolarHBondContact O-CG1 3.3Å; T325-I329 PolarHBondContact O-N 3.37Å; T325-I329 VanDerWaalsContact O-N 3.09Å
326L97.9Very high94.9Very high0 Ų016 Ų160%08%0.082CC..Hα-helixtrans-63.5-43177.9-67169.1000111.7L308 L322 Q323 Y328 I329 N330 V353 L357 P389 A392 A393 L396L308-L326 HydrophobicContact CD2-CD2 4.23Å; L322-L326 HydrophobicContact CG-CD1 4.27Å; L322-L326 WeakPolarHBondContact O-CG 3.32Å; L322-L326 PolarHBondContact O-N 3.19Å; Q323-L326 PolarHBondContact O-N 3.2Å; L326-Y328 VanDerWaalsContact C-N 3.35Å; L326-Y328 PolarHBondContact O-N 3.36Å; L326-I329 CarbonylContact O-C 2.92Å; L326-I329 PolarHBondContact O-N 2.85Å; L326-I329 VanDerWaalsContact O-N 3.14Å; L326-N330 WeakPolarHBondContact O-CB 3.45Å; L326-N330 PolarHBondContact O-N 3.46Å; L326-V353 HydrophobicContact CD2-CG1 4.29Å; L326-L357 HydrophobicContact CD1-CD1 3.8Å; L326-P389 WeakPolarHBondContact CD1-O 3.41Å; L326-A392 HydrophobicContact CB-CB 3.95Å; L326-A392 HydrophobicContact CD1-CB 4.21Å; L326-A393 HydrophobicContact CD1-CB 4Å; L326-L396 HydrophobicContact CD2-CD2 3.8Å
327N96.3Very high95Very high52 Ų5217.4 Ų17.428%0.2789%0.092SC..Hα-helixtrans-59.7-42.6176.7-68.6-3.5000112.4Q323 I329 N330 Q331 A392Q323-N327 PolarHBondContact NE2-ND2 3.41Å; Q323-N327 PolarHBondContact O-N 3.03Å; Q323-N327 PolarHBondContact O-OD1 3.08Å; N327-I329 PolarHBondContact O-N 3.21Å; N327-N330 WeakPolarHBondContact O-CB 3.47Å; N327-N330 PolarHBondContact O-N 3.02Å; N327-Q331 PolarHBondContact O-N 3.47Å; N327-A392 VanDerWaalsContact OD1-CB 3.26Å; N327-A392 WeakPolarHBondContact OD1-CB 3.31Å
328Y97.5Very high95.1Very high3 Ų316.7 Ų16.71%0.0129%0.088CC..Hα-helixtrans-64.2-41.9175.6-168.4-76.2000111.9L268 F272 A297 V300 L304 Q324 T325 L326 N330 Q331 G332L268-Y328 HydrophobicContact CB-CD2 4.04Å; L268-Y328 HydrophobicContact CB-CE2 4Å; L268-Y328 VanDerWaalsContact O-CE2 3.29Å; L268-Y328 WeakPolarHBondContact O-CE2 3.49Å; F272-Y328 HydrophobicContact CB-CD2 4.2Å; F272-Y328 HydrophobicContact CB-CE2 3.68Å; F272-Y328 HydrophobicContact CD1-CD1 4.01Å; F272-Y328 HydrophobicContact CD1-CD2 4.11Å; F272-Y328 AromaticContact CD1-CE1 3.63Å; F272-Y328 HydrophobicContact CD1-CE1 3.63Å; F272-Y328 AromaticContact CD1-CE2 3.71Å; F272-Y328 HydrophobicContact CD1-CE2 3.71Å; F272-Y328 HydrophobicContact CD1-CG 4.23Å; F272-Y328 AromaticContact CD1-CZ 3.44Å; F272-Y328 VanDerWaalsContact CD1-CZ 3.44Å; F272-Y328 HydrophobicContact CE1-CD1 4.4Å; F272-Y328 AromaticContact CE1-CE1 3.95Å; F272-Y328 HydrophobicContact CE1-CE1 3.95Å; F272-Y328 HydrophobicContact CG-CE2 4.09Å; A297-Y328 WeakPolarHBondContact CA-OH 3.3Å; V300-Y328 HydrophobicContact CB-CE1 4.12Å; V300-Y328 HydrophobicContact CB-CE2 4.44Å; V300-Y328 WeakPolarHBondContact CB-OH 3.13Å; V300-Y328 HydrophobicContact CG1-CD1 4.32Å; V300-Y328 HydrophobicContact CG1-CD2 4.28Å; V300-Y328 HydrophobicContact CG1-CE1 3.73Å; V300-Y328 HydrophobicContact CG1-CE2 3.72Å; V300-Y328 VanDerWaalsContact CG1-CZ 3.42Å; L304-Y328 VanDerWaalsContact CD1-CB 3.44Å; L304-Y328 HydrophobicContact CD1-CD1 3.37Å; L304-Y328 HydrophobicContact CD1-CD2 4.22Å; L304-Y328 HydrophobicContact CD1-CE1 4.21Å; L304-Y328 HydrophobicContact CD1-CG 3.39Å; Q324-Y328 PolarHBondContact O-N 3.42Å; Q324-Y328 VanDerWaalsContact O-N 3.12Å; T325-Y328 PolarHBondContact O-N 3.15Å; L326-Y328 VanDerWaalsContact C-N 3.35Å; L326-Y328 PolarHBondContact O-N 3.36Å; Y328-N330 VanDerWaalsContact C-N 3.29Å; Y328-N330 PolarHBondContact O-N 2.5Å; Y328-Q331 PolarHBondContact O-N 2.66Å; Y328-G332 PolarHBondContact O-N 2.99Å; Y328-G332 VanDerWaalsContact O-N 3.12Å
329I97.8Very high95.2Very high0 Ų016.8 Ų16.80%09%0.088CC..Hα-helixtrans-64.6-37.8176.7-64.9-60.9000110.6Q301 L304 L308 T325 L326 N327 G332 V333 L342 L396Q301-I329 HydrophobicContact CG-CD1 3.85Å; L304-I329 HydrophobicContact CB-CD1 4.13Å; L308-I329 HydrophobicContact CD1-CG1 4.23Å; T325-I329 VanDerWaalsContact O-CG1 3.3Å; T325-I329 WeakPolarHBondContact O-CG1 3.3Å; T325-I329 PolarHBondContact O-N 3.37Å; T325-I329 VanDerWaalsContact O-N 3.09Å; L326-I329 CarbonylContact O-C 2.92Å; L326-I329 PolarHBondContact O-N 2.85Å; L326-I329 VanDerWaalsContact O-N 3.14Å; N327-I329 PolarHBondContact O-N 3.21Å; I329-G332 CarbonylContact O-C 3.58Å; I329-G332 WeakPolarHBondContact O-CA 3.43Å; I329-G332 PolarHBondContact O-N 2.94Å; I329-G332 VanDerWaalsContact O-N 3.1Å; I329-V333 PolarHBondContact O-N 3.5Å; I329-L342 HydrophobicContact CG2-CD1 3.87Å; I329-L342 HydrophobicContact CG2-CD2 3.82Å; I329-L396 HydrophobicContact CB-CD2 4.36Å; I329-L396 HydrophobicContact CG2-CD1 3.99Å; I329-L396 HydrophobicContact CG2-CD2 3.9Å
330N96.4Very high95.2Very high23 Ų2321.6 Ų21.612%0.12310%0.103CC..Hα-helixtrans-57.8-50.7175-172.250.6000111.4L326 N327 Y328 G332 V333 T395 L396 T399L326-N330 WeakPolarHBondContact O-CB 3.45Å; L326-N330 PolarHBondContact O-N 3.46Å; N327-N330 WeakPolarHBondContact O-CB 3.47Å; N327-N330 PolarHBondContact O-N 3.02Å; Y328-N330 VanDerWaalsContact C-N 3.29Å; Y328-N330 PolarHBondContact O-N 2.5Å; N330-G332 PolarHBondContact O-N 3.08Å; N330-V333 VanDerWaalsContact O-CB 3.27Å; N330-V333 WeakPolarHBondContact O-CB 3.37Å; N330-V333 PolarHBondContact O-N 2.87Å; N330-T395 PolarHBondContact OD1-O 3.3Å; N330-L396 HydrophobicContact CB-CB 4.32Å; N330-L396 HydrophobicContact CB-CD1 4.09Å; N330-L396 WeakPolarHBondContact OD1-CA 3.34Å; N330-T399 WeakPolarHBondContact OD1-CB 3.43Å; N330-T399 WeakPolarHBondContact OD1-CG2 3.46Å; N330-T399 PolarHBondContact OD1-OG1 3.35Å
331Q94.9Very high95.1Very high36 Ų3620.5 Ų20.517%0.16810%0.102CC..Hα-helixtrans-58.5-35.3175.2-164.162.421.200112.2F272 S277 N327 Y328 V333 S334 H335F272-Q331 HydrophobicContact CB-CG 4.44Å; F272-Q331 HydrophobicContact CD1-CB 3.72Å; F272-Q331 HydrophobicContact CD1-CG 3.77Å; F272-Q331 HydrophobicContact CD2-CG 3.96Å; F272-Q331 HydrophobicContact CE1-CB 3.88Å; F272-Q331 HydrophobicContact CE1-CG 3.95Å; F272-Q331 HydrophobicContact CE2-CG 4.11Å; F272-Q331 HydrophobicContact CG-CB 4.21Å; F272-Q331 HydrophobicContact CG-CG 3.78Å; F272-Q331 HydrophobicContact CZ-CB 4.47Å; F272-Q331 HydrophobicContact CZ-CG 4.11Å; S277-Q331 PolarHBondContact OG-NE2 3.18Å; N327-Q331 PolarHBondContact O-N 3.47Å; Y328-Q331 PolarHBondContact O-N 2.66Å; Q331-V333 PolarHBondContact O-N 3Å; Q331-S334 PolarHBondContact O-N 3.33Å; Q331-H335 PolarHBondContact O-CD2 2.77Å
332G94.6Very high95Very high1 Ų120.4 Ų20.41%0.0110%0.101CC..Hα-helixtrans-68.6-13.1176.300000115.2Y328 I329 N330 T338 W339Y328-G332 PolarHBondContact O-N 2.99Å; Y328-G332 VanDerWaalsContact O-N 3.12Å; I329-G332 CarbonylContact O-C 3.58Å; I329-G332 WeakPolarHBondContact O-CA 3.43Å; I329-G332 PolarHBondContact O-N 2.94Å; I329-G332 VanDerWaalsContact O-N 3.1Å; N330-G332 PolarHBondContact O-N 3.08Å; G332-T338 WeakPolarHBondContact CA-OG1 3.48Å; G332-T338 WeakPolarHBondContact O-CB 3.47Å; G332-T338 PolarHBondContact O-OG1 3.09Å; G332-W339 PolarHBondContact O-N 3.12Å
333V95Very high95Very high0 Ų024.8 Ų24.80%012%0.12CC..Hα-helixtrans-71.4-35.6174.7175.90000111I329 N330 Q331 H335 W339 L342 L396 T399 A400 R404I329-V333 PolarHBondContact O-N 3.5Å; N330-V333 VanDerWaalsContact O-CB 3.27Å; N330-V333 WeakPolarHBondContact O-CB 3.37Å; N330-V333 PolarHBondContact O-N 2.87Å; Q331-V333 PolarHBondContact O-N 3Å; V333-H335 PolarHBondContact O-N 3.29Å; V333-W339 HydrophobicContact CG1-CE3 4.45Å; V333-W339 HydrophobicContact CG1-CZ3 4.39Å; V333-L342 HydrophobicContact CG2-CD2 3.84Å; V333-L396 HydrophobicContact CG2-CD1 3.7Å; V333-T399 HydrophobicContact CB-CG2 4.17Å; V333-T399 HydrophobicContact CG1-CG2 4.04Å; V333-A400 HydrophobicContact CG1-CB 4.38Å; V333-A400 HydrophobicContact CG2-CB 4.41Å; V333-R404 HydrophobicContact CG1-CG 3.84Å; V333-R404 PolarHBondContact O-NE 2.89Å; V333-R404 PolarHBondContact O-NH2 3.22Å
334S90.1Very high94.9Very high6 Ų629.1 Ų29.14%0.04215%0.149CC..Hα-helixtrans-69.8-28.8-175.2-60.80000113.7Q331 R404 D907Q331-S334 PolarHBondContact O-N 3.33Å; S334-R404 PolarHBondContact O-NH2 2.9Å; S334-R404 VanDerWaalsContact O-NH2 3.16Å; S334-D907 PolarHBondContact O-N 3.38Å
335H91.1Very high94.9Very high0 Ų032.9 Ų32.90%017%0.166CC..SBendtrans-101.6127.4-175.1-59.6-80.1000112.6F272 S277 L293 Q331 V333 L337 T338 W339 R404 D906F272-H335 AromaticContact CE2-CD2 3.81Å; F272-H335 AromaticContact CZ-CD2 3.82Å; S277-H335 VanDerWaalsContact CB-NE2 3.35Å; S277-H335 WeakPolarHBondContact CB-NE2 3.31Å; S277-H335 PolarHBondContact OG-NE2 3.05Å; L293-H335 HydrophobicContact CD1-CB 3.83Å; L293-H335 HydrophobicContact CD2-CB 4.2Å; Q331-H335 PolarHBondContact O-CD2 2.77Å; V333-H335 PolarHBondContact O-N 3.29Å; H335-L337 VanDerWaalsContact C-N 3.28Å; H335-L337 PolarHBondContact O-N 2.89Å; H335-T338 WeakPolarHBondContact CB-OG1 3.49Å; H335-T338 PolarHBondContact O-N 2.81Å; H335-T338 PolarHBondContact O-OG1 3.41Å; H335-W339 WeakPolarHBondContact O-CB 3.33Å; H335-W339 PolarHBondContact O-N 3.45Å; H335-R404 VanDerWaalsContact C-NH2 3.32Å; H335-D906 VanDerWaalsContact CA-OD1 3.27Å; H335-D906 WeakPolarHBondContact CA-OD1 3.33Å
336A91.9Very high94.8Very high12 Ų1233.2 Ų33.210%0.09917%0.168CC..Hα-helixtrans-51.9-41177.900000113.2W339 K340 D906A336-W339 PolarHBondContact O-N 2.96Å; A336-K340 WeakPolarHBondContact O-CB 3.39Å; A336-K340 PolarHBondContact O-N 2.76Å; A336-D906 VanDerWaalsContact CB-OD1 3.3Å; A336-D906 WeakPolarHBondContact CB-OD1 3.19Å; A336-D906 PolarHBondContact N-OD1 3.29Å
337L93.9Very high94.7Very high71 Ų7135.2 Ų35.237%0.37218%0.177SC..Hα-helixtrans-62-50.2-179.7179.463.3000111.9L293 K294 V298 H335L293-L337 HydrophobicContact CG-CD2 4.19Å; L293-L337 WeakPolarHBondContact O-CD2 3.46Å; K294-L337 HydrophobicContact CG-CD2 4.38Å; V298-L337 HydrophobicContact CG2-CD1 4.4Å; V298-L337 HydrophobicContact CG2-CD2 4.22Å; V298-L337 HydrophobicContact CG2-CG 3.87Å; H335-L337 VanDerWaalsContact C-N 3.28Å; H335-L337 PolarHBondContact O-N 2.89Å
338T94.6Very high94.7Very high0 Ų034.1 Ų34.10%018%0.178CC..Hα-helixtrans-74.9-32.117846.60000111.5F272 L293 A297 V298 Q301 G332 H335 N341 L342F272-T338 HydrophobicContact CZ-CG2 4.15Å; L293-T338 HydrophobicContact CD1-CG2 3.98Å; A297-T338 HydrophobicContact CB-CG2 3.66Å; V298-T338 HydrophobicContact CG2-CG2 4.3Å; Q301-T338 PolarHBondContact NE2-O 3.07Å; Q301-T338 PolarHBondContact OE1-O 2.83Å; G332-T338 WeakPolarHBondContact CA-OG1 3.48Å; G332-T338 WeakPolarHBondContact O-CB 3.47Å; G332-T338 PolarHBondContact O-OG1 3.09Å; H335-T338 WeakPolarHBondContact CB-OG1 3.49Å; H335-T338 PolarHBondContact O-N 2.81Å; H335-T338 PolarHBondContact O-OG1 3.41Å; T338-N341 PolarHBondContact O-N 2.94Å; T338-L342 WeakPolarHBondContact O-CB 2.9Å; T338-L342 PolarHBondContact O-N 2.82Å
339W95.5Very high94.7Very high7 Ų734.5 Ų34.53%0.02718%0.18CC..Hα-helixtrans-63.4-41.9175.5177.5-118.8000112.1G332 V333 H335 A336 N341 L342 K343 I346 R404 V407G332-W339 PolarHBondContact O-N 3.12Å; V333-W339 HydrophobicContact CG1-CE3 4.45Å; V333-W339 HydrophobicContact CG1-CZ3 4.39Å; H335-W339 WeakPolarHBondContact O-CB 3.33Å; H335-W339 PolarHBondContact O-N 3.45Å; A336-W339 PolarHBondContact O-N 2.96Å; W339-N341 PolarHBondContact O-N 2.94Å; W339-N341 VanDerWaalsContact O-N 3.14Å; W339-L342 HydrophobicContact CE3-CB 4.12Å; W339-L342 HydrophobicContact CE3-CD2 4.07Å; W339-L342 HydrophobicContact CE3-CG 4.31Å; W339-L342 HydrophobicContact CZ3-CD2 4.13Å; W339-L342 HydrophobicContact CZ3-CG 4.3Å; W339-L342 CarbonylContact O-C 3.59Å; W339-L342 PolarHBondContact O-N 3.4Å; W339-K343 HydrophobicContact CD2-CB 4.33Å; W339-K343 HydrophobicContact CZ2-CB 4.11Å; W339-K343 HydrophobicContact CZ2-CG 4.09Å; W339-K343 VanDerWaalsContact O-CB 3.28Å; W339-K343 WeakPolarHBondContact O-CB 3.35Å; W339-K343 PolarHBondContact O-N 2.95Å; W339-I346 HydrophobicContact CH2-CB 4.21Å; W339-I346 HydrophobicContact CH2-CG1 4.14Å; W339-I346 HydrophobicContact CH2-CG2 3.9Å; W339-I346 HydrophobicContact CZ3-CB 4.3Å; W339-I346 HydrophobicContact CZ3-CG1 4.13Å; W339-I346 HydrophobicContact CZ3-CG2 4.47Å; W339-R404 HydrophobicContact CD2-CG 3.83Å; W339-R404 HydrophobicContact CE3-CG 3.96Å; W339-R404 VanDerWaalsContact CG-NE 3.34Å; W339-R404 HydrophobicContact CH2-CB 3.68Å; W339-R404 HydrophobicContact CH2-CG 3.72Å; W339-R404 HydrophobicContact CZ2-CB 3.45Å; W339-R404 VanDerWaalsContact CZ2-CB 3.45Å; W339-R404 HydrophobicContact CZ2-CG 3.58Å; W339-R404 HydrophobicContact CZ3-CB 4.36Å; W339-R404 HydrophobicContact CZ3-CG 3.91Å; W339-V407 HydrophobicContact CH2-CG2 3.8Å; W339-V407 HydrophobicContact CZ2-CG2 4.13Å
340K94Very high94.8Very high158 Ų15834.5 Ų34.569%0.68718%0.18SC*.Hα-helixtrans-55.6-34.7177.1-177.3176.6179.3176.70112.6A336A336-K340 WeakPolarHBondContact O-CB 3.39Å; A336-K340 PolarHBondContact O-N 2.76Å
341N92.5Very high94.8Very high38 Ų3836.5 Ų36.520%0.20319%0.189CC..Hα-helixtrans-83.2-31.7175.4-173.531.1000112.4V298 Q301 T338 W339 P344 H345V298-N341 HydrophobicContact CG1-CB 4.36Å; V298-N341 WeakPolarHBondContact CG1-ND2 3.33Å; Q301-N341 PolarHBondContact OE1-ND2 2.86Å; T338-N341 PolarHBondContact O-N 2.94Å; W339-N341 PolarHBondContact O-N 2.94Å; W339-N341 VanDerWaalsContact O-N 3.14Å; N341-P344 WeakPolarHBondContact O-CD 3.48Å; N341-H345 PolarHBondContact O-CD2 2.94Å
342L94.9Very high94.8Very high0 Ų037.5 Ų37.50%020%0.195CC..Hα-helixtrans-76.7-36.1179.1-169.254.9000113.9L305 I329 V333 T338 W339 P344 H345 I346 I349L305-L342 HydrophobicContact CD2-CD1 4.24Å; I329-L342 HydrophobicContact CG2-CD1 3.87Å; I329-L342 HydrophobicContact CG2-CD2 3.82Å; V333-L342 HydrophobicContact CG2-CD2 3.84Å; T338-L342 WeakPolarHBondContact O-CB 2.9Å; T338-L342 PolarHBondContact O-N 2.82Å; W339-L342 HydrophobicContact CE3-CB 4.12Å; W339-L342 HydrophobicContact CE3-CD2 4.07Å; W339-L342 HydrophobicContact CE3-CG 4.31Å; W339-L342 HydrophobicContact CZ3-CD2 4.13Å; W339-L342 HydrophobicContact CZ3-CG 4.3Å; W339-L342 CarbonylContact O-C 3.59Å; W339-L342 PolarHBondContact O-N 3.4Å; L342-P344 VanDerWaalsContact C-N 3.34Å; L342-H345 WeakPolarHBondContact O-CA 3.37Å; L342-H345 PolarHBondContact O-N 3.31Å; L342-I346 HydrophobicContact CD2-CD1 4.31Å; L342-I346 HydrophobicContact CG-CD1 4.33Å; L342-I346 PolarHBondContact O-N 3.36Å; L342-I349 HydrophobicContact CD1-CD1 3.66Å
343K94.9Very high95Very high96 Ų9637.6 Ų37.642%0.41720%0.196SC..THydrogen-bonded Turntrans-50.3-40.5-172.8-178.6178-176173.10114.3W339 H345 I346W339-K343 HydrophobicContact CD2-CB 4.33Å; W339-K343 HydrophobicContact CZ2-CB 4.11Å; W339-K343 HydrophobicContact CZ2-CG 4.09Å; W339-K343 VanDerWaalsContact O-CB 3.28Å; W339-K343 WeakPolarHBondContact O-CB 3.35Å; W339-K343 PolarHBondContact O-N 2.95Å; K343-H345 PolarHBondContact O-N 3.05Å; K343-I346 WeakPolarHBondContact O-CG2 3.44Å
344P95Very high95.1Very high99 Ų9937.6 Ų37.664%0.64320%0.196SC*.THydrogen-bonded Turntrans-68.1-21.1176-19.833.9000114.2N341 L342N341-P344 WeakPolarHBondContact O-CD 3.48Å; L342-P344 VanDerWaalsContact C-N 3.34Å
345H95.7Very high95.5Very high89 Ų8938 Ų3841%0.41220%0.197SC..THydrogen-bonded Turntrans-104.1-24.4-173.4-58.8-67.9000113.2L305 N341 L342 K343 Q347 G348 I349L305-H345 HydrophobicContact CD2-CB 4.15Å; N341-H345 PolarHBondContact O-CD2 2.94Å; L342-H345 WeakPolarHBondContact O-CA 3.37Å; L342-H345 PolarHBondContact O-N 3.31Å; K343-H345 PolarHBondContact O-N 3.05Å; H345-Q347 VanDerWaalsContact C-N 3.29Å; H345-Q347 PolarHBondContact O-N 3.31Å; H345-Q347 VanDerWaalsContact O-N 3.17Å; H345-G348 WeakPolarHBondContact O-CA 3.31Å; H345-G348 PolarHBondContact O-N 3.45Å; H345-I349 HydrophobicContact CB-CD1 4.17Å; H345-I349 WeakPolarHBondContact O-CG1 3.3Å; H345-I349 PolarHBondContact O-N 3.38Å
346I96.7Very high95.7Very high7 Ų740.3 Ų40.34%0.03621%0.212CC..Hα-helixtrans-54.6-40.8-170.7-165.460.3000113.4W339 L342 K343 G348 I349 I350 A400W339-I346 HydrophobicContact CH2-CB 4.21Å; W339-I346 HydrophobicContact CH2-CG1 4.14Å; W339-I346 HydrophobicContact CH2-CG2 3.9Å; W339-I346 HydrophobicContact CZ3-CB 4.3Å; W339-I346 HydrophobicContact CZ3-CG1 4.13Å; W339-I346 HydrophobicContact CZ3-CG2 4.47Å; L342-I346 HydrophobicContact CD2-CD1 4.31Å; L342-I346 HydrophobicContact CG-CD1 4.33Å; L342-I346 PolarHBondContact O-N 3.36Å; K343-I346 WeakPolarHBondContact O-CG2 3.44Å; I346-G348 VanDerWaalsContact C-N 3.33Å; I346-G348 PolarHBondContact O-N 2.89Å; I346-I349 PolarHBondContact O-N 3.49Å; I346-I350 HydrophobicContact CG1-CD1 4.11Å; I346-I350 VanDerWaalsContact O-CG1 3.31Å; I346-I350 WeakPolarHBondContact O-CG1 3.36Å; I346-I350 PolarHBondContact O-N 3.01Å; I346-A400 HydrophobicContact CD1-CB 4.27Å; I346-A400 HydrophobicContact CG1-CB 4.38Å
347Q96Very high95.9Very high42 Ų4240.7 Ų40.720%0.19621%0.212CC..Hα-helixtrans-63.8-39.8177.9-171.263.233.700112.1H345 I350 Q351H345-Q347 VanDerWaalsContact C-N 3.29Å; H345-Q347 PolarHBondContact O-N 3.31Å; H345-Q347 VanDerWaalsContact O-N 3.17Å; Q347-I350 PolarHBondContact O-N 3.24Å; Q347-Q351 WeakPolarHBondContact O-CG 3.19Å; Q347-Q351 PolarHBondContact O-N 3.36Å
348G96.3Very high95.9Very high29 Ų2937.5 Ų37.530%0.29920%0.195SC..Hα-helixtrans-69.4-36.9175.700000111.9H345 I346 I350 Q351 D352H345-G348 WeakPolarHBondContact O-CA 3.31Å; H345-G348 PolarHBondContact O-N 3.45Å; I346-G348 VanDerWaalsContact C-N 3.33Å; I346-G348 PolarHBondContact O-N 2.89Å; G348-I350 VanDerWaalsContact C-N 3.35Å; G348-Q351 PolarHBondContact O-N 3.06Å; G348-D352 WeakPolarHBondContact O-CA 3.08Å; G348-D352 WeakPolarHBondContact O-CB 3.49Å; G348-D352 PolarHBondContact O-N 3.44Å
349I97.8Very high96Very high10 Ų1038.3 Ų38.35%0.05120%0.201CC..Hα-helixtrans-62.6-44.5173.9-63.9168.4000110.2L305 L308 L342 H345 I346 Q351 V353 I354 L396L305-I349 HydrophobicContact CD2-CD1 3.76Å; L308-I349 HydrophobicContact CD1-CD1 4.04Å; L308-I349 HydrophobicContact CD1-CG1 4.12Å; L308-I349 HydrophobicContact CD1-CG2 4.18Å; L342-I349 HydrophobicContact CD1-CD1 3.66Å; H345-I349 HydrophobicContact CB-CD1 4.17Å; H345-I349 WeakPolarHBondContact O-CG1 3.3Å; H345-I349 PolarHBondContact O-N 3.38Å; I346-I349 PolarHBondContact O-N 3.49Å; I349-Q351 PolarHBondContact O-N 2.99Å; I349-V353 HydrophobicContact CG2-CB 4.36Å; I349-V353 WeakPolarHBondContact O-CA 3.25Å; I349-V353 VanDerWaalsContact O-CB 3.28Å; I349-V353 WeakPolarHBondContact O-CB 3.21Å; I349-V353 PolarHBondContact O-N 3.46Å; I349-I354 HydrophobicContact CG2-CD1 4.27Å; I349-I354 HydrophobicContact CG2-CG1 4.27Å; I349-I354 PolarHBondContact O-N 3.34Å; I349-L396 HydrophobicContact CG2-CD2 4.29Å
350I97.9Very high96Very high0 Ų038.4 Ų38.40%020%0.201CC..Iπ-helixtrans-59.7-48.2177.3-70.4166.1000110.8I346 Q347 G348 I354 F355 L397 V407 T411 M435I346-I350 HydrophobicContact CG1-CD1 4.11Å; I346-I350 VanDerWaalsContact O-CG1 3.31Å; I346-I350 WeakPolarHBondContact O-CG1 3.36Å; I346-I350 PolarHBondContact O-N 3.01Å; Q347-I350 PolarHBondContact O-N 3.24Å; G348-I350 VanDerWaalsContact C-N 3.35Å; I350-I354 HydrophobicContact CG1-CD1 4.01Å; I350-F355 VanDerWaalsContact O-CB 3.26Å; I350-F355 WeakPolarHBondContact O-CB 3.37Å; I350-F355 PolarHBondContact O-N 3.04Å; I350-L397 HydrophobicContact CD1-CD1 4.38Å; I350-L397 HydrophobicContact CG1-CD1 4.19Å; I350-L397 HydrophobicContact CG2-CD1 4.14Å; I350-V407 HydrophobicContact CD1-CG1 3.67Å; I350-T411 HydrophobicContact CG2-CG2 4.43Å; I350-M435 HydrophobicContact CG2-CE 3.56Å
351Q97.1Very high95.9Very high65 Ų6533.5 Ų33.530%0.30418%0.184SC..Iπ-helixtrans-78.5-37.4-173.8-69.4178.4-14.700114.3Q347 G348 I349 P356 F414Q347-Q351 WeakPolarHBondContact O-CG 3.19Å; Q347-Q351 PolarHBondContact O-N 3.36Å; G348-Q351 PolarHBondContact O-N 3.06Å; I349-Q351 PolarHBondContact O-N 2.99Å; Q351-P356 WeakPolarHBondContact O-CD 3.48Å; Q351-F414 HydrophobicContact CB-CE2 4.34Å; Q351-F414 HydrophobicContact CB-CZ 4.22Å; Q351-F414 HydrophobicContact CG-CD1 4.21Å; Q351-F414 HydrophobicContact CG-CD2 3.87Å; Q351-F414 HydrophobicContact CG-CE1 4.15Å; Q351-F414 HydrophobicContact CG-CE2 3.79Å; Q351-F414 HydrophobicContact CG-CG 4.05Å; Q351-F414 HydrophobicContact CG-CZ 3.92Å
352D96.2Very high95.9Very high57 Ų5737 Ų3731%0.30520%0.204SC..Iπ-helixtrans-105.6-9.9-169.4-58.1-47000113.5K312 G348K312-D352 HydrophobicContact CB-CB 4.41Å; K312-D352 HydrophobicContact CD-CB 3.72Å; K312-D352 WeakPolarHBondContact CE-OD2 3.36Å; K312-D352 HydrophobicContact CG-CB 3.96Å; K312-D352 IonicContact NZ-OD2 2.61Å; K312-D352 PolarHBondContact NZ-OD2 2.93Å; G348-D352 WeakPolarHBondContact O-CA 3.08Å; G348-D352 WeakPolarHBondContact O-CB 3.49Å; G348-D352 PolarHBondContact O-N 3.44Å
353V97.4Very high95.6Very high4 Ų440.2 Ų40.22%0.02423%0.23CC..Iπ-helixtrans-125.4-61179.8-176.10000111.4L308 Y311 L322 L326 I349 P356 L357L308-V353 HydrophobicContact CB-CG2 4.3Å; L308-V353 HydrophobicContact CD2-CG1 4.18Å; Y311-V353 HydrophobicContact CD1-CB 4.43Å; Y311-V353 HydrophobicContact CD1-CG1 3.91Å; Y311-V353 HydrophobicContact CD1-CG2 4.3Å; Y311-V353 HydrophobicContact CE1-CG1 4.09Å; L322-V353 HydrophobicContact CD1-CG1 4.43Å; L326-V353 HydrophobicContact CD2-CG1 4.29Å; I349-V353 HydrophobicContact CG2-CB 4.36Å; I349-V353 WeakPolarHBondContact O-CA 3.25Å; I349-V353 VanDerWaalsContact O-CB 3.28Å; I349-V353 WeakPolarHBondContact O-CB 3.21Å; I349-V353 PolarHBondContact O-N 3.46Å; V353-P356 WeakPolarHBondContact O-CD 3.29Å; V353-L357 HydrophobicContact CG1-CD1 4.15Å; V353-L357 VanDerWaalsContact O-CG 3.3Å; V353-L357 WeakPolarHBondContact O-CG 3.21Å; V353-L357 PolarHBondContact O-N 3.39Å
354I98Very high95.4Very high0 Ų036.9 Ų36.90%022%0.216CC..Iπ-helixtrans-64.2-51.8-176.3-64.5177.2000110.3I349 I350 L357 M358 A393 L396 L397I349-I354 HydrophobicContact CG2-CD1 4.27Å; I349-I354 HydrophobicContact CG2-CG1 4.27Å; I349-I354 PolarHBondContact O-N 3.34Å; I350-I354 HydrophobicContact CG1-CD1 4.01Å; I354-L357 WeakPolarHBondContact O-CB 3.22Å; I354-L357 PolarHBondContact O-N 2.86Å; I354-L357 VanDerWaalsContact O-N 3.11Å; I354-M358 HydrophobicContact CG2-CG 4.36Å; I354-M358 HydrophobicContact CG2-SD 3.73Å; I354-M358 WeakPolarHBondContact O-CG 3.23Å; I354-M358 PolarHBondContact O-N 2.9Å; I354-A393 HydrophobicContact CB-CB 4.34Å; I354-A393 HydrophobicContact CG1-CB 4.18Å; I354-A393 HydrophobicContact CG2-CB 4.1Å; I354-L396 HydrophobicContact CD1-CB 4.35Å; I354-L396 HydrophobicContact CD1-CD2 3.87Å; I354-L396 HydrophobicContact CD1-CG 3.9Å; I354-L396 HydrophobicContact CG1-CD2 4.49Å; I354-L397 HydrophobicContact CD1-CB 4.38Å; I354-L397 HydrophobicContact CG2-CB 4.1Å; I354-L397 HydrophobicContact CG2-CD1 4.45Å; I354-L397 HydrophobicContact CG2-CD2 4.36Å
355F97.8Very high95.4Very high14 Ų1434.8 Ų34.86%0.06120%0.198CC..Hα-helixtrans-58.7-47.5-177.8171.4-105.1000113I350 L357 M358 C359 F414 I418 K428 A432 M435I350-F355 VanDerWaalsContact O-CB 3.26Å; I350-F355 WeakPolarHBondContact O-CB 3.37Å; I350-F355 PolarHBondContact O-N 3.04Å; F355-L357 VanDerWaalsContact C-N 3.33Å; F355-L357 PolarHBondContact O-N 2.92Å; F355-M358 CarbonylContact O-C 3.5Å; F355-M358 PolarHBondContact O-N 3.47Å; F355-M358 VanDerWaalsContact O-N 3.11Å; F355-C359 VanDerWaalsContact CZ-SG 3.53Å; F355-C359 PolarHBondContact O-N 3.11Å; F355-C359 VanDerWaalsContact O-N 3.08Å; F355-C359 PolarHBondContact O-SG 3.4Å; F355-F414 HydrophobicContact CB-CE1 3.99Å; F355-F414 HydrophobicContact CB-CZ 4.4Å; F355-F414 HydrophobicContact CD1-CE1 4.11Å; F355-F414 AromaticContact CD1-CZ 3.86Å; F355-F414 HydrophobicContact CD1-CZ 3.86Å; F355-F414 AromaticContact CD2-CE1 3.85Å; F355-F414 HydrophobicContact CD2-CE1 3.85Å; F355-F414 HydrophobicContact CD2-CZ 4.37Å; F355-F414 HydrophobicContact CE1-CZ 4.21Å; F355-F414 HydrophobicContact CE2-CE1 4.33Å; F355-F414 AromaticContact CG-CE1 3.7Å; F355-F414 HydrophobicContact CG-CE1 3.7Å; F355-F414 AromaticContact CG-CZ 3.95Å; F355-F414 HydrophobicContact CG-CZ 3.95Å; F355-I418 HydrophobicContact CD2-CD1 4.49Å; F355-I418 HydrophobicContact CE1-CD1 4.05Å; F355-I418 HydrophobicContact CE2-CD1 3.71Å; F355-I418 HydrophobicContact CZ-CD1 3.46Å; F355-I418 VanDerWaalsContact CZ-CD1 3.46Å; F355-K428 HydrophobicContact CE1-CB 4.49Å; F355-K428 HydrophobicContact CE1-CG 4.23Å; F355-K428 HydrophobicContact CZ-CB 3.87Å; F355-K428 HydrophobicContact CZ-CG 4.09Å; F355-K428 WeakPolarHBondContact CZ-O 3.24Å; F355-A432 HydrophobicContact CE2-CB 4.28Å; F355-M435 HydrophobicContact CB-SD 3.88Å; F355-M435 HydrophobicContact CD2-SD 3.57Å; F355-M435 VanDerWaalsContact CD2-SD 3.57Å; F355-M435 HydrophobicContact CG-SD 4.2Å
356P95.7Very high95.3Very high48 Ų4836.2 Ų36.231%0.31221%0.205SC..Hα-helixtrans-57.9-38.7172.5-28.936.8000114.7Q351 V353 M358 C359Q351-P356 WeakPolarHBondContact O-CD 3.48Å; V353-P356 WeakPolarHBondContact O-CD 3.29Å; P356-M358 PolarHBondContact O-N 2.9Å; P356-C359 PolarHBondContact O-N 3.08Å
357L95.4Very high95Very high21 Ų2137.8 Ų37.811%0.1121%0.213CC..Hα-helixtrans-66.1-27.6175.8-73.2170.5000112.9Y311 L322 L326 V353 I354 F355 P389 T390 A393Y311-L357 HydrophobicContact CE1-CG 4.4Å; Y311-L357 VanDerWaalsContact OH-CD2 3.27Å; Y311-L357 WeakPolarHBondContact OH-CD2 3.45Å; L322-L357 HydrophobicContact CD2-CD1 3.96Å; L322-L357 HydrophobicContact CD2-CD2 3.82Å; L322-L357 HydrophobicContact CD2-CG 4.39Å; L322-L357 HydrophobicContact CG-CD1 4.4Å; L326-L357 HydrophobicContact CD1-CD1 3.8Å; V353-L357 HydrophobicContact CG1-CD1 4.15Å; V353-L357 VanDerWaalsContact O-CG 3.3Å; V353-L357 WeakPolarHBondContact O-CG 3.21Å; V353-L357 PolarHBondContact O-N 3.39Å; I354-L357 WeakPolarHBondContact O-CB 3.22Å; I354-L357 PolarHBondContact O-N 2.86Å; I354-L357 VanDerWaalsContact O-N 3.11Å; F355-L357 VanDerWaalsContact C-N 3.33Å; F355-L357 PolarHBondContact O-N 2.92Å; L357-P389 HydrophobicContact CD1-CB 4.39Å; L357-P389 HydrophobicContact CD2-CB 4.1Å; L357-T390 PolarHBondContact O-OG1 3.02Å; L357-A393 HydrophobicContact CB-CB 4.27Å; L357-A393 HydrophobicContact CD1-CB 3.89Å
358M95.3Very high94.9Very high3 Ų336.4 Ų36.42%0.01521%0.206CC..Hα-helixtrans-90.3-7.7178.3-65.6-174.273.100113.4I354 F355 P356 T390 Q394 L397 G431 H434 M435 S438I354-M358 HydrophobicContact CG2-CG 4.36Å; I354-M358 HydrophobicContact CG2-SD 3.73Å; I354-M358 WeakPolarHBondContact O-CG 3.23Å; I354-M358 PolarHBondContact O-N 2.9Å; F355-M358 CarbonylContact O-C 3.5Å; F355-M358 PolarHBondContact O-N 3.47Å; F355-M358 VanDerWaalsContact O-N 3.11Å; P356-M358 PolarHBondContact O-N 2.9Å; M358-T390 HydrophobicContact CG-CG2 4.45Å; M358-Q394 HydrophobicContact CE-CG 3.66Å; M358-Q394 HydrophobicContact SD-CG 4.19Å; M358-L397 HydrophobicContact CE-CD2 4.48Å; M358-L397 HydrophobicContact SD-CD2 3.94Å; M358-G431 WeakPolarHBondContact O-CA 3.32Å; M358-H434 HydrophobicContact CB-CB 4.37Å; M358-H434 VanDerWaalsContact CE-C 3.48Å; M358-H434 HydrophobicContact CE-CB 4.03Å; M358-H434 VanDerWaalsContact CE-CD2 3.41Å; M358-H434 WeakPolarHBondContact CE-CD2 3.31Å; M358-H434 PolarHBondContact O-ND1 2.95Å; M358-M435 HydrophobicContact CB-CG 4.5Å; M358-M435 HydrophobicContact CE-CB 4.38Å; M358-M435 HydrophobicContact CE-CG 3.98Å; M358-M435 HydrophobicContact SD-CB 4.49Å; M358-M435 HydrophobicContact SD-CG 3.56Å; M358-M435 VanDerWaalsContact SD-CG 3.56Å; M358-S438 WeakPolarHBondContact CE-OG 3.36Å
359C96.1Very high94.8Very high17 Ų1740.8 Ų40.812%0.11522%0.219CC..SBendtrans-83144.2175.1-67.20000110.8F355 P356 T361F355-C359 VanDerWaalsContact CZ-SG 3.53Å; F355-C359 PolarHBondContact O-N 3.11Å; F355-C359 VanDerWaalsContact O-N 3.08Å; F355-C359 PolarHBondContact O-SG 3.4Å; P356-C359 PolarHBondContact O-N 3.08Å; C359-T361 WeakPolarHBondContact O-CG2 3.37Å; C359-T361 PolarHBondContact O-N 3.42Å
360Y94.4Very high94.7Very high10 Ų1047.7 Ų47.74%0.03925%0.251CS..  trans-52125.9166.7-163.9-97.4000112.7D364 E365 W368 Y375 R427 D430 Y471Y360-D364 HydrophobicContact CD1-CB 4.32Å; Y360-D364 HydrophobicContact CD2-CB 3.73Å; Y360-D364 HydrophobicContact CE1-CB 4.14Å; Y360-D364 HydrophobicContact CE2-CB 3.5Å; Y360-D364 HydrophobicContact CG-CB 4.14Å; Y360-D364 PolarHBondContact OH-O 3.3Å; Y360-D364 VanDerWaalsContact OH-O 3.09Å; Y360-E365 HydrophobicContact CE1-CB 3.81Å; Y360-E365 WeakPolarHBondContact CE1-OE2 3.12Å; Y360-E365 WeakPolarHBondContact OH-CA 3.44Å; Y360-E365 PolarHBondContact OH-N 2.93Å; Y360-W368 HydrophobicContact CE2-CE3 4.4Å; Y360-W368 WeakPolarHBondContact OH-CB 3.15Å; Y360-Y375 HydrophobicContact CE2-CE2 4.29Å; Y360-R427 HydrophobicContact CD1-CG 4.49Å; Y360-R427 WeakPolarHBondContact O-CD 3.46Å; Y360-D430 WeakPolarHBondContact CB-OD2 3.42Å; Y360-D430 PolarHBondContact N-OD2 3.12Å; Y360-Y471 HydrophobicContact CD1-CD1 4.09Å; Y360-Y471 HydrophobicContact CD1-CD2 4.19Å; Y360-Y471 HydrophobicContact CD1-CE1 4.16Å; Y360-Y471 HydrophobicContact CD1-CE2 4.27Å; Y360-Y471 HydrophobicContact CD1-CG 4.1Å; Y360-Y471 AromaticContact CD2-CD2 3.96Å; Y360-Y471 HydrophobicContact CD2-CD2 3.96Å; Y360-Y471 AromaticContact CD2-CG 3.87Å; Y360-Y471 HydrophobicContact CD2-CG 3.87Å; Y360-Y471 AromaticContact CE1-CD1 3.78Å; Y360-Y471 HydrophobicContact CE1-CD1 3.78Å; Y360-Y471 HydrophobicContact CE1-CE1 4.1Å; Y360-Y471 HydrophobicContact CE1-CG 4.04Å; Y360-Y471 VanDerWaalsContact CE2-CB 3.43Å; Y360-Y471 HydrophobicContact CE2-CD1 4.31Å; Y360-Y471 HydrophobicContact CE2-CD2 4.41Å; Y360-Y471 AromaticContact CE2-CG 3.84Å; Y360-Y471 HydrophobicContact CE2-CG 3.84Å; Y360-Y471 HydrophobicContact CG-CD1 4.44Å; Y360-Y471 AromaticContact CG-CD2 3.83Å; Y360-Y471 HydrophobicContact CG-CD2 3.83Å; Y360-Y471 HydrophobicContact CG-CE2 4.16Å; Y360-Y471 AromaticContact CG-CG 3.98Å; Y360-Y471 HydrophobicContact CG-CG 3.98Å; Y360-Y471 AromaticContact CZ-CD1 3.9Å; Y360-Y471 AromaticContact CZ-CG 3.91Å
361T92.5Very high94.5Very high54 Ų5451.2 Ų51.233%0.33127%0.27SS..  trans-103.1175.8-172.869.20000113.1C359 A363 D364 E365C359-T361 WeakPolarHBondContact O-CG2 3.37Å; C359-T361 PolarHBondContact O-N 3.42Å; T361-A363 VanDerWaalsContact C-N 3.33Å; T361-A363 PolarHBondContact OG1-N 2.83Å; T361-D364 WeakPolarHBondContact CB-OD2 3.37Å; T361-D364 PolarHBondContact N-OD2 3.21Å; T361-D364 PolarHBondContact OG1-N 3.03Å; T361-D364 VanDerWaalsContact OG1-N 3.13Å; T361-D364 PolarHBondContact OG1-OD2 2.91Å; T361-E365 PolarHBondContact O-N 3.18Å; T361-E365 VanDerWaalsContact O-N 3.15Å
362D92Very high94.2Very high113 Ų11349.7 Ų49.760%0.60427%0.266SS*.Hα-helixtrans-69.6-32.4172.1-68.8-38.5000112E365 E366 R427D362-E365 PolarHBondContact O-N 3.45Å; D362-E366 PolarHBondContact O-N 3.25Å; D362-R427 IonicContact OD1-CZ 3.57Å; D362-R427 IonicContact OD1-NH1 3.33Å; D362-R427 PolarHBondContact OD1-NH1 3.25Å; D362-R427 IonicContact OD1-NH2 3.96Å; D362-R427 PolarHBondContact OD1-NH2 3.46Å; D362-R427 IonicContact OD2-NH1 3.48Å
363A88.5Confident93.9Very high66 Ų6651.6 Ų51.655%0.54527%0.269SS..Hα-helixtrans-67.4-39173.800000111.4T361 E365 E366 L367T361-A363 VanDerWaalsContact C-N 3.33Å; T361-A363 PolarHBondContact OG1-N 2.83Å; A363-E365 VanDerWaalsContact C-N 3.31Å; A363-E365 PolarHBondContact O-N 2.81Å; A363-E366 PolarHBondContact O-N 3.15Å; A363-L367 WeakPolarHBondContact O-CB 3.32Å; A363-L367 PolarHBondContact O-N 2.74Å
364D92.3Very high93.4Very high26 Ų2654.7 Ų54.714%0.13928%0.283CS..Hα-helixtrans-62.9-38.1172.5-64.2-72.1000111.5Y360 T361 W368 Y375 K379Y360-D364 HydrophobicContact CD1-CB 4.32Å; Y360-D364 HydrophobicContact CD2-CB 3.73Å; Y360-D364 HydrophobicContact CE1-CB 4.14Å; Y360-D364 HydrophobicContact CE2-CB 3.5Å; Y360-D364 HydrophobicContact CG-CB 4.14Å; Y360-D364 PolarHBondContact OH-O 3.3Å; Y360-D364 VanDerWaalsContact OH-O 3.09Å; T361-D364 WeakPolarHBondContact CB-OD2 3.37Å; T361-D364 PolarHBondContact N-OD2 3.21Å; T361-D364 PolarHBondContact OG1-N 3.03Å; T361-D364 VanDerWaalsContact OG1-N 3.13Å; T361-D364 PolarHBondContact OG1-OD2 2.91Å; D364-W368 WeakPolarHBondContact O-CB 3.45Å; D364-W368 PolarHBondContact O-N 3.18Å; D364-Y375 HydrophobicContact CB-CE2 4.12Å; D364-K379 IonicContact OD1-NZ 2.76Å; D364-K379 PolarHBondContact OD1-NZ 3.09Å
365E94.6Very high93Very high55 Ų5555.9 Ų55.926%0.25729%0.288SS..Hα-helixtrans-67-44.3176.7-175.573.5-140.600111.9Y360 T361 D362 A363 W368 Q369Y360-E365 HydrophobicContact CE1-CB 3.81Å; Y360-E365 WeakPolarHBondContact CE1-OE2 3.12Å; Y360-E365 WeakPolarHBondContact OH-CA 3.44Å; Y360-E365 PolarHBondContact OH-N 2.93Å; T361-E365 PolarHBondContact O-N 3.18Å; T361-E365 VanDerWaalsContact O-N 3.15Å; D362-E365 PolarHBondContact O-N 3.45Å; A363-E365 VanDerWaalsContact C-N 3.31Å; A363-E365 PolarHBondContact O-N 2.81Å; E365-W368 PolarHBondContact O-N 3.45Å; E365-Q369 HydrophobicContact CG-CG 4.36Å; E365-Q369 WeakPolarHBondContact O-CB 3.19Å; E365-Q369 VanDerWaalsContact O-CG 3.26Å; E365-Q369 WeakPolarHBondContact O-CG 3.31Å; E365-Q369 PolarHBondContact O-N 3.09Å; E365-Q369 WeakPolarHBondContact OE1-CG 3.21Å; E365-Q369 PolarHBondContact OE1-NE2 3.02Å
366E93.2Very high92.6Very high120 Ų12055.4 Ų55.456%0.56129%0.286SS*.Hα-helixtrans-57.8-51.6177.1-175.9169-168.200110.5D362 A363 W368 Q369 E370D362-E366 PolarHBondContact O-N 3.25Å; A363-E366 PolarHBondContact O-N 3.15Å; E366-W368 PolarHBondContact O-N 3.24Å; E366-Q369 PolarHBondContact O-N 3.2Å; E366-E370 WeakPolarHBondContact O-CB 3.11Å; E366-E370 WeakPolarHBondContact O-CG 3.26Å; E366-E370 PolarHBondContact O-N 3.21Å
367L91.5Very high92.1Very high40 Ų4058.1 Ų58.121%0.20929%0.29CS..Hα-helixtrans-63-44.5178.5-163.163.9000111.9A363 Q369 D371 E374 Y375 M378A363-L367 WeakPolarHBondContact O-CB 3.32Å; A363-L367 PolarHBondContact O-N 2.74Å; L367-Q369 VanDerWaalsContact C-N 3.28Å; L367-Q369 PolarHBondContact O-N 2.81Å; L367-D371 HydrophobicContact CD1-CB 4.43Å; L367-D371 CarbonylContact O-C 3.6Å; L367-D371 WeakPolarHBondContact O-CA 3.41Å; L367-D371 PolarHBondContact O-N 3.48Å; L367-E374 HydrophobicContact CD1-CB 3.84Å; L367-E374 HydrophobicContact CD1-CG 3.77Å; L367-Y375 HydrophobicContact CB-CD2 4.32Å; L367-Y375 VanDerWaalsContact CD2-CA 3.45Å; L367-Y375 HydrophobicContact CD2-CD2 4.15Å; L367-Y375 HydrophobicContact CG-CD2 4.4Å; L367-M378 HydrophobicContact CD2-CG 4.3Å; L367-M378 HydrophobicContact CD2-SD 3.45Å; L367-M378 WeakPolarHBondContact CD2-SD 3.29Å
368W94Very high91.4Very high12 Ų1261.2 Ų61.25%0.04531%0.305CS..Hα-helixtrans-60-35.3178.4-175.2-76.3000113.6Y360 D364 E365 E366 Y375 G470 A474 E510 P512 V513Y360-W368 HydrophobicContact CE2-CE3 4.4Å; Y360-W368 WeakPolarHBondContact OH-CB 3.15Å; D364-W368 WeakPolarHBondContact O-CB 3.45Å; D364-W368 PolarHBondContact O-N 3.18Å; E365-W368 PolarHBondContact O-N 3.45Å; E366-W368 PolarHBondContact O-N 3.24Å; W368-Y375 HydrophobicContact CB-CD2 4.42Å; W368-Y375 AromaticContact CE3-CD1 3.79Å; W368-Y375 HydrophobicContact CE3-CD1 3.79Å; W368-Y375 HydrophobicContact CE3-CD2 4.2Å; W368-Y375 AromaticContact CE3-CE1 3.55Å; W368-Y375 HydrophobicContact CE3-CE1 3.55Å; W368-Y375 AromaticContact CE3-CE2 3.98Å; W368-Y375 HydrophobicContact CE3-CE2 3.98Å; W368-Y375 HydrophobicContact CE3-CG 4.11Å; W368-Y375 AromaticContact CE3-CZ 3.64Å; W368-Y375 HydrophobicContact CZ3-CD1 4.05Å; W368-Y375 AromaticContact CZ3-CE1 3.54Å; W368-Y375 HydrophobicContact CZ3-CE1 3.54Å; W368-Y375 AromaticContact CZ3-CZ 3.88Å; W368-G470 VanDerWaalsContact CZ2-C 3.45Å; W368-A474 HydrophobicContact CH2-CB 3.82Å; W368-A474 HydrophobicContact CZ3-CB 4.3Å; W368-E510 HydrophobicContact CZ2-CB 4.21Å; W368-E510 WeakPolarHBondContact CZ2-OE2 3.39Å; W368-E510 PolarHBondContact NE1-OE2 2.94Å; W368-P512 HydrophobicContact CD2-CG 4.37Å; W368-P512 HydrophobicContact CE3-CB 4.11Å; W368-P512 HydrophobicContact CE3-CG 4.06Å; W368-P512 HydrophobicContact CH2-CB 3.55Å; W368-P512 HydrophobicContact CH2-CG 4.01Å; W368-P512 HydrophobicContact CZ2-CB 4.26Å; W368-P512 HydrophobicContact CZ2-CG 4.28Å; W368-P512 HydrophobicContact CZ3-CB 3.46Å; W368-P512 VanDerWaalsContact CZ3-CB 3.46Å; W368-P512 HydrophobicContact CZ3-CG 3.9Å; W368-V513 HydrophobicContact CH2-CG2 3.93Å; W368-V513 HydrophobicContact CZ2-CG2 3.92Å
369Q94.1Very high90.8Very high121 Ų12165.7 Ų65.757%0.56533%0.325SS*.Hα-helixtrans-87.4-40-178.7-64-61-3000113E365 E366 L367E365-Q369 HydrophobicContact CG-CG 4.36Å; E365-Q369 WeakPolarHBondContact O-CB 3.19Å; E365-Q369 VanDerWaalsContact O-CG 3.26Å; E365-Q369 WeakPolarHBondContact O-CG 3.31Å; E365-Q369 PolarHBondContact O-N 3.09Å; E365-Q369 WeakPolarHBondContact OE1-CG 3.21Å; E365-Q369 PolarHBondContact OE1-NE2 3.02Å; E366-Q369 PolarHBondContact O-N 3.2Å; L367-Q369 VanDerWaalsContact C-N 3.28Å; L367-Q369 PolarHBondContact O-N 2.81Å
370E94.2Very high89.8Confident156 Ų15667 Ų6773%0.72933%0.328SS*.Hα-helixtrans-87-42.9-174.1-61.7-161.1168.300112.4E366E366-E370 WeakPolarHBondContact O-CB 3.11Å; E366-E370 WeakPolarHBondContact O-CG 3.26Å; E366-E370 PolarHBondContact O-N 3.21Å
371D93.7Very high88.9Confident73 Ų7368.6 Ų68.639%0.3934%0.338SS..  trans-143.979.5-179.8-162.2-22.9000112L367 Y373 E374 Y375L367-D371 HydrophobicContact CD1-CB 4.43Å; L367-D371 CarbonylContact O-C 3.6Å; L367-D371 WeakPolarHBondContact O-CA 3.41Å; L367-D371 PolarHBondContact O-N 3.48Å; D371-Y373 PolarHBondContact O-N 2.94Å; D371-Y373 VanDerWaalsContact O-N 3.13Å; D371-Y373 PolarHBondContact OD1-N 2.91Å; D371-E374 HydrophobicContact CB-CB 4Å; D371-E374 PolarHBondContact O-N 3.18Å; D371-E374 PolarHBondContact OD1-N 3.19Å; D371-Y375 PolarHBondContact O-N 2.95Å
372P92.2Very high87.6Confident34 Ų3470.6 Ų70.622%0.22135%0.35CS..Hα-helixtrans-64-17.1-18025.6-34.9000113.5I376 P512P372-I376 WeakPolarHBondContact O-CD1 3.31Å; P372-I376 VanDerWaalsContact O-CG1 3.3Å; P372-I376 WeakPolarHBondContact O-CG1 3.45Å; P372-I376 PolarHBondContact O-N 2.88Å; P372-P512 HydrophobicContact CB-CG 3.95Å
373Y89.5Confident86.5Confident96 Ų9672.6 Ų72.638%0.37635%0.353SS..Hα-helixtrans-78.7-42.5177.3-64.1-84.6000110.4D371 Y375 I376 R377 M511 E552 T553D371-Y373 PolarHBondContact O-N 2.94Å; D371-Y373 VanDerWaalsContact O-N 3.13Å; D371-Y373 PolarHBondContact OD1-N 2.91Å; Y373-Y375 VanDerWaalsContact C-N 3.26Å; Y373-Y375 PolarHBondContact O-N 3.32Å; Y373-I376 WeakPolarHBondContact O-CB 3.41Å; Y373-I376 PolarHBondContact O-N 2.79Å; Y373-I376 VanDerWaalsContact O-N 3.11Å; Y373-R377 PolarHBondContact O-N 3.41Å; Y373-M511 HydrophobicContact CE1-CG 4.25Å; Y373-E552 WeakPolarHBondContact CD1-O 3.42Å; Y373-E552 HydrophobicContact CE1-CB 4.05Å; Y373-E552 WeakPolarHBondContact CE1-O 3.24Å; Y373-T553 HydrophobicContact CD1-CG2 4.13Å; Y373-T553 HydrophobicContact CE1-CG2 4.11Å
374E86.5Confident85.8Confident69 Ų6972.8 Ų72.832%0.32234%0.342SS..Hα-helixtrans-63.8-34170.6-17265.4-176.400111.4L367 D371 I376 R377 M378L367-E374 HydrophobicContact CD1-CB 3.84Å; L367-E374 HydrophobicContact CD1-CG 3.77Å; D371-E374 HydrophobicContact CB-CB 4Å; D371-E374 PolarHBondContact O-N 3.18Å; D371-E374 PolarHBondContact OD1-N 3.19Å; E374-I376 VanDerWaalsContact C-N 3.34Å; E374-I376 PolarHBondContact O-N 3.01Å; E374-R377 PolarHBondContact O-N 3.15Å; E374-R377 IonicContact OE2-NH1 2.73Å; E374-M378 HydrophobicContact CG-CG 4.41Å; E374-M378 WeakPolarHBondContact O-CB 3.31Å; E374-M378 WeakPolarHBondContact O-CG 3.44Å; E374-M378 PolarHBondContact O-N 2.76Å
375Y90.2Very high85Confident25 Ų2575.3 Ų75.310%0.09836%0.356CS..Hα-helixtrans-57.7-45.4170.2-176.8-86.5000112.4Y360 D364 L367 W368 D371 Y373 K379 P512Y360-Y375 HydrophobicContact CE2-CE2 4.29Å; D364-Y375 HydrophobicContact CB-CE2 4.12Å; L367-Y375 HydrophobicContact CB-CD2 4.32Å; L367-Y375 VanDerWaalsContact CD2-CA 3.45Å; L367-Y375 HydrophobicContact CD2-CD2 4.15Å; L367-Y375 HydrophobicContact CG-CD2 4.4Å; W368-Y375 HydrophobicContact CB-CD2 4.42Å; W368-Y375 AromaticContact CE3-CD1 3.79Å; W368-Y375 HydrophobicContact CE3-CD1 3.79Å; W368-Y375 HydrophobicContact CE3-CD2 4.2Å; W368-Y375 AromaticContact CE3-CE1 3.55Å; W368-Y375 HydrophobicContact CE3-CE1 3.55Å; W368-Y375 AromaticContact CE3-CE2 3.98Å; W368-Y375 HydrophobicContact CE3-CE2 3.98Å; W368-Y375 HydrophobicContact CE3-CG 4.11Å; W368-Y375 AromaticContact CE3-CZ 3.64Å; W368-Y375 HydrophobicContact CZ3-CD1 4.05Å; W368-Y375 AromaticContact CZ3-CE1 3.54Å; W368-Y375 HydrophobicContact CZ3-CE1 3.54Å; W368-Y375 AromaticContact CZ3-CZ 3.88Å; D371-Y375 PolarHBondContact O-N 2.95Å; Y373-Y375 VanDerWaalsContact C-N 3.26Å; Y373-Y375 PolarHBondContact O-N 3.32Å; Y375-K379 HydrophobicContact CD1-CG 4.15Å; Y375-K379 HydrophobicContact CE1-CG 3.73Å; Y375-K379 HydrophobicContact CE2-CG 4.43Å; Y375-K379 VanDerWaalsContact CZ-CE 3.4Å; Y375-K379 VanDerWaalsContact O-CG 3.27Å; Y375-K379 WeakPolarHBondContact O-CG 3.12Å; Y375-K379 PolarHBondContact O-N 3.35Å; Y375-K379 VanDerWaalsContact OH-CE 3.28Å; Y375-K379 WeakPolarHBondContact OH-CE 3.41Å; Y375-P512 HydrophobicContact CD1-CB 3.99Å; Y375-P512 HydrophobicContact CD1-CG 4.11Å; Y375-P512 HydrophobicContact CE1-CB 4.26Å
376I88.8Confident83.9Confident4 Ų479.5 Ų79.52%0.02137%0.374CS..Hα-helixtrans-63-51.9177.6-68158.6000108.8P372 Y373 E374 M378 K379 F380 M511 P512 V515 T553P372-I376 WeakPolarHBondContact O-CD1 3.31Å; P372-I376 VanDerWaalsContact O-CG1 3.3Å; P372-I376 WeakPolarHBondContact O-CG1 3.45Å; P372-I376 PolarHBondContact O-N 2.88Å; Y373-I376 WeakPolarHBondContact O-CB 3.41Å; Y373-I376 PolarHBondContact O-N 2.79Å; Y373-I376 VanDerWaalsContact O-N 3.11Å; E374-I376 VanDerWaalsContact C-N 3.34Å; E374-I376 PolarHBondContact O-N 3.01Å; I376-M378 PolarHBondContact O-N 3.15Å; I376-K379 PolarHBondContact O-N 3.46Å; I376-F380 HydrophobicContact CG2-CD2 3.81Å; I376-F380 HydrophobicContact CG2-CE2 4.21Å; I376-F380 VanDerWaalsContact O-CD2 3.27Å; I376-F380 WeakPolarHBondContact O-CD2 3.45Å; I376-F380 PolarHBondContact O-N 2.95Å; I376-F380 VanDerWaalsContact O-N 3.08Å; I376-M511 HydrophobicContact CD1-CB 4.16Å; I376-M511 HydrophobicContact CD1-CG 3.8Å; I376-P512 HydrophobicContact CD1-CB 4.35Å; I376-P512 HydrophobicContact CD1-CG 4.1Å; I376-P512 HydrophobicContact CG1-CB 3.95Å; I376-P512 HydrophobicContact CG1-CG 3.99Å; I376-V515 HydrophobicContact CD1-CG2 3.86Å; I376-V515 HydrophobicContact CG1-CG2 4.31Å; I376-V515 HydrophobicContact CG2-CG1 4.39Å; I376-V515 HydrophobicContact CG2-CG2 4.29Å; I376-T553 HydrophobicContact CD1-CG2 3.89Å
377R84.3Confident83.4Confident105 Ų10576.8 Ų76.840%0.39636%0.362SS..Hα-helixtrans-53.7-50.1-179.5-169.1-178.5-178.2-171.50.9112.2Y373 E374 K379 F380 D381 D603Y373-R377 PolarHBondContact O-N 3.41Å; E374-R377 PolarHBondContact O-N 3.15Å; E374-R377 IonicContact OE2-NH1 2.73Å; R377-K379 VanDerWaalsContact C-N 3.28Å; R377-K379 PolarHBondContact O-N 3.29Å; R377-F380 PolarHBondContact O-N 2.9Å; R377-D381 VanDerWaalsContact O-CB 3.3Å; R377-D381 WeakPolarHBondContact O-CB 3.41Å; R377-D381 PolarHBondContact O-N 3.48Å; R377-D603 IonicContact CZ-OD2 3.95Å; R377-D603 IonicContact NE-OD2 3Å; R377-D603 PolarHBondContact NE-OD2 3.11Å; R377-D603 IonicContact NH2-OD2 3.37Å; R377-D603 PolarHBondContact NH2-OD2 3.15Å
378M81.7Confident83.3Confident86 Ų8676 Ų7642%0.42436%0.36SS..Hα-helixtrans-63.7-28.5179.1-72-170.374.300114.3L367 E374 I376L367-M378 HydrophobicContact CD2-CG 4.3Å; L367-M378 HydrophobicContact CD2-SD 3.45Å; L367-M378 WeakPolarHBondContact CD2-SD 3.29Å; E374-M378 HydrophobicContact CG-CG 4.41Å; E374-M378 WeakPolarHBondContact O-CB 3.31Å; E374-M378 WeakPolarHBondContact O-CG 3.44Å; E374-M378 PolarHBondContact O-N 2.76Å; I376-M378 PolarHBondContact O-N 3.15Å
379K81.8Confident83.3Confident98 Ų9876.4 Ų76.443%0.42636%0.364SS..Hα-helixtrans-84.1-24.9-179.9-70.6-60.5-176-156.90113.4D364 Y375 I376 R377D364-K379 IonicContact OD1-NZ 2.76Å; D364-K379 PolarHBondContact OD1-NZ 3.09Å; Y375-K379 HydrophobicContact CD1-CG 4.15Å; Y375-K379 HydrophobicContact CE1-CG 3.73Å; Y375-K379 HydrophobicContact CE2-CG 4.43Å; Y375-K379 VanDerWaalsContact CZ-CE 3.4Å; Y375-K379 VanDerWaalsContact O-CG 3.27Å; Y375-K379 WeakPolarHBondContact O-CG 3.12Å; Y375-K379 PolarHBondContact O-N 3.35Å; Y375-K379 VanDerWaalsContact OH-CE 3.28Å; Y375-K379 WeakPolarHBondContact OH-CE 3.41Å; I376-K379 PolarHBondContact O-N 3.46Å; R377-K379 VanDerWaalsContact C-N 3.28Å; R377-K379 PolarHBondContact O-N 3.29Å
380F76.1Confident83.3Confident45 Ų4572.5 Ų72.520%0.19735%0.349CS..Hα-helixtrans-105.2-2.8-179.4-69.6-80.7000113I376 R377 V382 V515 I519 N555 D557I376-F380 HydrophobicContact CG2-CD2 3.81Å; I376-F380 HydrophobicContact CG2-CE2 4.21Å; I376-F380 VanDerWaalsContact O-CD2 3.27Å; I376-F380 WeakPolarHBondContact O-CD2 3.45Å; I376-F380 PolarHBondContact O-N 2.95Å; I376-F380 VanDerWaalsContact O-N 3.08Å; R377-F380 PolarHBondContact O-N 2.9Å; F380-V382 PolarHBondContact O-N 2.89Å; F380-V515 HydrophobicContact CD2-CG1 4.36Å; F380-V515 HydrophobicContact CE2-CG1 3.62Å; F380-V515 HydrophobicContact CZ-CG1 3.76Å; F380-I519 HydrophobicContact CD1-CD1 4.2Å; F380-I519 HydrophobicContact CE1-CD1 3.25Å; F380-I519 HydrophobicContact CZ-CD1 3.63Å; F380-N555 WeakPolarHBondContact CB-ND2 3.44Å; F380-D557 WeakPolarHBondContact CD1-OD2 3.43Å
381D74.4Confident83.2Confident43 Ų4366.3 Ų66.323%0.2332%0.322CS..  trans-73.1112.1174.4-176.6-5.1000112R377 F383 E384 D385R377-D381 VanDerWaalsContact O-CB 3.3Å; R377-D381 WeakPolarHBondContact O-CB 3.41Å; R377-D381 PolarHBondContact O-N 3.48Å; D381-F383 PolarHBondContact O-N 3.33Å; D381-F383 WeakPolarHBondContact OD1-CA 3.43Å; D381-F383 VanDerWaalsContact OD1-CB 3.32Å; D381-F383 WeakPolarHBondContact OD1-CB 3.24Å; D381-F383 WeakPolarHBondContact OD1-CD2 3.4Å; D381-F383 PolarHBondContact OD1-N 3.14Å; D381-E384 HydrophobicContact CB-CB 4.17Å; D381-E384 HydrophobicContact CB-CG 4.19Å; D381-E384 PolarHBondContact O-N 3.28Å; D381-D385 PolarHBondContact O-N 3.24Å
382V66.2Low83.3Confident96 Ų9663 Ų6358%0.58231%0.305SS*.Hα-helixtrans-58.8-30177.1-175.80000112.2F380 F386F380-V382 PolarHBondContact O-N 2.89Å; V382-F386 HydrophobicContact CG1-CE2 4.08Å; V382-F386 WeakPolarHBondContact O-CD2 3.29Å; V382-F386 WeakPolarHBondContact O-CE2 3.32Å
383F68.8Low83.5Confident155 Ų15561.4 Ų61.468%0.6829%0.294SS*.Hα-helixtrans-74.2-35.5178.8-64.3-71.7000113D381 D385 F386D381-F383 PolarHBondContact O-N 3.33Å; D381-F383 WeakPolarHBondContact OD1-CA 3.43Å; D381-F383 VanDerWaalsContact OD1-CB 3.32Å; D381-F383 WeakPolarHBondContact OD1-CB 3.24Å; D381-F383 WeakPolarHBondContact OD1-CD2 3.4Å; D381-F383 PolarHBondContact OD1-N 3.14Å; F383-D385 VanDerWaalsContact C-N 3.25Å; F383-D385 PolarHBondContact O-N 2.93Å; F383-F386 PolarHBondContact O-N 3.37Å
384E73.5Confident83.8Confident69 Ų6958.8 Ų58.832%0.32229%0.285SS..Hα-helixtrans-62.7-34.9174.8-82.9-62.5149.300111.2D381 F386 I387 S388D381-E384 HydrophobicContact CB-CB 4.17Å; D381-E384 HydrophobicContact CB-CG 4.19Å; D381-E384 PolarHBondContact O-N 3.28Å; E384-F386 VanDerWaalsContact C-N 3.33Å; E384-F386 PolarHBondContact O-N 3.09Å; E384-I387 CarbonylContact O-C 3.55Å; E384-I387 WeakPolarHBondContact O-CG1 3.46Å; E384-I387 PolarHBondContact O-N 3.42Å; E384-S388 VanDerWaalsContact O-CB 3.26Å; E384-S388 WeakPolarHBondContact O-CB 3.46Å; E384-S388 PolarHBondContact O-N 3.08Å
385D74.8Confident84.2Confident79 Ų7958.5 Ų58.542%0.42229%0.288SS..Hα-helixtrans-60.9-37.1177.1-90.9-23.7000113.7D381 F383 I387 T391D381-D385 PolarHBondContact O-N 3.24Å; F383-D385 VanDerWaalsContact C-N 3.25Å; F383-D385 PolarHBondContact O-N 2.93Å; D385-I387 PolarHBondContact O-N 3.02Å; D385-T391 HydrophobicContact CB-CG2 4.18Å; D385-T391 WeakPolarHBondContact O-CB 3.41Å; D385-T391 PolarHBondContact OD1-OG1 3.49Å
386F72.7Confident84.6Confident144 Ų14457.3 Ų57.363%0.63228%0.284SS*.THydrogen-bonded Turntrans-66.9-17.4175.5-69.7-69.9000113.2R320 Q323 V382 F383 E384R320-F386 PolarHBondContact NH1-O 3.46Å; Q323-F386 PolarHBondContact NE2-O 2.68Å; V382-F386 HydrophobicContact CG1-CE2 4.08Å; V382-F386 WeakPolarHBondContact O-CD2 3.29Å; V382-F386 WeakPolarHBondContact O-CE2 3.32Å; F383-F386 PolarHBondContact O-N 3.37Å; E384-F386 VanDerWaalsContact C-N 3.33Å; E384-F386 PolarHBondContact O-N 3.09Å
387I83.1Confident85Confident62 Ų6257.1 Ų57.132%0.31828%0.283SS..THydrogen-bonded Turntrans-116.7-12.1-175.772.1169.7000116.8E384 D385E384-I387 CarbonylContact O-C 3.55Å; E384-I387 WeakPolarHBondContact O-CG1 3.46Å; E384-I387 PolarHBondContact O-N 3.42Å; D385-I387 PolarHBondContact O-N 3.02Å
388S88.6Confident85.6Confident24 Ų2454.9 Ų54.917%0.16828%0.276CS..  trans-69.3128.1-179.3176.10000113.1Q323 E384 T390 T391 A392Q323-S388 WeakPolarHBondContact CG-O 3.47Å; E384-S388 VanDerWaalsContact O-CB 3.26Å; E384-S388 WeakPolarHBondContact O-CB 3.46Å; E384-S388 PolarHBondContact O-N 3.08Å; S388-T390 PolarHBondContact O-N 2.86Å; S388-T390 WeakPolarHBondContact OG-CB 3.37Å; S388-T390 PolarHBondContact OG-N 3.34Å; S388-T390 VanDerWaalsContact OG-N 3.12Å; S388-T391 WeakPolarHBondContact CB-OG1 3.36Å; S388-T391 PolarHBondContact OG-N 3.05Å; S388-T391 PolarHBondContact OG-OG1 3.05Å; S388-A392 PolarHBondContact O-N 3.08Å
389P93.8Very high86.3Confident20 Ų2051.5 Ų51.513%0.1326%0.26CS..Hα-helixtrans-62.1-27.6167-19.932000112.9P319 L322 Q323 L326 L357 A393P319-P389 HydrophobicContact CB-CG 3.78Å; P319-P389 WeakPolarHBondContact O-CG 3.47Å; L322-P389 HydrophobicContact CB-CB 4.45Å; L322-P389 HydrophobicContact CD2-CB 4.2Å; L322-P389 HydrophobicContact CG-CB 4.28Å; Q323-P389 HydrophobicContact CB-CB 4.46Å; Q323-P389 HydrophobicContact CB-CG 4.31Å; L326-P389 WeakPolarHBondContact CD1-O 3.41Å; L357-P389 HydrophobicContact CD1-CB 4.39Å; L357-P389 HydrophobicContact CD2-CB 4.1Å; P389-A393 VanDerWaalsContact O-CB 3.27Å; P389-A393 WeakPolarHBondContact O-CB 3.42Å; P389-A393 PolarHBondContact O-N 3.41Å
390T93.3Very high86.9Confident39 Ų3946.9 Ų46.924%0.23924%0.24CC..Hα-helixtrans-69.5-45.8-179.7-56.80000110.6L357 M358 S388 A393 Q394L357-T390 PolarHBondContact O-OG1 3.02Å; M358-T390 HydrophobicContact CG-CG2 4.45Å; S388-T390 PolarHBondContact O-N 2.86Å; S388-T390 WeakPolarHBondContact OG-CB 3.37Å; S388-T390 PolarHBondContact OG-N 3.34Å; S388-T390 VanDerWaalsContact OG-N 3.12Å; T390-A393 WeakPolarHBondContact O-CB 3.48Å; T390-A393 PolarHBondContact O-N 3.19Å; T390-A393 VanDerWaalsContact O-N 3.11Å; T390-Q394 WeakPolarHBondContact O-CG 3.27Å; T390-Q394 PolarHBondContact O-N 2.97Å
391T92.7Very high87.9Confident26 Ų2644.7 Ų44.716%0.1623%0.231CC..Hα-helixtrans-63.3-44.4176.5-45.90000110.2D385 S388 A393 Q394 T395D385-T391 HydrophobicContact CB-CG2 4.18Å; D385-T391 WeakPolarHBondContact O-CB 3.41Å; D385-T391 PolarHBondContact OD1-OG1 3.49Å; S388-T391 WeakPolarHBondContact CB-OG1 3.36Å; S388-T391 PolarHBondContact OG-N 3.05Å; S388-T391 PolarHBondContact OG-OG1 3.05Å; T391-A393 VanDerWaalsContact C-N 3.29Å; T391-A393 PolarHBondContact O-N 3.22Å; T391-Q394 WeakPolarHBondContact O-CB 3.34Å; T391-Q394 PolarHBondContact O-N 3.15Å; T391-Q394 VanDerWaalsContact O-N 3.16Å; T391-T395 PolarHBondContact O-N 3.38Å; T391-T395 PolarHBondContact O-OG1 2.87Å
392A95.4Very high88.7Confident4 Ų443.4 Ų43.43%0.03323%0.225CC..Hα-helixtrans-61.2-34.3172.700000113.7Q323 L326 N327 S388 L396Q323-A392 HydrophobicContact CG-CB 3.92Å; L326-A392 HydrophobicContact CB-CB 3.95Å; L326-A392 HydrophobicContact CD1-CB 4.21Å; N327-A392 VanDerWaalsContact OD1-CB 3.26Å; N327-A392 WeakPolarHBondContact OD1-CB 3.31Å; S388-A392 PolarHBondContact O-N 3.08Å; A392-L396 WeakPolarHBondContact O-CB 3.02Å; A392-L396 PolarHBondContact O-N 2.87Å
393A97.2Very high89.9Confident0 Ų041.4 Ų41.40%021%0.208CC..Hα-helixtrans-70-39.8175.100000112L326 I354 L357 P389 T390 T391 L396 L397L326-A393 HydrophobicContact CD1-CB 4Å; I354-A393 HydrophobicContact CB-CB 4.34Å; I354-A393 HydrophobicContact CG1-CB 4.18Å; I354-A393 HydrophobicContact CG2-CB 4.1Å; L357-A393 HydrophobicContact CB-CB 4.27Å; L357-A393 HydrophobicContact CD1-CB 3.89Å; P389-A393 VanDerWaalsContact O-CB 3.27Å; P389-A393 WeakPolarHBondContact O-CB 3.42Å; P389-A393 PolarHBondContact O-N 3.41Å; T390-A393 WeakPolarHBondContact O-CB 3.48Å; T390-A393 PolarHBondContact O-N 3.19Å; T390-A393 VanDerWaalsContact O-N 3.11Å; T391-A393 VanDerWaalsContact C-N 3.29Å; T391-A393 PolarHBondContact O-N 3.22Å; A393-L396 PolarHBondContact O-N 2.9Å; A393-L397 WeakPolarHBondContact O-CB 3.46Å; A393-L397 PolarHBondContact O-N 3.04Å
394Q95.5Very high91Very high41 Ų4134 Ų3419%0.19218%0.176CC..Hα-helixtrans-61.8-48.4172.6-70.7170.2-2.900111.1M358 T390 T391 L396 L397 F398 H434M358-Q394 HydrophobicContact CE-CG 3.66Å; M358-Q394 HydrophobicContact SD-CG 4.19Å; T390-Q394 WeakPolarHBondContact O-CG 3.27Å; T390-Q394 PolarHBondContact O-N 2.97Å; T391-Q394 WeakPolarHBondContact O-CB 3.34Å; T391-Q394 PolarHBondContact O-N 3.15Å; T391-Q394 VanDerWaalsContact O-N 3.16Å; Q394-L396 VanDerWaalsContact C-N 3.32Å; Q394-L396 PolarHBondContact O-N 3.34Å; Q394-L397 WeakPolarHBondContact O-CB 3.29Å; Q394-L397 PolarHBondContact O-N 3.2Å; Q394-L397 VanDerWaalsContact O-N 3.13Å; Q394-F398 WeakPolarHBondContact O-CB 3.26Å; Q394-F398 PolarHBondContact O-N 3.15Å; Q394-H434 PolarHBondContact NE2-NE2 3.27Å
395T95.8Very high91.7Very high63 Ų6336 Ų3639%0.38718%0.183SC..Hα-helixtrans-59.8-42.9177.9-48.90000111.5N330 T391 F398 T399N330-T395 PolarHBondContact OD1-O 3.3Å; T391-T395 PolarHBondContact O-N 3.38Å; T391-T395 PolarHBondContact O-OG1 2.87Å; T395-F398 PolarHBondContact O-N 3.13Å; T395-T399 WeakPolarHBondContact O-CB 3.47Å; T395-T399 PolarHBondContact O-N 2.93Å; T395-T399 PolarHBondContact O-OG1 2.95Å
396L97.5Very high92.4Very high0 Ų037.3 Ų37.30%019%0.187CC..Hα-helixtrans-63.9-42.3175.1174.459.3000112.1L326 I329 N330 V333 I349 I354 A392 A393 Q394 A400L326-L396 HydrophobicContact CD2-CD2 3.8Å; I329-L396 HydrophobicContact CB-CD2 4.36Å; I329-L396 HydrophobicContact CG2-CD1 3.99Å; I329-L396 HydrophobicContact CG2-CD2 3.9Å; N330-L396 HydrophobicContact CB-CB 4.32Å; N330-L396 HydrophobicContact CB-CD1 4.09Å; N330-L396 WeakPolarHBondContact OD1-CA 3.34Å; V333-L396 HydrophobicContact CG2-CD1 3.7Å; I349-L396 HydrophobicContact CG2-CD2 4.29Å; I354-L396 HydrophobicContact CD1-CB 4.35Å; I354-L396 HydrophobicContact CD1-CD2 3.87Å; I354-L396 HydrophobicContact CD1-CG 3.9Å; I354-L396 HydrophobicContact CG1-CD2 4.49Å; A392-L396 WeakPolarHBondContact O-CB 3.02Å; A392-L396 PolarHBondContact O-N 2.87Å; A393-L396 PolarHBondContact O-N 2.9Å; Q394-L396 VanDerWaalsContact C-N 3.32Å; Q394-L396 PolarHBondContact O-N 3.34Å; L396-A400 WeakPolarHBondContact O-CB 3.41Å; L396-A400 PolarHBondContact O-N 3.02Å
397L97.9Very high93.5Very high0 Ų030.7 Ų30.70%016%0.159CC..Hα-helixtrans-61.5-48.8177.2-178.365.4000111.2I350 I354 M358 A393 Q394 A400 C401 T411 M435 L439I350-L397 HydrophobicContact CD1-CD1 4.38Å; I350-L397 HydrophobicContact CG1-CD1 4.19Å; I350-L397 HydrophobicContact CG2-CD1 4.14Å; I354-L397 HydrophobicContact CD1-CB 4.38Å; I354-L397 HydrophobicContact CG2-CB 4.1Å; I354-L397 HydrophobicContact CG2-CD1 4.45Å; I354-L397 HydrophobicContact CG2-CD2 4.36Å; M358-L397 HydrophobicContact CE-CD2 4.48Å; M358-L397 HydrophobicContact SD-CD2 3.94Å; A393-L397 WeakPolarHBondContact O-CB 3.46Å; A393-L397 PolarHBondContact O-N 3.04Å; Q394-L397 WeakPolarHBondContact O-CB 3.29Å; Q394-L397 PolarHBondContact O-N 3.2Å; Q394-L397 VanDerWaalsContact O-N 3.13Å; L397-A400 PolarHBondContact O-N 3.37Å; L397-C401 VanDerWaalsContact O-CB 3.3Å; L397-C401 WeakPolarHBondContact O-CB 3.39Å; L397-C401 PolarHBondContact O-N 3.03Å; L397-C401 PolarHBondContact O-SG 3.3Å; L397-T411 HydrophobicContact CD1-CG2 3.94Å; L397-M435 HydrophobicContact CD1-CE 3.56Å; L397-M435 HydrophobicContact CD2-CB 3.88Å; L397-M435 HydrophobicContact CD2-CE 3.64Å; L397-M435 HydrophobicContact CD2-CG 3.79Å; L397-M435 HydrophobicContact CG-CE 4.26Å; L397-L439 HydrophobicContact CD2-CD1 4.24Å; L397-L439 HydrophobicContact CD2-CG 4.3Å; L397-L439 HydrophobicContact CG-CD1 4.3Å; L397-L439 HydrophobicContact CG-CD2 4.22Å; L397-L439 HydrophobicContact CG-CG 4.4Å
398F96.8Very high94.1Very high59 Ų5928 Ų2826%0.25915%0.145SC..Hα-helixtrans-58.5-54.4178.4-175.8-85.4000110.7Q394 T395 A400 C401 S402 S438 E441 I442Q394-F398 WeakPolarHBondContact O-CB 3.26Å; Q394-F398 PolarHBondContact O-N 3.15Å; T395-F398 PolarHBondContact O-N 3.13Å; F398-A400 PolarHBondContact O-N 2.89Å; F398-C401 PolarHBondContact O-N 2.94Å; F398-S402 VanDerWaalsContact O-CB 3.26Å; F398-S402 WeakPolarHBondContact O-CB 3.46Å; F398-S402 PolarHBondContact O-N 2.73Å; F398-S438 WeakPolarHBondContact CD2-O 3.44Å; F398-E441 HydrophobicContact CE2-CB 4.24Å; F398-E441 WeakPolarHBondContact CZ-OE2 3.4Å; F398-I442 HydrophobicContact CD1-CD1 4.3Å; F398-I442 HydrophobicContact CD2-CD1 3.58Å; F398-I442 HydrophobicContact CD2-CG1 4.19Å; F398-I442 HydrophobicContact CE1-CD1 4.32Å; F398-I442 HydrophobicContact CE2-CD1 3.62Å; F398-I442 HydrophobicContact CE2-CG1 3.7Å; F398-I442 HydrophobicContact CG-CD1 3.95Å; F398-I442 HydrophobicContact CZ-CD1 4Å; F398-I442 HydrophobicContact CZ-CG1 3.93Å
399T95.4Very high94.3Very high15 Ų1533.4 Ų33.49%0.09217%0.167CC..Hα-helixtrans-59.9-44.6-179-560000111.6N330 V333 T395 S402 K403N330-T399 WeakPolarHBondContact OD1-CB 3.43Å; N330-T399 WeakPolarHBondContact OD1-CG2 3.46Å; N330-T399 PolarHBondContact OD1-OG1 3.35Å; V333-T399 HydrophobicContact CB-CG2 4.17Å; V333-T399 HydrophobicContact CG1-CG2 4.04Å; T395-T399 WeakPolarHBondContact O-CB 3.47Å; T395-T399 PolarHBondContact O-N 2.93Å; T395-T399 PolarHBondContact O-OG1 2.95Å; T399-S402 PolarHBondContact O-N 3.32Å; T399-K403 HydrophobicContact CG2-CD 3.87Å; T399-K403 HydrophobicContact CG2-CG 4.39Å; T399-K403 WeakPolarHBondContact O-CB 3.47Å; T399-K403 PolarHBondContact O-N 3.15Å
400A96.2Very high94.5Very high0 Ų037.2 Ų37.20%018%0.182CC..Hα-helixtrans-66.6-37.3178.900000113V333 I346 L396 L397 F398 R404 V407V333-A400 HydrophobicContact CG1-CB 4.38Å; V333-A400 HydrophobicContact CG2-CB 4.41Å; I346-A400 HydrophobicContact CD1-CB 4.27Å; I346-A400 HydrophobicContact CG1-CB 4.38Å; L396-A400 WeakPolarHBondContact O-CB 3.41Å; L396-A400 PolarHBondContact O-N 3.02Å; L397-A400 PolarHBondContact O-N 3.37Å; F398-A400 PolarHBondContact O-N 2.89Å; A400-R404 PolarHBondContact O-N 3.12Å; A400-V407 HydrophobicContact CB-CG1 4.12Å; A400-V407 WeakPolarHBondContact O-CB 3.4Å
401C95.5Very high94.6Very high0 Ų035.3 Ų35.30%017%0.17CC..Hα-helixtrans-78-29.2178.5-68.50000113.3L397 F398 L408 L439 I442L397-C401 VanDerWaalsContact O-CB 3.3Å; L397-C401 WeakPolarHBondContact O-CB 3.39Å; L397-C401 PolarHBondContact O-N 3.03Å; L397-C401 PolarHBondContact O-SG 3.3Å; F398-C401 PolarHBondContact O-N 2.94Å; C401-L408 HydrophobicContact CB-CB 4.13Å; C401-L408 HydrophobicContact CB-CD1 4.03Å; C401-L439 HydrophobicContact CB-CD1 4.49Å; C401-L439 HydrophobicContact CB-CD2 3.73Å; C401-I442 HydrophobicContact CB-CD1 4.36Å
402S92.7Very high94.8Very high15 Ų1535.2 Ų35.211%0.10517%0.168CC..Hα-helixtrans-74.8-54.2176.5-1770000110.8F398 T399 T898F398-S402 VanDerWaalsContact O-CB 3.26Å; F398-S402 WeakPolarHBondContact O-CB 3.46Å; F398-S402 PolarHBondContact O-N 2.73Å; T399-S402 PolarHBondContact O-N 3.32Å; S402-T898 WeakPolarHBondContact OG-CG2 3.37Å
403K89.9Confident94.8Very high54 Ų5436.9 Ų36.924%0.23519%0.186CC..Hα-helixtrans-87.5-21.4-167.4-60.4-171.6179.5-179.50115.2T399 L901 D907T399-K403 HydrophobicContact CG2-CD 3.87Å; T399-K403 HydrophobicContact CG2-CG 4.39Å; T399-K403 WeakPolarHBondContact O-CB 3.47Å; T399-K403 PolarHBondContact O-N 3.15Å; K403-L901 HydrophobicContact CB-CD1 4.12Å; K403-L901 WeakPolarHBondContact O-CB 3.5Å; K403-L901 PolarHBondContact O-N 3.07Å; K403-D907 WeakPolarHBondContact CE-OD2 3.18Å; K403-D907 IonicContact NZ-OD2 3.14Å; K403-D907 PolarHBondContact NZ-OD2 3.46Å
404R91.8Very high94.8Very high1 Ų138.4 Ų38.40%0.00419%0.193CC..BIsolated β-bridgetrans-122.6126.3-169-62.5-63-169.6-174.1-7.2113.8V333 S334 H335 W339 A400 V407 G902 E905V333-R404 HydrophobicContact CG1-CG 3.84Å; V333-R404 PolarHBondContact O-NE 2.89Å; V333-R404 PolarHBondContact O-NH2 3.22Å; S334-R404 PolarHBondContact O-NH2 2.9Å; S334-R404 VanDerWaalsContact O-NH2 3.16Å; H335-R404 VanDerWaalsContact C-NH2 3.32Å; W339-R404 HydrophobicContact CD2-CG 3.83Å; W339-R404 HydrophobicContact CE3-CG 3.96Å; W339-R404 VanDerWaalsContact CG-NE 3.34Å; W339-R404 HydrophobicContact CH2-CB 3.68Å; W339-R404 HydrophobicContact CH2-CG 3.72Å; W339-R404 HydrophobicContact CZ2-CB 3.45Å; W339-R404 VanDerWaalsContact CZ2-CB 3.45Å; W339-R404 HydrophobicContact CZ2-CG 3.58Å; W339-R404 HydrophobicContact CZ3-CB 4.36Å; W339-R404 HydrophobicContact CZ3-CG 3.91Å; A400-R404 PolarHBondContact O-N 3.12Å; R404-V407 HydrophobicContact CB-CG2 3.88Å; R404-V407 WeakPolarHBondContact O-CB 3.46Å; R404-V407 WeakPolarHBondContact O-CG2 3.42Å; R404-V407 PolarHBondContact O-N 3.36Å; R404-G902 PolarHBondContact NH1-O 3.44Å; R404-E905 PolarHBondContact NH1-O 2.93Å; R404-E905 PolarHBondContact NH2-O 3.44Å
405K88.6Confident94.9Very high109 Ų10936.5 Ų36.547%0.47418%0.184SC..THydrogen-bonded Turntrans-54.3146.6179.8-55.9-167.6170.8159.20112.7V407 E900K405-V407 PolarHBondContact O-N 2.73Å; K405-E900 WeakPolarHBondContact CE-O 3.48Å; K405-E900 HydrophobicContact CG-CB 3.97Å; K405-E900 WeakPolarHBondContact CG-OE2 3.19Å; K405-E900 PolarHBondContact NZ-O 3.15Å
406E90.2Very high94.9Very high107 Ų10740.3 Ų40.350%0.519%0.192SC..THydrogen-bonded Turntrans65.7-16.6-179.3-49.9177.9179.700116.4K410E406-K410 WeakPolarHBondContact O-CG 3.33Å; E406-K410 PolarHBondContact O-N 3.09Å; E406-K410 VanDerWaalsContact O-N 3.12Å; E406-K410 IonicContact OE2-NZ 2.81Å; E406-K410 PolarHBondContact OE2-NZ 3.21Å
407V95.6Very high94.8Very high6 Ų646.7 Ų46.74%0.03622%0.222CC..Hα-helixtrans-64.3-53.9-177.4-178.20000109.8W339 I350 A400 R404 K405 Q409 K410 T411W339-V407 HydrophobicContact CH2-CG2 3.8Å; W339-V407 HydrophobicContact CZ2-CG2 4.13Å; I350-V407 HydrophobicContact CD1-CG1 3.67Å; A400-V407 HydrophobicContact CB-CG1 4.12Å; A400-V407 WeakPolarHBondContact O-CB 3.4Å; R404-V407 HydrophobicContact CB-CG2 3.88Å; R404-V407 WeakPolarHBondContact O-CB 3.46Å; R404-V407 WeakPolarHBondContact O-CG2 3.42Å; R404-V407 PolarHBondContact O-N 3.36Å; K405-V407 PolarHBondContact O-N 2.73Å; V407-Q409 VanDerWaalsContact C-N 3.3Å; V407-Q409 PolarHBondContact O-N 2.87Å; V407-K410 PolarHBondContact O-N 3.03Å; V407-K410 VanDerWaalsContact O-N 3.14Å; V407-T411 WeakPolarHBondContact O-CB 3.38Å; V407-T411 PolarHBondContact O-N 3.16Å; V407-T411 PolarHBondContact O-OG1 3.41Å
408L95.2Very high94.7Very high6 Ų647.3 Ų47.33%0.03123%0.225CC..Hα-helixtrans-53.5-45.7177.9179.362.9000112.4C401 K410 T411 M412 L439 I442 L443 K446 Y449C401-L408 HydrophobicContact CB-CB 4.13Å; C401-L408 HydrophobicContact CB-CD1 4.03Å; L408-K410 PolarHBondContact O-N 2.97Å; L408-T411 PolarHBondContact O-N 3.2Å; L408-M412 HydrophobicContact CD1-CG 3.98Å; L408-M412 HydrophobicContact CG-CG 4.44Å; L408-M412 WeakPolarHBondContact O-CB 3.44Å; L408-M412 WeakPolarHBondContact O-CG 3.48Å; L408-M412 PolarHBondContact O-N 3.29Å; L408-L439 HydrophobicContact CD1-CD1 4.24Å; L408-I442 HydrophobicContact CD2-CG2 3.89Å; L408-L443 HydrophobicContact CD1-CD2 4.05Å; L408-K446 HydrophobicContact CD2-CD 3.63Å; L408-Y449 HydrophobicContact CD2-CD2 4.17Å; L408-Y449 HydrophobicContact CD2-CE2 3.62Å; L408-Y449 HydrophobicContact CG-CE2 4.02Å
409Q94.1Very high94.6Very high136 Ų13645.3 Ų45.364%0.63622%0.217SC*.Hα-helixtrans-63-42.5-179.3-171.5-176.46.200112.2V407 G413 Y449V407-Q409 VanDerWaalsContact C-N 3.3Å; V407-Q409 PolarHBondContact O-N 2.87Å; Q409-G413 PolarHBondContact O-N 3.43Å; Q409-Y449 WeakPolarHBondContact CA-OH 3.42Å
410K96.1Very high94.5Very high100 Ų10047.5 Ų47.544%0.43523%0.23SC..Hα-helixtrans-70.6-38.8178.3-69.6171.2-172.8157.60111.7E406 V407 L408 G413 F414E406-K410 WeakPolarHBondContact O-CG 3.33Å; E406-K410 PolarHBondContact O-N 3.09Å; E406-K410 VanDerWaalsContact O-N 3.12Å; E406-K410 IonicContact OE2-NZ 2.81Å; E406-K410 PolarHBondContact OE2-NZ 3.21Å; V407-K410 PolarHBondContact O-N 3.03Å; V407-K410 VanDerWaalsContact O-N 3.14Å; L408-K410 PolarHBondContact O-N 2.97Å; K410-G413 PolarHBondContact O-N 3Å; K410-F414 WeakPolarHBondContact O-CB 3.33Å; K410-F414 PolarHBondContact O-N 3.15Å
411T97.3Very high94.4Very high0 Ų052 Ų520%025%0.252CS..Hα-helixtrans-60-52.7173.7-60.60000111I350 L397 V407 L408 G413 F414 C415 M435 L439I350-T411 HydrophobicContact CG2-CG2 4.43Å; L397-T411 HydrophobicContact CD1-CG2 3.94Å; V407-T411 WeakPolarHBondContact O-CB 3.38Å; V407-T411 PolarHBondContact O-N 3.16Å; V407-T411 PolarHBondContact O-OG1 3.41Å; L408-T411 PolarHBondContact O-N 3.2Å; T411-G413 VanDerWaalsContact C-N 3.31Å; T411-G413 PolarHBondContact O-N 3.42Å; T411-F414 WeakPolarHBondContact O-CB 3.45Å; T411-F414 PolarHBondContact O-N 3.05Å; T411-F414 VanDerWaalsContact O-N 3.08Å; T411-C415 PolarHBondContact O-N 3.37Å; T411-C415 PolarHBondContact O-SG 3.36Å; T411-C415 VanDerWaalsContact O-SG 3.42Å; T411-M435 HydrophobicContact CG2-CE 3.6Å; T411-L439 HydrophobicContact CG2-CD1 4.1Å
412M96Very high93.9Very high23 Ų2357.5 Ų57.511%0.11329%0.287CS..Hα-helixtrans-63.3-37178.4-69.6-54.4-6400112.3L408 F414 C415 Y416 I436 L443 Y449L408-M412 HydrophobicContact CD1-CG 3.98Å; L408-M412 HydrophobicContact CG-CG 4.44Å; L408-M412 WeakPolarHBondContact O-CB 3.44Å; L408-M412 WeakPolarHBondContact O-CG 3.48Å; L408-M412 PolarHBondContact O-N 3.29Å; M412-F414 VanDerWaalsContact C-N 3.32Å; M412-F414 PolarHBondContact O-N 3.22Å; M412-C415 PolarHBondContact O-N 3.15Å; M412-Y416 VanDerWaalsContact O-CB 3.22Å; M412-Y416 WeakPolarHBondContact O-CB 3.4Å; M412-Y416 PolarHBondContact O-N 2.99Å; M412-I436 HydrophobicContact CE-CD1 4.37Å; M412-I436 HydrophobicContact CE-CG1 4.02Å; M412-I436 HydrophobicContact SD-CG1 4.17Å; M412-L443 HydrophobicContact CE-CD1 4.19Å; M412-L443 HydrophobicContact CE-CD2 4.24Å; M412-L443 HydrophobicContact CG-CD2 4.17Å; M412-L443 HydrophobicContact SD-CD1 4.09Å; M412-L443 HydrophobicContact SD-CD2 3.99Å; M412-Y449 HydrophobicContact CB-CE1 4.02Å; M412-Y449 HydrophobicContact CG-CD1 4.46Å; M412-Y449 HydrophobicContact CG-CE1 3.82Å
413G96.1Very high93.7Very high40 Ų4064.1 Ų64.141%0.41232%0.321SS..Hα-helixtrans-60.9-39.7172.700000112.8Q409 K410 T411 Q417Q409-G413 PolarHBondContact O-N 3.43Å; K410-G413 PolarHBondContact O-N 3Å; T411-G413 VanDerWaalsContact C-N 3.31Å; T411-G413 PolarHBondContact O-N 3.42Å; G413-Q417 PolarHBondContact O-N 2.64Å; G413-Q417 VanDerWaalsContact O-N 3.08Å
414F97.3Very high93.7Very high32 Ų3262.1 Ų62.114%0.1432%0.315CS..Hα-helixtrans-66.7-49.6175.1170.6-108000112.2Q351 F355 K410 T411 M412 Y416 Q417 I418 M435Q351-F414 HydrophobicContact CB-CE2 4.34Å; Q351-F414 HydrophobicContact CB-CZ 4.22Å; Q351-F414 HydrophobicContact CG-CD1 4.21Å; Q351-F414 HydrophobicContact CG-CD2 3.87Å; Q351-F414 HydrophobicContact CG-CE1 4.15Å; Q351-F414 HydrophobicContact CG-CE2 3.79Å; Q351-F414 HydrophobicContact CG-CG 4.05Å; Q351-F414 HydrophobicContact CG-CZ 3.92Å; F355-F414 HydrophobicContact CB-CE1 3.99Å; F355-F414 HydrophobicContact CB-CZ 4.4Å; F355-F414 HydrophobicContact CD1-CE1 4.11Å; F355-F414 AromaticContact CD1-CZ 3.86Å; F355-F414 HydrophobicContact CD1-CZ 3.86Å; F355-F414 AromaticContact CD2-CE1 3.85Å; F355-F414 HydrophobicContact CD2-CE1 3.85Å; F355-F414 HydrophobicContact CD2-CZ 4.37Å; F355-F414 HydrophobicContact CE1-CZ 4.21Å; F355-F414 HydrophobicContact CE2-CE1 4.33Å; F355-F414 AromaticContact CG-CE1 3.7Å; F355-F414 HydrophobicContact CG-CE1 3.7Å; F355-F414 AromaticContact CG-CZ 3.95Å; F355-F414 HydrophobicContact CG-CZ 3.95Å; K410-F414 WeakPolarHBondContact O-CB 3.33Å; K410-F414 PolarHBondContact O-N 3.15Å; T411-F414 WeakPolarHBondContact O-CB 3.45Å; T411-F414 PolarHBondContact O-N 3.05Å; T411-F414 VanDerWaalsContact O-N 3.08Å; M412-F414 VanDerWaalsContact C-N 3.32Å; M412-F414 PolarHBondContact O-N 3.22Å; F414-Y416 VanDerWaalsContact C-N 3.32Å; F414-Y416 PolarHBondContact O-N 3.45Å; F414-Q417 WeakPolarHBondContact O-CB 3.48Å; F414-Q417 PolarHBondContact O-N 3.48Å; F414-I418 HydrophobicContact CD1-CD1 4.26Å; F414-I418 HydrophobicContact CD2-CD1 4.35Å; F414-I418 HydrophobicContact CE1-CD1 3.72Å; F414-I418 HydrophobicContact CE2-CD1 3.82Å; F414-I418 HydrophobicContact CE2-CG1 4.49Å; F414-I418 HydrophobicContact CZ-CD1 3.49Å; F414-I418 VanDerWaalsContact CZ-CD1 3.49Å; F414-I418 PolarHBondContact O-N 3.13Å; F414-M435 HydrophobicContact CE1-SD 4.46Å
415C96.8Very high93.8Very high0 Ų065.7 Ų65.70%033%0.334CS..Hα-helixtrans-59.6-44.1177-62.60000111.3T411 M412 Q417 I418 L419 A432 I436T411-C415 PolarHBondContact O-N 3.37Å; T411-C415 PolarHBondContact O-SG 3.36Å; T411-C415 VanDerWaalsContact O-SG 3.42Å; M412-C415 PolarHBondContact O-N 3.15Å; C415-Q417 VanDerWaalsContact C-N 3.33Å; C415-Q417 PolarHBondContact O-N 3.11Å; C415-I418 PolarHBondContact O-N 3.37Å; C415-I418 VanDerWaalsContact O-N 3.15Å; C415-L419 WeakPolarHBondContact O-CG 3.43Å; C415-L419 PolarHBondContact O-N 2.79Å; C415-A432 HydrophobicContact CB-CB 4.3Å; C415-I436 HydrophobicContact CB-CD1 3.89Å; C415-I436 HydrophobicContact CB-CG1 4.02Å
416Y95Very high94.1Very high144 Ų14463 Ų6357%0.56533%0.328SS*.Hα-helixtrans-61.4-39.2177.6-176.5-101000112.8M412 F414 I418 L419 T420M412-Y416 VanDerWaalsContact O-CB 3.22Å; M412-Y416 WeakPolarHBondContact O-CB 3.4Å; M412-Y416 PolarHBondContact O-N 2.99Å; F414-Y416 VanDerWaalsContact C-N 3.32Å; F414-Y416 PolarHBondContact O-N 3.45Å; Y416-I418 VanDerWaalsContact C-N 3.3Å; Y416-I418 PolarHBondContact O-N 3.24Å; Y416-L419 PolarHBondContact O-N 3.48Å; Y416-T420 HydrophobicContact CD1-CG2 4.28Å; Y416-T420 HydrophobicContact CD2-CG2 4.12Å; Y416-T420 HydrophobicContact CE1-CG2 3.85Å; Y416-T420 HydrophobicContact CE2-CG2 3.67Å; Y416-T420 HydrophobicContact CG-CG2 4.41Å; Y416-T420 WeakPolarHBondContact O-CB 3.32Å; Y416-T420 WeakPolarHBondContact O-CG2 3.38Å; Y416-T420 PolarHBondContact O-N 3.02Å; Y416-T420 PolarHBondContact O-OG1 3.47Å
417Q95.9Very high94.3Very high134 Ų13461 Ų6163%0.62632%0.315SS*.Hα-helixtrans-59.9-41.2175.2-177.6-179.1-12.700111.6G413 F414 C415 T420 E421G413-Q417 PolarHBondContact O-N 2.64Å; G413-Q417 VanDerWaalsContact O-N 3.08Å; F414-Q417 WeakPolarHBondContact O-CB 3.48Å; F414-Q417 PolarHBondContact O-N 3.48Å; C415-Q417 VanDerWaalsContact C-N 3.33Å; C415-Q417 PolarHBondContact O-N 3.11Å; Q417-T420 PolarHBondContact O-OG1 3.24Å; Q417-E421 PolarHBondContact O-N 3.38Å
418I95.8Very high94.4Very high13 Ų1365.5 Ų65.57%0.06734%0.335CS..Hα-helixtrans-69-45.8178.4-64.8171000111F355 F414 C415 Y416 T420 E421 A424 K428 A432F355-I418 HydrophobicContact CD2-CD1 4.49Å; F355-I418 HydrophobicContact CE1-CD1 4.05Å; F355-I418 HydrophobicContact CE2-CD1 3.71Å; F355-I418 HydrophobicContact CZ-CD1 3.46Å; F355-I418 VanDerWaalsContact CZ-CD1 3.46Å; F414-I418 HydrophobicContact CD1-CD1 4.26Å; F414-I418 HydrophobicContact CD2-CD1 4.35Å; F414-I418 HydrophobicContact CE1-CD1 3.72Å; F414-I418 HydrophobicContact CE2-CD1 3.82Å; F414-I418 HydrophobicContact CE2-CG1 4.49Å; F414-I418 HydrophobicContact CZ-CD1 3.49Å; F414-I418 VanDerWaalsContact CZ-CD1 3.49Å; F414-I418 PolarHBondContact O-N 3.13Å; C415-I418 PolarHBondContact O-N 3.37Å; C415-I418 VanDerWaalsContact O-N 3.15Å; Y416-I418 VanDerWaalsContact C-N 3.3Å; Y416-I418 PolarHBondContact O-N 3.24Å; I418-T420 VanDerWaalsContact C-N 3.27Å; I418-T420 PolarHBondContact O-N 3.3Å; I418-E421 PolarHBondContact O-N 3.4Å; I418-A424 HydrophobicContact CG2-CB 4.46Å; I418-A424 WeakPolarHBondContact O-CB 3.49Å; I418-K428 HydrophobicContact CG2-CB 3.97Å; I418-K428 WeakPolarHBondContact CG2-O 3.27Å; I418-A432 HydrophobicContact CB-CB 4.21Å; I418-A432 HydrophobicContact CD1-CB 4.49Å; I418-A432 HydrophobicContact CG2-CB 4.03Å
419L94.7Very high94.4Very high16 Ų1667.9 Ų67.98%0.08435%0.345CS..Hα-helixtrans-65.9-29.4-177.7-67.5178.8000113.3C415 Y416 K429 A432 L433 I436 H460C415-L419 WeakPolarHBondContact O-CG 3.43Å; C415-L419 PolarHBondContact O-N 2.79Å; Y416-L419 PolarHBondContact O-N 3.48Å; L419-K429 HydrophobicContact CD2-CB 4.43Å; L419-A432 HydrophobicContact CD2-CB 4.1Å; L419-A432 HydrophobicContact CG-CB 4.22Å; L419-L433 HydrophobicContact CD1-CD2 4.16Å; L419-L433 HydrophobicContact CD2-CD2 4.1Å; L419-L433 HydrophobicContact CD2-CG 3.99Å; L419-I436 HydrophobicContact CD1-CD1 3.6Å; L419-H460 HydrophobicContact CD1-CB 4.32Å
420T93.6Very high94.5Very high61 Ų6161.5 Ų61.537%0.37432%0.315SS..Hα-helixtrans-92.1-8179.655.80000114.1Y416 Q417 I418 P422Y416-T420 HydrophobicContact CD1-CG2 4.28Å; Y416-T420 HydrophobicContact CD2-CG2 4.12Å; Y416-T420 HydrophobicContact CE1-CG2 3.85Å; Y416-T420 HydrophobicContact CE2-CG2 3.67Å; Y416-T420 HydrophobicContact CG-CG2 4.41Å; Y416-T420 WeakPolarHBondContact O-CB 3.32Å; Y416-T420 WeakPolarHBondContact O-CG2 3.38Å; Y416-T420 PolarHBondContact O-N 3.02Å; Y416-T420 PolarHBondContact O-OG1 3.47Å; Q417-T420 PolarHBondContact O-OG1 3.24Å; I418-T420 VanDerWaalsContact C-N 3.27Å; I418-T420 PolarHBondContact O-N 3.3Å; T420-P422 WeakPolarHBondContact O-CD 3.41Å
421E93.6Very high94.6Very high96 Ų9656.8 Ų56.845%0.44929%0.294SS..  trans-69.6120.5177.3-178.3170.5-162.300110.6Q417 I418 N423 A424Q417-E421 PolarHBondContact O-N 3.38Å; I418-E421 PolarHBondContact O-N 3.4Å; E421-N423 VanDerWaalsContact C-N 3.26Å; E421-N423 PolarHBondContact O-N 2.9Å; E421-N423 VanDerWaalsContact O-N 3.16Å; E421-A424 HydrophobicContact CB-CB 3.83Å; E421-A424 HydrophobicContact CG-CB 4.12Å; E421-A424 PolarHBondContact O-N 3.15Å
422P85.2Confident94.6Very high115 Ų11556.8 Ų56.875%0.74729%0.294SS*.THydrogen-bonded Turntrans-59.5-32.6-172.2-27.234.7000114.7T420T420-P422 WeakPolarHBondContact O-CD 3.41Å
423N88.8Confident94.7Very high154 Ų15455.7 Ų55.782%0.82429%0.289SS*.THydrogen-bonded Turntrans-117.325.9-177.2-60.5-35.8000112E421 D425E421-N423 VanDerWaalsContact C-N 3.26Å; E421-N423 PolarHBondContact O-N 2.9Å; E421-N423 VanDerWaalsContact O-N 3.16Å; N423-D425 PolarHBondContact O-N 3.48Å
424A90Very high94.7Very high11 Ų1154.4 Ų54.49%0.09127%0.273CS..  trans-60.8134.1175.800000110.5I418 E421 K429I418-A424 HydrophobicContact CG2-CB 4.46Å; I418-A424 WeakPolarHBondContact O-CB 3.49Å; E421-A424 HydrophobicContact CB-CB 3.83Å; E421-A424 HydrophobicContact CG-CB 4.12Å; E421-A424 PolarHBondContact O-N 3.15Å; A424-K429 HydrophobicContact CB-CD 4.46Å; A424-K429 HydrophobicContact CB-CG 4.08Å
425D93.6Very high94.8Very high77 Ų7752.9 Ų52.941%0.41227%0.266SS..  trans-50.5126.2171.1-177.3-15.3000109.9N423 R427 K428 K429N423-D425 PolarHBondContact O-N 3.48Å; D425-R427 PolarHBondContact O-N 3.49Å; D425-R427 PolarHBondContact OD1-N 3.01Å; D425-K428 HydrophobicContact CB-CB 4.29Å; D425-K428 HydrophobicContact CB-CD 4.11Å; D425-K428 HydrophobicContact CB-CG 4.01Å; D425-K428 WeakPolarHBondContact O-CA 3.35Å; D425-K428 WeakPolarHBondContact O-CB 3.48Å; D425-K428 PolarHBondContact O-N 3.42Å; D425-K429 PolarHBondContact O-N 2.89Å; D425-K429 VanDerWaalsContact O-N 3.14Å
426P95Very high94.8Very high53 Ų5353 Ų5334%0.34427%0.266SS..Hα-helixtrans-51-37.5178-28.936.5000113.6K428 K429 D430 L469 Y471 M472P426-K428 VanDerWaalsContact C-N 3.27Å; P426-K428 PolarHBondContact O-N 3.06Å; P426-K429 WeakPolarHBondContact O-CB 3.42Å; P426-K429 PolarHBondContact O-N 2.74Å; P426-D430 PolarHBondContact O-N 2.72Å; P426-L469 HydrophobicContact CB-CD1 3.61Å; P426-L469 HydrophobicContact CG-CD1 3.85Å; P426-Y471 WeakPolarHBondContact CB-OH 3.45Å; P426-M472 HydrophobicContact CB-CG 4.47Å; P426-M472 HydrophobicContact CB-SD 4.25Å
427R95.5Very high94.8Very high63 Ų6346.1 Ų46.124%0.23824%0.239CC..Hα-helixtrans-62.8-34.1177.1-66.3-178.1171.8-177.2-0.2112.7Y360 D362 D425 G431Y360-R427 HydrophobicContact CD1-CG 4.49Å; Y360-R427 WeakPolarHBondContact O-CD 3.46Å; D362-R427 IonicContact OD1-CZ 3.57Å; D362-R427 IonicContact OD1-NH1 3.33Å; D362-R427 PolarHBondContact OD1-NH1 3.25Å; D362-R427 IonicContact OD1-NH2 3.96Å; D362-R427 PolarHBondContact OD1-NH2 3.46Å; D362-R427 IonicContact OD2-NH1 3.48Å; D425-R427 PolarHBondContact O-N 3.49Å; D425-R427 PolarHBondContact OD1-N 3.01Å; R427-G431 PolarHBondContact O-N 3.36Å
428K96.4Very high94.8Very high101 Ų10140.7 Ų40.744%0.43922%0.216SC..Hα-helixtrans-72.2-35.2174.4-68.1-175.6-177.7-178.40112.1F355 I418 D425 P426 G431 A432F355-K428 HydrophobicContact CE1-CB 4.49Å; F355-K428 HydrophobicContact CE1-CG 4.23Å; F355-K428 HydrophobicContact CZ-CB 3.87Å; F355-K428 HydrophobicContact CZ-CG 4.09Å; F355-K428 WeakPolarHBondContact CZ-O 3.24Å; I418-K428 HydrophobicContact CG2-CB 3.97Å; I418-K428 WeakPolarHBondContact CG2-O 3.27Å; D425-K428 HydrophobicContact CB-CB 4.29Å; D425-K428 HydrophobicContact CB-CD 4.11Å; D425-K428 HydrophobicContact CB-CG 4.01Å; D425-K428 WeakPolarHBondContact O-CA 3.35Å; D425-K428 WeakPolarHBondContact O-CB 3.48Å; D425-K428 PolarHBondContact O-N 3.42Å; P426-K428 VanDerWaalsContact C-N 3.27Å; P426-K428 PolarHBondContact O-N 3.06Å; K428-G431 PolarHBondContact O-N 3Å; K428-A432 WeakPolarHBondContact O-CB 3.43Å; K428-A432 PolarHBondContact O-N 3.41Å
429K96.3Very high94.9Very high56 Ų5640 Ų4024%0.24321%0.213CC..Hα-helixtrans-66.5-42.1174.4-67-172.7179.8-175.90110.9L419 A424 D425 P426 A432 L433 M472L419-K429 HydrophobicContact CD2-CB 4.43Å; A424-K429 HydrophobicContact CB-CD 4.46Å; A424-K429 HydrophobicContact CB-CG 4.08Å; D425-K429 PolarHBondContact O-N 2.89Å; D425-K429 VanDerWaalsContact O-N 3.14Å; P426-K429 WeakPolarHBondContact O-CB 3.42Å; P426-K429 PolarHBondContact O-N 2.74Å; K429-A432 PolarHBondContact O-N 2.93Å; K429-L433 WeakPolarHBondContact O-CG 3.39Å; K429-L433 PolarHBondContact O-N 3.42Å; K429-M472 HydrophobicContact CB-CE 3.97Å
430D96.5Very high94.9Very high3 Ų339.4 Ų39.42%0.01621%0.21CC..Hα-helixtrans-54.1-55.7170.516770.3000110.9Y360 P426 A432 L433 H434 Y471 M472 R475Y360-D430 WeakPolarHBondContact CB-OD2 3.42Å; Y360-D430 PolarHBondContact N-OD2 3.12Å; P426-D430 PolarHBondContact O-N 2.72Å; D430-A432 VanDerWaalsContact C-N 3.26Å; D430-A432 PolarHBondContact O-N 2.79Å; D430-L433 PolarHBondContact O-N 2.99Å; D430-L433 VanDerWaalsContact O-N 3.08Å; D430-H434 WeakPolarHBondContact O-CB 3.34Å; D430-H434 PolarHBondContact O-N 3.31Å; D430-Y471 HydrophobicContact CB-CD2 4.33Å; D430-Y471 HydrophobicContact CB-CE2 4.18Å; D430-M472 HydrophobicContact CB-SD 3.77Å; D430-R475 WeakPolarHBondContact OD1-CB 3.47Å; D430-R475 VanDerWaalsContact OD1-CG 3.29Å; D430-R475 WeakPolarHBondContact OD1-CG 3.39Å; D430-R475 IonicContact OD1-CZ 3.79Å; D430-R475 IonicContact OD1-NE 3.28Å; D430-R475 PolarHBondContact OD1-NE 3.49Å; D430-R475 IonicContact OD1-NH2 2.63Å
431G96.9Very high94.9Very high0 Ų041.3 Ų41.30%021%0.214CC..Hα-helixtrans-59.6-34.4179.300000114M358 R427 K428 H434 M435M358-G431 WeakPolarHBondContact O-CA 3.32Å; R427-G431 PolarHBondContact O-N 3.36Å; K428-G431 PolarHBondContact O-N 3Å; G431-H434 WeakPolarHBondContact O-CB 3.22Å; G431-H434 PolarHBondContact O-N 2.88Å; G431-M435 WeakPolarHBondContact O-CG 3.28Å; G431-M435 PolarHBondContact O-N 3.21Å
432A97.8Very high94.9Very high0 Ų036.9 Ų36.90%019%0.194CC..Hα-helixtrans-69.2-38.9177.700000111.5F355 C415 I418 L419 K428 K429 D430 I436F355-A432 HydrophobicContact CE2-CB 4.28Å; C415-A432 HydrophobicContact CB-CB 4.3Å; I418-A432 HydrophobicContact CB-CB 4.21Å; I418-A432 HydrophobicContact CD1-CB 4.49Å; I418-A432 HydrophobicContact CG2-CB 4.03Å; L419-A432 HydrophobicContact CD2-CB 4.1Å; L419-A432 HydrophobicContact CG-CB 4.22Å; K428-A432 WeakPolarHBondContact O-CB 3.43Å; K428-A432 PolarHBondContact O-N 3.41Å; K429-A432 PolarHBondContact O-N 2.93Å; D430-A432 VanDerWaalsContact C-N 3.26Å; D430-A432 PolarHBondContact O-N 2.79Å; A432-I436 WeakPolarHBondContact O-CD1 3.45Å; A432-I436 VanDerWaalsContact O-CG1 3.23Å; A432-I436 WeakPolarHBondContact O-CG1 3.49Å; A432-I436 PolarHBondContact O-N 3.12Å; A432-I436 VanDerWaalsContact O-N 3.13Å
433L97.6Very high95.4Very high0 Ų031.4 Ų31.40%016%0.158CC..Hα-helixtrans-71-36.9174.8-74.7178.5000112.4L419 K429 D430 I436 G437 V461 L464 R475 V479L419-L433 HydrophobicContact CD1-CD2 4.16Å; L419-L433 HydrophobicContact CD2-CD2 4.1Å; L419-L433 HydrophobicContact CD2-CG 3.99Å; K429-L433 WeakPolarHBondContact O-CG 3.39Å; K429-L433 PolarHBondContact O-N 3.42Å; D430-L433 PolarHBondContact O-N 2.99Å; D430-L433 VanDerWaalsContact O-N 3.08Å; L433-I436 PolarHBondContact O-N 2.77Å; L433-G437 PolarHBondContact O-N 2.98Å; L433-V461 HydrophobicContact CD2-CG2 4Å; L433-L464 HydrophobicContact CD1-CD1 3.21Å; L433-R475 HydrophobicContact CB-CG 3.87Å; L433-R475 HydrophobicContact CD1-CG 4.31Å; L433-V479 HydrophobicContact CB-CG2 3.95Å
434H97.1Very high95.6Very high14 Ų1424.8 Ų24.87%0.06512%0.123CC..Hα-helixtrans-58-49.8173-167177.3000110.4M358 Q394 D430 G431 I436 G437 S438 R475 W478M358-H434 HydrophobicContact CB-CB 4.37Å; M358-H434 VanDerWaalsContact CE-C 3.48Å; M358-H434 HydrophobicContact CE-CB 4.03Å; M358-H434 VanDerWaalsContact CE-CD2 3.41Å; M358-H434 WeakPolarHBondContact CE-CD2 3.31Å; M358-H434 PolarHBondContact O-ND1 2.95Å; Q394-H434 PolarHBondContact NE2-NE2 3.27Å; D430-H434 WeakPolarHBondContact O-CB 3.34Å; D430-H434 PolarHBondContact O-N 3.31Å; G431-H434 WeakPolarHBondContact O-CB 3.22Å; G431-H434 PolarHBondContact O-N 2.88Å; H434-I436 VanDerWaalsContact C-N 3.32Å; H434-I436 PolarHBondContact O-N 3.3Å; H434-G437 PolarHBondContact O-N 2.97Å; H434-S438 PolarHBondContact O-N 3.13Å; H434-S438 PolarHBondContact O-OG 3.43Å; H434-S438 VanDerWaalsContact O-OG 3.08Å; H434-R475 PolarHBondContact CD2-NH1 3.19Å; H434-R475 PolarHBondContact ND1-NH2 3.13Å; H434-W478 AromaticContact CD2-CH2 3.6Å; H434-W478 AromaticContact CD2-CZ3 3.95Å
435M97.9Very high95.6Very high0 Ų030 Ų300%014%0.143CC..Hα-helixtrans-58.4-41.3174.9-72.8-17876.200112.9I350 F355 M358 L397 T411 F414 G431 L439I350-M435 HydrophobicContact CG2-CE 3.56Å; F355-M435 HydrophobicContact CB-SD 3.88Å; F355-M435 HydrophobicContact CD2-SD 3.57Å; F355-M435 VanDerWaalsContact CD2-SD 3.57Å; F355-M435 HydrophobicContact CG-SD 4.2Å; M358-M435 HydrophobicContact CB-CG 4.5Å; M358-M435 HydrophobicContact CE-CB 4.38Å; M358-M435 HydrophobicContact CE-CG 3.98Å; M358-M435 HydrophobicContact SD-CB 4.49Å; M358-M435 HydrophobicContact SD-CG 3.56Å; M358-M435 VanDerWaalsContact SD-CG 3.56Å; L397-M435 HydrophobicContact CD1-CE 3.56Å; L397-M435 HydrophobicContact CD2-CB 3.88Å; L397-M435 HydrophobicContact CD2-CE 3.64Å; L397-M435 HydrophobicContact CD2-CG 3.79Å; L397-M435 HydrophobicContact CG-CE 4.26Å; T411-M435 HydrophobicContact CG2-CE 3.6Å; F414-M435 HydrophobicContact CE1-SD 4.46Å; G431-M435 WeakPolarHBondContact O-CG 3.28Å; G431-M435 PolarHBondContact O-N 3.21Å; M435-L439 WeakPolarHBondContact O-CD1 3.42Å; M435-L439 VanDerWaalsContact O-CG 3.25Å; M435-L439 WeakPolarHBondContact O-CG 3.26Å; M435-L439 PolarHBondContact O-N 3.03Å
436I97.2Very high95.4Very high2 Ų228.3 Ų28.31%0.0113%0.132CC..Hα-helixtrans-67.8-44.1-179.5-69.7165.9000110.9M412 C415 L419 A432 L433 H434 L439 A440 L443 M456 F483M412-I436 HydrophobicContact CE-CD1 4.37Å; M412-I436 HydrophobicContact CE-CG1 4.02Å; M412-I436 HydrophobicContact SD-CG1 4.17Å; C415-I436 HydrophobicContact CB-CD1 3.89Å; C415-I436 HydrophobicContact CB-CG1 4.02Å; L419-I436 HydrophobicContact CD1-CD1 3.6Å; A432-I436 WeakPolarHBondContact O-CD1 3.45Å; A432-I436 VanDerWaalsContact O-CG1 3.23Å; A432-I436 WeakPolarHBondContact O-CG1 3.49Å; A432-I436 PolarHBondContact O-N 3.12Å; A432-I436 VanDerWaalsContact O-N 3.13Å; L433-I436 PolarHBondContact O-N 2.77Å; H434-I436 VanDerWaalsContact C-N 3.32Å; H434-I436 PolarHBondContact O-N 3.3Å; I436-L439 CarbonylContact O-C 3.59Å; I436-L439 PolarHBondContact O-N 3.14Å; I436-L439 VanDerWaalsContact O-N 3.14Å; I436-A440 PolarHBondContact O-N 2.83Å; I436-L443 HydrophobicContact CG2-CD1 4.04Å; I436-M456 HydrophobicContact CG2-CE 3.75Å; I436-M456 HydrophobicContact CG2-SD 4.5Å; I436-F483 HydrophobicContact CG2-CE2 3.83Å; I436-F483 HydrophobicContact CG2-CZ 3.83Å
437G96.2Very high95Very high0 Ų033.5 Ų33.50%015%0.149CC..Hα-helixtrans-67.6-37.8177.500000112.8L433 H434 L439 A440L433-G437 PolarHBondContact O-N 2.98Å; H434-G437 PolarHBondContact O-N 2.97Å; G437-L439 PolarHBondContact O-N 3.5Å; G437-A440 WeakPolarHBondContact O-CB 3.24Å; G437-A440 PolarHBondContact O-N 3.4Å
438S95.9Very high94.6Very high19 Ų1936.6 Ų36.613%0.13317%0.169CC..THydrogen-bonded Turntrans-63.7-11.5171.9-59.40000113.7M358 F398 H434M358-S438 WeakPolarHBondContact CE-OG 3.36Å; F398-S438 WeakPolarHBondContact CD2-O 3.44Å; H434-S438 PolarHBondContact O-N 3.13Å; H434-S438 PolarHBondContact O-OG 3.43Å; H434-S438 VanDerWaalsContact O-OG 3.08Å
439L96.5Very high94.4Very high0 Ų033.7 Ų33.70%016%0.156CC..THydrogen-bonded Turntrans-1099176.1-65.8173.9000112.4L397 C401 L408 T411 M435 I436 G437 E441 I442 L443L397-L439 HydrophobicContact CD2-CD1 4.24Å; L397-L439 HydrophobicContact CD2-CG 4.3Å; L397-L439 HydrophobicContact CG-CD1 4.3Å; L397-L439 HydrophobicContact CG-CD2 4.22Å; L397-L439 HydrophobicContact CG-CG 4.4Å; C401-L439 HydrophobicContact CB-CD1 4.49Å; C401-L439 HydrophobicContact CB-CD2 3.73Å; L408-L439 HydrophobicContact CD1-CD1 4.24Å; T411-L439 HydrophobicContact CG2-CD1 4.1Å; M435-L439 WeakPolarHBondContact O-CD1 3.42Å; M435-L439 VanDerWaalsContact O-CG 3.25Å; M435-L439 WeakPolarHBondContact O-CG 3.26Å; M435-L439 PolarHBondContact O-N 3.03Å; I436-L439 CarbonylContact O-C 3.59Å; I436-L439 PolarHBondContact O-N 3.14Å; I436-L439 VanDerWaalsContact O-N 3.14Å; G437-L439 PolarHBondContact O-N 3.5Å; L439-E441 PolarHBondContact O-N 3.09Å; L439-I442 HydrophobicContact CD2-CD1 3.77Å; L439-I442 PolarHBondContact O-N 2.74Å; L439-L443 HydrophobicContact CB-CD1 4.02Å; L439-L443 HydrophobicContact CB-CG 4.22Å; L439-L443 VanDerWaalsContact O-CG 3.24Å; L439-L443 WeakPolarHBondContact O-CG 3.26Å; L439-L443 PolarHBondContact O-N 3.09Å
440A95.5Very high94.1Very high2 Ų235.4 Ų35.42%0.01716%0.163CC..Hα-helixtrans-55.8-46.7-171.200000112.8I436 G437 I442 L443 L444 Y482 F483I436-A440 PolarHBondContact O-N 2.83Å; G437-A440 WeakPolarHBondContact O-CB 3.24Å; G437-A440 PolarHBondContact O-N 3.4Å; A440-I442 PolarHBondContact O-N 2.88Å; A440-L443 PolarHBondContact O-N 3.42Å; A440-L443 VanDerWaalsContact O-N 3.11Å; A440-L444 WeakPolarHBondContact O-CB 3.31Å; A440-L444 VanDerWaalsContact O-CG 3.26Å; A440-L444 WeakPolarHBondContact O-CG 3.24Å; A440-L444 PolarHBondContact O-N 3.03Å; A440-Y482 WeakPolarHBondContact CB-O 3.39Å; A440-F483 HydrophobicContact CB-CD1 4.09Å; A440-F483 HydrophobicContact CB-CD2 4.15Å; A440-F483 HydrophobicContact CB-CE1 3.82Å; A440-F483 HydrophobicContact CB-CE2 3.89Å; A440-F483 HydrophobicContact CB-CG 4.26Å; A440-F483 HydrophobicContact CB-CZ 3.73Å
441E93.8Very high93.7Very high101 Ų10139.3 Ų39.347%0.47218%0.184SC..Hα-helixtrans-54.9-49.3178.1-166.1-158.5139.200112.1F398 L439 L443 L444 K445F398-E441 HydrophobicContact CE2-CB 4.24Å; F398-E441 WeakPolarHBondContact CZ-OE2 3.4Å; L439-E441 PolarHBondContact O-N 3.09Å; E441-L443 VanDerWaalsContact C-N 3.33Å; E441-L443 PolarHBondContact O-N 3.39Å; E441-L444 PolarHBondContact O-N 3.3Å; E441-K445 WeakPolarHBondContact O-CG 3.13Å; E441-K445 PolarHBondContact O-N 3.13Å; E441-K445 VanDerWaalsContact O-N 3.13Å; E441-K445 IonicContact OE1-NZ 2.84Å; E441-K445 PolarHBondContact OE1-NZ 3.21Å
442I93.1Very high93.4Very high4 Ų444.6 Ų44.62%0.02121%0.209CC..Hα-helixtrans-63.9-40.6178.7-59.6163.2000110.7F398 C401 L408 L439 A440 K446F398-I442 HydrophobicContact CD1-CD1 4.3Å; F398-I442 HydrophobicContact CD2-CD1 3.58Å; F398-I442 HydrophobicContact CD2-CG1 4.19Å; F398-I442 HydrophobicContact CE1-CD1 4.32Å; F398-I442 HydrophobicContact CE2-CD1 3.62Å; F398-I442 HydrophobicContact CE2-CG1 3.7Å; F398-I442 HydrophobicContact CG-CD1 3.95Å; F398-I442 HydrophobicContact CZ-CD1 4Å; F398-I442 HydrophobicContact CZ-CG1 3.93Å; C401-I442 HydrophobicContact CB-CD1 4.36Å; L408-I442 HydrophobicContact CD2-CG2 3.89Å; L439-I442 HydrophobicContact CD2-CD1 3.77Å; L439-I442 PolarHBondContact O-N 2.74Å; A440-I442 PolarHBondContact O-N 2.88Å; I442-K446 HydrophobicContact CG2-CD 4.26Å; I442-K446 PolarHBondContact O-N 2.82Å; I442-K446 VanDerWaalsContact O-N 3.15Å
443L95.2Very high93.2Very high0 Ų044.9 Ų44.90%021%0.211CC..Hα-helixtrans-70.5-31.5-178.3-67.1171.9000112.3L408 M412 I436 L439 A440 E441 Y449 K450 M453 F483L408-L443 HydrophobicContact CD1-CD2 4.05Å; M412-L443 HydrophobicContact CE-CD1 4.19Å; M412-L443 HydrophobicContact CE-CD2 4.24Å; M412-L443 HydrophobicContact CG-CD2 4.17Å; M412-L443 HydrophobicContact SD-CD1 4.09Å; M412-L443 HydrophobicContact SD-CD2 3.99Å; I436-L443 HydrophobicContact CG2-CD1 4.04Å; L439-L443 HydrophobicContact CB-CD1 4.02Å; L439-L443 HydrophobicContact CB-CG 4.22Å; L439-L443 VanDerWaalsContact O-CG 3.24Å; L439-L443 WeakPolarHBondContact O-CG 3.26Å; L439-L443 PolarHBondContact O-N 3.09Å; A440-L443 PolarHBondContact O-N 3.42Å; A440-L443 VanDerWaalsContact O-N 3.11Å; E441-L443 VanDerWaalsContact C-N 3.33Å; E441-L443 PolarHBondContact O-N 3.39Å; L443-Y449 HydrophobicContact CD2-CD1 3.82Å; L443-Y449 HydrophobicContact CD2-CD2 3.87Å; L443-Y449 HydrophobicContact CD2-CE1 4.4Å; L443-Y449 HydrophobicContact CD2-CE2 4.46Å; L443-Y449 HydrophobicContact CD2-CG 3.52Å; L443-K450 PolarHBondContact O-N 3.06Å; L443-K450 VanDerWaalsContact O-N 3.13Å; L443-M453 HydrophobicContact CB-SD 4.15Å; L443-M453 HydrophobicContact CD1-SD 4.29Å; L443-F483 HydrophobicContact CB-CE1 4.34Å; L443-F483 HydrophobicContact CD1-CE1 4.46Å; L443-F483 HydrophobicContact CD1-CZ 3.92Å
444L93.1Very high93.1Very high15 Ų1545.9 Ų45.98%0.07922%0.215CC..Hα-helixtrans-79.6-25177.9-70.3170.7000113.3A440 E441 K450 M453 F483 E485 V486A440-L444 WeakPolarHBondContact O-CB 3.31Å; A440-L444 VanDerWaalsContact O-CG 3.26Å; A440-L444 WeakPolarHBondContact O-CG 3.24Å; A440-L444 PolarHBondContact O-N 3.03Å; E441-L444 PolarHBondContact O-N 3.3Å; L444-K450 WeakPolarHBondContact O-CD 3.35Å; L444-K450 VanDerWaalsContact O-CE 3.31Å; L444-K450 WeakPolarHBondContact O-CE 3.26Å; L444-K450 WeakPolarHBondContact O-CG 3.26Å; L444-K450 PolarHBondContact O-NZ 3.4Å; L444-M453 HydrophobicContact CD2-CG 4.49Å; L444-F483 HydrophobicContact CD1-CD1 4.23Å; L444-F483 HydrophobicContact CD2-CD1 4.17Å; L444-F483 HydrophobicContact CG-CD1 4.19Å; L444-F483 HydrophobicContact CG-CE1 4.35Å; L444-E485 HydrophobicContact CD1-CB 4.18Å; L444-V486 HydrophobicContact CD2-CG2 3.62Å
445K90.5Very high92.9Very high120 Ų12052.3 Ų52.352%0.52224%0.24SC..Hα-helixtrans-75-41.7169.8-70.4174.5176.3175.50111.9E441 K447E441-K445 WeakPolarHBondContact O-CG 3.13Å; E441-K445 PolarHBondContact O-N 3.13Å; E441-K445 VanDerWaalsContact O-N 3.13Å; E441-K445 IonicContact OE1-NZ 2.84Å; E441-K445 PolarHBondContact OE1-NZ 3.21Å; K445-K447 PolarHBondContact O-N 2.94Å
446K89.1Confident92.8Very high41 Ų4153.2 Ų53.218%0.17824%0.244CC..SBendtrans-83.4111.2-175.4-70.4-177-178.5174.80113.8L408 I442 I448 Y449 K450 E900L408-K446 HydrophobicContact CD2-CD 3.63Å; I442-K446 HydrophobicContact CG2-CD 4.26Å; I442-K446 PolarHBondContact O-N 2.82Å; I442-K446 VanDerWaalsContact O-N 3.15Å; K446-I448 VanDerWaalsContact C-N 3.29Å; K446-I448 PolarHBondContact O-N 3.4Å; K446-Y449 HydrophobicContact CB-CD2 3.98Å; K446-Y449 PolarHBondContact O-N 3.25Å; K446-K450 PolarHBondContact O-N 3.15Å; K446-E900 IonicContact NZ-OE1 2.85Å; K446-E900 PolarHBondContact NZ-OE1 3.14Å
447K86.9Confident92.7Very high162 Ų16253.1 Ų53.170%0.70424%0.244SC*.Hα-helixtrans-45.4-41.5-177.8-170.2172.3-175167.60115.9K445 Y449 D451K445-K447 PolarHBondContact O-N 2.94Å; K447-Y449 PolarHBondContact O-N 3.13Å; K447-D451 PolarHBondContact O-N 3.05Å
448I87.7Confident92.8Very high128 Ų12856.8 Ų56.866%0.65626%0.261SS*.Hα-helixtrans-60-35.1-178.8-62174.4000111.7K446 Q452K446-I448 VanDerWaalsContact C-N 3.29Å; K446-I448 PolarHBondContact O-N 3.4Å; I448-Q452 PolarHBondContact O-NE2 3.06Å
449Y91.7Very high92.7Very high40 Ų4058.9 Ų58.916%0.15727%0.271CS..Hα-helixtrans-92.7-47.4-180-62.3-71.8000111.1L408 Q409 M412 L443 K446 K447 D451 Q452 M453L408-Y449 HydrophobicContact CD2-CD2 4.17Å; L408-Y449 HydrophobicContact CD2-CE2 3.62Å; L408-Y449 HydrophobicContact CG-CE2 4.02Å; Q409-Y449 WeakPolarHBondContact CA-OH 3.42Å; M412-Y449 HydrophobicContact CB-CE1 4.02Å; M412-Y449 HydrophobicContact CG-CD1 4.46Å; M412-Y449 HydrophobicContact CG-CE1 3.82Å; L443-Y449 HydrophobicContact CD2-CD1 3.82Å; L443-Y449 HydrophobicContact CD2-CD2 3.87Å; L443-Y449 HydrophobicContact CD2-CE1 4.4Å; L443-Y449 HydrophobicContact CD2-CE2 4.46Å; L443-Y449 HydrophobicContact CD2-CG 3.52Å; K446-Y449 HydrophobicContact CB-CD2 3.98Å; K446-Y449 PolarHBondContact O-N 3.25Å; K447-Y449 PolarHBondContact O-N 3.13Å; Y449-D451 VanDerWaalsContact C-N 3.27Å; Y449-D451 PolarHBondContact O-N 3.06Å; Y449-D451 VanDerWaalsContact O-N 3.14Å; Y449-Q452 CarbonylContact O-C 3.52Å; Y449-Q452 WeakPolarHBondContact O-CA 3.2Å; Y449-Q452 PolarHBondContact O-N 3.01Å; Y449-M453 VanDerWaalsContact O-CE 3.24Å; Y449-M453 WeakPolarHBondContact O-CE 3.42Å; Y449-M453 WeakPolarHBondContact O-CG 3.46Å; Y449-M453 PolarHBondContact O-N 3.41Å; Y449-M453 VanDerWaalsContact O-N 3.13Å
450K89.9Confident92.6Very high92 Ų9260.8 Ų60.840%0.428%0.28SS..Hα-helixtrans-43.4-50.3179.3-170.7-176.8-162.2146.50112.8L443 L444 K446 Q452 M453L443-K450 PolarHBondContact O-N 3.06Å; L443-K450 VanDerWaalsContact O-N 3.13Å; L444-K450 WeakPolarHBondContact O-CD 3.35Å; L444-K450 VanDerWaalsContact O-CE 3.31Å; L444-K450 WeakPolarHBondContact O-CE 3.26Å; L444-K450 WeakPolarHBondContact O-CG 3.26Å; L444-K450 PolarHBondContact O-NZ 3.4Å; K446-K450 PolarHBondContact O-N 3.15Å; K450-Q452 PolarHBondContact O-N 3.28Å; K450-M453 PolarHBondContact O-N 2.93Å
451D88.5Confident92.7Very high86 Ų8660.7 Ų60.746%0.4628%0.279SS..Hα-helixtrans-66.9-18.3-178.6-86.8-41.4000114.6K447 Y449 K489K447-D451 PolarHBondContact O-N 3.05Å; Y449-D451 VanDerWaalsContact C-N 3.27Å; Y449-D451 PolarHBondContact O-N 3.06Å; Y449-D451 VanDerWaalsContact O-N 3.14Å; D451-K489 IonicContact OD1-NZ 3.93Å; D451-K489 PolarHBondContact OD1-NZ 3.37Å
452Q91.1Very high92.9Very high111 Ų11156.6 Ų56.652%0.51926%0.26SS..Hα-helixtrans-102.7-9.6-179-60.2-175.243.800113.2I448 Y449 K450 E454 Y455 M456I448-Q452 PolarHBondContact O-NE2 3.06Å; Y449-Q452 CarbonylContact O-C 3.52Å; Y449-Q452 WeakPolarHBondContact O-CA 3.2Å; Y449-Q452 PolarHBondContact O-N 3.01Å; K450-Q452 PolarHBondContact O-N 3.28Å; Q452-E454 PolarHBondContact O-N 2.96Å; Q452-Y455 WeakPolarHBondContact O-CB 3.36Å; Q452-Y455 PolarHBondContact O-N 2.88Å; Q452-Y455 VanDerWaalsContact O-N 3.13Å; Q452-M456 PolarHBondContact O-N 3.02Å
453M93.1Very high93.1Very high6 Ų660.1 Ų60.13%0.0328%0.283CS..Hα-helixtrans-62.5-42.6-174.6-69-55.992.700112.2L443 L444 Y449 K450 Y455 M456 L457 F483 V486L443-M453 HydrophobicContact CB-SD 4.15Å; L443-M453 HydrophobicContact CD1-SD 4.29Å; L444-M453 HydrophobicContact CD2-CG 4.49Å; Y449-M453 VanDerWaalsContact O-CE 3.24Å; Y449-M453 WeakPolarHBondContact O-CE 3.42Å; Y449-M453 WeakPolarHBondContact O-CG 3.46Å; Y449-M453 PolarHBondContact O-N 3.41Å; Y449-M453 VanDerWaalsContact O-N 3.13Å; K450-M453 PolarHBondContact O-N 2.93Å; M453-Y455 VanDerWaalsContact C-N 3.27Å; M453-Y455 PolarHBondContact O-N 2.88Å; M453-M456 HydrophobicContact CE-CB 4.49Å; M453-M456 WeakPolarHBondContact O-CB 3.34Å; M453-M456 PolarHBondContact O-N 3.36Å; M453-M456 HydrophobicContact SD-CE 4.15Å; M453-L457 WeakPolarHBondContact O-CG 3.21Å; M453-L457 PolarHBondContact O-N 2.93Å; M453-F483 HydrophobicContact CB-CD1 4.47Å; M453-F483 HydrophobicContact CB-CE1 4.47Å; M453-F483 HydrophobicContact CG-CD1 4.33Å; M453-F483 HydrophobicContact CG-CE1 3.9Å; M453-F483 HydrophobicContact SD-CD1 4.41Å; M453-F483 HydrophobicContact SD-CE1 3.54Å; M453-F483 VanDerWaalsContact SD-CE1 3.54Å; M453-F483 HydrophobicContact SD-CZ 3.92Å; M453-V486 HydrophobicContact CB-CG2 3.94Å
454E94.8Very high93.1Very high21 Ų2161.5 Ų61.510%0.09829%0.29CS..Hα-helixtrans-56.5-41.8174.7-176.8-179.1-179.600112.1Q452 L457 Q458 V486 F488 K489 S490 N493Q452-E454 PolarHBondContact O-N 2.96Å; E454-L457 PolarHBondContact O-N 2.85Å; E454-Q458 WeakPolarHBondContact O-CB 3.48Å; E454-Q458 PolarHBondContact O-N 3.11Å; E454-V486 HydrophobicContact CB-CG1 4.29Å; E454-F488 HydrophobicContact CG-CD1 4.14Å; E454-K489 PolarHBondContact OE1-N 3.16Å; E454-K489 VanDerWaalsContact OE2-CB 3.29Å; E454-K489 WeakPolarHBondContact OE2-CB 3.42Å; E454-K489 PolarHBondContact OE2-N 2.96Å; E454-S490 VanDerWaalsContact OE1-CB 3.27Å; E454-S490 WeakPolarHBondContact OE1-CB 3.43Å; E454-S490 PolarHBondContact OE1-N 3.02Å; E454-N493 HydrophobicContact CG-CB 4.4Å; E454-N493 PolarHBondContact OE1-ND2 3.15Å
455Y94Very high93.3Very high148 Ų14860.8 Ų60.858%0.5829%0.286SS*.Hα-helixtrans-68.8-37.1177.4-178.6-91.8000111.9Q452 M453 Q458 N459Q452-Y455 WeakPolarHBondContact O-CB 3.36Å; Q452-Y455 PolarHBondContact O-N 2.88Å; Q452-Y455 VanDerWaalsContact O-N 3.13Å; M453-Y455 VanDerWaalsContact C-N 3.27Å; M453-Y455 PolarHBondContact O-N 2.88Å; Y455-Q458 PolarHBondContact O-N 3.37Å; Y455-N459 WeakPolarHBondContact CD1-ND2 3.41Å; Y455-N459 WeakPolarHBondContact CD2-ND2 3.43Å; Y455-N459 WeakPolarHBondContact CE1-ND2 3.41Å; Y455-N459 WeakPolarHBondContact CE2-ND2 3.4Å; Y455-N459 PolarHBondContact O-N 3.46Å; Y455-N459 PolarHBondContact O-ND2 3.32Å
456M94.8Very high93.6Very high19 Ų1959 Ų599%0.09429%0.289CS..Hα-helixtrans-62.9-47.8175.4-175.2-78.9-67.400110.7I436 Q452 M453 Q458 N459 H460 V461 F483I436-M456 HydrophobicContact CG2-CE 3.75Å; I436-M456 HydrophobicContact CG2-SD 4.5Å; Q452-M456 PolarHBondContact O-N 3.02Å; M453-M456 HydrophobicContact CE-CB 4.49Å; M453-M456 WeakPolarHBondContact O-CB 3.34Å; M453-M456 PolarHBondContact O-N 3.36Å; M453-M456 HydrophobicContact SD-CE 4.15Å; M456-Q458 PolarHBondContact O-N 3.22Å; M456-N459 PolarHBondContact O-N 3.14Å; M456-H460 WeakPolarHBondContact O-CB 3.44Å; M456-H460 PolarHBondContact O-N 3.36Å; M456-V461 HydrophobicContact SD-CG2 3.94Å; M456-F483 HydrophobicContact CE-CD2 4.47Å; M456-F483 HydrophobicContact CE-CE2 4.03Å; M456-F483 HydrophobicContact CE-CZ 4.15Å
457L96.5Very high93.9Very high0 Ų058.4 Ų58.40%029%0.29CS..Iπ-helixtrans-57.6-49175.5-65.3179.6000111M453 E454 N459 V461 F462 V479 L480 F483 V486 F488M453-L457 WeakPolarHBondContact O-CG 3.21Å; M453-L457 PolarHBondContact O-N 2.93Å; E454-L457 PolarHBondContact O-N 2.85Å; L457-N459 PolarHBondContact O-N 3.42Å; L457-V461 HydrophobicContact CD2-CB 4.22Å; L457-V461 HydrophobicContact CD2-CG2 3.85Å; L457-V461 CarbonylContact O-C 3.51Å; L457-V461 WeakPolarHBondContact O-CA 3.44Å; L457-V461 WeakPolarHBondContact O-CB 3.37Å; L457-V461 PolarHBondContact O-N 3.03Å; L457-F462 HydrophobicContact CB-CE1 4.2Å; L457-F462 HydrophobicContact CB-CZ 4.46Å; L457-F462 PolarHBondContact O-N 3.34Å; L457-V479 HydrophobicContact CD2-CG1 3.93Å; L457-L480 HydrophobicContact CD1-CD2 3.93Å; L457-L480 HydrophobicContact CD2-CD2 3.95Å; L457-L480 HydrophobicContact CG-CD2 4.39Å; L457-F483 HydrophobicContact CD1-CB 4.23Å; L457-F483 HydrophobicContact CD2-CB 4.31Å; L457-F483 HydrophobicContact CD2-CD2 4.38Å; L457-F483 HydrophobicContact CD2-CG 4.45Å; L457-V486 HydrophobicContact CD1-CB 4.48Å; L457-V486 HydrophobicContact CD1-CG1 4.42Å; L457-V486 HydrophobicContact CD1-CG2 4.23Å; L457-F488 HydrophobicContact CD1-CE1 4.37Å; L457-F488 HydrophobicContact CD1-CZ 4.21Å
458Q96.2Very high94.2Very high77 Ų7758.9 Ų58.936%0.3629%0.294SS..Iπ-helixtrans-59.6-42.7-178.6-172.9-176.24800113.3E454 Y455 M456 F462 N493E454-Q458 WeakPolarHBondContact O-CB 3.48Å; E454-Q458 PolarHBondContact O-N 3.11Å; Y455-Q458 PolarHBondContact O-N 3.37Å; M456-Q458 PolarHBondContact O-N 3.22Å; Q458-F462 HydrophobicContact CB-CD2 4.25Å; Q458-F462 HydrophobicContact CB-CE2 4.28Å; Q458-F462 HydrophobicContact CG-CD2 4.24Å; Q458-F462 HydrophobicContact CG-CE2 4.46Å; Q458-N493 PolarHBondContact NE2-OD1 2.9Å
459N94.8Very high94.6Very high64 Ų6456.1 Ų56.134%0.34228%0.28SS..Iπ-helixtrans-94-27.3-171.5-67.9-68.5000114.3Y455 M456 L457Y455-N459 WeakPolarHBondContact CD1-ND2 3.41Å; Y455-N459 WeakPolarHBondContact CD2-ND2 3.43Å; Y455-N459 WeakPolarHBondContact CE1-ND2 3.41Å; Y455-N459 WeakPolarHBondContact CE2-ND2 3.4Å; Y455-N459 PolarHBondContact O-N 3.46Å; Y455-N459 PolarHBondContact O-ND2 3.32Å; M456-N459 PolarHBondContact O-N 3.14Å; L457-N459 PolarHBondContact O-N 3.42Å
460H95.3Very high94.8Very high40 Ų4054.3 Ų54.319%0.18527%0.274CS..Iπ-helixtrans-116.3-21-172.8-62.3-66000113.9L419 M456 L464L419-H460 HydrophobicContact CD1-CB 4.32Å; M456-H460 WeakPolarHBondContact O-CB 3.44Å; M456-H460 PolarHBondContact O-N 3.36Å; H460-L464 VanDerWaalsContact O-CD1 3.24Å; H460-L464 WeakPolarHBondContact O-CD1 3.48Å; H460-L464 WeakPolarHBondContact O-CG 3.08Å
461V97.2Very high95.1Very high0 Ų050.6 Ų50.60%026%0.258CS..Iπ-helixtrans-106.2-53.2-177.2-174.40000111.5L433 M456 L457 P463 L464 F465 A476 V479 L480L433-V461 HydrophobicContact CD2-CG2 4Å; M456-V461 HydrophobicContact SD-CG2 3.94Å; L457-V461 HydrophobicContact CD2-CB 4.22Å; L457-V461 HydrophobicContact CD2-CG2 3.85Å; L457-V461 CarbonylContact O-C 3.51Å; L457-V461 WeakPolarHBondContact O-CA 3.44Å; L457-V461 WeakPolarHBondContact O-CB 3.37Å; L457-V461 PolarHBondContact O-N 3.03Å; V461-P463 VanDerWaalsContact C-CD 3.44Å; V461-P463 VanDerWaalsContact C-N 3.35Å; V461-L464 VanDerWaalsContact O-CB 3.3Å; V461-L464 WeakPolarHBondContact O-CB 3.49Å; V461-L464 PolarHBondContact O-N 3.22Å; V461-F465 HydrophobicContact CG1-CE2 4.2Å; V461-A476 HydrophobicContact CG1-CB 3.92Å; V461-V479 HydrophobicContact CG1-CB 4.29Å; V461-V479 HydrophobicContact CG1-CG1 4.31Å; V461-V479 HydrophobicContact CG2-CG1 3.87Å; V461-L480 HydrophobicContact CG1-CG 4.45Å
462F97.9Very high95.5Very high15 Ų1546.7 Ų46.77%0.06624%0.237CC..G310 helixtrans-53.5-40.8-178.9-66.2-6.3000114.4L457 Q458 L464 F465 L480 F488 N493 T496 A497 L500L457-F462 HydrophobicContact CB-CE1 4.2Å; L457-F462 HydrophobicContact CB-CZ 4.46Å; L457-F462 PolarHBondContact O-N 3.34Å; Q458-F462 HydrophobicContact CB-CD2 4.25Å; Q458-F462 HydrophobicContact CB-CE2 4.28Å; Q458-F462 HydrophobicContact CG-CD2 4.24Å; Q458-F462 HydrophobicContact CG-CE2 4.46Å; F462-L464 PolarHBondContact O-N 2.61Å; F462-F465 PolarHBondContact O-N 2.65Å; F462-L480 HydrophobicContact CE1-CD1 4.42Å; F462-L480 HydrophobicContact CE1-CD2 4.01Å; F462-F488 HydrophobicContact CZ-CE1 4.45Å; F462-N493 HydrophobicContact CE2-CB 4.28Å; F462-T496 HydrophobicContact CD2-CG2 3.8Å; F462-T496 HydrophobicContact CE2-CG2 4.05Å; F462-T496 HydrophobicContact CG-CG2 4.39Å; F462-A497 HydrophobicContact CE1-CB 3.86Å; F462-A497 HydrophobicContact CZ-CB 3.88Å; F462-L500 HydrophobicContact CB-CD1 3.76Å; F462-L500 HydrophobicContact CD1-CD1 4.06Å; F462-L500 HydrophobicContact CG-CD1 3.91Å
463P96.4Very high95.8Very high78 Ų7842 Ų4251%0.50621%0.214SC..G310 helixtrans-62.4-26177.5-24.736.7000113.9V461 F465 S466V461-P463 VanDerWaalsContact C-CD 3.44Å; V461-P463 VanDerWaalsContact C-N 3.35Å; P463-F465 VanDerWaalsContact C-N 3.31Å; P463-F465 PolarHBondContact O-N 3.19Å; P463-S466 PolarHBondContact O-N 3.02Å
464L96.5Very high96Very high28 Ų2842 Ų4215%0.14722%0.216CC..G310 helixtrans-72.8-21.8-176.6-62177.4000113.3L433 H460 V461 F462 S466 S467 M472 R473 A476L433-L464 HydrophobicContact CD1-CD1 3.21Å; H460-L464 VanDerWaalsContact O-CD1 3.24Å; H460-L464 WeakPolarHBondContact O-CD1 3.48Å; H460-L464 WeakPolarHBondContact O-CG 3.08Å; V461-L464 VanDerWaalsContact O-CB 3.3Å; V461-L464 WeakPolarHBondContact O-CB 3.49Å; V461-L464 PolarHBondContact O-N 3.22Å; F462-L464 PolarHBondContact O-N 2.61Å; L464-S466 PolarHBondContact O-N 2.96Å; L464-S467 WeakPolarHBondContact O-CB 3.45Å; L464-S467 PolarHBondContact O-N 3.23Å; L464-M472 HydrophobicContact CD1-CE 3.74Å; L464-M472 HydrophobicContact CD2-CE 3.73Å; L464-M472 HydrophobicContact CG-CE 4.32Å; L464-R473 WeakPolarHBondContact O-CG 3.46Å; L464-A476 HydrophobicContact CB-CB 3.95Å
465F97.3Very high96.1Very high1 Ų142.6 Ų42.60%0.00422%0.217CC..G310 helixtrans-61.8-12.7171.8-76.9-95.5000113.8V461 F462 P463 A476 C477 L480 L500 T501 R503V461-F465 HydrophobicContact CG1-CE2 4.2Å; F462-F465 PolarHBondContact O-N 2.65Å; P463-F465 VanDerWaalsContact C-N 3.31Å; P463-F465 PolarHBondContact O-N 3.19Å; F465-A476 HydrophobicContact CD2-CB 3.7Å; F465-A476 HydrophobicContact CE2-CB 3.45Å; F465-A476 VanDerWaalsContact CE2-CB 3.45Å; F465-A476 HydrophobicContact CG-CB 4.36Å; F465-A476 HydrophobicContact CZ-CB 3.9Å; F465-C477 WeakPolarHBondContact CE1-SG 3.15Å; F465-L480 HydrophobicContact CE2-CD1 3.8Å; F465-L480 HydrophobicContact CE2-CG 4.45Å; F465-L480 HydrophobicContact CZ-CD1 3.51Å; F465-L480 HydrophobicContact CZ-CG 4.31Å; F465-L500 HydrophobicContact CB-CB 4.21Å; F465-L500 HydrophobicContact CB-CD1 4.21Å; F465-L500 HydrophobicContact CB-CD2 3.79Å; F465-L500 HydrophobicContact CB-CG 4.29Å; F465-L500 HydrophobicContact CD1-CB 3.64Å; F465-L500 HydrophobicContact CD2-CB 4.13Å; F465-L500 HydrophobicContact CD2-CD1 3.88Å; F465-L500 HydrophobicContact CE1-CB 3.97Å; F465-L500 HydrophobicContact CE2-CB 4.42Å; F465-L500 HydrophobicContact CE2-CD1 4.48Å; F465-L500 HydrophobicContact CG-CB 3.73Å; F465-L500 HydrophobicContact CG-CD1 4.05Å; F465-L500 HydrophobicContact CG-CD2 4.26Å; F465-L500 HydrophobicContact CG-CG 4.23Å; F465-L500 HydrophobicContact CZ-CB 4.37Å; F465-T501 HydrophobicContact CE1-CG2 4.07Å; F465-T501 HydrophobicContact CZ-CG2 4.09Å; F465-R503 PolarHBondContact O-NH2 2.67Å
466S95.3Very high96.3Very high83 Ų8335.5 Ų35.558%0.5819%0.189SC*.G310 helixtrans-109.512.4173.6-54.30000112.7P463 L464 R503P463-S466 PolarHBondContact O-N 3.02Å; L464-S466 PolarHBondContact O-N 2.96Å; S466-R503 PolarHBondContact OG-NH2 3.14Å
467S95.1Very high96.4Very high28 Ų2834.6 Ų34.620%0.19619%0.185CC..  trans-63.3141.7173.3175.80000111.1L464 L469 R473L464-S467 WeakPolarHBondContact O-CB 3.45Å; L464-S467 PolarHBondContact O-N 3.23Å; S467-L469 PolarHBondContact O-N 3.06Å; S467-L469 PolarHBondContact OG-N 3.08Å; S467-L469 VanDerWaalsContact OG-N 3.12Å; S467-L469 PolarHBondContact OG-O 3.25Å; S467-R473 WeakPolarHBondContact O-CD 3.26Å; S467-R473 PolarHBondContact O-NH1 3.26Å
468E94.7Very high96.5Very high172 Ų17235.7 Ų35.780%0.80419%0.189SC*.SBendtrans-69-25.1172.1-63.5-174.4168.700112.2R473 R509E468-R473 PolarHBondContact O-NH1 3.02Å; E468-R509 PolarHBondContact O-NH2 3.46Å
469L95.7Very high96.5Very high69 Ų6932 Ų3236%0.36117%0.172SC..SBendtrans-84.4121.7179.1-55.5171.6000110.3P426 S467 Y471 M472 R473P426-L469 HydrophobicContact CB-CD1 3.61Å; P426-L469 HydrophobicContact CG-CD1 3.85Å; S467-L469 PolarHBondContact O-N 3.06Å; S467-L469 PolarHBondContact OG-N 3.08Å; S467-L469 VanDerWaalsContact OG-N 3.12Å; S467-L469 PolarHBondContact OG-O 3.25Å; L469-Y471 HydrophobicContact CB-CD1 4.22Å; L469-Y471 HydrophobicContact CB-CE1 3.88Å; L469-Y471 HydrophobicContact CD1-CE1 4.1Å; L469-Y471 HydrophobicContact CD2-CE1 4.34Å; L469-Y471 HydrophobicContact CG-CE1 4.33Å; L469-M472 HydrophobicContact CB-CB 4.34Å; L469-M472 HydrophobicContact CB-CG 3.98Å; L469-M472 HydrophobicContact CD1-CG 4.22Å; L469-M472 PolarHBondContact O-N 3.05Å; L469-R473 VanDerWaalsContact C-NH1 3.32Å; L469-R473 PolarHBondContact O-NH1 3.26Å
470G96Very high96.6Very high3 Ų329 Ų293%0.03116%0.156CC..Hα-helixtrans-65.3-44.5-177.400000114.5W368 M472 R473 A474 E510 V513W368-G470 VanDerWaalsContact CZ2-C 3.45Å; G470-M472 PolarHBondContact O-N 2.83Å; G470-M472 VanDerWaalsContact O-N 3.1Å; G470-R473 WeakPolarHBondContact O-CA 3.41Å; G470-R473 WeakPolarHBondContact O-CB 3.47Å; G470-R473 PolarHBondContact O-N 2.68Å; G470-A474 PolarHBondContact O-N 2.6Å; G470-E510 VanDerWaalsContact CA-OE2 3.26Å; G470-E510 WeakPolarHBondContact CA-OE2 3.2Å; G470-V513 WeakPolarHBondContact O-CG2 3.29Å
471Y95.6Very high96.6Very high14 Ų1429.6 Ų29.66%0.05516%0.158CC..Hα-helixtrans-58.1-29.4178.371.1-96.5000112.9Y360 P426 D430 L469 R475Y360-Y471 HydrophobicContact CD1-CD1 4.09Å; Y360-Y471 HydrophobicContact CD1-CD2 4.19Å; Y360-Y471 HydrophobicContact CD1-CE1 4.16Å; Y360-Y471 HydrophobicContact CD1-CE2 4.27Å; Y360-Y471 HydrophobicContact CD1-CG 4.1Å; Y360-Y471 AromaticContact CD2-CD2 3.96Å; Y360-Y471 HydrophobicContact CD2-CD2 3.96Å; Y360-Y471 AromaticContact CD2-CG 3.87Å; Y360-Y471 HydrophobicContact CD2-CG 3.87Å; Y360-Y471 AromaticContact CE1-CD1 3.78Å; Y360-Y471 HydrophobicContact CE1-CD1 3.78Å; Y360-Y471 HydrophobicContact CE1-CE1 4.1Å; Y360-Y471 HydrophobicContact CE1-CG 4.04Å; Y360-Y471 VanDerWaalsContact CE2-CB 3.43Å; Y360-Y471 HydrophobicContact CE2-CD1 4.31Å; Y360-Y471 HydrophobicContact CE2-CD2 4.41Å; Y360-Y471 AromaticContact CE2-CG 3.84Å; Y360-Y471 HydrophobicContact CE2-CG 3.84Å; Y360-Y471 HydrophobicContact CG-CD1 4.44Å; Y360-Y471 AromaticContact CG-CD2 3.83Å; Y360-Y471 HydrophobicContact CG-CD2 3.83Å; Y360-Y471 HydrophobicContact CG-CE2 4.16Å; Y360-Y471 AromaticContact CG-CG 3.98Å; Y360-Y471 HydrophobicContact CG-CG 3.98Å; Y360-Y471 AromaticContact CZ-CD1 3.9Å; Y360-Y471 AromaticContact CZ-CG 3.91Å; P426-Y471 WeakPolarHBondContact CB-OH 3.45Å; D430-Y471 HydrophobicContact CB-CD2 4.33Å; D430-Y471 HydrophobicContact CB-CE2 4.18Å; L469-Y471 HydrophobicContact CB-CD1 4.22Å; L469-Y471 HydrophobicContact CB-CE1 3.88Å; L469-Y471 HydrophobicContact CD1-CE1 4.1Å; L469-Y471 HydrophobicContact CD2-CE1 4.34Å; L469-Y471 HydrophobicContact CG-CE1 4.33Å; Y471-R475 WeakPolarHBondContact O-CB 3.38Å; Y471-R475 PolarHBondContact O-N 3.42Å
472M97.2Very high96.5Very high3 Ų334.4 Ų34.42%0.01518%0.177CC..Hα-helixtrans-71.3-34.5173.4-66.6-60.9-56.700112.6P426 K429 D430 L464 L469 G470 A476P426-M472 HydrophobicContact CB-CG 4.47Å; P426-M472 HydrophobicContact CB-SD 4.25Å; K429-M472 HydrophobicContact CB-CE 3.97Å; D430-M472 HydrophobicContact CB-SD 3.77Å; L464-M472 HydrophobicContact CD1-CE 3.74Å; L464-M472 HydrophobicContact CD2-CE 3.73Å; L464-M472 HydrophobicContact CG-CE 4.32Å; L469-M472 HydrophobicContact CB-CB 4.34Å; L469-M472 HydrophobicContact CB-CG 3.98Å; L469-M472 HydrophobicContact CD1-CG 4.22Å; L469-M472 PolarHBondContact O-N 3.05Å; G470-M472 PolarHBondContact O-N 2.83Å; G470-M472 VanDerWaalsContact O-N 3.1Å; M472-A476 WeakPolarHBondContact O-CB 3.48Å; M472-A476 PolarHBondContact O-N 3.32Å; M472-A476 VanDerWaalsContact O-N 3.08Å
473R97.8Very high96.4Very high13 Ų1333.7 Ų33.75%0.04917%0.174CC..Hα-helixtrans-70.6-43.1174.2-61.3-167.8-60.4-76.7-2.1110.6L464 S467 E468 L469 G470 A476 C477 D508 E510 V513L464-R473 WeakPolarHBondContact O-CG 3.46Å; S467-R473 WeakPolarHBondContact O-CD 3.26Å; S467-R473 PolarHBondContact O-NH1 3.26Å; E468-R473 PolarHBondContact O-NH1 3.02Å; L469-R473 VanDerWaalsContact C-NH1 3.32Å; L469-R473 PolarHBondContact O-NH1 3.26Å; G470-R473 WeakPolarHBondContact O-CA 3.41Å; G470-R473 WeakPolarHBondContact O-CB 3.47Å; G470-R473 PolarHBondContact O-N 2.68Å; R473-A476 WeakPolarHBondContact O-CB 3.39Å; R473-A476 PolarHBondContact O-N 3.35Å; R473-C477 PolarHBondContact O-N 2.91Å; R473-C477 PolarHBondContact O-SG 3.34Å; R473-D508 IonicContact CZ-OD1 3.88Å; R473-D508 IonicContact CZ-OD2 3.8Å; R473-D508 IonicContact NE-OD1 2.68Å; R473-D508 IonicContact NE-OD2 2.82Å; R473-D508 PolarHBondContact NE-OD2 3.18Å; R473-D508 IonicContact NH2-OD1 2.68Å; R473-D508 PolarHBondContact NH2-OD1 3.44Å; R473-D508 IonicContact NH2-OD2 2.82Å; R473-D508 PolarHBondContact NH2-OD2 2.99Å; R473-E510 IonicContact CZ-OE1 2.72Å; R473-E510 IonicContact NH1-OE1 2.6Å; R473-E510 IonicContact NH2-OE1 3.93Å; R473-E510 PolarHBondContact NH2-OE1 2.91Å; R473-V513 HydrophobicContact CB-CG1 3.78Å; R473-V513 HydrophobicContact CB-CG2 4.27Å
474A96.9Very high96.3Very high7 Ų730.5 Ų30.56%0.05815%0.154CC..Hα-helixtrans-57.9-49.8172.600000111.3W368 G470 A476 C477 W478 V513 E516W368-A474 HydrophobicContact CH2-CB 3.82Å; W368-A474 HydrophobicContact CZ3-CB 4.3Å; G470-A474 PolarHBondContact O-N 2.6Å; A474-A476 PolarHBondContact O-N 2.94Å; A474-C477 WeakPolarHBondContact O-CB 3.22Å; A474-C477 PolarHBondContact O-N 3.34Å; A474-W478 PolarHBondContact O-N 3.1Å; A474-V513 HydrophobicContact CB-CG2 4.14Å; A474-E516 HydrophobicContact CB-CB 4.48Å; A474-E516 HydrophobicContact CB-CG 4.2Å
475R97Very high96.1Very high32 Ų3235 Ų3512%0.12117%0.174CC..Hα-helixtrans-57.7-37175-178.158.462.8-160.5-1.9112.7D430 L433 H434 Y471 W478 V479D430-R475 WeakPolarHBondContact OD1-CB 3.47Å; D430-R475 VanDerWaalsContact OD1-CG 3.29Å; D430-R475 WeakPolarHBondContact OD1-CG 3.39Å; D430-R475 IonicContact OD1-CZ 3.79Å; D430-R475 IonicContact OD1-NE 3.28Å; D430-R475 PolarHBondContact OD1-NE 3.49Å; D430-R475 IonicContact OD1-NH2 2.63Å; L433-R475 HydrophobicContact CB-CG 3.87Å; L433-R475 HydrophobicContact CD1-CG 4.31Å; H434-R475 PolarHBondContact CD2-NH1 3.19Å; H434-R475 PolarHBondContact ND1-NH2 3.13Å; Y471-R475 WeakPolarHBondContact O-CB 3.38Å; Y471-R475 PolarHBondContact O-N 3.42Å; R475-W478 PolarHBondContact O-N 3.36Å; R475-V479 HydrophobicContact CG-CG2 4.38Å; R475-V479 VanDerWaalsContact O-CG2 3.27Å; R475-V479 WeakPolarHBondContact O-CG2 3.47Å; R475-V479 PolarHBondContact O-N 2.98Å
476A98Very high95.9Very high0 Ų035.1 Ų35.10%018%0.175CC..Hα-helixtrans-66.5-38.3177.600000112.2V461 L464 F465 M472 R473 A474 L480V461-A476 HydrophobicContact CG1-CB 3.92Å; L464-A476 HydrophobicContact CB-CB 3.95Å; F465-A476 HydrophobicContact CD2-CB 3.7Å; F465-A476 HydrophobicContact CE2-CB 3.45Å; F465-A476 VanDerWaalsContact CE2-CB 3.45Å; F465-A476 HydrophobicContact CG-CB 4.36Å; F465-A476 HydrophobicContact CZ-CB 3.9Å; M472-A476 WeakPolarHBondContact O-CB 3.48Å; M472-A476 PolarHBondContact O-N 3.32Å; M472-A476 VanDerWaalsContact O-N 3.08Å; R473-A476 WeakPolarHBondContact O-CB 3.39Å; R473-A476 PolarHBondContact O-N 3.35Å; A474-A476 PolarHBondContact O-N 2.94Å; A476-L480 PolarHBondContact O-N 3.41Å
477C98Very high95.6Very high0 Ų038.6 Ų38.60%018%0.179CC..Hα-helixtrans-63.9-49.8171.7-61.10000110.7F465 R473 A474 V479 L480 H481 E516 A520F465-C477 WeakPolarHBondContact CE1-SG 3.15Å; R473-C477 PolarHBondContact O-N 2.91Å; R473-C477 PolarHBondContact O-SG 3.34Å; A474-C477 WeakPolarHBondContact O-CB 3.22Å; A474-C477 PolarHBondContact O-N 3.34Å; C477-V479 VanDerWaalsContact C-N 3.32Å; C477-V479 PolarHBondContact O-N 2.99Å; C477-L480 WeakPolarHBondContact O-CA 3.36Å; C477-L480 WeakPolarHBondContact O-CB 3.3Å; C477-L480 PolarHBondContact O-N 3.47Å; C477-H481 PolarHBondContact O-N 3.08Å; C477-E516 HydrophobicContact CB-CB 3.84Å; C477-A520 HydrophobicContact CB-CB 4.22Å; C477-A520 VanDerWaalsContact O-CB 3.28Å; C477-A520 WeakPolarHBondContact O-CB 3.34Å
478W96.8Very high95.4Very high23 Ų2338.3 Ų38.39%0.08717%0.174CC..Hα-helixtrans-55.7-43.9177.6-173.494.1000112.2H434 A474 R475 L480 H481 Y482H434-W478 AromaticContact CD2-CH2 3.6Å; H434-W478 AromaticContact CD2-CZ3 3.95Å; A474-W478 PolarHBondContact O-N 3.1Å; R475-W478 PolarHBondContact O-N 3.36Å; W478-L480 VanDerWaalsContact C-N 3.33Å; W478-L480 PolarHBondContact O-N 2.82Å; W478-H481 WeakPolarHBondContact O-CB 3.27Å; W478-H481 PolarHBondContact O-N 3.18Å; W478-Y482 AromaticContact CD2-CD2 3.75Å; W478-Y482 HydrophobicContact CD2-CD2 3.75Å; W478-Y482 AromaticContact CD2-CE2 3.78Å; W478-Y482 HydrophobicContact CD2-CE2 3.78Å; W478-Y482 AromaticContact CE2-CD2 3.55Å; W478-Y482 AromaticContact CE2-CE2 3.09Å; W478-Y482 AromaticContact CE2-CZ 3.89Å; W478-Y482 HydrophobicContact CE3-CD2 4.05Å; W478-Y482 HydrophobicContact CE3-CE2 4.43Å; W478-Y482 HydrophobicContact CG-CD2 4.37Å; W478-Y482 HydrophobicContact CG-CE2 4.32Å; W478-Y482 AromaticContact CH2-CD2 3.94Å; W478-Y482 HydrophobicContact CH2-CD2 3.94Å; W478-Y482 AromaticContact CH2-CE2 3.91Å; W478-Y482 HydrophobicContact CH2-CE2 3.91Å; W478-Y482 HydrophobicContact CH2-CG 4.36Å; W478-Y482 AromaticContact CZ2-CD2 3.64Å; W478-Y482 HydrophobicContact CZ2-CD2 3.64Å; W478-Y482 HydrophobicContact CZ2-CE1 4.28Å; W478-Y482 AromaticContact CZ2-CE2 3.16Å; W478-Y482 HydrophobicContact CZ2-CE2 3.16Å; W478-Y482 HydrophobicContact CZ2-CG 4.4Å; W478-Y482 AromaticContact CZ2-CZ 3.5Å; W478-Y482 HydrophobicContact CZ3-CD2 4.17Å; W478-Y482 AromaticContact NE1-CE2 3.32Å; W478-Y482 VanDerWaalsContact NE1-CE2 3.32Å; W478-Y482 WeakPolarHBondContact O-CD2 3.46Å; W478-Y482 PolarHBondContact O-N 3.21Å; W478-Y482 VanDerWaalsContact O-N 3.14Å
479V97.6Very high95.2Very high0 Ų037 Ų370%017%0.166CC..Hα-helixtrans-63.3-39.6175.5174.40000111.4L433 L457 V461 R475 C477 H481 Y482 F483L433-V479 HydrophobicContact CB-CG2 3.95Å; L457-V479 HydrophobicContact CD2-CG1 3.93Å; V461-V479 HydrophobicContact CG1-CB 4.29Å; V461-V479 HydrophobicContact CG1-CG1 4.31Å; V461-V479 HydrophobicContact CG2-CG1 3.87Å; R475-V479 HydrophobicContact CG-CG2 4.38Å; R475-V479 VanDerWaalsContact O-CG2 3.27Å; R475-V479 WeakPolarHBondContact O-CG2 3.47Å; R475-V479 PolarHBondContact O-N 2.98Å; C477-V479 VanDerWaalsContact C-N 3.32Å; C477-V479 PolarHBondContact O-N 2.99Å; V479-H481 VanDerWaalsContact C-N 3.32Å; V479-H481 PolarHBondContact O-N 3.04Å; V479-Y482 PolarHBondContact O-N 3.32Å; V479-F483 HydrophobicContact CG1-CD2 3.7Å; V479-F483 HydrophobicContact CG1-CE2 4.07Å; V479-F483 WeakPolarHBondContact O-CB 3.35Å; V479-F483 VanDerWaalsContact O-CD2 3.31Å; V479-F483 WeakPolarHBondContact O-CD2 3.45Å; V479-F483 PolarHBondContact O-N 2.98Å
480L96.5Very high95.1Very high1 Ų135.8 Ų35.81%0.00516%0.163CC..Hα-helixtrans-66.8-33.7176-73.6-176.8000113.3L457 V461 F462 F465 A476 C477 W478 F483 C484 A497 T501 L524L457-L480 HydrophobicContact CD1-CD2 3.93Å; L457-L480 HydrophobicContact CD2-CD2 3.95Å; L457-L480 HydrophobicContact CG-CD2 4.39Å; V461-L480 HydrophobicContact CG1-CG 4.45Å; F462-L480 HydrophobicContact CE1-CD1 4.42Å; F462-L480 HydrophobicContact CE1-CD2 4.01Å; F465-L480 HydrophobicContact CE2-CD1 3.8Å; F465-L480 HydrophobicContact CE2-CG 4.45Å; F465-L480 HydrophobicContact CZ-CD1 3.51Å; F465-L480 HydrophobicContact CZ-CG 4.31Å; A476-L480 PolarHBondContact O-N 3.41Å; C477-L480 WeakPolarHBondContact O-CA 3.36Å; C477-L480 WeakPolarHBondContact O-CB 3.3Å; C477-L480 PolarHBondContact O-N 3.47Å; W478-L480 VanDerWaalsContact C-N 3.33Å; W478-L480 PolarHBondContact O-N 2.82Å; L480-F483 CarbonylContact O-C 3.6Å; L480-F483 PolarHBondContact O-N 3.3Å; L480-C484 PolarHBondContact O-N 3.38Å; L480-A497 HydrophobicContact CD1-CB 4.16Å; L480-T501 HydrophobicContact CD1-CG2 3.67Å; L480-L524 HydrophobicContact CB-CD1 4.36Å
481H95.3Very high94.9Very high51 Ų5138.6 Ų38.624%0.23618%0.177CC..Hα-helixtrans-56.5-55.8170.7168-162.9000110.3C477 W478 V479 F483 C484 A520C477-H481 PolarHBondContact O-N 3.08Å; W478-H481 WeakPolarHBondContact O-CB 3.27Å; W478-H481 PolarHBondContact O-N 3.18Å; V479-H481 VanDerWaalsContact C-N 3.32Å; V479-H481 PolarHBondContact O-N 3.04Å; H481-F483 PolarHBondContact O-N 3.44Å; H481-C484 VanDerWaalsContact O-CB 3.24Å; H481-C484 WeakPolarHBondContact O-CB 3.49Å; H481-C484 PolarHBondContact O-N 3.03Å; H481-C484 VanDerWaalsContact O-N 3.15Å; H481-C484 PolarHBondContact O-SG 3.46Å; H481-A520 HydrophobicContact CB-CB 3.96Å
482Y95.5Very high94.9Very high101 Ų10143.3 Ų43.340%0.39620%0.2SC..Hα-helixtrans-67.6-21.3-178.3-80.7-94.9000114.2A440 W478 V479A440-Y482 WeakPolarHBondContact CB-O 3.39Å; W478-Y482 AromaticContact CD2-CD2 3.75Å; W478-Y482 HydrophobicContact CD2-CD2 3.75Å; W478-Y482 AromaticContact CD2-CE2 3.78Å; W478-Y482 HydrophobicContact CD2-CE2 3.78Å; W478-Y482 AromaticContact CE2-CD2 3.55Å; W478-Y482 AromaticContact CE2-CE2 3.09Å; W478-Y482 AromaticContact CE2-CZ 3.89Å; W478-Y482 HydrophobicContact CE3-CD2 4.05Å; W478-Y482 HydrophobicContact CE3-CE2 4.43Å; W478-Y482 HydrophobicContact CG-CD2 4.37Å; W478-Y482 HydrophobicContact CG-CE2 4.32Å; W478-Y482 AromaticContact CH2-CD2 3.94Å; W478-Y482 HydrophobicContact CH2-CD2 3.94Å; W478-Y482 AromaticContact CH2-CE2 3.91Å; W478-Y482 HydrophobicContact CH2-CE2 3.91Å; W478-Y482 HydrophobicContact CH2-CG 4.36Å; W478-Y482 AromaticContact CZ2-CD2 3.64Å; W478-Y482 HydrophobicContact CZ2-CD2 3.64Å; W478-Y482 HydrophobicContact CZ2-CE1 4.28Å; W478-Y482 AromaticContact CZ2-CE2 3.16Å; W478-Y482 HydrophobicContact CZ2-CE2 3.16Å; W478-Y482 HydrophobicContact CZ2-CG 4.4Å; W478-Y482 AromaticContact CZ2-CZ 3.5Å; W478-Y482 HydrophobicContact CZ3-CD2 4.17Å; W478-Y482 AromaticContact NE1-CE2 3.32Å; W478-Y482 VanDerWaalsContact NE1-CE2 3.32Å; W478-Y482 WeakPolarHBondContact O-CD2 3.46Å; W478-Y482 PolarHBondContact O-N 3.21Å; W478-Y482 VanDerWaalsContact O-N 3.14Å; V479-Y482 PolarHBondContact O-N 3.32Å
483F96Very high94.9Very high1 Ų143.8 Ų43.80%0.00420%0.203CC..THydrogen-bonded Turntrans-104.323.4175.8-77-77.1000113I436 A440 L443 L444 M453 M456 L457 V479 L480 H481 E485 V486I436-F483 HydrophobicContact CG2-CE2 3.83Å; I436-F483 HydrophobicContact CG2-CZ 3.83Å; A440-F483 HydrophobicContact CB-CD1 4.09Å; A440-F483 HydrophobicContact CB-CD2 4.15Å; A440-F483 HydrophobicContact CB-CE1 3.82Å; A440-F483 HydrophobicContact CB-CE2 3.89Å; A440-F483 HydrophobicContact CB-CG 4.26Å; A440-F483 HydrophobicContact CB-CZ 3.73Å; L443-F483 HydrophobicContact CB-CE1 4.34Å; L443-F483 HydrophobicContact CD1-CE1 4.46Å; L443-F483 HydrophobicContact CD1-CZ 3.92Å; L444-F483 HydrophobicContact CD1-CD1 4.23Å; L444-F483 HydrophobicContact CD2-CD1 4.17Å; L444-F483 HydrophobicContact CG-CD1 4.19Å; L444-F483 HydrophobicContact CG-CE1 4.35Å; M453-F483 HydrophobicContact CB-CD1 4.47Å; M453-F483 HydrophobicContact CB-CE1 4.47Å; M453-F483 HydrophobicContact CG-CD1 4.33Å; M453-F483 HydrophobicContact CG-CE1 3.9Å; M453-F483 HydrophobicContact SD-CD1 4.41Å; M453-F483 HydrophobicContact SD-CE1 3.54Å; M453-F483 VanDerWaalsContact SD-CE1 3.54Å; M453-F483 HydrophobicContact SD-CZ 3.92Å; M456-F483 HydrophobicContact CE-CD2 4.47Å; M456-F483 HydrophobicContact CE-CE2 4.03Å; M456-F483 HydrophobicContact CE-CZ 4.15Å; L457-F483 HydrophobicContact CD1-CB 4.23Å; L457-F483 HydrophobicContact CD2-CB 4.31Å; L457-F483 HydrophobicContact CD2-CD2 4.38Å; L457-F483 HydrophobicContact CD2-CG 4.45Å; V479-F483 HydrophobicContact CG1-CD2 3.7Å; V479-F483 HydrophobicContact CG1-CE2 4.07Å; V479-F483 WeakPolarHBondContact O-CB 3.35Å; V479-F483 VanDerWaalsContact O-CD2 3.31Å; V479-F483 WeakPolarHBondContact O-CD2 3.45Å; V479-F483 PolarHBondContact O-N 2.98Å; L480-F483 CarbonylContact O-C 3.6Å; L480-F483 PolarHBondContact O-N 3.3Å; H481-F483 PolarHBondContact O-N 3.44Å; F483-E485 PolarHBondContact O-N 3.24Å; F483-V486 HydrophobicContact CB-CG2 3.73Å; F483-V486 HydrophobicContact CD1-CG2 3.69Å; F483-V486 HydrophobicContact CG-CG2 4.15Å; F483-V486 VanDerWaalsContact O-CB 3.31Å; F483-V486 WeakPolarHBondContact O-CB 3.37Å; F483-V486 VanDerWaalsContact O-CG2 3.26Å; F483-V486 WeakPolarHBondContact O-CG2 3.44Å; F483-V486 PolarHBondContact O-N 3.34Å
484C92.8Very high94.8Very high11 Ų1143.3 Ų43.37%0.07420%0.201CC..THydrogen-bonded Turntrans-58.7-31.6-179.757.50000113.7L480 H481 V486 V523 L524 N527 Q528L480-C484 PolarHBondContact O-N 3.38Å; H481-C484 VanDerWaalsContact O-CB 3.24Å; H481-C484 WeakPolarHBondContact O-CB 3.49Å; H481-C484 PolarHBondContact O-N 3.03Å; H481-C484 VanDerWaalsContact O-N 3.15Å; H481-C484 PolarHBondContact O-SG 3.46Å; C484-V486 VanDerWaalsContact C-N 3.27Å; C484-V486 PolarHBondContact O-N 2.94Å; C484-V523 HydrophobicContact CB-CB 4.38Å; C484-V523 HydrophobicContact CB-CG1 3.6Å; C484-V523 WeakPolarHBondContact SG-CG1 3.27Å; C484-L524 HydrophobicContact CB-CD2 4.29Å; C484-N527 HydrophobicContact CB-CB 4.38Å; C484-Q528 PolarHBondContact O-NE2 2.89Å
485E92.3Very high94.7Very high123 Ų12346.3 Ų46.358%0.57521%0.214SC*.THydrogen-bonded Turntrans-80.81.7177.5-64.6177.9-177.500114L444 F483 K487L444-E485 HydrophobicContact CD1-CB 4.18Å; F483-E485 PolarHBondContact O-N 3.24Å; E485-K487 PolarHBondContact O-N 2.61Å; E485-K487 VanDerWaalsContact O-N 3.15Å
486V93Very high94.7Very high3 Ų346.8 Ų46.82%0.01822%0.22CC..  trans-57.8124.1175.4166.80000109.8L444 M453 E454 L457 F483 C484 F488 Q528L444-V486 HydrophobicContact CD2-CG2 3.62Å; M453-V486 HydrophobicContact CB-CG2 3.94Å; E454-V486 HydrophobicContact CB-CG1 4.29Å; L457-V486 HydrophobicContact CD1-CB 4.48Å; L457-V486 HydrophobicContact CD1-CG1 4.42Å; L457-V486 HydrophobicContact CD1-CG2 4.23Å; F483-V486 HydrophobicContact CB-CG2 3.73Å; F483-V486 HydrophobicContact CD1-CG2 3.69Å; F483-V486 HydrophobicContact CG-CG2 4.15Å; F483-V486 VanDerWaalsContact O-CB 3.31Å; F483-V486 WeakPolarHBondContact O-CB 3.37Å; F483-V486 VanDerWaalsContact O-CG2 3.26Å; F483-V486 WeakPolarHBondContact O-CG2 3.44Å; F483-V486 PolarHBondContact O-N 3.34Å; C484-V486 VanDerWaalsContact C-N 3.27Å; C484-V486 PolarHBondContact O-N 2.94Å; V486-F488 HydrophobicContact CB-CE2 4.36Å; V486-F488 HydrophobicContact CG1-CE2 4.45Å; V486-F488 WeakPolarHBondContact O-CD2 3.4Å; V486-F488 PolarHBondContact O-N 2.99Å; V486-Q528 PolarHBondContact O-NE2 2.89Å
487K89.8Confident94.7Very high155 Ų15546.8 Ų46.867%0.67422%0.22SC*.  trans-73.495172.6-63.2-170178.2-172.90109.9E485 K489E485-K487 PolarHBondContact O-N 2.61Å; E485-K487 VanDerWaalsContact O-N 3.15Å; K487-K489 PolarHBondContact O-N 3.33Å
488F91.1Very high94.6Very high23 Ų2346.9 Ų46.910%0.10122%0.221CC..  trans-66.2113.8176.4-69.9-87.9000110.9E454 L457 F462 V486 N493 L494 A497 L524E454-F488 HydrophobicContact CG-CD1 4.14Å; L457-F488 HydrophobicContact CD1-CE1 4.37Å; L457-F488 HydrophobicContact CD1-CZ 4.21Å; F462-F488 HydrophobicContact CZ-CE1 4.45Å; V486-F488 HydrophobicContact CB-CE2 4.36Å; V486-F488 HydrophobicContact CG1-CE2 4.45Å; V486-F488 WeakPolarHBondContact O-CD2 3.4Å; V486-F488 PolarHBondContact O-N 2.99Å; F488-N493 HydrophobicContact CD1-CB 3.91Å; F488-N493 HydrophobicContact CE1-CB 4.39Å; F488-L494 HydrophobicContact CB-CB 4.1Å; F488-L494 HydrophobicContact CD1-CB 4.33Å; F488-L494 HydrophobicContact CD2-CB 4.27Å; F488-L494 HydrophobicContact CD2-CD1 3.92Å; F488-L494 HydrophobicContact CE2-CD1 4.02Å; F488-L494 HydrophobicContact CG-CB 3.98Å; F488-L494 HydrophobicContact CG-CD1 4.48Å; F488-A497 HydrophobicContact CZ-CB 4.32Å; F488-L524 HydrophobicContact CE2-CD2 4.5Å
489K90.7Very high94.6Very high144 Ų14449.7 Ų49.763%0.62624%0.235SC*.SBendtrans-77-28175-60.8175-175.7172.60111.4D451 E454 K487D451-K489 IonicContact OD1-NZ 3.93Å; D451-K489 PolarHBondContact OD1-NZ 3.37Å; E454-K489 PolarHBondContact OE1-N 3.16Å; E454-K489 VanDerWaalsContact OE2-CB 3.29Å; E454-K489 WeakPolarHBondContact OE2-CB 3.42Å; E454-K489 PolarHBondContact OE2-N 2.96Å; K487-K489 PolarHBondContact O-N 3.33Å
490S93.3Very high94.6Very high43 Ų4350.5 Ų50.530%0.30124%0.239SC..  trans-104.5114.1176-179.50000110.9E454 Q492 N493 L494E454-S490 VanDerWaalsContact OE1-CB 3.27Å; E454-S490 WeakPolarHBondContact OE1-CB 3.43Å; E454-S490 PolarHBondContact OE1-N 3.02Å; S490-Q492 PolarHBondContact O-N 2.84Å; S490-Q492 VanDerWaalsContact O-N 3.12Å; S490-Q492 PolarHBondContact OG-N 3.19Å; S490-N493 WeakPolarHBondContact O-CB 3.36Å; S490-N493 PolarHBondContact O-N 3.45Å; S490-L494 PolarHBondContact O-N 3.44Å
491D92.7Very high94.7Very high62 Ų6250.5 Ų50.533%0.33224%0.239SC..Hα-helixtrans-55.8-30.9172.9-72.4-4.9000111.8N493 L494 Q495 K530D491-N493 VanDerWaalsContact C-N 3.3Å; D491-N493 PolarHBondContact O-N 2.82Å; D491-L494 PolarHBondContact O-N 3.16Å; D491-Q495 WeakPolarHBondContact O-CG 3.21Å; D491-Q495 PolarHBondContact O-N 2.76Å; D491-K530 IonicContact OD1-NZ 3.2Å; D491-K530 PolarHBondContact OD1-NZ 3.27Å; D491-K530 IonicContact OD2-NZ 3.32Å; D491-K530 PolarHBondContact OD2-NZ 2.95Å
492Q94.9Very high94.8Very high113 Ų11349.3 Ų49.353%0.52823%0.233SC..Hα-helixtrans-64-34.5175-174.762.760.600112.3S490 T496S490-Q492 PolarHBondContact O-N 2.84Å; S490-Q492 VanDerWaalsContact O-N 3.12Å; S490-Q492 PolarHBondContact OG-N 3.19Å; Q492-T496 WeakPolarHBondContact O-CB 3.29Å; Q492-T496 PolarHBondContact O-N 3.35Å; Q492-T496 PolarHBondContact O-OG1 2.82Å
493N96Very high94.9Very high13 Ų1348.7 Ų48.77%0.0723%0.23CC..Hα-helixtrans-72.7-39.8178.6-74.2-19.9000110.8E454 Q458 F462 F488 S490 D491 T496 A497E454-N493 HydrophobicContact CG-CB 4.4Å; E454-N493 PolarHBondContact OE1-ND2 3.15Å; Q458-N493 PolarHBondContact NE2-OD1 2.9Å; F462-N493 HydrophobicContact CE2-CB 4.28Å; F488-N493 HydrophobicContact CD1-CB 3.91Å; F488-N493 HydrophobicContact CE1-CB 4.39Å; S490-N493 WeakPolarHBondContact O-CB 3.36Å; S490-N493 PolarHBondContact O-N 3.45Å; D491-N493 VanDerWaalsContact C-N 3.3Å; D491-N493 PolarHBondContact O-N 2.82Å; N493-T496 PolarHBondContact O-N 2.63Å; N493-A497 WeakPolarHBondContact O-CB 3.37Å; N493-A497 PolarHBondContact O-N 3.26Å
494L95.8Very high95Very high4 Ų448.7 Ų48.72%0.02123%0.23CC..Hα-helixtrans-61.2-49.6172.3177.359.7000111.2F488 S490 D491 T496 A497 L498 Q528 K530 Y534F488-L494 HydrophobicContact CB-CB 4.1Å; F488-L494 HydrophobicContact CD1-CB 4.33Å; F488-L494 HydrophobicContact CD2-CB 4.27Å; F488-L494 HydrophobicContact CD2-CD1 3.92Å; F488-L494 HydrophobicContact CE2-CD1 4.02Å; F488-L494 HydrophobicContact CG-CB 3.98Å; F488-L494 HydrophobicContact CG-CD1 4.48Å; S490-L494 PolarHBondContact O-N 3.44Å; D491-L494 PolarHBondContact O-N 3.16Å; L494-T496 PolarHBondContact O-N 2.79Å; L494-A497 WeakPolarHBondContact O-CB 3.33Å; L494-A497 PolarHBondContact O-N 3.28Å; L494-A497 VanDerWaalsContact O-N 3.13Å; L494-L498 HydrophobicContact CD1-CD1 3.97Å; L494-L498 HydrophobicContact CD1-CG 4.14Å; L494-L498 HydrophobicContact CG-CD1 3.92Å; L494-L498 WeakPolarHBondContact O-CG 3.33Å; L494-L498 PolarHBondContact O-N 3.02Å; L494-Q528 HydrophobicContact CD1-CB 4.24Å; L494-Q528 HydrophobicContact CD1-CG 4.12Å; L494-Q528 HydrophobicContact CD2-CB 4.42Å; L494-K530 HydrophobicContact CD2-CB 3.96Å; L494-Y534 HydrophobicContact CD2-CE2 4.26Å
495Q95.9Very high95.2Very high70 Ų7048.2 Ų48.233%0.32723%0.227SC..Hα-helixtrans-56.9-39.6175-73.2177.321.600112.1D491 E499 Y534D491-Q495 WeakPolarHBondContact O-CG 3.21Å; D491-Q495 PolarHBondContact O-N 2.76Å; Q495-E499 WeakPolarHBondContact O-CB 3.14Å; Q495-E499 PolarHBondContact O-N 3.49Å; Q495-Y534 HydrophobicContact CG-CD1 3.94Å; Q495-Y534 HydrophobicContact CG-CD2 3.76Å; Q495-Y534 HydrophobicContact CG-CE1 3.73Å; Q495-Y534 HydrophobicContact CG-CE2 3.53Å; Q495-Y534 HydrophobicContact CG-CG 3.96Å; Q495-Y534 PolarHBondContact NE2-OH 2.99Å
496T96.9Very high95.5Very high41 Ų4144.3 Ų44.325%0.25221%0.209SC..Hα-helixtrans-66.9-44.1177.5-56.30000111F462 Q492 N493 L494 E499 L500F462-T496 HydrophobicContact CD2-CG2 3.8Å; F462-T496 HydrophobicContact CE2-CG2 4.05Å; F462-T496 HydrophobicContact CG-CG2 4.39Å; Q492-T496 WeakPolarHBondContact O-CB 3.29Å; Q492-T496 PolarHBondContact O-N 3.35Å; Q492-T496 PolarHBondContact O-OG1 2.82Å; N493-T496 PolarHBondContact O-N 2.63Å; L494-T496 PolarHBondContact O-N 2.79Å; T496-E499 PolarHBondContact O-N 3.17Å; T496-L500 HydrophobicContact CG2-CD1 3.79Å; T496-L500 HydrophobicContact CG2-CG 4.19Å; T496-L500 VanDerWaalsContact O-CB 3.31Å; T496-L500 WeakPolarHBondContact O-CB 3.27Å; T496-L500 WeakPolarHBondContact O-CG 3.35Å; T496-L500 PolarHBondContact O-N 2.83Å
497A96.9Very high95.6Very high0 Ų049.5 Ų49.50%024%0.237CC..Hα-helixtrans-58.2-49.8176.600000111.2F462 L480 F488 N493 L494 L500 T501F462-A497 HydrophobicContact CE1-CB 3.86Å; F462-A497 HydrophobicContact CZ-CB 3.88Å; L480-A497 HydrophobicContact CD1-CB 4.16Å; F488-A497 HydrophobicContact CZ-CB 4.32Å; N493-A497 WeakPolarHBondContact O-CB 3.37Å; N493-A497 PolarHBondContact O-N 3.26Å; L494-A497 WeakPolarHBondContact O-CB 3.33Å; L494-A497 PolarHBondContact O-N 3.28Å; L494-A497 VanDerWaalsContact O-N 3.13Å; A497-L500 PolarHBondContact O-N 3.43Å; A497-T501 PolarHBondContact O-N 2.88Å; A497-T501 PolarHBondContact O-OG1 3.4Å; A497-T501 VanDerWaalsContact O-OG1 3.11Å
498L97Very high95.9Very high3 Ų343.2 Ų43.22%0.01621%0.21CC..Hα-helixtrans-62.7-43.3178.5-67.2168.1000112.5L494 L500 T501 R502 L521 L524 A531 Y534 I535L494-L498 HydrophobicContact CD1-CD1 3.97Å; L494-L498 HydrophobicContact CD1-CG 4.14Å; L494-L498 HydrophobicContact CG-CD1 3.92Å; L494-L498 WeakPolarHBondContact O-CG 3.33Å; L494-L498 PolarHBondContact O-N 3.02Å; L498-L500 VanDerWaalsContact C-N 3.35Å; L498-L500 PolarHBondContact O-N 3.2Å; L498-T501 PolarHBondContact O-OG1 2.8Å; L498-T501 VanDerWaalsContact O-OG1 3.12Å; L498-R502 WeakPolarHBondContact O-CB 3.29Å; L498-R502 PolarHBondContact O-N 3.21Å; L498-L521 HydrophobicContact CD2-CD1 3.99Å; L498-L524 HydrophobicContact CD2-CB 4.13Å; L498-L524 HydrophobicContact CD2-CD1 4.49Å; L498-A531 HydrophobicContact CD1-CB 3.55Å; L498-A531 HydrophobicContact CD2-CB 3.77Å; L498-A531 HydrophobicContact CG-CB 4.26Å; L498-Y534 HydrophobicContact CD1-CD2 3.79Å; L498-Y534 HydrophobicContact CD1-CG 4.38Å; L498-I535 HydrophobicContact CB-CD1 4.16Å; L498-I535 HydrophobicContact CD2-CG1 4.21Å
499E97.2Very high96.1Very high81 Ų8151 Ų5138%0.37924%0.239SC..Hα-helixtrans-64.2-41.3177.7175.757.7-163.900111.8Q495 T496 R502 R503Q495-E499 WeakPolarHBondContact O-CB 3.14Å; Q495-E499 PolarHBondContact O-N 3.49Å; T496-E499 PolarHBondContact O-N 3.17Å; E499-R502 IonicContact OE1-CZ 2.77Å; E499-R502 IonicContact OE1-NH2 3.84Å; E499-R502 PolarHBondContact OE1-NH2 2.89Å; E499-R502 IonicContact OE2-CZ 3.68Å; E499-R502 VanDerWaalsContact OE2-CZ 3.29Å; E499-R502 IonicContact OE2-NE 3.63Å; E499-R502 PolarHBondContact OE2-NE 3.01Å; E499-R502 IonicContact OE2-NH2 3.68Å; E499-R502 PolarHBondContact OE2-NH2 3.48Å; E499-R503 VanDerWaalsContact O-CB 3.26Å; E499-R503 WeakPolarHBondContact O-CB 3.46Å; E499-R503 PolarHBondContact O-N 3.21Å
500L98Very high96.3Very high18 Ų1845.7 Ų45.79%0.09422%0.217CC..Hα-helixtrans-68.1-45.1-179.7-71.8176.1000112F462 F465 T496 A497 L498 R503 C504F462-L500 HydrophobicContact CB-CD1 3.76Å; F462-L500 HydrophobicContact CD1-CD1 4.06Å; F462-L500 HydrophobicContact CG-CD1 3.91Å; F465-L500 HydrophobicContact CB-CB 4.21Å; F465-L500 HydrophobicContact CB-CD1 4.21Å; F465-L500 HydrophobicContact CB-CD2 3.79Å; F465-L500 HydrophobicContact CB-CG 4.29Å; F465-L500 HydrophobicContact CD1-CB 3.64Å; F465-L500 HydrophobicContact CD2-CB 4.13Å; F465-L500 HydrophobicContact CD2-CD1 3.88Å; F465-L500 HydrophobicContact CE1-CB 3.97Å; F465-L500 HydrophobicContact CE2-CB 4.42Å; F465-L500 HydrophobicContact CE2-CD1 4.48Å; F465-L500 HydrophobicContact CG-CB 3.73Å; F465-L500 HydrophobicContact CG-CD1 4.05Å; F465-L500 HydrophobicContact CG-CD2 4.26Å; F465-L500 HydrophobicContact CG-CG 4.23Å; F465-L500 HydrophobicContact CZ-CB 4.37Å; T496-L500 HydrophobicContact CG2-CD1 3.79Å; T496-L500 HydrophobicContact CG2-CG 4.19Å; T496-L500 VanDerWaalsContact O-CB 3.31Å; T496-L500 WeakPolarHBondContact O-CB 3.27Å; T496-L500 WeakPolarHBondContact O-CG 3.35Å; T496-L500 PolarHBondContact O-N 2.83Å; A497-L500 PolarHBondContact O-N 3.43Å; L498-L500 VanDerWaalsContact C-N 3.35Å; L498-L500 PolarHBondContact O-N 3.2Å; L500-R503 PolarHBondContact O-N 2.78Å; L500-C504 PolarHBondContact O-N 3.3Å
501T97.5Very high96.4Very high0 Ų044.9 Ų44.90%021%0.208CC..Hα-helixtrans-66.1-4617652.40000111.2F465 L480 A497 L498 R503 C504 L505 A520 L524F465-T501 HydrophobicContact CE1-CG2 4.07Å; F465-T501 HydrophobicContact CZ-CG2 4.09Å; L480-T501 HydrophobicContact CD1-CG2 3.67Å; A497-T501 PolarHBondContact O-N 2.88Å; A497-T501 PolarHBondContact O-OG1 3.4Å; A497-T501 VanDerWaalsContact O-OG1 3.11Å; L498-T501 PolarHBondContact O-OG1 2.8Å; L498-T501 VanDerWaalsContact O-OG1 3.12Å; T501-R503 VanDerWaalsContact C-N 3.32Å; T501-R503 PolarHBondContact O-N 2.88Å; T501-C504 PolarHBondContact O-N 3.4Å; T501-C504 VanDerWaalsContact O-N 3.13Å; T501-L505 PolarHBondContact O-N 3.18Å; T501-A520 HydrophobicContact CG2-CB 4.23Å; T501-L524 HydrophobicContact CG2-CD1 4.14Å
502R97.6Very high96.5Very high26 Ų2642.1 Ų42.110%0.09819%0.194CC..Hα-helixtrans-56.8-42.5175.3-173.4-166.969.670-0.4112.5L498 E499 L505 I506 L521 I535 V542L498-R502 WeakPolarHBondContact O-CB 3.29Å; L498-R502 PolarHBondContact O-N 3.21Å; E499-R502 IonicContact OE1-CZ 2.77Å; E499-R502 IonicContact OE1-NH2 3.84Å; E499-R502 PolarHBondContact OE1-NH2 2.89Å; E499-R502 IonicContact OE2-CZ 3.68Å; E499-R502 VanDerWaalsContact OE2-CZ 3.29Å; E499-R502 IonicContact OE2-NE 3.63Å; E499-R502 PolarHBondContact OE2-NE 3.01Å; E499-R502 IonicContact OE2-NH2 3.68Å; E499-R502 PolarHBondContact OE2-NH2 3.48Å; R502-L505 PolarHBondContact O-N 3.17Å; R502-I506 HydrophobicContact CG-CD1 3.9Å; R502-I506 WeakPolarHBondContact O-CG1 3.28Å; R502-I506 PolarHBondContact O-N 3.48Å; R502-L521 HydrophobicContact CB-CD2 4.42Å; R502-I535 HydrophobicContact CB-CD1 4.39Å; R502-I535 HydrophobicContact CG-CD1 4.47Å; R502-V542 HydrophobicContact CG-CG2 4.07Å
503R97.3Very high96.6Very high89 Ų8936.7 Ų36.734%0.33617%0.168SC..Hα-helixtrans-65.3-41.9176.5-169.4-175.977.5-177.23.8111.8F465 S466 E499 L500 T501 L505 I506 D507F465-R503 PolarHBondContact O-NH2 2.67Å; S466-R503 PolarHBondContact OG-NH2 3.14Å; E499-R503 VanDerWaalsContact O-CB 3.26Å; E499-R503 WeakPolarHBondContact O-CB 3.46Å; E499-R503 PolarHBondContact O-N 3.21Å; L500-R503 PolarHBondContact O-N 2.78Å; T501-R503 VanDerWaalsContact C-N 3.32Å; T501-R503 PolarHBondContact O-N 2.88Å; R503-L505 VanDerWaalsContact C-N 3.32Å; R503-I506 PolarHBondContact O-N 3.46Å; R503-D507 HydrophobicContact CG-CB 4.19Å; R503-D507 WeakPolarHBondContact O-CA 3.15Å; R503-D507 WeakPolarHBondContact O-CB 3.46Å; R503-D507 PolarHBondContact O-N 3.29Å
504C97.9Very high96.7Very high1 Ų137.6 Ų37.61%0.00717%0.172CC..Hα-helixtrans-64.1-38175.4-850000112.1L500 T501 D508 V513 A517L500-C504 PolarHBondContact O-N 3.3Å; T501-C504 PolarHBondContact O-N 3.4Å; T501-C504 VanDerWaalsContact O-N 3.13Å; C504-D508 WeakPolarHBondContact O-CB 3.24Å; C504-V513 HydrophobicContact CB-CG1 4.02Å; C504-A517 HydrophobicContact CB-CB 3.67Å
505L97.8Very high96.7Very high1 Ų137.4 Ų37.41%0.00517%0.171CC..Hα-helixtrans-62.6-48.2175.8176.558000112.4T501 R502 R503 A517 A518 L521 V542 A545 L546 I549T501-L505 PolarHBondContact O-N 3.18Å; R502-L505 PolarHBondContact O-N 3.17Å; R503-L505 VanDerWaalsContact C-N 3.32Å; L505-A517 HydrophobicContact CB-CB 4.04Å; L505-A518 HydrophobicContact CD1-CB 3.76Å; L505-L521 HydrophobicContact CD2-CD2 3.8Å; L505-V542 HydrophobicContact CD2-CB 4.48Å; L505-V542 HydrophobicContact CD2-CG1 3.84Å; L505-V542 HydrophobicContact CD2-CG2 4.41Å; L505-A545 HydrophobicContact CD1-CB 4.4Å; L505-A545 HydrophobicContact CG-CB 4.17Å; L505-L546 HydrophobicContact CD1-CD2 4.1Å; L505-L546 HydrophobicContact CD2-CD2 4.24Å; L505-L546 HydrophobicContact CD2-CG 4.4Å; L505-I549 HydrophobicContact CD1-CD1 3.4Å; L505-I549 VanDerWaalsContact CD1-CD1 3.4Å
506I97.2Very high96.7Very high41 Ų4135.4 Ų35.421%0.2116%0.161CC..Hα-helixtrans-86.6-48.5-170.8-61.4172.4000111.9R502 R503 P541 V542 A545R502-I506 HydrophobicContact CG-CD1 3.9Å; R502-I506 WeakPolarHBondContact O-CG1 3.28Å; R502-I506 PolarHBondContact O-N 3.48Å; R503-I506 PolarHBondContact O-N 3.46Å; I506-P541 HydrophobicContact CD1-CB 3.84Å; I506-V542 HydrophobicContact CD1-CG2 4.12Å; I506-A545 HydrophobicContact CG1-CB 4.24Å
507D95.7Very high96.8Very high112 Ų11233.5 Ų33.560%0.59915%0.149SC*.Hα-helixtrans-104.6-10.2-163.4-60.7-42.1000114.2R503R503-D507 HydrophobicContact CG-CB 4.19Å; R503-D507 WeakPolarHBondContact O-CA 3.15Å; R503-D507 WeakPolarHBondContact O-CB 3.46Å; R503-D507 PolarHBondContact O-N 3.29Å
508D97.1Very high96.8Very high22 Ų2233.6 Ų33.612%0.11815%0.15CC..  trans-66.3156.5-179.7-149.2-64.9000111.4R473 C504 E510 V513 K514R473-D508 IonicContact CZ-OD1 3.88Å; R473-D508 IonicContact CZ-OD2 3.8Å; R473-D508 IonicContact NE-OD1 2.68Å; R473-D508 IonicContact NE-OD2 2.82Å; R473-D508 PolarHBondContact NE-OD2 3.18Å; R473-D508 IonicContact NH2-OD1 2.68Å; R473-D508 PolarHBondContact NH2-OD1 3.44Å; R473-D508 IonicContact NH2-OD2 2.82Å; R473-D508 PolarHBondContact NH2-OD2 2.99Å; C504-D508 WeakPolarHBondContact O-CB 3.24Å; D508-E510 PolarHBondContact OD1-N 3.33Å; D508-V513 HydrophobicContact CB-CB 4.43Å; D508-V513 HydrophobicContact CB-CG1 4.27Å; D508-V513 WeakPolarHBondContact OD2-CG1 3.36Å; D508-K514 HydrophobicContact CB-CG 4.32Å; D508-K514 WeakPolarHBondContact O-CE 3.49Å; D508-K514 PolarHBondContact O-NZ 3.45Å
509R94.2Very high96.7Very high188 Ų18834.1 Ų34.171%0.70915%0.153SC*.SBendtrans-98.3-18.6-178.574.5-166.1174.1-174.5-5.4112.5E468E468-R509 PolarHBondContact O-NH2 3.46Å
510E95.5Very high96.7Very high32 Ų3230.3 Ų30.315%0.1514%0.135CC..SBendtrans-105.3118.7-173.4-64.1171.2-12400109.2W368 G470 R473 D508 P512 V513 K514W368-E510 HydrophobicContact CZ2-CB 4.21Å; W368-E510 WeakPolarHBondContact CZ2-OE2 3.39Å; W368-E510 PolarHBondContact NE1-OE2 2.94Å; G470-E510 VanDerWaalsContact CA-OE2 3.26Å; G470-E510 WeakPolarHBondContact CA-OE2 3.2Å; R473-E510 IonicContact CZ-OE1 2.72Å; R473-E510 IonicContact NH1-OE1 2.6Å; R473-E510 IonicContact NH2-OE1 3.93Å; R473-E510 PolarHBondContact NH2-OE1 2.91Å; D508-E510 PolarHBondContact OD1-N 3.33Å; E510-P512 VanDerWaalsContact C-CD 3.48Å; E510-V513 HydrophobicContact CB-CG2 4Å; E510-V513 WeakPolarHBondContact O-CB 3.44Å; E510-V513 PolarHBondContact O-N 2.95Å; E510-V513 VanDerWaalsContact O-N 3.13Å; E510-K514 PolarHBondContact O-N 2.84Å
511M95.1Very high96.7Very high25 Ų2529.5 Ų29.512%0.12313%0.131CC..Hα-helixtrans-57.1-42.4-173-165.762.174.300114.2Y373 I376 V513 K514 V515 I549 E552 T553Y373-M511 HydrophobicContact CE1-CG 4.25Å; I376-M511 HydrophobicContact CD1-CB 4.16Å; I376-M511 HydrophobicContact CD1-CG 3.8Å; M511-V513 PolarHBondContact O-N 3.18Å; M511-K514 WeakPolarHBondContact O-CA 3.38Å; M511-K514 WeakPolarHBondContact O-CB 3.46Å; M511-K514 PolarHBondContact O-N 3Å; M511-K514 HydrophobicContact SD-CB 4.42Å; M511-K514 HydrophobicContact SD-CD 4.15Å; M511-V515 PolarHBondContact O-N 3.3Å; M511-V515 VanDerWaalsContact O-N 3.14Å; M511-I549 HydrophobicContact SD-CG1 4.11Å; M511-I549 HydrophobicContact SD-CG2 4.03Å; M511-E552 HydrophobicContact CE-CB 4.05Å; M511-E552 HydrophobicContact CE-CG 4.31Å; M511-T553 HydrophobicContact CG-CG2 3.48Å; M511-T553 VanDerWaalsContact CG-CG2 3.48Å; M511-T553 HydrophobicContact SD-CG2 3.99Å
512P95.5Very high96.6Very high4 Ų430 Ų303%0.02613%0.133CC..Hα-helixtrans-62.5-28.7-179.8-20.230.9000112.9W368 P372 Y375 I376 E510 E516W368-P512 HydrophobicContact CD2-CG 4.37Å; W368-P512 HydrophobicContact CE3-CB 4.11Å; W368-P512 HydrophobicContact CE3-CG 4.06Å; W368-P512 HydrophobicContact CH2-CB 3.55Å; W368-P512 HydrophobicContact CH2-CG 4.01Å; W368-P512 HydrophobicContact CZ2-CB 4.26Å; W368-P512 HydrophobicContact CZ2-CG 4.28Å; W368-P512 HydrophobicContact CZ3-CB 3.46Å; W368-P512 VanDerWaalsContact CZ3-CB 3.46Å; W368-P512 HydrophobicContact CZ3-CG 3.9Å; P372-P512 HydrophobicContact CB-CG 3.95Å; Y375-P512 HydrophobicContact CD1-CB 3.99Å; Y375-P512 HydrophobicContact CD1-CG 4.11Å; Y375-P512 HydrophobicContact CE1-CB 4.26Å; I376-P512 HydrophobicContact CD1-CB 4.35Å; I376-P512 HydrophobicContact CD1-CG 4.1Å; I376-P512 HydrophobicContact CG1-CB 3.95Å; I376-P512 HydrophobicContact CG1-CG 3.99Å; E510-P512 VanDerWaalsContact C-CD 3.48Å; P512-E516 WeakPolarHBondContact O-CG 3.46Å; P512-E516 PolarHBondContact O-N 3.26Å
513V97.2Very high96.5Very high0 Ų029.8 Ų29.80%014%0.135CC..Hα-helixtrans-68-37.7174.1-175.10000111W368 G470 R473 A474 C504 D508 E510 M511 A517W368-V513 HydrophobicContact CH2-CG2 3.93Å; W368-V513 HydrophobicContact CZ2-CG2 3.92Å; G470-V513 WeakPolarHBondContact O-CG2 3.29Å; R473-V513 HydrophobicContact CB-CG1 3.78Å; R473-V513 HydrophobicContact CB-CG2 4.27Å; A474-V513 HydrophobicContact CB-CG2 4.14Å; C504-V513 HydrophobicContact CB-CG1 4.02Å; D508-V513 HydrophobicContact CB-CB 4.43Å; D508-V513 HydrophobicContact CB-CG1 4.27Å; D508-V513 WeakPolarHBondContact OD2-CG1 3.36Å; E510-V513 HydrophobicContact CB-CG2 4Å; E510-V513 WeakPolarHBondContact O-CB 3.44Å; E510-V513 PolarHBondContact O-N 2.95Å; E510-V513 VanDerWaalsContact O-N 3.13Å; M511-V513 PolarHBondContact O-N 3.18Å; V513-A517 WeakPolarHBondContact O-CB 3.31Å; V513-A517 PolarHBondContact O-N 3.35Å
514K97.5Very high96.4Very high32 Ų3225.6 Ų25.614%0.13912%0.119CC..Hα-helixtrans-66.6-41.4178.5-62.5-168.3175.4-167.70112.1D508 E510 M511 A517 A518 I549D508-K514 HydrophobicContact CB-CG 4.32Å; D508-K514 WeakPolarHBondContact O-CE 3.49Å; D508-K514 PolarHBondContact O-NZ 3.45Å; E510-K514 PolarHBondContact O-N 2.84Å; M511-K514 WeakPolarHBondContact O-CA 3.38Å; M511-K514 WeakPolarHBondContact O-CB 3.46Å; M511-K514 PolarHBondContact O-N 3Å; M511-K514 HydrophobicContact SD-CB 4.42Å; M511-K514 HydrophobicContact SD-CD 4.15Å; K514-A517 PolarHBondContact O-N 3.22Å; K514-A518 WeakPolarHBondContact O-CB 3.32Å; K514-A518 PolarHBondContact O-N 3.25Å; K514-I549 HydrophobicContact CB-CD1 3.73Å; K514-I549 HydrophobicContact CB-CG1 4.24Å; K514-I549 HydrophobicContact CD-CD1 4.32Å; K514-I549 HydrophobicContact CD-CG1 4.32Å
515V95.9Very high96.3Very high0 Ų025.5 Ų25.50%012%0.119CC..Hα-helixtrans-61.9-51.6177.5179.10000110.4I376 F380 M511 A517 A518 I519 I549 T553 L558I376-V515 HydrophobicContact CD1-CG2 3.86Å; I376-V515 HydrophobicContact CG1-CG2 4.31Å; I376-V515 HydrophobicContact CG2-CG1 4.39Å; I376-V515 HydrophobicContact CG2-CG2 4.29Å; F380-V515 HydrophobicContact CD2-CG1 4.36Å; F380-V515 HydrophobicContact CE2-CG1 3.62Å; F380-V515 HydrophobicContact CZ-CG1 3.76Å; M511-V515 PolarHBondContact O-N 3.3Å; M511-V515 VanDerWaalsContact O-N 3.14Å; V515-A517 VanDerWaalsContact C-N 3.27Å; V515-A517 PolarHBondContact O-N 2.75Å; V515-A518 WeakPolarHBondContact O-CB 3.44Å; V515-A518 PolarHBondContact O-N 3.39Å; V515-A518 VanDerWaalsContact O-N 3.11Å; V515-I519 HydrophobicContact CG1-CD1 4.31Å; V515-I519 PolarHBondContact O-N 3.26Å; V515-I549 HydrophobicContact CG2-CG2 3.81Å; V515-T553 HydrophobicContact CG2-CG2 4.14Å; V515-L558 HydrophobicContact CG1-CD2 4.35Å; V515-L558 HydrophobicContact CG2-CD1 4.37Å
516E96.4Very high96Very high28 Ų2827.7 Ų27.713%0.13113%0.134CC..Hα-helixtrans-60.6-37.5176.9-73.7-75.9-169.800112.5A474 C477 P512 A520A474-E516 HydrophobicContact CB-CB 4.48Å; A474-E516 HydrophobicContact CB-CG 4.2Å; C477-E516 HydrophobicContact CB-CB 3.84Å; P512-E516 WeakPolarHBondContact O-CG 3.46Å; P512-E516 PolarHBondContact O-N 3.26Å; E516-A520 WeakPolarHBondContact O-CB 3.33Å; E516-A520 PolarHBondContact O-N 2.9Å
517A97.7Very high95.8Very high0 Ų029.1 Ų29.10%014%0.142CC..Hα-helixtrans-68.6-35.2176.100000113C504 L505 V513 K514 V515 L521C504-A517 HydrophobicContact CB-CB 3.67Å; L505-A517 HydrophobicContact CB-CB 4.04Å; V513-A517 WeakPolarHBondContact O-CB 3.31Å; V513-A517 PolarHBondContact O-N 3.35Å; K514-A517 PolarHBondContact O-N 3.22Å; V515-A517 VanDerWaalsContact C-N 3.27Å; V515-A517 PolarHBondContact O-N 2.75Å; A517-L521 WeakPolarHBondContact O-CB 3.43Å; A517-L521 PolarHBondContact O-N 3.42Å
518A97.2Very high95.6Very high2 Ų225.2 Ų25.22%0.01712%0.12CC..Hα-helixtrans-60.6-52.6175.700000111L505 K514 V515 L521 Q522 L546 L558L505-A518 HydrophobicContact CD1-CB 3.76Å; K514-A518 WeakPolarHBondContact O-CB 3.32Å; K514-A518 PolarHBondContact O-N 3.25Å; V515-A518 WeakPolarHBondContact O-CB 3.44Å; V515-A518 PolarHBondContact O-N 3.39Å; V515-A518 VanDerWaalsContact O-N 3.11Å; A518-L521 PolarHBondContact O-N 2.86Å; A518-Q522 PolarHBondContact O-N 3.13Å; A518-L546 HydrophobicContact CB-CD2 3.41Å; A518-L546 VanDerWaalsContact CB-CD2 3.41Å; A518-L558 HydrophobicContact CB-CD2 3.56Å
519I96Very high95.2Very high15 Ų1530.6 Ų30.68%0.07715%0.145CC..Hα-helixtrans-63.1-49.7-180-61.2170.2000109.8F380 V515 L521 Q522 V523 L558 V561F380-I519 HydrophobicContact CD1-CD1 4.2Å; F380-I519 HydrophobicContact CE1-CD1 3.25Å; F380-I519 HydrophobicContact CZ-CD1 3.63Å; V515-I519 HydrophobicContact CG1-CD1 4.31Å; V515-I519 PolarHBondContact O-N 3.26Å; I519-L521 VanDerWaalsContact C-N 3.32Å; I519-L521 PolarHBondContact O-N 3.19Å; I519-Q522 PolarHBondContact O-N 3.1Å; I519-V523 HydrophobicContact CG2-CG2 4.36Å; I519-V523 WeakPolarHBondContact O-CG2 3.14Å; I519-V523 PolarHBondContact O-N 3.46Å; I519-L558 HydrophobicContact CG1-CD2 4.48Å; I519-V561 HydrophobicContact CG1-CG2 4.01Å
520A96.7Very high95.1Very high0 Ų026.2 Ų26.20%013%0.131CC..Hα-helixtrans-60-39.9179.400000113C477 H481 T501 E516 L524C477-A520 HydrophobicContact CB-CB 4.22Å; C477-A520 VanDerWaalsContact O-CB 3.28Å; C477-A520 WeakPolarHBondContact O-CB 3.34Å; H481-A520 HydrophobicContact CB-CB 3.96Å; T501-A520 HydrophobicContact CG2-CB 4.23Å; E516-A520 WeakPolarHBondContact O-CB 3.33Å; E516-A520 PolarHBondContact O-N 2.9Å; A520-L524 VanDerWaalsContact O-CB 3.31Å; A520-L524 WeakPolarHBondContact O-CB 3.19Å; A520-L524 WeakPolarHBondContact O-CD1 3.49Å; A520-L524 WeakPolarHBondContact O-CG 3.4Å; A520-L524 PolarHBondContact O-N 3.28Å
521L97.4Very high95Very high2 Ų224.7 Ų24.71%0.0112%0.124CC..Hα-helixtrans-66.1-46.2178.3179.662.1000111.6L498 R502 L505 A517 A518 I519 L524 I525 I535 V542L498-L521 HydrophobicContact CD2-CD1 3.99Å; R502-L521 HydrophobicContact CB-CD2 4.42Å; L505-L521 HydrophobicContact CD2-CD2 3.8Å; A517-L521 WeakPolarHBondContact O-CB 3.43Å; A517-L521 PolarHBondContact O-N 3.42Å; A518-L521 PolarHBondContact O-N 2.86Å; I519-L521 VanDerWaalsContact C-N 3.32Å; I519-L521 PolarHBondContact O-N 3.19Å; L521-L524 PolarHBondContact O-N 3.42Å; L521-I525 HydrophobicContact CD1-CD1 4Å; L521-I525 HydrophobicContact CD1-CG1 4.41Å; L521-I525 HydrophobicContact CG-CD1 3.88Å; L521-I525 WeakPolarHBondContact O-CD1 3.02Å; L521-I525 VanDerWaalsContact O-CG1 3.28Å; L521-I525 WeakPolarHBondContact O-CG1 3.14Å; L521-I525 PolarHBondContact O-N 3.46Å; L521-I535 HydrophobicContact CD1-CD1 3.9Å; L521-I535 HydrophobicContact CD1-CG1 4.2Å; L521-V542 HydrophobicContact CD2-CG1 4.08Å; L521-V542 HydrophobicContact CD2-CG2 4.1Å
522Q96.2Very high94.8Very high10 Ų1025.6 Ų25.65%0.04713%0.127CC..Hα-helixtrans-62.8-47.4179.9177.3-81.5-55.800111.5A518 I519 L524 I525 S526 V561 K564 M565A518-Q522 PolarHBondContact O-N 3.13Å; I519-Q522 PolarHBondContact O-N 3.1Å; Q522-L524 VanDerWaalsContact C-N 3.31Å; Q522-L524 PolarHBondContact O-N 3.01Å; Q522-I525 WeakPolarHBondContact O-CB 3.21Å; Q522-I525 PolarHBondContact O-N 2.9Å; Q522-I525 VanDerWaalsContact O-N 3.09Å; Q522-S526 PolarHBondContact NE2-OG 3.2Å; Q522-S526 PolarHBondContact O-N 2.89Å; Q522-S526 PolarHBondContact O-OG 2.74Å; Q522-V561 HydrophobicContact CB-CB 4.45Å; Q522-V561 HydrophobicContact CB-CG1 3.75Å; Q522-V561 HydrophobicContact CB-CG2 4.34Å; Q522-V561 HydrophobicContact CG-CB 4.45Å; Q522-V561 HydrophobicContact CG-CG1 4.12Å; Q522-V561 HydrophobicContact CG-CG2 4.5Å; Q522-K564 HydrophobicContact CG-CB 3.99Å; Q522-M565 HydrophobicContact CB-CG 4.3Å; Q522-M565 HydrophobicContact CB-SD 4.16Å; Q522-M565 HydrophobicContact CG-CG 4.08Å; Q522-M565 HydrophobicContact CG-SD 4.22Å
523V95Very high94.7Very high22 Ų2232.3 Ų32.313%0.13316%0.158CC..Hα-helixtrans-66.2-35.3-179.3-175.80000111.3C484 I519 I525 N527C484-V523 HydrophobicContact CB-CB 4.38Å; C484-V523 HydrophobicContact CB-CG1 3.6Å; C484-V523 WeakPolarHBondContact SG-CG1 3.27Å; I519-V523 HydrophobicContact CG2-CG2 4.36Å; I519-V523 WeakPolarHBondContact O-CG2 3.14Å; I519-V523 PolarHBondContact O-N 3.46Å; V523-I525 VanDerWaalsContact C-N 3.34Å; V523-I525 PolarHBondContact O-N 2.79Å; V523-N527 WeakPolarHBondContact CG1-ND2 3.05Å; V523-N527 WeakPolarHBondContact O-CB 3.31Å; V523-N527 PolarHBondContact O-N 2.64Å; V523-N527 VanDerWaalsContact O-N 3.14Å; V523-N527 PolarHBondContact O-ND2 2.94Å
524L95.3Very high94.5Very high0 Ų035.2 Ų35.20%017%0.169CC..Hα-helixtrans-62.2-39.4171.4-80.6169.4000112.6L480 C484 F488 L498 T501 A520 L521 Q522 Q528L480-L524 HydrophobicContact CB-CD1 4.36Å; C484-L524 HydrophobicContact CB-CD2 4.29Å; F488-L524 HydrophobicContact CE2-CD2 4.5Å; L498-L524 HydrophobicContact CD2-CB 4.13Å; L498-L524 HydrophobicContact CD2-CD1 4.49Å; T501-L524 HydrophobicContact CG2-CD1 4.14Å; A520-L524 VanDerWaalsContact O-CB 3.31Å; A520-L524 WeakPolarHBondContact O-CB 3.19Å; A520-L524 WeakPolarHBondContact O-CD1 3.49Å; A520-L524 WeakPolarHBondContact O-CG 3.4Å; A520-L524 PolarHBondContact O-N 3.28Å; L521-L524 PolarHBondContact O-N 3.42Å; Q522-L524 VanDerWaalsContact C-N 3.31Å; Q522-L524 PolarHBondContact O-N 3.01Å; L524-Q528 WeakPolarHBondContact O-CB 3.33Å; L524-Q528 VanDerWaalsContact O-CG 3.31Å; L524-Q528 WeakPolarHBondContact O-CG 3.19Å; L524-Q528 PolarHBondContact O-N 2.71Å; L524-Q528 VanDerWaalsContact O-N 3.15Å
525I95Very high94.3Very high0 Ų033.9 Ų33.90%016%0.164CC..Hα-helixtrans-66.1-47.6178.7-71.6162.2000110.7L521 Q522 V523 N527 Q528 A531 K532 I535 M565 E568 Y569L521-I525 HydrophobicContact CD1-CD1 4Å; L521-I525 HydrophobicContact CD1-CG1 4.41Å; L521-I525 HydrophobicContact CG-CD1 3.88Å; L521-I525 WeakPolarHBondContact O-CD1 3.02Å; L521-I525 VanDerWaalsContact O-CG1 3.28Å; L521-I525 WeakPolarHBondContact O-CG1 3.14Å; L521-I525 PolarHBondContact O-N 3.46Å; Q522-I525 WeakPolarHBondContact O-CB 3.21Å; Q522-I525 PolarHBondContact O-N 2.9Å; Q522-I525 VanDerWaalsContact O-N 3.09Å; V523-I525 VanDerWaalsContact C-N 3.34Å; V523-I525 PolarHBondContact O-N 2.79Å; I525-N527 VanDerWaalsContact C-N 3.28Å; I525-N527 PolarHBondContact O-N 2.81Å; I525-Q528 PolarHBondContact O-N 3.06Å; I525-A531 HydrophobicContact CG1-CB 4.38Å; I525-K532 HydrophobicContact CG2-CG 4.11Å; I525-I535 HydrophobicContact CD1-CB 4.33Å; I525-I535 HydrophobicContact CD1-CG1 4.18Å; I525-I535 HydrophobicContact CD1-CG2 3.98Å; I525-I535 HydrophobicContact CG1-CG1 4.33Å; I525-M565 HydrophobicContact CD1-CE 3.69Å; I525-M565 HydrophobicContact CD1-SD 3.57Å; I525-M565 VanDerWaalsContact CD1-SD 3.57Å; I525-E568 HydrophobicContact CG2-CB 4.5Å; I525-Y569 HydrophobicContact CD1-CE2 4.14Å; I525-Y569 HydrophobicContact CG2-CE2 3.81Å; I525-Y569 WeakPolarHBondContact CG2-OH 3.3Å
526S93.1Very high94.3Very high46 Ų4636 Ų3632%0.32218%0.177SC..Hα-helixtrans-66.1-29-178.5-62.70000113.2Q522Q522-S526 PolarHBondContact NE2-OG 3.2Å; Q522-S526 PolarHBondContact O-N 2.89Å; Q522-S526 PolarHBondContact O-OG 2.74Å
527N92.4Very high94.2Very high72 Ų7239.3 Ų39.339%0.38520%0.2SC..Hα-helixtrans-96.3-5.6-178.9-74.1-82.1000114.5C484 V523 I525C484-N527 HydrophobicContact CB-CB 4.38Å; V523-N527 WeakPolarHBondContact CG1-ND2 3.05Å; V523-N527 WeakPolarHBondContact O-CB 3.31Å; V523-N527 PolarHBondContact O-N 2.64Å; V523-N527 VanDerWaalsContact O-N 3.14Å; V523-N527 PolarHBondContact O-ND2 2.94Å; I525-N527 VanDerWaalsContact C-N 3.28Å; I525-N527 PolarHBondContact O-N 2.81Å
528Q91.8Very high94.1Very high29 Ų2942.8 Ų42.814%0.13622%0.216CC..  trans-134.4100.6-175-56.9-73.2-30.700110.6C484 V486 L494 L524 I525 K530 A531C484-Q528 PolarHBondContact O-NE2 2.89Å; V486-Q528 PolarHBondContact O-NE2 2.89Å; L494-Q528 HydrophobicContact CD1-CB 4.24Å; L494-Q528 HydrophobicContact CD1-CG 4.12Å; L494-Q528 HydrophobicContact CD2-CB 4.42Å; L524-Q528 WeakPolarHBondContact O-CB 3.33Å; L524-Q528 VanDerWaalsContact O-CG 3.31Å; L524-Q528 WeakPolarHBondContact O-CG 3.19Å; L524-Q528 PolarHBondContact O-N 2.71Å; L524-Q528 VanDerWaalsContact O-N 3.15Å; I525-Q528 PolarHBondContact O-N 3.06Å; Q528-K530 VanDerWaalsContact C-N 3.29Å; Q528-K530 PolarHBondContact O-N 2.86Å; Q528-K530 VanDerWaalsContact O-N 3.15Å; Q528-A531 HydrophobicContact CB-CB 3.88Å; Q528-A531 WeakPolarHBondContact O-CA 3.36Å; Q528-A531 WeakPolarHBondContact O-CB 3.4Å; Q528-A531 PolarHBondContact O-N 3.41Å
529E88.9Confident94Very high136 Ų13643 Ų4364%0.63622%0.217SC*.Hα-helixtrans-55.1-41.4-175.6-171.957-157.400113.6A531 K532E529-A531 PolarHBondContact O-N 2.9Å; E529-K532 WeakPolarHBondContact O-CB 3.45Å; E529-K532 PolarHBondContact O-N 3.12Å; E529-K532 VanDerWaalsContact OE2-CE 3.25Å; E529-K532 WeakPolarHBondContact OE2-CE 3.17Å; E529-K532 IonicContact OE2-NZ 3.72Å; E529-K532 PolarHBondContact OE2-NZ 2.99Å; E529-K532 VanDerWaalsContact OE2-NZ 3.07Å
530K91.7Very high93.9Very high96 Ų9648.1 Ų48.142%0.41724%0.235SC..Hα-helixtrans-65.2-20.3176.1-68.1-172.7-177.8-1790113.9D491 L494 Q528 K532 Y534D491-K530 IonicContact OD1-NZ 3.2Å; D491-K530 PolarHBondContact OD1-NZ 3.27Å; D491-K530 IonicContact OD2-NZ 3.32Å; D491-K530 PolarHBondContact OD2-NZ 2.95Å; L494-K530 HydrophobicContact CD2-CB 3.96Å; Q528-K530 VanDerWaalsContact C-N 3.29Å; Q528-K530 PolarHBondContact O-N 2.86Å; Q528-K530 VanDerWaalsContact O-N 3.15Å; K530-K532 PolarHBondContact O-N 3.5Å; K530-Y534 HydrophobicContact CB-CE2 4.2Å; K530-Y534 WeakPolarHBondContact O-CD2 3.45Å
531A92.3Very high93.9Very high0 Ų050.6 Ų50.60%025%0.251CS..Hα-helixtrans-65.6-31.8178.400000111.8L498 I525 Q528 E529 E533 Y534 I535L498-A531 HydrophobicContact CD1-CB 3.55Å; L498-A531 HydrophobicContact CD2-CB 3.77Å; L498-A531 HydrophobicContact CG-CB 4.26Å; I525-A531 HydrophobicContact CG1-CB 4.38Å; Q528-A531 HydrophobicContact CB-CB 3.88Å; Q528-A531 WeakPolarHBondContact O-CA 3.36Å; Q528-A531 WeakPolarHBondContact O-CB 3.4Å; Q528-A531 PolarHBondContact O-N 3.41Å; E529-A531 PolarHBondContact O-N 2.9Å; A531-E533 PolarHBondContact O-N 3Å; A531-Y534 PolarHBondContact O-N 3.36Å; A531-I535 PolarHBondContact O-N 2.92Å; A531-I535 VanDerWaalsContact O-N 3.09Å
532K92.3Very high93.9Very high44 Ų4450.5 Ų50.519%0.19125%0.251CS..Hα-helixtrans-55-53.9177.8-58.7-177.7-169.6-176.80110.7I525 E529 K530 Y534 I535 T536 E568 Y569I525-K532 HydrophobicContact CG2-CG 4.11Å; E529-K532 WeakPolarHBondContact O-CB 3.45Å; E529-K532 PolarHBondContact O-N 3.12Å; E529-K532 VanDerWaalsContact OE2-CE 3.25Å; E529-K532 WeakPolarHBondContact OE2-CE 3.17Å; E529-K532 IonicContact OE2-NZ 3.72Å; E529-K532 PolarHBondContact OE2-NZ 2.99Å; E529-K532 VanDerWaalsContact OE2-NZ 3.07Å; K530-K532 PolarHBondContact O-N 3.5Å; K532-Y534 VanDerWaalsContact C-N 3.29Å; K532-Y534 PolarHBondContact O-N 3.47Å; K532-I535 PolarHBondContact O-N 3.01Å; K532-T536 PolarHBondContact O-N 3.37Å; K532-T536 PolarHBondContact O-OG1 2.9Å; K532-E568 WeakPolarHBondContact CE-OE2 3.46Å; K532-E568 IonicContact NZ-OE1 2.75Å; K532-E568 IonicContact NZ-OE2 3.67Å; K532-E568 PolarHBondContact NZ-OE2 2.94Å; K532-Y569 WeakPolarHBondContact CA-OH 3.48Å; K532-Y569 HydrophobicContact CB-CE1 4.41Å
533E92.4Very high93.8Very high144 Ų14450.1 Ų50.167%0.67325%0.249SC*.Hα-helixtrans-57.3-37.1178.4-61.6-176.4-17600113.8A531A531-E533 PolarHBondContact O-N 3Å
534Y92.8Very high93.8Very high61 Ų6153 Ų5324%0.23926%0.261CS..Hα-helixtrans-76.8-30.8-177.3-64.4-43.8000113.4L494 Q495 L498 K530 A531 K532L494-Y534 HydrophobicContact CD2-CE2 4.26Å; Q495-Y534 HydrophobicContact CG-CD1 3.94Å; Q495-Y534 HydrophobicContact CG-CD2 3.76Å; Q495-Y534 HydrophobicContact CG-CE1 3.73Å; Q495-Y534 HydrophobicContact CG-CE2 3.53Å; Q495-Y534 HydrophobicContact CG-CG 3.96Å; Q495-Y534 PolarHBondContact NE2-OH 2.99Å; L498-Y534 HydrophobicContact CD1-CD2 3.79Å; L498-Y534 HydrophobicContact CD1-CG 4.38Å; K530-Y534 HydrophobicContact CB-CE2 4.2Å; K530-Y534 WeakPolarHBondContact O-CD2 3.45Å; A531-Y534 PolarHBondContact O-N 3.36Å; K532-Y534 VanDerWaalsContact C-N 3.29Å; K532-Y534 PolarHBondContact O-N 3.47Å
535I94.9Very high93.9Very high4 Ų453.7 Ų53.72%0.02127%0.267CS..Hα-helixtrans-90.8-23.8-177.6-67.7-63.1000112.4L498 R502 L521 I525 A531 K532 P537 F538 I539 Y569L498-I535 HydrophobicContact CB-CD1 4.16Å; L498-I535 HydrophobicContact CD2-CG1 4.21Å; R502-I535 HydrophobicContact CB-CD1 4.39Å; R502-I535 HydrophobicContact CG-CD1 4.47Å; L521-I535 HydrophobicContact CD1-CD1 3.9Å; L521-I535 HydrophobicContact CD1-CG1 4.2Å; I525-I535 HydrophobicContact CD1-CB 4.33Å; I525-I535 HydrophobicContact CD1-CG1 4.18Å; I525-I535 HydrophobicContact CD1-CG2 3.98Å; I525-I535 HydrophobicContact CG1-CG1 4.33Å; A531-I535 PolarHBondContact O-N 2.92Å; A531-I535 VanDerWaalsContact O-N 3.09Å; K532-I535 PolarHBondContact O-N 3.01Å; I535-P537 VanDerWaalsContact C-N 3.29Å; I535-P537 WeakPolarHBondContact O-CD 3.46Å; I535-F538 CarbonylContact O-C 3.57Å; I535-F538 WeakPolarHBondContact O-CA 3.43Å; I535-F538 PolarHBondContact O-N 3.07Å; I535-I539 PolarHBondContact O-N 3.45Å; I535-Y569 WeakPolarHBondContact CB-OH 3.4Å
536T94.8Very high94Very high46 Ų4653.8 Ų53.828%0.28227%0.267SS..G310 helixtrans-39.1-47.9176.9-62.60000114.3K532 F538 I539 E572K532-T536 PolarHBondContact O-N 3.37Å; K532-T536 PolarHBondContact O-OG1 2.9Å; T536-F538 PolarHBondContact O-N 2.95Å; T536-F538 VanDerWaalsContact O-N 3.12Å; T536-I539 VanDerWaalsContact O-CG2 3.24Å; T536-I539 WeakPolarHBondContact O-CG2 3.36Å; T536-I539 PolarHBondContact O-N 3.48Å; T536-E572 HydrophobicContact CG2-CG 4.05Å; T536-E572 VanDerWaalsContact CG2-OE1 3.23Å; T536-E572 WeakPolarHBondContact CG2-OE1 3.29Å
537P94.2Very high94.1Very high96 Ų9652 Ų5262%0.62325%0.254SS*.G310 helixtrans-67.2-16.1-178.6-19.133.7000114.9I535I535-P537 VanDerWaalsContact C-N 3.29Å; I535-P537 WeakPolarHBondContact O-CD 3.46Å
538F95.5Very high94.2Very high74 Ų7451.8 Ų51.833%0.32525%0.25SS..G310 helixtrans-114.21.8-173.4-54.6-79000113.4I535 T536 R540 P541 V542I535-F538 CarbonylContact O-C 3.57Å; I535-F538 WeakPolarHBondContact O-CA 3.43Å; I535-F538 PolarHBondContact O-N 3.07Å; T536-F538 PolarHBondContact O-N 2.95Å; T536-F538 VanDerWaalsContact O-N 3.12Å; F538-R540 VanDerWaalsContact C-N 3.32Å; F538-R540 PolarHBondContact O-N 3.27Å; F538-P541 WeakPolarHBondContact O-CD 3.31Å; F538-V542 WeakPolarHBondContact O-CG2 3.28Å; F538-V542 PolarHBondContact O-N 3.34Å
539I94.6Very high94.3Very high7 Ų750.4 Ų50.44%0.03624%0.244CC..Hα-helixtrans-56-44.3-175.8-171.258.7000112.2I535 T536 V542 M543 M565 Y569 E572 V573I535-I539 PolarHBondContact O-N 3.45Å; T536-I539 VanDerWaalsContact O-CG2 3.24Å; T536-I539 WeakPolarHBondContact O-CG2 3.36Å; T536-I539 PolarHBondContact O-N 3.48Å; I539-V542 WeakPolarHBondContact O-CB 3.42Å; I539-V542 PolarHBondContact O-N 3.07Å; I539-V542 VanDerWaalsContact O-N 3.14Å; I539-M543 HydrophobicContact CD1-CG 4.1Å; I539-M543 HydrophobicContact CD1-SD 4.06Å; I539-M543 HydrophobicContact CG1-CG 4.2Å; I539-M543 WeakPolarHBondContact O-CG 3.38Å; I539-M543 PolarHBondContact O-N 2.81Å; I539-M565 HydrophobicContact CD1-CE 3.47Å; I539-M565 VanDerWaalsContact CD1-CE 3.47Å; I539-Y569 HydrophobicContact CD1-CD1 4.38Å; I539-Y569 HydrophobicContact CD1-CD2 3.46Å; I539-Y569 VanDerWaalsContact CD1-CD2 3.46Å; I539-Y569 HydrophobicContact CD1-CE2 3.93Å; I539-Y569 HydrophobicContact CD1-CG 3.71Å; I539-Y569 HydrophobicContact CG1-CD1 4.41Å; I539-Y569 HydrophobicContact CG1-CD2 4.21Å; I539-Y569 HydrophobicContact CG1-CG 3.93Å; I539-E572 HydrophobicContact CG2-CB 3.55Å; I539-E572 HydrophobicContact CG2-CG 4.2Å; I539-V573 HydrophobicContact CG1-CG2 4.45Å
540R94.8Very high94.5Very high121 Ų12144 Ų4446%0.45721%0.214SC..Hα-helixtrans-59.9-53178.6176.5176.8-167.4175.911.1113.1F538 V542 M543 Q544 I576 E579F538-R540 VanDerWaalsContact C-N 3.32Å; F538-R540 PolarHBondContact O-N 3.27Å; R540-V542 VanDerWaalsContact C-N 3.27Å; R540-V542 PolarHBondContact O-N 3.1Å; R540-M543 PolarHBondContact O-N 3.13Å; R540-Q544 WeakPolarHBondContact O-CG 3.21Å; R540-Q544 PolarHBondContact O-N 3.01Å; R540-I576 HydrophobicContact CB-CD1 4.25Å; R540-I576 HydrophobicContact CG-CD1 4.23Å; R540-I576 HydrophobicContact CG-CG2 4.15Å; R540-E579 IonicContact CZ-OE2 3.74Å; R540-E579 IonicContact NH2-OE2 3.05Å; R540-E579 PolarHBondContact NH2-OE2 3.11Å
541P95.9Very high94.4Very high52 Ų5243.5 Ų43.534%0.33821%0.21SC..Hα-helixtrans-55.1-38.6171.6-28.331.5000114.4I506 F538 A545I506-P541 HydrophobicContact CD1-CB 3.84Å; F538-P541 WeakPolarHBondContact O-CD 3.31Å; P541-A545 WeakPolarHBondContact O-CB 3.48Å; P541-A545 PolarHBondContact O-N 2.91Å
542V97Very high94.3Very high1 Ų147 Ų471%0.00623%0.226CC..Hα-helixtrans-63.4-51.9177.4166.70000110.5R502 L505 I506 L521 F538 I539 R540 Q544 A545 L546 M565R502-V542 HydrophobicContact CG-CG2 4.07Å; L505-V542 HydrophobicContact CD2-CB 4.48Å; L505-V542 HydrophobicContact CD2-CG1 3.84Å; L505-V542 HydrophobicContact CD2-CG2 4.41Å; I506-V542 HydrophobicContact CD1-CG2 4.12Å; L521-V542 HydrophobicContact CD2-CG1 4.08Å; L521-V542 HydrophobicContact CD2-CG2 4.1Å; F538-V542 WeakPolarHBondContact O-CG2 3.28Å; F538-V542 PolarHBondContact O-N 3.34Å; I539-V542 WeakPolarHBondContact O-CB 3.42Å; I539-V542 PolarHBondContact O-N 3.07Å; I539-V542 VanDerWaalsContact O-N 3.14Å; R540-V542 VanDerWaalsContact C-N 3.27Å; R540-V542 PolarHBondContact O-N 3.1Å; V542-Q544 VanDerWaalsContact C-N 3.32Å; V542-Q544 PolarHBondContact O-N 3.36Å; V542-A545 WeakPolarHBondContact O-CB 3.47Å; V542-A545 PolarHBondContact O-N 2.95Å; V542-A545 VanDerWaalsContact O-N 3.1Å; V542-L546 HydrophobicContact CG1-CD1 3.96Å; V542-L546 HydrophobicContact CG1-CG 4.43Å; V542-L546 WeakPolarHBondContact O-CG 3.47Å; V542-L546 PolarHBondContact O-N 3.23Å; V542-M565 HydrophobicContact CG1-CE 3.93Å
543M95.9Very high94.1Very high1 Ų145.9 Ų45.91%0.00522%0.223CC..Hα-helixtrans-61.1-39.6178.5-61.4-48.1-8000112.1I539 R540 A545 L546 L547 I562 M565 I566 V573 I576 M580I539-M543 HydrophobicContact CD1-CG 4.1Å; I539-M543 HydrophobicContact CD1-SD 4.06Å; I539-M543 HydrophobicContact CG1-CG 4.2Å; I539-M543 WeakPolarHBondContact O-CG 3.38Å; I539-M543 PolarHBondContact O-N 2.81Å; R540-M543 PolarHBondContact O-N 3.13Å; M543-A545 VanDerWaalsContact C-N 3.34Å; M543-A545 PolarHBondContact O-N 3.48Å; M543-L546 PolarHBondContact O-N 3.39Å; M543-L546 HydrophobicContact SD-CD1 3.98Å; M543-L547 WeakPolarHBondContact O-CB 3.27Å; M543-L547 VanDerWaalsContact O-CG 3.29Å; M543-L547 WeakPolarHBondContact O-CG 3.47Å; M543-L547 PolarHBondContact O-N 3.13Å; M543-I562 HydrophobicContact CE-CG2 3.79Å; M543-M565 HydrophobicContact CE-CB 4.08Å; M543-M565 HydrophobicContact SD-CB 3.79Å; M543-I566 HydrophobicContact CE-CG1 3.9Å; M543-V573 HydrophobicContact CG-CG2 4.46Å; M543-I576 HydrophobicContact CB-CD1 4.2Å; M543-I576 HydrophobicContact CG-CD1 4.34Å; M543-M580 HydrophobicContact CB-CE 4.42Å; M543-M580 HydrophobicContact CB-SD 4.18Å; M543-M580 HydrophobicContact CE-CE 3.33Å; M543-M580 HydrophobicContact CE-SD 4.25Å; M543-M580 HydrophobicContact CG-SD 4.38Å
544Q95.2Very high93.8Very high83 Ų8342.2 Ų42.239%0.38821%0.206SC..Hα-helixtrans-63.8-38.7175.2-74178-27.100112.4R540 V542 H548 E579R540-Q544 WeakPolarHBondContact O-CG 3.21Å; R540-Q544 PolarHBondContact O-N 3.01Å; V542-Q544 VanDerWaalsContact C-N 3.32Å; V542-Q544 PolarHBondContact O-N 3.36Å; Q544-H548 WeakPolarHBondContact O-CB 3.47Å; Q544-H548 PolarHBondContact O-N 3.07Å; Q544-H548 VanDerWaalsContact O-N 3.12Å; Q544-E579 PolarHBondContact NE2-OE1 3.04Å
545A96.4Very high93.5Very high15 Ų1539.8 Ų39.812%0.12420%0.197CC..Hα-helixtrans-66.2-45.7174.700000111.1L505 I506 P541 V542 M543 L547 H548 I549L505-A545 HydrophobicContact CD1-CB 4.4Å; L505-A545 HydrophobicContact CG-CB 4.17Å; I506-A545 HydrophobicContact CG1-CB 4.24Å; P541-A545 WeakPolarHBondContact O-CB 3.48Å; P541-A545 PolarHBondContact O-N 2.91Å; V542-A545 WeakPolarHBondContact O-CB 3.47Å; V542-A545 PolarHBondContact O-N 2.95Å; V542-A545 VanDerWaalsContact O-N 3.1Å; M543-A545 VanDerWaalsContact C-N 3.34Å; M543-A545 PolarHBondContact O-N 3.48Å; A545-L547 PolarHBondContact O-N 3.37Å; A545-H548 WeakPolarHBondContact O-CB 3.35Å; A545-H548 PolarHBondContact O-N 3.49Å; A545-I549 WeakPolarHBondContact O-CD1 3.46Å; A545-I549 WeakPolarHBondContact O-CG1 3.33Å; A545-I549 PolarHBondContact O-N 2.92Å
546L96.5Very high93.1Very high2 Ų242.2 Ų42.21%0.0121%0.21CC..Hα-helixtrans-59.1-48.3178.2-68171.5000111.9L505 A518 V542 M543 H548 I549 I550 V561 I562 M565L505-L546 HydrophobicContact CD1-CD2 4.1Å; L505-L546 HydrophobicContact CD2-CD2 4.24Å; L505-L546 HydrophobicContact CD2-CG 4.4Å; A518-L546 HydrophobicContact CB-CD2 3.41Å; A518-L546 VanDerWaalsContact CB-CD2 3.41Å; V542-L546 HydrophobicContact CG1-CD1 3.96Å; V542-L546 HydrophobicContact CG1-CG 4.43Å; V542-L546 WeakPolarHBondContact O-CG 3.47Å; V542-L546 PolarHBondContact O-N 3.23Å; M543-L546 PolarHBondContact O-N 3.39Å; M543-L546 HydrophobicContact SD-CD1 3.98Å; L546-H548 VanDerWaalsContact C-N 3.3Å; L546-H548 PolarHBondContact O-N 2.98Å; L546-I549 PolarHBondContact O-N 3.21Å; L546-I549 VanDerWaalsContact O-N 3.13Å; L546-I550 PolarHBondContact O-N 3.41Å; L546-V561 HydrophobicContact CD1-CG1 4.16Å; L546-V561 HydrophobicContact CD2-CG1 3.87Å; L546-I562 HydrophobicContact CB-CD1 3.76Å; L546-I562 HydrophobicContact CB-CG1 3.72Å; L546-I562 HydrophobicContact CD1-CG1 4.07Å; L546-I562 HydrophobicContact CG-CG1 4.42Å; L546-M565 HydrophobicContact CD1-CG 4.31Å
547L95.2Very high92.8Very high8 Ų842.6 Ų42.64%0.04221%0.21CC..Hα-helixtrans-59.9-40176.7-72.8172.8000112.4M543 A545 R551 I562 M580 H583 L584M543-L547 WeakPolarHBondContact O-CB 3.27Å; M543-L547 VanDerWaalsContact O-CG 3.29Å; M543-L547 WeakPolarHBondContact O-CG 3.47Å; M543-L547 PolarHBondContact O-N 3.13Å; A545-L547 PolarHBondContact O-N 3.37Å; L547-R551 PolarHBondContact O-N 2.87Å; L547-I562 HydrophobicContact CD2-CD1 3.84Å; L547-I562 HydrophobicContact CG-CD1 4.21Å; L547-M580 HydrophobicContact CD1-CB 3.92Å; L547-M580 HydrophobicContact CD1-CG 3.73Å; L547-H583 HydrophobicContact CD1-CB 4.19Å; L547-H583 PolarHBondContact O-CE1 3.32Å; L547-L584 HydrophobicContact CD2-CD1 4.43Å; L547-L584 HydrophobicContact CD2-CD2 3.57Å; L547-L584 HydrophobicContact CD2-CG 3.72Å
548H94.6Very high92.7Very high67 Ų6738 Ų3831%0.3118%0.181SC..Hα-helixtrans-63.9-44.1174.9176.639.7000111.5Q544 A545 L546 R551 E552Q544-H548 WeakPolarHBondContact O-CB 3.47Å; Q544-H548 PolarHBondContact O-N 3.07Å; Q544-H548 VanDerWaalsContact O-N 3.12Å; A545-H548 WeakPolarHBondContact O-CB 3.35Å; A545-H548 PolarHBondContact O-N 3.49Å; L546-H548 VanDerWaalsContact C-N 3.3Å; L546-H548 PolarHBondContact O-N 2.98Å; H548-R551 PolarHBondContact ND1-NH2 2.92Å; H548-R551 PolarHBondContact O-N 2.98Å; H548-E552 WeakPolarHBondContact CE1-CG 3.43Å; H548-E552 IonicContact CE1-OE1 2.83Å; H548-E552 PolarHBondContact CE1-OE1 3.39Å; H548-E552 IonicContact ND1-OE1 2.74Å; H548-E552 VanDerWaalsContact O-CG 3.32Å; H548-E552 WeakPolarHBondContact O-CG 3.34Å; H548-E552 PolarHBondContact O-N 3.32Å
549I94.4Very high92.6Very high1 Ų134.6 Ų34.61%0.00517%0.166CC..Hα-helixtrans-64.2-48.2-178.3-62.2157.5000110.2L505 M511 K514 V515 A545 L546 R551 E552 T553 L558L505-I549 HydrophobicContact CD1-CD1 3.4Å; L505-I549 VanDerWaalsContact CD1-CD1 3.4Å; M511-I549 HydrophobicContact SD-CG1 4.11Å; M511-I549 HydrophobicContact SD-CG2 4.03Å; K514-I549 HydrophobicContact CB-CD1 3.73Å; K514-I549 HydrophobicContact CB-CG1 4.24Å; K514-I549 HydrophobicContact CD-CD1 4.32Å; K514-I549 HydrophobicContact CD-CG1 4.32Å; V515-I549 HydrophobicContact CG2-CG2 3.81Å; A545-I549 WeakPolarHBondContact O-CD1 3.46Å; A545-I549 WeakPolarHBondContact O-CG1 3.33Å; A545-I549 PolarHBondContact O-N 2.92Å; L546-I549 PolarHBondContact O-N 3.21Å; L546-I549 VanDerWaalsContact O-N 3.13Å; I549-R551 PolarHBondContact O-N 3.13Å; I549-E552 PolarHBondContact O-N 2.98Å; I549-T553 HydrophobicContact CG2-CG2 3.82Å; I549-T553 PolarHBondContact O-N 3.18Å; I549-T553 PolarHBondContact O-OG1 3.11Å; I549-T553 VanDerWaalsContact O-OG1 3.05Å; I549-L558 HydrophobicContact CB-CD1 4.1Å; I549-L558 HydrophobicContact CG2-CD1 3.31Å
550I92.3Very high92.5Very high1 Ų137.8 Ų37.81%0.00518%0.183CC..Hα-helixtrans-53.5-42.8177.9-69.4-178000111.6L546 E552 E554 L558 T559 I562 T587 I611L546-I550 PolarHBondContact O-N 3.41Å; I550-E552 VanDerWaalsContact C-N 3.3Å; I550-E552 PolarHBondContact O-N 3.37Å; I550-E554 WeakPolarHBondContact O-CA 3.24Å; I550-E554 PolarHBondContact O-N 3.07Å; I550-L558 HydrophobicContact CD1-CB 3.92Å; I550-L558 HydrophobicContact CG1-CB 3.49Å; I550-L558 VanDerWaalsContact CG1-CB 3.49Å; I550-L558 HydrophobicContact CG1-CD1 4.14Å; I550-L558 HydrophobicContact CG1-CG 4.49Å; I550-T559 HydrophobicContact CD1-CG2 4.13Å; I550-I562 HydrophobicContact CD1-CD1 3.21Å; I550-I562 HydrophobicContact CD1-CG1 3.91Å; I550-I562 HydrophobicContact CG1-CD1 4.25Å; I550-T587 HydrophobicContact CG2-CG2 4.39Å; I550-I611 HydrophobicContact CG2-CD1 4.42Å; I550-I611 HydrophobicContact CG2-CG1 4.42Å
551R90.8Very high92.5Very high85 Ų8532.3 Ų32.332%0.32116%0.163SC..Hα-helixtrans-66.9-29.9179.6-170.3-171.272.6-156.41.1113.5L547 H548 I549 H583 T587L547-R551 PolarHBondContact O-N 2.87Å; H548-R551 PolarHBondContact ND1-NH2 2.92Å; H548-R551 PolarHBondContact O-N 2.98Å; I549-R551 PolarHBondContact O-N 3.13Å; R551-H583 PolarHBondContact NH1-NE2 2.81Å; R551-T587 HydrophobicContact CB-CG2 4.04Å; R551-T587 HydrophobicContact CG-CG2 4.12Å
552E90.4Very high92.5Very high73 Ų7329.8 Ų29.834%0.34115%0.147SC..Hα-helixtrans-91.6-33-178.3-57.2-69.2140.700112.3Y373 M511 H548 I549 I550Y373-E552 WeakPolarHBondContact CD1-O 3.42Å; Y373-E552 HydrophobicContact CE1-CB 4.05Å; Y373-E552 WeakPolarHBondContact CE1-O 3.24Å; M511-E552 HydrophobicContact CE-CB 4.05Å; M511-E552 HydrophobicContact CE-CG 4.31Å; H548-E552 WeakPolarHBondContact CE1-CG 3.43Å; H548-E552 IonicContact CE1-OE1 2.83Å; H548-E552 PolarHBondContact CE1-OE1 3.39Å; H548-E552 IonicContact ND1-OE1 2.74Å; H548-E552 VanDerWaalsContact O-CG 3.32Å; H548-E552 WeakPolarHBondContact O-CG 3.34Å; H548-E552 PolarHBondContact O-N 3.32Å; I549-E552 PolarHBondContact O-N 2.98Å; I550-E552 VanDerWaalsContact C-N 3.3Å; I550-E552 PolarHBondContact O-N 3.37Å
553T88.3Confident92.5Very high22 Ų2231.5 Ų31.514%0.13515%0.154CC..Hα-helixtrans-100.3-18-174.666.30000113.8Y373 I376 M511 V515 I549 N555Y373-T553 HydrophobicContact CD1-CG2 4.13Å; Y373-T553 HydrophobicContact CE1-CG2 4.11Å; I376-T553 HydrophobicContact CD1-CG2 3.89Å; M511-T553 HydrophobicContact CG-CG2 3.48Å; M511-T553 VanDerWaalsContact CG-CG2 3.48Å; M511-T553 HydrophobicContact SD-CG2 3.99Å; V515-T553 HydrophobicContact CG2-CG2 4.14Å; I549-T553 HydrophobicContact CG2-CG2 3.82Å; I549-T553 PolarHBondContact O-N 3.18Å; I549-T553 PolarHBondContact O-OG1 3.11Å; I549-T553 VanDerWaalsContact O-OG1 3.05Å; T553-N555 PolarHBondContact O-N 2.91Å; T553-N555 VanDerWaalsContact O-N 3.08Å
554E86.2Confident92.5Very high66 Ų6636.8 Ų36.831%0.30818%0.177SC..  trans49.634.9-176.2-59.2178.5-173.500112.6I550 V591 K604 T607I550-E554 WeakPolarHBondContact O-CA 3.24Å; I550-E554 PolarHBondContact O-N 3.07Å; E554-V591 HydrophobicContact CG-CG2 4.39Å; E554-K604 WeakPolarHBondContact OE2-CE 3.36Å; E554-T607 HydrophobicContact CB-CG2 4.34Å; E554-T607 PolarHBondContact O-OG1 3.25Å
555N85.8Confident92.4Very high10 Ų1032.9 Ų32.95%0.05316%0.159CC..  trans-92.9128.9-178.3169.1-82.8000110.1F380 T553 D557 L558F380-N555 WeakPolarHBondContact CB-ND2 3.44Å; T553-N555 PolarHBondContact O-N 2.91Å; T553-N555 VanDerWaalsContact O-N 3.08Å; N555-D557 PolarHBondContact ND2-OD2 2.98Å; N555-D557 WeakPolarHBondContact OD1-CB 3.35Å; N555-D557 PolarHBondContact OD1-N 3.22Å; N555-D557 VanDerWaalsContact OD1-N 3.16Å; N555-L558 HydrophobicContact CB-CD1 4.3Å; N555-L558 HydrophobicContact CB-CG 4.5Å; N555-L558 WeakPolarHBondContact OD1-CG 3.33Å; N555-L558 PolarHBondContact OD1-N 3.37Å; N555-L558 VanDerWaalsContact OD1-N 3.13Å
556D87.1Confident92.4Very high56 Ų5632.2 Ų32.230%0.29915%0.153SC..SBendtrans-76.8-32.1-174.768-71.8000113.1L558 T559 V606D556-L558 PolarHBondContact O-N 3.32Å; D556-L558 VanDerWaalsContact O-N 3.1Å; D556-T559 WeakPolarHBondContact O-CB 3.44Å; D556-T559 PolarHBondContact O-N 3.14Å; D556-T559 PolarHBondContact O-OG1 3.34Å; D556-V606 HydrophobicContact CB-CG1 3.83Å
557D87.9Confident92.3Very high53 Ų5335.7 Ų35.728%0.28318%0.177SC..Hα-helixtrans-54-35.7175.2-62.5-76.3000111.9F380 N555 T559 N560 V561F380-D557 WeakPolarHBondContact CD1-OD2 3.43Å; N555-D557 PolarHBondContact ND2-OD2 2.98Å; N555-D557 WeakPolarHBondContact OD1-CB 3.35Å; N555-D557 PolarHBondContact OD1-N 3.22Å; N555-D557 VanDerWaalsContact OD1-N 3.16Å; D557-T559 VanDerWaalsContact C-N 3.26Å; D557-T559 PolarHBondContact O-N 2.88Å; D557-N560 WeakPolarHBondContact O-CB 3.28Å; D557-N560 PolarHBondContact O-N 3.14Å; D557-V561 PolarHBondContact O-N 3.37Å
558L92.1Very high92.2Very high0 Ų038.2 Ų38.20%019%0.189CC..Hα-helixtrans-67.5-25178.2-68.4177.8000113.2V515 A518 I519 I549 I550 N555 D556 V561 I562V515-L558 HydrophobicContact CG1-CD2 4.35Å; V515-L558 HydrophobicContact CG2-CD1 4.37Å; A518-L558 HydrophobicContact CB-CD2 3.56Å; I519-L558 HydrophobicContact CG1-CD2 4.48Å; I549-L558 HydrophobicContact CB-CD1 4.1Å; I549-L558 HydrophobicContact CG2-CD1 3.31Å; I550-L558 HydrophobicContact CD1-CB 3.92Å; I550-L558 HydrophobicContact CG1-CB 3.49Å; I550-L558 VanDerWaalsContact CG1-CB 3.49Å; I550-L558 HydrophobicContact CG1-CD1 4.14Å; I550-L558 HydrophobicContact CG1-CG 4.49Å; N555-L558 HydrophobicContact CB-CD1 4.3Å; N555-L558 HydrophobicContact CB-CG 4.5Å; N555-L558 WeakPolarHBondContact OD1-CG 3.33Å; N555-L558 PolarHBondContact OD1-N 3.37Å; N555-L558 VanDerWaalsContact OD1-N 3.13Å; D556-L558 PolarHBondContact O-N 3.32Å; D556-L558 VanDerWaalsContact O-N 3.1Å; L558-V561 WeakPolarHBondContact O-CB 3.49Å; L558-V561 PolarHBondContact O-N 2.85Å; L558-I562 WeakPolarHBondContact O-CG1 3.43Å; L558-I562 PolarHBondContact O-N 3.1Å
559T92.9Very high92.2Very high2 Ų235.2 Ų35.21%0.01218%0.175CC..Hα-helixtrans-66.2-43.417369.50000110.2I550 D556 D557 V561 I562 Q563 I611I550-T559 HydrophobicContact CD1-CG2 4.13Å; D556-T559 WeakPolarHBondContact O-CB 3.44Å; D556-T559 PolarHBondContact O-N 3.14Å; D556-T559 PolarHBondContact O-OG1 3.34Å; D557-T559 VanDerWaalsContact C-N 3.26Å; D557-T559 PolarHBondContact O-N 2.88Å; T559-V561 VanDerWaalsContact C-N 3.32Å; T559-V561 PolarHBondContact O-N 3.13Å; T559-I562 PolarHBondContact O-N 3.16Å; T559-I562 VanDerWaalsContact O-N 3.15Å; T559-Q563 WeakPolarHBondContact O-CG 3.49Å; T559-Q563 PolarHBondContact O-N 2.81Å; T559-I611 HydrophobicContact CG2-CG1 4.27Å
560N93.4Very high92.1Very high75 Ų7537.5 Ų37.540%0.40119%0.191SC..Hα-helixtrans-62.4-39.1173.4-66-36.4000111.7D557 Q563 K564D557-N560 WeakPolarHBondContact O-CB 3.28Å; D557-N560 PolarHBondContact O-N 3.14Å; N560-Q563 PolarHBondContact O-N 3.19Å; N560-K564 WeakPolarHBondContact O-CG 3.25Å; N560-K564 PolarHBondContact O-N 3.07Å
561V95.2Very high92.1Very high5 Ų545 Ų453%0.0323%0.226CC..Hα-helixtrans-59.2-47.1173166.60000111I519 Q522 L546 D557 L558 T559 M565I519-V561 HydrophobicContact CG1-CG2 4.01Å; Q522-V561 HydrophobicContact CB-CB 4.45Å; Q522-V561 HydrophobicContact CB-CG1 3.75Å; Q522-V561 HydrophobicContact CB-CG2 4.34Å; Q522-V561 HydrophobicContact CG-CB 4.45Å; Q522-V561 HydrophobicContact CG-CG1 4.12Å; Q522-V561 HydrophobicContact CG-CG2 4.5Å; L546-V561 HydrophobicContact CD1-CG1 4.16Å; L546-V561 HydrophobicContact CD2-CG1 3.87Å; D557-V561 PolarHBondContact O-N 3.37Å; L558-V561 WeakPolarHBondContact O-CB 3.49Å; L558-V561 PolarHBondContact O-N 2.85Å; T559-V561 VanDerWaalsContact C-N 3.32Å; T559-V561 PolarHBondContact O-N 3.13Å; V561-M565 HydrophobicContact CG1-CG 4.46Å; V561-M565 WeakPolarHBondContact O-CB 3.49Å; V561-M565 WeakPolarHBondContact O-CG 3.33Å; V561-M565 PolarHBondContact O-N 3.34Å
562I96.2Very high92.2Very high0 Ų043.9 Ų43.90%023%0.225CC..Hα-helixtrans-64-44.4178.7-70.2-171.4000111.3M543 L546 L547 I550 L558 T559 K564 M565 I566 M580 T614M543-I562 HydrophobicContact CE-CG2 3.79Å; L546-I562 HydrophobicContact CB-CD1 3.76Å; L546-I562 HydrophobicContact CB-CG1 3.72Å; L546-I562 HydrophobicContact CD1-CG1 4.07Å; L546-I562 HydrophobicContact CG-CG1 4.42Å; L547-I562 HydrophobicContact CD2-CD1 3.84Å; L547-I562 HydrophobicContact CG-CD1 4.21Å; I550-I562 HydrophobicContact CD1-CD1 3.21Å; I550-I562 HydrophobicContact CD1-CG1 3.91Å; I550-I562 HydrophobicContact CG1-CD1 4.25Å; L558-I562 WeakPolarHBondContact O-CG1 3.43Å; L558-I562 PolarHBondContact O-N 3.1Å; T559-I562 PolarHBondContact O-N 3.16Å; T559-I562 VanDerWaalsContact O-N 3.15Å; I562-K564 PolarHBondContact O-N 3.35Å; I562-M565 CarbonylContact O-C 3.56Å; I562-M565 PolarHBondContact O-N 2.79Å; I562-I566 HydrophobicContact CG2-CD1 3.59Å; I562-I566 HydrophobicContact CG2-CG1 4.18Å; I562-I566 WeakPolarHBondContact O-CD1 3.49Å; I562-I566 VanDerWaalsContact O-CG1 3.24Å; I562-I566 WeakPolarHBondContact O-CG1 3.32Å; I562-I566 PolarHBondContact O-N 3.36Å; I562-M580 HydrophobicContact CG2-CE 4.29Å; I562-T614 HydrophobicContact CB-CG2 4.17Å; I562-T614 HydrophobicContact CG2-CG2 3.47Å; I562-T614 VanDerWaalsContact CG2-CG2 3.47Å
563Q96Very high92.3Very high36 Ų3640.4 Ų40.417%0.16821%0.208CC..Hα-helixtrans-57.4-50.4178.5-72.317232.400111.8T559 N560 M565 I566 C567 G610 T614 T617T559-Q563 WeakPolarHBondContact O-CG 3.49Å; T559-Q563 PolarHBondContact O-N 2.81Å; N560-Q563 PolarHBondContact O-N 3.19Å; Q563-M565 VanDerWaalsContact C-N 3.29Å; Q563-M565 PolarHBondContact O-N 3.27Å; Q563-I566 WeakPolarHBondContact O-CB 3.48Å; Q563-I566 PolarHBondContact O-N 3.45Å; Q563-I566 VanDerWaalsContact O-N 3.08Å; Q563-C567 PolarHBondContact O-N 2.98Å; Q563-C567 VanDerWaalsContact O-N 3.09Å; Q563-C567 PolarHBondContact O-SG 2.94Å; Q563-C567 VanDerWaalsContact O-SG 3.41Å; Q563-G610 PolarHBondContact NE2-O 3.14Å; Q563-T614 HydrophobicContact CG-CG2 4.13Å; Q563-T614 PolarHBondContact NE2-OG1 3.44Å; Q563-T617 HydrophobicContact CB-CG2 4.36Å; Q563-T617 HydrophobicContact CG-CG2 4.46Å
564K94.9Very high92.6Very high112 Ų11240 Ų4049%0.48721%0.205SC..Hα-helixtrans-60.6-40176.7-69.8-176.9-178.4179.30111.9Q522 N560 I562 I566 C567 E568Q522-K564 HydrophobicContact CG-CB 3.99Å; N560-K564 WeakPolarHBondContact O-CG 3.25Å; N560-K564 PolarHBondContact O-N 3.07Å; I562-K564 PolarHBondContact O-N 3.35Å; K564-I566 VanDerWaalsContact C-N 3.32Å; K564-I566 PolarHBondContact O-N 2.86Å; K564-C567 PolarHBondContact O-N 3.35Å; K564-E568 VanDerWaalsContact O-CG 3.24Å; K564-E568 WeakPolarHBondContact O-CG 3.25Å; K564-E568 PolarHBondContact O-N 3.27Å; K564-E568 VanDerWaalsContact O-N 3.09Å
565M94.9Very high92.8Very high2 Ų241.8 Ų41.81%0.0122%0.223CC..Hα-helixtrans-66.4-32.2176-69-68.3-61.900112.9Q522 I525 I539 V542 M543 L546 V561 I562 Q563 Y569Q522-M565 HydrophobicContact CB-CG 4.3Å; Q522-M565 HydrophobicContact CB-SD 4.16Å; Q522-M565 HydrophobicContact CG-CG 4.08Å; Q522-M565 HydrophobicContact CG-SD 4.22Å; I525-M565 HydrophobicContact CD1-CE 3.69Å; I525-M565 HydrophobicContact CD1-SD 3.57Å; I525-M565 VanDerWaalsContact CD1-SD 3.57Å; I539-M565 HydrophobicContact CD1-CE 3.47Å; I539-M565 VanDerWaalsContact CD1-CE 3.47Å; V542-M565 HydrophobicContact CG1-CE 3.93Å; M543-M565 HydrophobicContact CE-CB 4.08Å; M543-M565 HydrophobicContact SD-CB 3.79Å; L546-M565 HydrophobicContact CD1-CG 4.31Å; V561-M565 HydrophobicContact CG1-CG 4.46Å; V561-M565 WeakPolarHBondContact O-CB 3.49Å; V561-M565 WeakPolarHBondContact O-CG 3.33Å; V561-M565 PolarHBondContact O-N 3.34Å; I562-M565 CarbonylContact O-C 3.56Å; I562-M565 PolarHBondContact O-N 2.79Å; Q563-M565 VanDerWaalsContact C-N 3.29Å; Q563-M565 PolarHBondContact O-N 3.27Å; M565-Y569 HydrophobicContact CE-CD2 4Å; M565-Y569 HydrophobicContact CE-CE2 3.67Å; M565-Y569 WeakPolarHBondContact O-CD2 3.36Å; M565-Y569 PolarHBondContact O-N 2.71Å; M565-Y569 HydrophobicContact SD-CE2 4.2Å
566I95Very high93.2Very high0 Ų041.8 Ų41.80%022%0.223CC..Hα-helixtrans-66.2-46174.6-69.7157000110.5M543 I562 Q563 K564 Y569 S570 V573 M580 T614 T617 L618 V621M543-I566 HydrophobicContact CE-CG1 3.9Å; I562-I566 HydrophobicContact CG2-CD1 3.59Å; I562-I566 HydrophobicContact CG2-CG1 4.18Å; I562-I566 WeakPolarHBondContact O-CD1 3.49Å; I562-I566 VanDerWaalsContact O-CG1 3.24Å; I562-I566 WeakPolarHBondContact O-CG1 3.32Å; I562-I566 PolarHBondContact O-N 3.36Å; Q563-I566 WeakPolarHBondContact O-CB 3.48Å; Q563-I566 PolarHBondContact O-N 3.45Å; Q563-I566 VanDerWaalsContact O-N 3.08Å; K564-I566 VanDerWaalsContact C-N 3.32Å; K564-I566 PolarHBondContact O-N 2.86Å; I566-Y569 CarbonylContact O-C 3.53Å; I566-Y569 PolarHBondContact O-N 3.32Å; I566-S570 WeakPolarHBondContact O-CA 3.41Å; I566-S570 PolarHBondContact O-N 3.46Å; I566-V573 HydrophobicContact CG1-CG1 4.27Å; I566-V573 HydrophobicContact CG2-CG1 4.37Å; I566-M580 HydrophobicContact CD1-CE 4.31Å; I566-M580 HydrophobicContact CG1-CE 4.17Å; I566-T614 HydrophobicContact CD1-CG2 3.87Å; I566-T617 HydrophobicContact CB-CG2 4.4Å; I566-T617 HydrophobicContact CG2-CG2 4.14Å; I566-L618 HydrophobicContact CB-CD2 4.46Å; I566-L618 HydrophobicContact CD1-CD1 4.31Å; I566-L618 HydrophobicContact CD1-CD2 3.59Å; I566-L618 HydrophobicContact CD1-CG 3.58Å; I566-L618 HydrophobicContact CG1-CD2 3.74Å; I566-L618 HydrophobicContact CG1-CG 4.3Å; I566-L618 HydrophobicContact CG2-CD2 3.84Å; I566-L618 HydrophobicContact CG2-CG 4.48Å; I566-V621 HydrophobicContact CG2-CB 4.11Å; I566-V621 HydrophobicContact CG2-CG1 4.31Å; I566-V621 HydrophobicContact CG2-CG2 3.87Å
567C94.4Very high93.6Very high75 Ų7539.1 Ų39.151%0.50721%0.209SC..Hα-helixtrans-64.5-40.7-179.8-620000112.3Q563 K564 Y569Q563-C567 PolarHBondContact O-N 2.98Å; Q563-C567 VanDerWaalsContact O-N 3.09Å; Q563-C567 PolarHBondContact O-SG 2.94Å; Q563-C567 VanDerWaalsContact O-SG 3.41Å; K564-C567 PolarHBondContact O-N 3.35Å; C567-Y569 PolarHBondContact O-N 3.04Å
568E93.2Very high93.9Very high62 Ų6237.9 Ų37.929%0.2920%0.203SC..Hα-helixtrans-73.8-22.8-178.2-66.1-73.8-169.800114.1I525 K532 K564I525-E568 HydrophobicContact CG2-CB 4.5Å; K532-E568 WeakPolarHBondContact CE-OE2 3.46Å; K532-E568 IonicContact NZ-OE1 2.75Å; K532-E568 IonicContact NZ-OE2 3.67Å; K532-E568 PolarHBondContact NZ-OE2 2.94Å; K564-E568 VanDerWaalsContact O-CG 3.24Å; K564-E568 WeakPolarHBondContact O-CG 3.25Å; K564-E568 PolarHBondContact O-N 3.27Å; K564-E568 VanDerWaalsContact O-N 3.09Å
569Y94.5Very high94.1Very high3 Ų341.9 Ų41.91%0.01222%0.222CC..THydrogen-bonded Turntrans-130.544.4-176.6-60.1-83.8000112.2I525 K532 I535 I539 M565 I566 C567 E571 E572 V573I525-Y569 HydrophobicContact CD1-CE2 4.14Å; I525-Y569 HydrophobicContact CG2-CE2 3.81Å; I525-Y569 WeakPolarHBondContact CG2-OH 3.3Å; K532-Y569 WeakPolarHBondContact CA-OH 3.48Å; K532-Y569 HydrophobicContact CB-CE1 4.41Å; I535-Y569 WeakPolarHBondContact CB-OH 3.4Å; I539-Y569 HydrophobicContact CD1-CD1 4.38Å; I539-Y569 HydrophobicContact CD1-CD2 3.46Å; I539-Y569 VanDerWaalsContact CD1-CD2 3.46Å; I539-Y569 HydrophobicContact CD1-CE2 3.93Å; I539-Y569 HydrophobicContact CD1-CG 3.71Å; I539-Y569 HydrophobicContact CG1-CD1 4.41Å; I539-Y569 HydrophobicContact CG1-CD2 4.21Å; I539-Y569 HydrophobicContact CG1-CG 3.93Å; M565-Y569 HydrophobicContact CE-CD2 4Å; M565-Y569 HydrophobicContact CE-CE2 3.67Å; M565-Y569 WeakPolarHBondContact O-CD2 3.36Å; M565-Y569 PolarHBondContact O-N 2.71Å; M565-Y569 HydrophobicContact SD-CE2 4.2Å; I566-Y569 CarbonylContact O-C 3.53Å; I566-Y569 PolarHBondContact O-N 3.32Å; C567-Y569 PolarHBondContact O-N 3.04Å; Y569-E571 VanDerWaalsContact C-N 3.31Å; Y569-E571 PolarHBondContact O-N 2.9Å; Y569-E572 PolarHBondContact O-N 3.02Å; Y569-V573 VanDerWaalsContact O-CB 3.32Å; Y569-V573 WeakPolarHBondContact O-CB 3.27Å; Y569-V573 VanDerWaalsContact O-CG2 3.26Å; Y569-V573 WeakPolarHBondContact O-CG2 3.46Å; Y569-V573 PolarHBondContact O-N 3.04Å
570S92.5Very high94.1Very high50 Ų5042 Ų4235%0.3522%0.222SC..Hα-helixtrans-52.4-46-177.252.90000113.2I566 E572 V573 T574I566-S570 WeakPolarHBondContact O-CA 3.41Å; I566-S570 PolarHBondContact O-N 3.46Å; S570-E572 PolarHBondContact O-N 3.44Å; S570-V573 PolarHBondContact O-N 3.44Å; S570-T574 WeakPolarHBondContact O-CB 3.44Å; S570-T574 PolarHBondContact O-N 3.2Å; S570-T574 PolarHBondContact O-OG1 3.01Å
571E92.1Very high94.3Very high159 Ų15938.5 Ų38.574%0.74320%0.203SC*.Hα-helixtrans-62.9-41.5-179.9-65.4-167175.100112.2Y569 P575Y569-E571 VanDerWaalsContact C-N 3.31Å; Y569-E571 PolarHBondContact O-N 2.9Å; E571-P575 VanDerWaalsContact O-CD 3.29Å; E571-P575 WeakPolarHBondContact O-CD 3.34Å
572E92.9Very high94.3Very high61 Ų6142.9 Ų42.929%0.28522%0.224SC..Hα-helixtrans-84-23.2-177.6-60.287.2167.800114.1T536 I539 Y569 S570 P575T536-E572 HydrophobicContact CG2-CG 4.05Å; T536-E572 VanDerWaalsContact CG2-OE1 3.23Å; T536-E572 WeakPolarHBondContact CG2-OE1 3.29Å; I539-E572 HydrophobicContact CG2-CB 3.55Å; I539-E572 HydrophobicContact CG2-CG 4.2Å; Y569-E572 PolarHBondContact O-N 3.02Å; S570-E572 PolarHBondContact O-N 3.44Å; E572-P575 WeakPolarHBondContact O-CD 3.05Å
573V93.5Very high94.2Very high0 Ų044.9 Ų44.90%023%0.233CC..Hα-helixtrans-78.8-34.1175.1167.80000111.2I539 M543 I566 Y569 S570 I576 A577 M580 L618I539-V573 HydrophobicContact CG1-CG2 4.45Å; M543-V573 HydrophobicContact CG-CG2 4.46Å; I566-V573 HydrophobicContact CG1-CG1 4.27Å; I566-V573 HydrophobicContact CG2-CG1 4.37Å; Y569-V573 VanDerWaalsContact O-CB 3.32Å; Y569-V573 WeakPolarHBondContact O-CB 3.27Å; Y569-V573 VanDerWaalsContact O-CG2 3.26Å; Y569-V573 WeakPolarHBondContact O-CG2 3.46Å; Y569-V573 PolarHBondContact O-N 3.04Å; S570-V573 PolarHBondContact O-N 3.44Å; V573-I576 CarbonylContact O-C 3.56Å; V573-I576 WeakPolarHBondContact O-CG1 3.44Å; V573-I576 PolarHBondContact O-N 3.18Å; V573-A577 PolarHBondContact O-N 3.01Å; V573-M580 HydrophobicContact CG1-CE 4.43Å; V573-M580 HydrophobicContact CG1-SD 3.87Å; V573-L618 HydrophobicContact CG1-CD2 3.69Å
574T93.4Very high94.2Very high12 Ų1243.2 Ų43.27%0.07423%0.225CC..G310 helixtrans-47-48.1-179.6-68.60000113.7S570 I576 A577 V622 I628S570-T574 WeakPolarHBondContact O-CB 3.44Å; S570-T574 PolarHBondContact O-N 3.2Å; S570-T574 PolarHBondContact O-OG1 3.01Å; T574-I576 PolarHBondContact O-N 2.72Å; T574-A577 WeakPolarHBondContact O-CB 3.2Å; T574-A577 PolarHBondContact O-N 2.99Å; T574-V622 HydrophobicContact CG2-CG1 4.46Å; T574-I628 HydrophobicContact CG2-CD1 3.33Å
575P92Very high94.2Very high104 Ų10438.2 Ų38.268%0.67521%0.205SC*.G310 helixtrans-65-19.6178.9-22.534000115.7E571 E572E571-P575 VanDerWaalsContact O-CD 3.29Å; E571-P575 WeakPolarHBondContact O-CD 3.34Å; E572-P575 WeakPolarHBondContact O-CD 3.05Å
576I93.5Very high94.2Very high11 Ų1143.8 Ų43.86%0.05623%0.232CC..G310 helixtrans-110.9-2-179.359.6170.5000112.9R540 M543 V573 T574 V578 E579 M580R540-I576 HydrophobicContact CB-CD1 4.25Å; R540-I576 HydrophobicContact CG-CD1 4.23Å; R540-I576 HydrophobicContact CG-CG2 4.15Å; M543-I576 HydrophobicContact CB-CD1 4.2Å; M543-I576 HydrophobicContact CG-CD1 4.34Å; V573-I576 CarbonylContact O-C 3.56Å; V573-I576 WeakPolarHBondContact O-CG1 3.44Å; V573-I576 PolarHBondContact O-N 3.18Å; T574-I576 PolarHBondContact O-N 2.72Å; I576-V578 PolarHBondContact O-N 3.2Å; I576-V578 VanDerWaalsContact O-N 3.13Å; I576-E579 WeakPolarHBondContact O-CB 3.4Å; I576-E579 PolarHBondContact O-N 3.2Å; I576-M580 HydrophobicContact CD1-CG 4.34Å; I576-M580 HydrophobicContact CD1-SD 3.76Å; I576-M580 HydrophobicContact CG1-CG 4.28Å; I576-M580 HydrophobicContact CG1-SD 3.83Å; I576-M580 WeakPolarHBondContact O-CG 3.5Å; I576-M580 PolarHBondContact O-N 2.96Å
577A94.8Very high94Very high0 Ų044 Ų440%023%0.233CC..Hα-helixtrans-52.9-38.7-176.400000113.2V573 T574 M580 T581 V622 I628V573-A577 PolarHBondContact O-N 3.01Å; T574-A577 WeakPolarHBondContact O-CB 3.2Å; T574-A577 PolarHBondContact O-N 2.99Å; A577-M580 PolarHBondContact O-N 2.83Å; A577-T581 WeakPolarHBondContact O-CB 3.19Å; A577-T581 PolarHBondContact O-N 3.39Å; A577-T581 PolarHBondContact O-OG1 3.37Å; A577-V622 HydrophobicContact CB-CG1 4.03Å; A577-I628 HydrophobicContact CB-CG2 4.21Å
578V95.5Very high94Very high27 Ų2740.4 Ų40.416%0.16421%0.209CC..Hα-helixtrans-65.2-44.6176.8-176.70000111.9I576 M580 Q582 I628 Q631 L632 I635I576-V578 PolarHBondContact O-N 3.2Å; I576-V578 VanDerWaalsContact O-N 3.13Å; V578-M580 VanDerWaalsContact C-N 3.33Å; V578-Q582 VanDerWaalsContact O-CG 3.26Å; V578-Q582 WeakPolarHBondContact O-CG 3.18Å; V578-Q582 PolarHBondContact O-N 3.38Å; V578-Q582 VanDerWaalsContact O-N 3.09Å; V578-I628 HydrophobicContact CG2-CG2 4.19Å; V578-Q631 HydrophobicContact CG1-CB 4.38Å; V578-Q631 HydrophobicContact CG2-CB 3.93Å; V578-L632 HydrophobicContact CB-CD2 4.34Å; V578-L632 HydrophobicContact CG2-CD2 4.03Å; V578-I635 HydrophobicContact CG1-CD1 4.07Å
579E94.8Very high93.8Very high84 Ų8439.1 Ų39.139%0.39320%0.204SC..Hα-helixtrans-63.1-42.4177.3-173.6-175154.900110.3R540 Q544 I576 H583R540-E579 IonicContact CZ-OE2 3.74Å; R540-E579 IonicContact NH2-OE2 3.05Å; R540-E579 PolarHBondContact NH2-OE2 3.11Å; Q544-E579 PolarHBondContact NE2-OE1 3.04Å; I576-E579 WeakPolarHBondContact O-CB 3.4Å; I576-E579 PolarHBondContact O-N 3.2Å; E579-H583 PolarHBondContact O-N 3.48Å; E579-H583 VanDerWaalsContact O-N 3.13Å
580M94.5Very high93.5Very high4 Ų443.4 Ų43.42%0.0222%0.224CC..Hα-helixtrans-65.7-47.9179.3-63.6-17749.300112.2M543 L547 I562 I566 V573 I576 A577 V578 Q582 H583 L584 L618M543-M580 HydrophobicContact CB-CE 4.42Å; M543-M580 HydrophobicContact CB-SD 4.18Å; M543-M580 HydrophobicContact CE-CE 3.33Å; M543-M580 HydrophobicContact CE-SD 4.25Å; M543-M580 HydrophobicContact CG-SD 4.38Å; L547-M580 HydrophobicContact CD1-CB 3.92Å; L547-M580 HydrophobicContact CD1-CG 3.73Å; I562-M580 HydrophobicContact CG2-CE 4.29Å; I566-M580 HydrophobicContact CD1-CE 4.31Å; I566-M580 HydrophobicContact CG1-CE 4.17Å; V573-M580 HydrophobicContact CG1-CE 4.43Å; V573-M580 HydrophobicContact CG1-SD 3.87Å; I576-M580 HydrophobicContact CD1-CG 4.34Å; I576-M580 HydrophobicContact CD1-SD 3.76Å; I576-M580 HydrophobicContact CG1-CG 4.28Å; I576-M580 HydrophobicContact CG1-SD 3.83Å; I576-M580 WeakPolarHBondContact O-CG 3.5Å; I576-M580 PolarHBondContact O-N 2.96Å; A577-M580 PolarHBondContact O-N 2.83Å; V578-M580 VanDerWaalsContact C-N 3.33Å; M580-Q582 VanDerWaalsContact C-N 3.3Å; M580-Q582 PolarHBondContact O-N 3.05Å; M580-H583 WeakPolarHBondContact O-CB 3.27Å; M580-H583 PolarHBondContact O-N 3.35Å; M580-H583 VanDerWaalsContact O-N 3.07Å; M580-L584 WeakPolarHBondContact O-CG 3.43Å; M580-L584 PolarHBondContact O-N 3.49Å; M580-L618 HydrophobicContact CB-CD1 4.21Å; M580-L618 HydrophobicContact CE-CD1 4.36Å; M580-L618 HydrophobicContact CE-CD2 4.16Å
581T96.1Very high93.1Very high1 Ų141.3 Ų41.31%0.00621%0.209CC..Hα-helixtrans-64.2-37-179.2-52.40000111.3A577 H583 L584 A585 I615 L632 I635A577-T581 WeakPolarHBondContact O-CB 3.19Å; A577-T581 PolarHBondContact O-N 3.39Å; A577-T581 PolarHBondContact O-OG1 3.37Å; T581-H583 VanDerWaalsContact C-N 3.35Å; T581-L584 PolarHBondContact O-N 3.13Å; T581-A585 VanDerWaalsContact O-CB 3.26Å; T581-A585 WeakPolarHBondContact O-CB 3.47Å; T581-A585 PolarHBondContact O-N 3.28Å; T581-I615 HydrophobicContact CG2-CG1 4.38Å; T581-I615 HydrophobicContact CG2-CG2 3.98Å; T581-L632 HydrophobicContact CG2-CD2 4.08Å; T581-L632 VanDerWaalsContact OG1-CD2 3.31Å; T581-L632 WeakPolarHBondContact OG1-CD2 3.4Å; T581-I635 HydrophobicContact CG2-CB 4.27Å; T581-I635 HydrophobicContact CG2-CD1 4.36Å; T581-I635 HydrophobicContact CG2-CG2 3.91Å
582Q95.9Very high92.7Very high98 Ų9835.3 Ų35.346%0.45818%0.182SC..Hα-helixtrans-61.2-43.9171.9-74174-0.800111.8V578 M580 M586 I635V578-Q582 VanDerWaalsContact O-CG 3.26Å; V578-Q582 WeakPolarHBondContact O-CG 3.18Å; V578-Q582 PolarHBondContact O-N 3.38Å; V578-Q582 VanDerWaalsContact O-N 3.09Å; M580-Q582 VanDerWaalsContact C-N 3.3Å; M580-Q582 PolarHBondContact O-N 3.05Å; Q582-M586 WeakPolarHBondContact O-CB 3.28Å; Q582-M586 VanDerWaalsContact O-CG 3.27Å; Q582-M586 WeakPolarHBondContact O-CG 3.35Å; Q582-M586 PolarHBondContact O-N 2.9Å; Q582-I635 HydrophobicContact CG-CD1 3.47Å; Q582-I635 VanDerWaalsContact CG-CD1 3.47Å; Q582-I635 HydrophobicContact CG-CG1 3.97Å
583H94.5Very high92Very high42 Ų4239.2 Ų39.219%0.19420%0.2CC..Hα-helixtrans-64.2-47.3178.4-165.8-71.6000111.4L547 R551 E579 M580 T581 M586 T587L547-H583 HydrophobicContact CD1-CB 4.19Å; L547-H583 PolarHBondContact O-CE1 3.32Å; R551-H583 PolarHBondContact NH1-NE2 2.81Å; E579-H583 PolarHBondContact O-N 3.48Å; E579-H583 VanDerWaalsContact O-N 3.13Å; M580-H583 WeakPolarHBondContact O-CB 3.27Å; M580-H583 PolarHBondContact O-N 3.35Å; M580-H583 VanDerWaalsContact O-N 3.07Å; T581-H583 VanDerWaalsContact C-N 3.35Å; H583-M586 PolarHBondContact O-N 3.13Å; H583-T587 PolarHBondContact O-N 3.02Å; H583-T587 PolarHBondContact O-OG1 2.96Å; H583-T587 VanDerWaalsContact O-OG1 3.07Å
584L95.7Very high90.8Very high1 Ų141.5 Ų41.51%0.00521%0.214CC..Hα-helixtrans-59.2-47176.8-71171.4000111.6L547 M580 T581 M586 T587 F588 I611 T614 I615 L618L547-L584 HydrophobicContact CD2-CD1 4.43Å; L547-L584 HydrophobicContact CD2-CD2 3.57Å; L547-L584 HydrophobicContact CD2-CG 3.72Å; M580-L584 WeakPolarHBondContact O-CG 3.43Å; M580-L584 PolarHBondContact O-N 3.49Å; T581-L584 PolarHBondContact O-N 3.13Å; L584-M586 VanDerWaalsContact C-N 3.31Å; L584-M586 PolarHBondContact O-N 3.49Å; L584-T587 PolarHBondContact O-N 2.98Å; L584-F588 WeakPolarHBondContact O-CB 3.44Å; L584-F588 PolarHBondContact O-N 3Å; L584-I611 HydrophobicContact CB-CG2 3.95Å; L584-I611 HydrophobicContact CD2-CG2 4.14Å; L584-I611 WeakPolarHBondContact O-CG2 3.23Å; L584-T614 HydrophobicContact CD1-CG2 3.72Å; L584-T614 HydrophobicContact CD2-CG2 4.39Å; L584-I615 HydrophobicContact CB-CD1 4.03Å; L584-I615 HydrophobicContact CB-CG1 3.87Å; L584-I615 HydrophobicContact CD1-CG1 3.95Å; L584-L618 HydrophobicContact CD1-CD1 3.75Å
585A95.1Very high88.9Confident7 Ų742.7 Ų42.76%0.05823%0.229CC..Hα-helixtrans-61.5-38176.500000112.6T581 N589 I635 V639T581-A585 VanDerWaalsContact O-CB 3.26Å; T581-A585 WeakPolarHBondContact O-CB 3.47Å; T581-A585 PolarHBondContact O-N 3.28Å; A585-N589 WeakPolarHBondContact O-CB 3.48Å; A585-N589 PolarHBondContact O-N 2.98Å; A585-N589 PolarHBondContact O-ND2 2.92Å; A585-I635 HydrophobicContact CB-CG2 3.63Å; A585-V639 HydrophobicContact CB-CG2 3.55Å
586M93.7Very high87.2Confident119 Ų11943.1 Ų43.159%0.58623%0.232SC*.Hα-helixtrans-66.9-42.8174.6-74.9177.561.500112Q582 H583 L584 N589 Q590Q582-M586 WeakPolarHBondContact O-CB 3.28Å; Q582-M586 VanDerWaalsContact O-CG 3.27Å; Q582-M586 WeakPolarHBondContact O-CG 3.35Å; Q582-M586 PolarHBondContact O-N 2.9Å; H583-M586 PolarHBondContact O-N 3.13Å; L584-M586 VanDerWaalsContact C-N 3.31Å; L584-M586 PolarHBondContact O-N 3.49Å; M586-N589 PolarHBondContact O-N 3.14Å; M586-Q590 WeakPolarHBondContact O-CG 3.29Å; M586-Q590 PolarHBondContact O-N 2.72Å
587T92Very high85.1Confident3 Ų350.5 Ų50.52%0.01827%0.271CS..Hα-helixtrans-64.2-45.6177-58.70000110.9I550 R551 H583 L584 N589 Q590 V591 I611I550-T587 HydrophobicContact CG2-CG2 4.39Å; R551-T587 HydrophobicContact CB-CG2 4.04Å; R551-T587 HydrophobicContact CG-CG2 4.12Å; H583-T587 PolarHBondContact O-N 3.02Å; H583-T587 PolarHBondContact O-OG1 2.96Å; H583-T587 VanDerWaalsContact O-OG1 3.07Å; L584-T587 PolarHBondContact O-N 2.98Å; T587-N589 VanDerWaalsContact C-N 3.32Å; T587-N589 PolarHBondContact O-N 3.28Å; T587-Q590 WeakPolarHBondContact O-CB 3.42Å; T587-Q590 PolarHBondContact O-N 3.04Å; T587-V591 HydrophobicContact CG2-CG2 4.41Å; T587-V591 WeakPolarHBondContact O-CG2 3.4Å; T587-V591 PolarHBondContact O-N 3.48Å; T587-I611 HydrophobicContact CG2-CD1 3.72Å
588F93.3Very high83.1Confident0 Ų055.5 Ų55.50%029%0.294CS..Hα-helixtrans-52.3-50.3172.5177.7-96.9000111.5L584 Q590 V591 I592 A608 I611 L612 V639 V643 F651L584-F588 WeakPolarHBondContact O-CB 3.44Å; L584-F588 PolarHBondContact O-N 3Å; F588-Q590 PolarHBondContact O-N 3.47Å; F588-V591 PolarHBondContact O-N 2.89Å; F588-I592 HydrophobicContact CD1-CD1 4.18Å; F588-I592 HydrophobicContact CD1-CG2 4.39Å; F588-I592 HydrophobicContact CD2-CG2 4.4Å; F588-I592 HydrophobicContact CE1-CD1 3.77Å; F588-I592 HydrophobicContact CE1-CG2 3.98Å; F588-I592 HydrophobicContact CE2-CG2 3.97Å; F588-I592 HydrophobicContact CZ-CD1 4.47Å; F588-I592 HydrophobicContact CZ-CG2 3.74Å; F588-I592 WeakPolarHBondContact O-CG2 3.34Å; F588-I592 PolarHBondContact O-N 2.76Å; F588-A608 HydrophobicContact CD2-CB 3.99Å; F588-A608 HydrophobicContact CE2-CB 3.92Å; F588-I611 HydrophobicContact CB-CG2 3.95Å; F588-L612 HydrophobicContact CD2-CD1 4.41Å; F588-L612 HydrophobicContact CD2-CD2 3.82Å; F588-L612 HydrophobicContact CD2-CG 3.91Å; F588-L612 HydrophobicContact CE2-CD1 3.64Å; F588-L612 HydrophobicContact CE2-CD2 3.72Å; F588-L612 HydrophobicContact CE2-CG 3.64Å; F588-L612 HydrophobicContact CG-CD2 4.29Å; F588-L612 HydrophobicContact CZ-CD1 4.08Å; F588-L612 HydrophobicContact CZ-CD2 4.09Å; F588-L612 HydrophobicContact CZ-CG 4.35Å; F588-V639 HydrophobicContact CD1-CG1 3.8Å; F588-V639 HydrophobicContact CE1-CG1 3.75Å; F588-V639 HydrophobicContact CG-CG1 4.45Å; F588-V639 HydrophobicContact CZ-CG1 4.38Å; F588-V643 HydrophobicContact CE1-CG2 3.74Å; F588-V643 HydrophobicContact CZ-CG2 3.62Å; F588-F651 HydrophobicContact CE2-CD2 4.45Å; F588-F651 HydrophobicContact CE2-CG 4.49Å; F588-F651 HydrophobicContact CZ-CD2 4.16Å; F588-F651 HydrophobicContact CZ-CE2 4.44Å; F588-F651 HydrophobicContact CZ-CG 4.43Å
589N90.2Very high81Confident35 Ų3563.7 Ų63.719%0.18733%0.331CS..Hα-helixtrans-62.4-28.1178.3-81.4-64.1000113.8A585 M586 T587 Q593A585-N589 WeakPolarHBondContact O-CB 3.48Å; A585-N589 PolarHBondContact O-N 2.98Å; A585-N589 PolarHBondContact O-ND2 2.92Å; M586-N589 PolarHBondContact O-N 3.14Å; T587-N589 VanDerWaalsContact C-N 3.32Å; T587-N589 PolarHBondContact O-N 3.28Å; N589-Q593 WeakPolarHBondContact O-CB 3.36Å; N589-Q593 WeakPolarHBondContact O-CG 3.45Å; N589-Q593 PolarHBondContact O-N 2.95Å; N589-Q593 PolarHBondContact O-NE2 3.23Å
590Q87Confident79.2Confident93 Ų9360.8 Ų60.844%0.43532%0.324SS..Hα-helixtrans-73.3-45.3174.9-73.4171.8-21.400110.9M586 T587 F588 Q593M586-Q590 WeakPolarHBondContact O-CG 3.29Å; M586-Q590 PolarHBondContact O-N 2.72Å; T587-Q590 WeakPolarHBondContact O-CB 3.42Å; T587-Q590 PolarHBondContact O-N 3.04Å; F588-Q590 PolarHBondContact O-N 3.47Å; Q590-Q593 PolarHBondContact O-N 3.06Å
591V84.7Confident77.8Confident6 Ų663 Ų634%0.03634%0.339CS..Hα-helixtrans-63.7-42.8-178.9177.10000111.2E554 T587 F588 Q593 T594 K604 A608E554-V591 HydrophobicContact CG-CG2 4.39Å; T587-V591 HydrophobicContact CG2-CG2 4.41Å; T587-V591 WeakPolarHBondContact O-CG2 3.4Å; T587-V591 PolarHBondContact O-N 3.48Å; F588-V591 PolarHBondContact O-N 2.89Å; V591-Q593 VanDerWaalsContact C-N 3.33Å; V591-Q593 PolarHBondContact O-N 3.2Å; V591-T594 PolarHBondContact O-OG1 3.42Å; V591-K604 HydrophobicContact CG1-CB 3.77Å; V591-K604 HydrophobicContact CG1-CG 4.3Å; V591-K604 VanDerWaalsContact CG1-O 3.24Å; V591-K604 WeakPolarHBondContact CG1-O 3.25Å; V591-A608 HydrophobicContact CG1-CB 4.05Å
592I83.7Confident76.6Confident33 Ų3368.7 Ų68.717%0.16937%0.37CS..Hα-helixtrans-73.7-19.717969.5176.7000114F588 T642 F651F588-I592 HydrophobicContact CD1-CD1 4.18Å; F588-I592 HydrophobicContact CD1-CG2 4.39Å; F588-I592 HydrophobicContact CD2-CG2 4.4Å; F588-I592 HydrophobicContact CE1-CD1 3.77Å; F588-I592 HydrophobicContact CE1-CG2 3.98Å; F588-I592 HydrophobicContact CE2-CG2 3.97Å; F588-I592 HydrophobicContact CZ-CD1 4.47Å; F588-I592 HydrophobicContact CZ-CG2 3.74Å; F588-I592 WeakPolarHBondContact O-CG2 3.34Å; F588-I592 PolarHBondContact O-N 2.76Å; I592-T642 HydrophobicContact CD1-CG2 3.79Å; I592-F651 HydrophobicContact CG2-CE2 3.83Å; I592-F651 HydrophobicContact CG2-CZ 4.33Å
593Q78.7Confident75.5Confident144 Ų14467.2 Ų67.267%0.67337%0.365SS*.Hα-helixtrans-81.6-19.4-178.1-82.9177.726.200113.2N589 Q590 V591 G595N589-Q593 WeakPolarHBondContact O-CB 3.36Å; N589-Q593 WeakPolarHBondContact O-CG 3.45Å; N589-Q593 PolarHBondContact O-N 2.95Å; N589-Q593 PolarHBondContact O-NE2 3.23Å; Q590-Q593 PolarHBondContact O-N 3.06Å; V591-Q593 VanDerWaalsContact C-N 3.33Å; V591-Q593 PolarHBondContact O-N 3.2Å; Q593-G595 PolarHBondContact O-N 2.8Å
594T67.2Low74.8Confident48 Ų4867 Ų6729%0.29436%0.364SS..SBendtrans-74.2112.4168.948.20000108.5V591 K604V591-T594 PolarHBondContact O-OG1 3.42Å; T594-K604 WeakPolarHBondContact OG1-CD 3.15Å; T594-K604 PolarHBondContact OG1-NZ 3.49Å
595G54.6Low74.3Confident36 Ų3667.7 Ų67.737%0.37137%0.369SS..  trans-65.8162.4-165.500000114.7Q593 D597 E598Q593-G595 PolarHBondContact O-N 2.8Å; G595-D597 PolarHBondContact O-N 3.28Å; G595-E598 PolarHBondContact O-N 3.1Å
596P55.4Low73.8Confident114 Ų11470.8 Ų70.874%0.7439%0.387SS*.THydrogen-bonded Turntrans-64.8-9.7-176.626.3-35.3000114.6E598P596-E598 VanDerWaalsContact C-N 3.32Å
597D50Low73.6Confident166 Ų16665.2 Ų65.289%0.88836%0.36SS*.THydrogen-bonded Turntrans-83.6-2.7179.1-67.7-37000113.3G595G595-D597 PolarHBondContact O-N 3.28Å
598E52.6Low73.5Confident104 Ų10465.1 Ų65.149%0.48636%0.359SS..SBendtrans-85135.1174.3-71.4-173.1171.200111.6G595 P596 G600 S601 K604G595-E598 PolarHBondContact O-N 3.1Å; P596-E598 VanDerWaalsContact C-N 3.32Å; E598-G600 PolarHBondContact O-N 3.5Å; E598-S601 PolarHBondContact O-N 3.29Å; E598-K604 IonicContact OE2-NZ 2.64Å; E598-K604 PolarHBondContact OE2-NZ 3.43Å; E598-K604 VanDerWaalsContact OE2-NZ 3.08Å
599E51.2Low73.4Confident200 Ų20067.8 Ų67.894%0.93537%0.372SS*.THydrogen-bonded Turntrans-57.2121.8171.8-72.8177.916500109.7
600G58Low73.6Confident23 Ų2366.5 Ų66.524%0.23737%0.368CS..THydrogen-bonded Turntrans104.117.3-176.100000115.6E598 D602 D603 K604E598-G600 PolarHBondContact O-N 3.5Å; G600-D602 PolarHBondContact O-N 3.28Å; G600-D603 PolarHBondContact O-N 3.27Å; G600-K604 PolarHBondContact O-N 3.07Å
601S64.4Low73.9Confident49 Ų4962.1 Ų62.134%0.34335%0.347SS..Hα-helixtrans-50.2-38.6173.856.70000113.5E598 K604 A605E598-S601 PolarHBondContact O-N 3.29Å; S601-K604 PolarHBondContact O-N 3.38Å; S601-A605 PolarHBondContact O-N 2.84Å
602D70.2Confident74.5Confident122 Ų12261.8 Ų61.865%0.65235%0.345SS*.Hα-helixtrans-69.3-43.9-174.5-60.1-3.5000111G600 K604 A605 V606G600-D602 PolarHBondContact O-N 3.28Å; D602-K604 VanDerWaalsContact C-N 3.27Å; D602-K604 PolarHBondContact O-N 3.05Å; D602-A605 WeakPolarHBondContact O-CB 3.39Å; D602-A605 PolarHBondContact O-N 3.12Å; D602-A605 VanDerWaalsContact O-N 3.13Å; D602-V606 WeakPolarHBondContact O-CG2 3.42Å; D602-V606 PolarHBondContact O-N 3.42Å
603D73Confident75Confident66 Ų6663.5 Ų63.535%0.35336%0.355SS..Hα-helixtrans-61.3-38.7176.6-62.3-4.1000111.3R377 G600 V606 T607R377-D603 IonicContact CZ-OD2 3.95Å; R377-D603 IonicContact NE-OD2 3Å; R377-D603 PolarHBondContact NE-OD2 3.11Å; R377-D603 IonicContact NH2-OD2 3.37Å; R377-D603 PolarHBondContact NH2-OD2 3.15Å; G600-D603 PolarHBondContact O-N 3.27Å; D603-V606 PolarHBondContact O-N 3Å; D603-T607 PolarHBondContact O-N 3.36Å; D603-T607 PolarHBondContact O-OG1 2.85Å
604K79.9Confident75.8Confident39 Ų3956.7 Ų56.717%0.1732%0.323CS..Hα-helixtrans-66.4-38.4176.1-72.3-174.6177.8-178.80112.2E554 V591 T594 E598 G600 S601 D602 T607 A608E554-K604 WeakPolarHBondContact OE2-CE 3.36Å; V591-K604 HydrophobicContact CG1-CB 3.77Å; V591-K604 HydrophobicContact CG1-CG 4.3Å; V591-K604 VanDerWaalsContact CG1-O 3.24Å; V591-K604 WeakPolarHBondContact CG1-O 3.25Å; T594-K604 WeakPolarHBondContact OG1-CD 3.15Å; T594-K604 PolarHBondContact OG1-NZ 3.49Å; E598-K604 IonicContact OE2-NZ 2.64Å; E598-K604 PolarHBondContact OE2-NZ 3.43Å; E598-K604 VanDerWaalsContact OE2-NZ 3.08Å; G600-K604 PolarHBondContact O-N 3.07Å; S601-K604 PolarHBondContact O-N 3.38Å; D602-K604 VanDerWaalsContact C-N 3.27Å; D602-K604 PolarHBondContact O-N 3.05Å; K604-T607 PolarHBondContact O-N 2.93Å; K604-A608 VanDerWaalsContact O-CB 3.32Å; K604-A608 WeakPolarHBondContact O-CB 3.38Å; K604-A608 PolarHBondContact O-N 3.01Å
605A84.8Confident77.2Confident15 Ų1554.4 Ų54.412%0.12431%0.309CS..Hα-helixtrans-62.9-44.3175.100000111.1S601 D602 T607 A608 M609S601-A605 PolarHBondContact O-N 2.84Å; D602-A605 WeakPolarHBondContact O-CB 3.39Å; D602-A605 PolarHBondContact O-N 3.12Å; D602-A605 VanDerWaalsContact O-N 3.13Å; A605-T607 PolarHBondContact O-N 3.23Å; A605-A608 PolarHBondContact O-N 3.21Å; A605-M609 WeakPolarHBondContact O-CG 3.48Å; A605-M609 PolarHBondContact O-N 3.01Å
606V86.3Confident79.1Confident72 Ų7254 Ų5444%0.43630%0.298SS..Hα-helixtrans-59.2-47.3176177.30000111.1D556 D602 D603 A608 M609 G610D556-V606 HydrophobicContact CB-CG1 3.83Å; D602-V606 WeakPolarHBondContact O-CG2 3.42Å; D602-V606 PolarHBondContact O-N 3.42Å; D603-V606 PolarHBondContact O-N 3Å; V606-A608 VanDerWaalsContact C-N 3.34Å; V606-A608 PolarHBondContact O-N 3.17Å; V606-M609 PolarHBondContact O-N 3.06Å; V606-G610 PolarHBondContact O-N 3.41Å
607T87.5Confident81Confident2 Ų249.9 Ų49.91%0.01227%0.271CS..Hα-helixtrans-63.7-39176.9-65.20000112.2E554 D603 K604 A605 G610 I611E554-T607 HydrophobicContact CB-CG2 4.34Å; E554-T607 PolarHBondContact O-OG1 3.25Å; D603-T607 PolarHBondContact O-N 3.36Å; D603-T607 PolarHBondContact O-OG1 2.85Å; K604-T607 PolarHBondContact O-N 2.93Å; A605-T607 PolarHBondContact O-N 3.23Å; T607-G610 PolarHBondContact O-N 3.18Å; T607-I611 HydrophobicContact CG2-CD1 4.15Å; T607-I611 VanDerWaalsContact O-CG1 3.28Å; T607-I611 WeakPolarHBondContact O-CG1 3.19Å; T607-I611 PolarHBondContact O-N 3.32Å
608A91Very high83.1Confident0 Ų042 Ų420%023%0.228CC..Hα-helixtrans-64.2-43176.600000112.2F588 V591 K604 A605 V606 I611 L612 F651F588-A608 HydrophobicContact CD2-CB 3.99Å; F588-A608 HydrophobicContact CE2-CB 3.92Å; V591-A608 HydrophobicContact CG1-CB 4.05Å; K604-A608 VanDerWaalsContact O-CB 3.32Å; K604-A608 WeakPolarHBondContact O-CB 3.38Å; K604-A608 PolarHBondContact O-N 3.01Å; A605-A608 PolarHBondContact O-N 3.21Å; V606-A608 VanDerWaalsContact C-N 3.34Å; V606-A608 PolarHBondContact O-N 3.17Å; A608-I611 WeakPolarHBondContact O-CB 3.45Å; A608-I611 PolarHBondContact O-N 2.97Å; A608-L612 WeakPolarHBondContact O-CG 3.31Å; A608-L612 PolarHBondContact O-N 3.48Å; A608-L612 VanDerWaalsContact O-N 3.08Å; A608-F651 HydrophobicContact CB-CE1 3.61Å; A608-F651 HydrophobicContact CB-CZ 3.55Å
609M91.7Very high85.1Confident57 Ų5737.3 Ų37.328%0.28121%0.207SC..Hα-helixtrans-59.7-47.4172.3-69.7167.9176.500111A605 V606 I611 L612 N613 E650 F651A605-M609 WeakPolarHBondContact O-CG 3.48Å; A605-M609 PolarHBondContact O-N 3.01Å; V606-M609 PolarHBondContact O-N 3.06Å; M609-I611 VanDerWaalsContact C-N 3.25Å; M609-I611 PolarHBondContact O-N 3.38Å; M609-L612 PolarHBondContact O-N 3.44Å; M609-N613 PolarHBondContact O-N 2.74Å; M609-E650 WeakPolarHBondContact CE-O 3.5Å; M609-F651 HydrophobicContact CE-CD1 4.46Å; M609-F651 HydrophobicContact CE-CE1 4.43Å; M609-F651 HydrophobicContact CG-CD1 3.95Å; M609-F651 HydrophobicContact CG-CE1 3.87Å
610G92.9Very high87Confident8 Ų830.8 Ų30.88%0.08218%0.183CC..Hα-helixtrans-57.5-36.8176.100000113.1Q563 V606 T607 T614Q563-G610 PolarHBondContact NE2-O 3.14Å; V606-G610 PolarHBondContact O-N 3.41Å; T607-G610 PolarHBondContact O-N 3.18Å; G610-T614 WeakPolarHBondContact O-CB 3.26Å; G610-T614 PolarHBondContact O-N 3.08Å; G610-T614 PolarHBondContact O-OG1 2.88Å
611I95.1Very high88.6Confident0 Ų031.6 Ų31.60%018%0.183CC..Hα-helixtrans-66.4-44.5174.1-69.4164.1000111.5I550 T559 L584 T587 F588 T607 A608 M609 T614 I615I550-I611 HydrophobicContact CG2-CD1 4.42Å; I550-I611 HydrophobicContact CG2-CG1 4.42Å; T559-I611 HydrophobicContact CG2-CG1 4.27Å; L584-I611 HydrophobicContact CB-CG2 3.95Å; L584-I611 HydrophobicContact CD2-CG2 4.14Å; L584-I611 WeakPolarHBondContact O-CG2 3.23Å; T587-I611 HydrophobicContact CG2-CD1 3.72Å; F588-I611 HydrophobicContact CB-CG2 3.95Å; T607-I611 HydrophobicContact CG2-CD1 4.15Å; T607-I611 VanDerWaalsContact O-CG1 3.28Å; T607-I611 WeakPolarHBondContact O-CG1 3.19Å; T607-I611 PolarHBondContact O-N 3.32Å; A608-I611 WeakPolarHBondContact O-CB 3.45Å; A608-I611 PolarHBondContact O-N 2.97Å; M609-I611 VanDerWaalsContact C-N 3.25Å; M609-I611 PolarHBondContact O-N 3.38Å; I611-T614 WeakPolarHBondContact O-CB 3.49Å; I611-T614 PolarHBondContact O-N 3.47Å; I611-I615 HydrophobicContact CG2-CD1 4.35Å; I611-I615 WeakPolarHBondContact O-CG1 2.95Å; I611-I615 PolarHBondContact O-N 2.83Å
612L95.7Very high89.9Confident0 Ų029.2 Ų29.20%017%0.167CC..Hα-helixtrans-62.9-45.2178.1-65.4178.5000111.4F588 A608 M609 T614 I615 D616 V639 F651 E654 I655 L658F588-L612 HydrophobicContact CD2-CD1 4.41Å; F588-L612 HydrophobicContact CD2-CD2 3.82Å; F588-L612 HydrophobicContact CD2-CG 3.91Å; F588-L612 HydrophobicContact CE2-CD1 3.64Å; F588-L612 HydrophobicContact CE2-CD2 3.72Å; F588-L612 HydrophobicContact CE2-CG 3.64Å; F588-L612 HydrophobicContact CG-CD2 4.29Å; F588-L612 HydrophobicContact CZ-CD1 4.08Å; F588-L612 HydrophobicContact CZ-CD2 4.09Å; F588-L612 HydrophobicContact CZ-CG 4.35Å; A608-L612 WeakPolarHBondContact O-CG 3.31Å; A608-L612 PolarHBondContact O-N 3.48Å; A608-L612 VanDerWaalsContact O-N 3.08Å; M609-L612 PolarHBondContact O-N 3.44Å; L612-T614 PolarHBondContact O-N 2.85Å; L612-I615 WeakPolarHBondContact O-CA 3.42Å; L612-I615 WeakPolarHBondContact O-CB 3.31Å; L612-I615 PolarHBondContact O-N 3.24Å; L612-D616 PolarHBondContact O-N 3.33Å; L612-V639 HydrophobicContact CD2-CG1 3.54Å; L612-F651 HydrophobicContact CD1-CB 4.07Å; L612-F651 HydrophobicContact CD1-CD1 4.16Å; L612-F651 HydrophobicContact CD1-CG 4.29Å; L612-E654 HydrophobicContact CB-CB 3.9Å; L612-E654 HydrophobicContact CB-CG 4.32Å; L612-E654 HydrophobicContact CD1-CB 3.57Å; L612-E654 HydrophobicContact CD1-CG 4.23Å; L612-E654 HydrophobicContact CG-CB 4.38Å; L612-I655 HydrophobicContact CD1-CG2 4.45Å; L612-L658 HydrophobicContact CB-CD1 4.38Å; L612-L658 HydrophobicContact CD2-CD1 3.92Å
613N94.9Very high90.7Very high69 Ų6928.1 Ų28.137%0.36916%0.158SC..Hα-helixtrans-61.6-33.2175.5-67.7-16.3000112.2M609 D616 T617M609-N613 PolarHBondContact O-N 2.74Å; N613-D616 PolarHBondContact O-N 3.27Å; N613-T617 PolarHBondContact O-N 3.1Å; N613-T617 PolarHBondContact O-OG1 3.45Å
614T95.3Very high91.4Very high0 Ų031.3 Ų31.30%018%0.175CC..Hα-helixtrans-67.6-38.2173.4-54.10000112.2I562 Q563 I566 L584 G610 I611 L612 D616 L618I562-T614 HydrophobicContact CB-CG2 4.17Å; I562-T614 HydrophobicContact CG2-CG2 3.47Å; I562-T614 VanDerWaalsContact CG2-CG2 3.47Å; Q563-T614 HydrophobicContact CG-CG2 4.13Å; Q563-T614 PolarHBondContact NE2-OG1 3.44Å; I566-T614 HydrophobicContact CD1-CG2 3.87Å; L584-T614 HydrophobicContact CD1-CG2 3.72Å; L584-T614 HydrophobicContact CD2-CG2 4.39Å; G610-T614 WeakPolarHBondContact O-CB 3.26Å; G610-T614 PolarHBondContact O-N 3.08Å; G610-T614 PolarHBondContact O-OG1 2.88Å; I611-T614 WeakPolarHBondContact O-CB 3.49Å; I611-T614 PolarHBondContact O-N 3.47Å; L612-T614 PolarHBondContact O-N 2.85Å; T614-D616 VanDerWaalsContact C-N 3.34Å; T614-L618 PolarHBondContact O-N 3.15Å; T614-L618 VanDerWaalsContact O-N 3.08Å
615I96.6Very high91.9Very high1 Ų133.7 Ų33.71%0.00519%0.186CC..Hα-helixtrans-65.4-40.5173.7-65.5170.7000110.1T581 L584 I611 L612 L618 L619 L658T581-I615 HydrophobicContact CG2-CG1 4.38Å; T581-I615 HydrophobicContact CG2-CG2 3.98Å; L584-I615 HydrophobicContact CB-CD1 4.03Å; L584-I615 HydrophobicContact CB-CG1 3.87Å; L584-I615 HydrophobicContact CD1-CG1 3.95Å; I611-I615 HydrophobicContact CG2-CD1 4.35Å; I611-I615 WeakPolarHBondContact O-CG1 2.95Å; I611-I615 PolarHBondContact O-N 2.83Å; L612-I615 WeakPolarHBondContact O-CA 3.42Å; L612-I615 WeakPolarHBondContact O-CB 3.31Å; L612-I615 PolarHBondContact O-N 3.24Å; I615-L618 WeakPolarHBondContact O-CB 3.43Å; I615-L618 PolarHBondContact O-N 2.95Å; I615-L619 WeakPolarHBondContact O-CG 3.5Å; I615-L619 PolarHBondContact O-N 3.39Å; I615-L658 HydrophobicContact CB-CD2 4.17Å; I615-L658 HydrophobicContact CG2-CD2 3.76Å
616D95.3Very high92Very high27 Ų2739.8 Ų39.814%0.14421%0.21CC..Hα-helixtrans-66.1-40.5179-157.433.1000112.1L612 N613 T614 L618 L619 S620 S657 L658 S661L612-D616 PolarHBondContact O-N 3.33Å; N613-D616 PolarHBondContact O-N 3.27Å; T614-D616 VanDerWaalsContact C-N 3.34Å; D616-L618 VanDerWaalsContact C-N 3.32Å; D616-L618 PolarHBondContact O-N 3.4Å; D616-L619 WeakPolarHBondContact O-CB 3.13Å; D616-L619 PolarHBondContact O-N 3.26Å; D616-L619 VanDerWaalsContact O-N 3.15Å; D616-S620 PolarHBondContact O-N 3.23Å; D616-S620 PolarHBondContact O-OG 3.34Å; D616-S657 PolarHBondContact OD2-OG 2.96Å; D616-S657 VanDerWaalsContact OD2-OG 3.09Å; D616-L658 HydrophobicContact CB-CD2 3.69Å; D616-S661 VanDerWaalsContact OD1-CB 3.32Å; D616-S661 WeakPolarHBondContact OD1-CB 3.49Å; D616-S661 PolarHBondContact OD1-OG 3.06Å
617T94.8Very high92.1Very high27 Ų2744.1 Ų44.117%0.16623%0.226CC..Hα-helixtrans-59.7-42.1171.8-56.50000111.4Q563 I566 N613 S620 V621Q563-T617 HydrophobicContact CB-CG2 4.36Å; Q563-T617 HydrophobicContact CG-CG2 4.46Å; I566-T617 HydrophobicContact CB-CG2 4.4Å; I566-T617 HydrophobicContact CG2-CG2 4.14Å; N613-T617 PolarHBondContact O-N 3.1Å; N613-T617 PolarHBondContact O-OG1 3.45Å; T617-S620 PolarHBondContact O-N 3.08Å; T617-V621 WeakPolarHBondContact O-CG2 3.33Å; T617-V621 PolarHBondContact O-N 3.44Å; T617-V621 VanDerWaalsContact O-N 3.08Å
618L94.4Very high92.3Very high0 Ų045.4 Ų45.40%023%0.232CC..Hα-helixtrans-62.6-41.1174.4-78.7170000112.3I566 V573 M580 L584 T614 I615 D616 V622I566-L618 HydrophobicContact CB-CD2 4.46Å; I566-L618 HydrophobicContact CD1-CD1 4.31Å; I566-L618 HydrophobicContact CD1-CD2 3.59Å; I566-L618 HydrophobicContact CD1-CG 3.58Å; I566-L618 HydrophobicContact CG1-CD2 3.74Å; I566-L618 HydrophobicContact CG1-CG 4.3Å; I566-L618 HydrophobicContact CG2-CD2 3.84Å; I566-L618 HydrophobicContact CG2-CG 4.48Å; V573-L618 HydrophobicContact CG1-CD2 3.69Å; M580-L618 HydrophobicContact CB-CD1 4.21Å; M580-L618 HydrophobicContact CE-CD1 4.36Å; M580-L618 HydrophobicContact CE-CD2 4.16Å; L584-L618 HydrophobicContact CD1-CD1 3.75Å; T614-L618 PolarHBondContact O-N 3.15Å; T614-L618 VanDerWaalsContact O-N 3.08Å; I615-L618 WeakPolarHBondContact O-CB 3.43Å; I615-L618 PolarHBondContact O-N 2.95Å; D616-L618 VanDerWaalsContact C-N 3.32Å; D616-L618 PolarHBondContact O-N 3.4Å; L618-V622 WeakPolarHBondContact O-CG2 3.35Å; L618-V622 PolarHBondContact O-N 3.07Å
619L93.7Very high92.3Very high7 Ų746.9 Ų46.94%0.03724%0.241CC..Hα-helixtrans-63.5-43.3177.8-73.3175000111.5I615 D616 V622 E623 L632 L658 L662I615-L619 WeakPolarHBondContact O-CG 3.5Å; I615-L619 PolarHBondContact O-N 3.39Å; D616-L619 WeakPolarHBondContact O-CB 3.13Å; D616-L619 PolarHBondContact O-N 3.26Å; D616-L619 VanDerWaalsContact O-N 3.15Å; L619-V622 PolarHBondContact O-N 3.35Å; L619-E623 PolarHBondContact O-N 2.91Å; L619-L632 HydrophobicContact CD2-CB 3.74Å; L619-L632 HydrophobicContact CD2-CD1 3.85Å; L619-L632 HydrophobicContact CD2-CG 4.46Å; L619-L658 HydrophobicContact CD1-CD2 3.75Å; L619-L662 HydrophobicContact CD1-CD2 4.03Å; L619-L662 HydrophobicContact CD1-CG 4.03Å; L619-L662 HydrophobicContact CD2-CD2 3.72Å
620S91.7Very high92.2Very high63 Ų6350.8 Ų50.844%0.44126%0.259SS..Hα-helixtrans-61.7-45.2178.3-57.50000111.5D616 T617 V622 E623D616-S620 PolarHBondContact O-N 3.23Å; D616-S620 PolarHBondContact O-OG 3.34Å; T617-S620 PolarHBondContact O-N 3.08Å; S620-V622 VanDerWaalsContact C-N 3.31Å; S620-V622 PolarHBondContact O-N 3.16Å; S620-E623 PolarHBondContact O-N 2.99Å
621V91.1Very high92.2Very high39 Ų3955.4 Ų55.424%0.23628%0.278CS..Hα-helixtrans-68.8-27.5-179.6168.50000113.4I566 T617I566-V621 HydrophobicContact CG2-CB 4.11Å; I566-V621 HydrophobicContact CG2-CG1 4.31Å; I566-V621 HydrophobicContact CG2-CG2 3.87Å; T617-V621 WeakPolarHBondContact O-CG2 3.33Å; T617-V621 PolarHBondContact O-N 3.44Å; T617-V621 VanDerWaalsContact O-N 3.08Å
622V91.6Very high92.2Very high0 Ų055.4 Ų55.40%028%0.278CS..THydrogen-bonded Turntrans-10114.4-179.9-56.90000113.7T574 A577 L618 L619 S620 D624 H625 I628 T629 L632T574-V622 HydrophobicContact CG2-CG1 4.46Å; A577-V622 HydrophobicContact CB-CG1 4.03Å; L618-V622 WeakPolarHBondContact O-CG2 3.35Å; L618-V622 PolarHBondContact O-N 3.07Å; L619-V622 PolarHBondContact O-N 3.35Å; S620-V622 VanDerWaalsContact C-N 3.31Å; S620-V622 PolarHBondContact O-N 3.16Å; V622-D624 PolarHBondContact O-N 3.26Å; V622-H625 PolarHBondContact O-N 3.1Å; V622-I628 HydrophobicContact CB-CG2 4.29Å; V622-I628 HydrophobicContact CG1-CG2 4.4Å; V622-I628 HydrophobicContact CG2-CG2 4.28Å; V622-T629 PolarHBondContact O-OG1 3.05Å; V622-L632 HydrophobicContact CG2-CD1 3.54Å
623E87.3Confident92.1Very high98 Ų9856.3 Ų56.346%0.45828%0.283SS..THydrogen-bonded Turntrans-59-33.8-173.777.7159.8-114.100113.4L619 S620 H625 Q665L619-E623 PolarHBondContact O-N 2.91Å; S620-E623 PolarHBondContact O-N 2.99Å; E623-H625 PolarHBondContact O-N 3.18Å; E623-Q665 PolarHBondContact O-NE2 2.82Å; E623-Q665 PolarHBondContact OE1-NE2 3.45Å; E623-Q665 VanDerWaalsContact OE1-NE2 3.14Å
624D87.4Confident92Very high134 Ų13454.3 Ų54.372%0.71728%0.278SS*.THydrogen-bonded Turntrans-74.2-11.7178.7-75.8-38.6000113.3V622V622-D624 PolarHBondContact O-N 3.26Å
625H89.9Confident92Very high88 Ų8855 Ų5541%0.40728%0.282SS..  trans-10470.3-174.1-66.3-70.3000112.9V622 E623 E627 I628 T629V622-H625 PolarHBondContact O-N 3.1Å; E623-H625 PolarHBondContact O-N 3.18Å; H625-E627 VanDerWaalsContact C-N 3.29Å; H625-E627 PolarHBondContact O-N 3.22Å; H625-I628 HydrophobicContact CB-CB 4.11Å; H625-I628 HydrophobicContact CB-CD1 3.99Å; H625-I628 HydrophobicContact CB-CG1 4.28Å; H625-I628 WeakPolarHBondContact O-CA 3.23Å; H625-I628 WeakPolarHBondContact O-CB 3.25Å; H625-I628 PolarHBondContact O-N 2.99Å; H625-T629 PolarHBondContact O-N 3.04Å; H625-T629 PolarHBondContact O-OG1 3.31Å; H625-T629 VanDerWaalsContact O-OG1 3.09Å
626K87.5Confident92Very high143 Ų14355 Ų5562%0.62228%0.282SS*.Hα-helixtrans-44.1-42.2-175.2-60.9-169.1177.7-1660116.6I628 Q630K626-I628 VanDerWaalsContact C-N 3.29Å; K626-I628 PolarHBondContact O-N 2.79Å; K626-Q630 WeakPolarHBondContact O-CB 3.39Å; K626-Q630 PolarHBondContact O-N 3.43Å
627E88.9Confident91.9Very high163 Ų16355.3 Ų55.376%0.76228%0.283SS*.Hα-helixtrans-67.4-29.9179.5-67.9-173.8176.500113H625 Q631H625-E627 VanDerWaalsContact C-N 3.29Å; H625-E627 PolarHBondContact O-N 3.22Å; E627-Q631 PolarHBondContact O-NE2 2.86Å
628I91.7Very high91.8Very high30 Ų3060.3 Ų60.315%0.15431%0.305CS..Hα-helixtrans-80.3-48.8177.1-63.3175.8000108.7T574 A577 V578 V622 H625 K626 Q630 Q631 L632T574-I628 HydrophobicContact CG2-CD1 3.33Å; A577-I628 HydrophobicContact CB-CG2 4.21Å; V578-I628 HydrophobicContact CG2-CG2 4.19Å; V622-I628 HydrophobicContact CB-CG2 4.29Å; V622-I628 HydrophobicContact CG1-CG2 4.4Å; V622-I628 HydrophobicContact CG2-CG2 4.28Å; H625-I628 HydrophobicContact CB-CB 4.11Å; H625-I628 HydrophobicContact CB-CD1 3.99Å; H625-I628 HydrophobicContact CB-CG1 4.28Å; H625-I628 WeakPolarHBondContact O-CA 3.23Å; H625-I628 WeakPolarHBondContact O-CB 3.25Å; H625-I628 PolarHBondContact O-N 2.99Å; K626-I628 VanDerWaalsContact C-N 3.29Å; K626-I628 PolarHBondContact O-N 2.79Å; I628-Q630 PolarHBondContact O-N 3.1Å; I628-Q631 WeakPolarHBondContact O-CA 3.35Å; I628-Q631 WeakPolarHBondContact O-CB 3.35Å; I628-Q631 PolarHBondContact O-N 2.75Å; I628-L632 HydrophobicContact CG2-CD1 4.22Å; I628-L632 HydrophobicContact CG2-CG 4.24Å; I628-L632 WeakPolarHBondContact O-CG 3.42Å; I628-L632 PolarHBondContact O-N 3.02Å
629T90.3Very high91.8Very high31 Ų3160.4 Ų60.419%0.1931%0.306CS..Hα-helixtrans-53.4-41.7176.8-37.60000111.6V622 H625 Q631 L632 E633V622-T629 PolarHBondContact O-OG1 3.05Å; H625-T629 PolarHBondContact O-N 3.04Å; H625-T629 PolarHBondContact O-OG1 3.31Å; H625-T629 VanDerWaalsContact O-OG1 3.09Å; T629-Q631 VanDerWaalsContact C-N 3.31Å; T629-Q631 PolarHBondContact O-N 3.11Å; T629-L632 PolarHBondContact O-N 3.11Å; T629-E633 PolarHBondContact O-N 3.13Å
630Q90.2Very high91.8Very high139 Ų13960.2 Ų60.265%0.6530%0.304SS*.Hα-helixtrans-64-32.5176.3-172.3174.731.600113.6K626 I628K626-Q630 WeakPolarHBondContact O-CB 3.39Å; K626-Q630 PolarHBondContact O-N 3.43Å; I628-Q630 PolarHBondContact O-N 3.1Å
631Q92.7Very high91.9Very high105 Ų10557.7 Ų57.749%0.49129%0.288SS..Hα-helixtrans-75.2-37.2174.7-72173.168.700111.5V578 E627 I628 T629 G634V578-Q631 HydrophobicContact CG1-CB 4.38Å; V578-Q631 HydrophobicContact CG2-CB 3.93Å; E627-Q631 PolarHBondContact O-NE2 2.86Å; I628-Q631 WeakPolarHBondContact O-CA 3.35Å; I628-Q631 WeakPolarHBondContact O-CB 3.35Å; I628-Q631 PolarHBondContact O-N 2.75Å; T629-Q631 VanDerWaalsContact C-N 3.31Å; T629-Q631 PolarHBondContact O-N 3.11Å; Q631-G634 PolarHBondContact O-N 3.37Å
632L94Very high91.8Very high0 Ų057.2 Ų57.20%029%0.286CS..Hα-helixtrans-66.7-40.6176.1-61.8-170.4000111.7V578 T581 L619 V622 I628 T629 G634 I635 C636V578-L632 HydrophobicContact CB-CD2 4.34Å; V578-L632 HydrophobicContact CG2-CD2 4.03Å; T581-L632 HydrophobicContact CG2-CD2 4.08Å; T581-L632 VanDerWaalsContact OG1-CD2 3.31Å; T581-L632 WeakPolarHBondContact OG1-CD2 3.4Å; L619-L632 HydrophobicContact CD2-CB 3.74Å; L619-L632 HydrophobicContact CD2-CD1 3.85Å; L619-L632 HydrophobicContact CD2-CG 4.46Å; V622-L632 HydrophobicContact CG2-CD1 3.54Å; I628-L632 HydrophobicContact CG2-CD1 4.22Å; I628-L632 HydrophobicContact CG2-CG 4.24Å; I628-L632 WeakPolarHBondContact O-CG 3.42Å; I628-L632 PolarHBondContact O-N 3.02Å; T629-L632 PolarHBondContact O-N 3.11Å; L632-G634 PolarHBondContact O-N 2.92Å; L632-I635 HydrophobicContact CD2-CD1 4.19Å; L632-I635 WeakPolarHBondContact O-CA 3.47Å; L632-I635 WeakPolarHBondContact O-CB 3.26Å; L632-I635 PolarHBondContact O-N 3.5Å; L632-C636 PolarHBondContact O-N 3.44Å; L632-C636 PolarHBondContact O-SG 3.33Å; L632-C636 VanDerWaalsContact O-SG 3.34Å
633E94.6Very high91.8Very high19 Ų1957.2 Ų57.29%0.08929%0.286CS..Hα-helixtrans-49.4-46.5175.1-172.1-166.9125.100111.6T629 I635 C636 L637 L662 S668 M671T629-E633 PolarHBondContact O-N 3.13Å; E633-I635 VanDerWaalsContact C-N 3.27Å; E633-I635 PolarHBondContact O-N 2.7Å; E633-C636 PolarHBondContact O-N 2.85Å; E633-L637 HydrophobicContact CG-CD1 4.08Å; E633-L637 HydrophobicContact CG-CG 4.46Å; E633-L637 WeakPolarHBondContact O-CB 3.48Å; E633-L637 VanDerWaalsContact O-CG 3.29Å; E633-L637 WeakPolarHBondContact O-CG 3.22Å; E633-L637 PolarHBondContact O-N 3.41Å; E633-L662 HydrophobicContact CB-CD2 4.02Å; E633-L662 HydrophobicContact CG-CD1 4.43Å; E633-L662 HydrophobicContact CG-CD2 4.3Å; E633-S668 VanDerWaalsContact CD-OG 3.28Å; E633-S668 VanDerWaalsContact OE1-CB 3.27Å; E633-S668 WeakPolarHBondContact OE1-CB 3.35Å; E633-S668 PolarHBondContact OE1-OG 3.4Å; E633-S668 WeakPolarHBondContact OE2-CB 3.35Å; E633-S668 PolarHBondContact OE2-OG 3.36Å; E633-M671 HydrophobicContact CG-CG 4.39Å; E633-M671 HydrophobicContact CG-SD 4.18Å
634G93.5Very high92Very high27 Ų2752.8 Ų52.828%0.27827%0.265SS..Hα-helixtrans-64.7-27.7179.300000114.3Q631 L632Q631-G634 PolarHBondContact O-N 3.37Å; L632-G634 PolarHBondContact O-N 2.92Å
635I95.1Very high92Very high13 Ų1352.9 Ų52.97%0.06726%0.261CS..Hα-helixtrans-81.3-48.2176.3-59.3157.3000109.5V578 T581 Q582 A585 L632 E633 L637 Q638 V639V578-I635 HydrophobicContact CG1-CD1 4.07Å; T581-I635 HydrophobicContact CG2-CB 4.27Å; T581-I635 HydrophobicContact CG2-CD1 4.36Å; T581-I635 HydrophobicContact CG2-CG2 3.91Å; Q582-I635 HydrophobicContact CG-CD1 3.47Å; Q582-I635 VanDerWaalsContact CG-CD1 3.47Å; Q582-I635 HydrophobicContact CG-CG1 3.97Å; A585-I635 HydrophobicContact CB-CG2 3.63Å; L632-I635 HydrophobicContact CD2-CD1 4.19Å; L632-I635 WeakPolarHBondContact O-CA 3.47Å; L632-I635 WeakPolarHBondContact O-CB 3.26Å; L632-I635 PolarHBondContact O-N 3.5Å; E633-I635 VanDerWaalsContact C-N 3.27Å; E633-I635 PolarHBondContact O-N 2.7Å; I635-L637 VanDerWaalsContact C-N 3.3Å; I635-L637 PolarHBondContact O-N 3.16Å; I635-Q638 WeakPolarHBondContact O-CB 3.41Å; I635-Q638 PolarHBondContact O-N 2.97Å; I635-V639 PolarHBondContact O-N 2.82Å
636C95.5Very high91.9Very high2 Ų253.7 Ų53.71%0.01427%0.265CS..Hα-helixtrans-59.9-39178.5-640000111.8L632 E633 Q638 V639 I640 L662L632-C636 PolarHBondContact O-N 3.44Å; L632-C636 PolarHBondContact O-SG 3.33Å; L632-C636 VanDerWaalsContact O-SG 3.34Å; E633-C636 PolarHBondContact O-N 2.85Å; C636-Q638 PolarHBondContact O-N 3.34Å; C636-V639 WeakPolarHBondContact O-CB 3.43Å; C636-V639 PolarHBondContact O-N 3.48Å; C636-I640 VanDerWaalsContact O-CG1 3.31Å; C636-I640 WeakPolarHBondContact O-CG1 3.2Å; C636-I640 PolarHBondContact O-N 3.06Å; C636-L662 HydrophobicContact CB-CD1 3.65Å
637L94.4Very high91.8Very high33 Ų3349.8 Ų49.817%0.17325%0.249CC..Hα-helixtrans-60.5-30.3174.5-80.3172.4000113.4E633 I635 G641 Q670 M671E633-L637 HydrophobicContact CG-CD1 4.08Å; E633-L637 HydrophobicContact CG-CG 4.46Å; E633-L637 WeakPolarHBondContact O-CB 3.48Å; E633-L637 VanDerWaalsContact O-CG 3.29Å; E633-L637 WeakPolarHBondContact O-CG 3.22Å; E633-L637 PolarHBondContact O-N 3.41Å; I635-L637 VanDerWaalsContact C-N 3.3Å; I635-L637 PolarHBondContact O-N 3.16Å; L637-G641 WeakPolarHBondContact O-CA 3.42Å; L637-G641 PolarHBondContact O-N 2.92Å; L637-Q670 HydrophobicContact CD1-CB 3.54Å; L637-Q670 HydrophobicContact CD1-CG 4.48Å; L637-M671 HydrophobicContact CD1-SD 4.4Å; L637-M671 HydrophobicContact CD2-SD 3.72Å; L637-M671 HydrophobicContact CG-SD 4.15Å
638Q92.4Very high91.7Very high133 Ų13343.7 Ų43.762%0.62122%0.223SC*.Hα-helixtrans-70.2-39.9173.6-65.9178.5-1.700111.3I635 C636 T642I635-Q638 WeakPolarHBondContact O-CB 3.41Å; I635-Q638 PolarHBondContact O-N 2.97Å; C636-Q638 PolarHBondContact O-N 3.34Å; Q638-T642 WeakPolarHBondContact O-CB 3.3Å; Q638-T642 PolarHBondContact O-N 3.46Å; Q638-T642 PolarHBondContact O-OG1 2.84Å
639V94.4Very high91.5Very high2 Ų245.5 Ų45.51%0.01223%0.232CC..Hα-helixtrans-65.8-56.2176.6177.80000110.2A585 F588 L612 I635 C636 G641 T642 V643A585-V639 HydrophobicContact CB-CG2 3.55Å; F588-V639 HydrophobicContact CD1-CG1 3.8Å; F588-V639 HydrophobicContact CE1-CG1 3.75Å; F588-V639 HydrophobicContact CG-CG1 4.45Å; F588-V639 HydrophobicContact CZ-CG1 4.38Å; L612-V639 HydrophobicContact CD2-CG1 3.54Å; I635-V639 PolarHBondContact O-N 2.82Å; C636-V639 WeakPolarHBondContact O-CB 3.43Å; C636-V639 PolarHBondContact O-N 3.48Å; V639-G641 VanDerWaalsContact C-N 3.3Å; V639-G641 PolarHBondContact O-N 3.38Å; V639-T642 WeakPolarHBondContact O-CB 3.1Å; V639-T642 PolarHBondContact O-N 2.9Å; V639-V643 PolarHBondContact O-N 2.89Å; V639-V643 VanDerWaalsContact O-N 3.1Å
640I94.5Very high91.4Very high2 Ų250 Ų501%0.0125%0.251CS..Hα-helixtrans-54.5-47.9177.7-64.5164000110.3C636 T642 V643 L644 I655 L658 A659 L662 L674C636-I640 VanDerWaalsContact O-CG1 3.31Å; C636-I640 WeakPolarHBondContact O-CG1 3.2Å; C636-I640 PolarHBondContact O-N 3.06Å; I640-T642 VanDerWaalsContact C-N 3.3Å; I640-T642 PolarHBondContact O-N 3.36Å; I640-V643 PolarHBondContact O-N 3.21Å; I640-L644 HydrophobicContact CG2-CD1 3.68Å; I640-L644 HydrophobicContact CG2-CG 4.2Å; I640-L644 WeakPolarHBondContact O-CB 3.4Å; I640-L644 WeakPolarHBondContact O-CG 3.44Å; I640-L644 PolarHBondContact O-N 3.06Å; I640-I655 HydrophobicContact CG1-CB 4.26Å; I640-L658 HydrophobicContact CD1-CB 4.34Å; I640-A659 HydrophobicContact CD1-CB 4.16Å; I640-L662 HydrophobicContact CD1-CD1 4.32Å; I640-L674 HydrophobicContact CG2-CD1 3.66Å; I640-L674 HydrophobicContact CG2-CD2 4.12Å
641G91.9Very high91.5Very high10 Ų1043.7 Ų43.710%0.10322%0.222CC..Hα-helixtrans-61.5-37.7179.200000112.8L637 V639 Q645L637-G641 WeakPolarHBondContact O-CA 3.42Å; L637-G641 PolarHBondContact O-N 2.92Å; V639-G641 VanDerWaalsContact C-N 3.3Å; V639-G641 PolarHBondContact O-N 3.38Å; G641-Q645 WeakPolarHBondContact O-CB 3.46Å; G641-Q645 WeakPolarHBondContact O-CG 3.27Å; G641-Q645 PolarHBondContact O-N 3Å
642T90.1Very high91.5Very high30 Ų3038.7 Ų38.718%0.18420%0.198CC..Hα-helixtrans-65.9-46.5178.7-60.60000110.9I592 Q638 V639 I640 Q646I592-T642 HydrophobicContact CD1-CG2 3.79Å; Q638-T642 WeakPolarHBondContact O-CB 3.3Å; Q638-T642 PolarHBondContact O-N 3.46Å; Q638-T642 PolarHBondContact O-OG1 2.84Å; V639-T642 WeakPolarHBondContact O-CB 3.1Å; V639-T642 PolarHBondContact O-N 2.9Å; I640-T642 VanDerWaalsContact C-N 3.3Å; I640-T642 PolarHBondContact O-N 3.36Å; T642-Q646 VanDerWaalsContact O-CB 3.25Å; T642-Q646 WeakPolarHBondContact O-CB 3.49Å; T642-Q646 VanDerWaalsContact O-CG 3.27Å; T642-Q646 WeakPolarHBondContact O-CG 3.47Å; T642-Q646 PolarHBondContact O-N 3.38Å
643V91.8Very high91.5Very high0 Ų044 Ų440%022%0.223CC..Hα-helixtrans-65.1-49-179.8177.30000111.5F588 V639 I640 Q645 Q646 H647 V648 F651 Y652 I655F588-V643 HydrophobicContact CE1-CG2 3.74Å; F588-V643 HydrophobicContact CZ-CG2 3.62Å; V639-V643 PolarHBondContact O-N 2.89Å; V639-V643 VanDerWaalsContact O-N 3.1Å; I640-V643 PolarHBondContact O-N 3.21Å; V643-Q645 PolarHBondContact O-N 3.34Å; V643-Q646 PolarHBondContact O-N 2.93Å; V643-H647 PolarHBondContact O-N 3.13Å; V643-V648 HydrophobicContact CG1-CB 4.21Å; V643-V648 WeakPolarHBondContact CG1-O 3.39Å; V643-V648 PolarHBondContact O-N 3.22Å; V643-F651 HydrophobicContact CG1-CB 3.92Å; V643-F651 HydrophobicContact CG2-CB 4.47Å; V643-Y652 HydrophobicContact CG1-CD1 4.19Å; V643-Y652 HydrophobicContact CG1-CE1 4.29Å; V643-I655 HydrophobicContact CB-CD1 3.97Å; V643-I655 HydrophobicContact CB-CG2 3.98Å; V643-I655 HydrophobicContact CG1-CD1 3.37Å; V643-I655 HydrophobicContact CG1-CG2 4.03Å; V643-I655 HydrophobicContact CG2-CG2 3.94Å
644L91.3Very high91.5Very high4 Ų444.4 Ų44.42%0.02123%0.225CC..Hα-helixtrans-66.2-36.6-179.6-64.5178.9000112.5I640 Y652 I655 F656 L674 L677 V681I640-L644 HydrophobicContact CG2-CD1 3.68Å; I640-L644 HydrophobicContact CG2-CG 4.2Å; I640-L644 WeakPolarHBondContact O-CB 3.4Å; I640-L644 WeakPolarHBondContact O-CG 3.44Å; I640-L644 PolarHBondContact O-N 3.06Å; L644-Y652 HydrophobicContact CD2-CE1 4.23Å; L644-I655 HydrophobicContact CD2-CD1 3.49Å; L644-I655 VanDerWaalsContact CD2-CD1 3.49Å; L644-I655 HydrophobicContact CD2-CG1 4.4Å; L644-I655 HydrophobicContact CG-CD1 4.02Å; L644-F656 HydrophobicContact CD2-CE1 4.37Å; L644-F656 HydrophobicContact CD2-CZ 4.19Å; L644-L674 HydrophobicContact CD1-CD1 3.71Å; L644-L677 HydrophobicContact CD1-CB 4.49Å; L644-V681 HydrophobicContact CB-CG2 4.06Å; L644-V681 HydrophobicContact CD2-CB 4.44Å; L644-V681 HydrophobicContact CD2-CG1 4.25Å; L644-V681 HydrophobicContact CD2-CG2 3.96Å
645Q88.1Confident91.6Very high136 Ų13643.1 Ų43.164%0.63621%0.212SC*.Hα-helixtrans-76.6-28.5178.8-71.1171.74.200113.2G641 V643G641-Q645 WeakPolarHBondContact O-CB 3.46Å; G641-Q645 WeakPolarHBondContact O-CG 3.27Å; G641-Q645 PolarHBondContact O-N 3Å; V643-Q645 PolarHBondContact O-N 3.34Å
646Q87.3Confident91.7Very high105 Ų10542.7 Ų42.749%0.49121%0.209SC..Hα-helixtrans-89.5-2.9176.9-67.4-176.421.100113T642 V643 V648T642-Q646 VanDerWaalsContact O-CB 3.25Å; T642-Q646 WeakPolarHBondContact O-CB 3.49Å; T642-Q646 VanDerWaalsContact O-CG 3.27Å; T642-Q646 WeakPolarHBondContact O-CG 3.47Å; T642-Q646 PolarHBondContact O-N 3.38Å; V643-Q646 PolarHBondContact O-N 2.93Å; Q646-V648 VanDerWaalsContact C-N 3.31Å; Q646-V648 HydrophobicContact CB-CG2 3.76Å; Q646-V648 PolarHBondContact O-N 3.49Å
647H85.3Confident91.7Very high62 Ų6244.8 Ų44.829%0.28722%0.224SC..THydrogen-bonded Turntrans56.742.8179.8-67.1-85.1000112.9V643 L649 Q684 D685V643-H647 PolarHBondContact O-N 3.13Å; H647-L649 PolarHBondContact O-N 3.23Å; H647-L649 VanDerWaalsContact O-N 3.16Å; H647-Q684 PolarHBondContact CE1-OE1 2.9Å; H647-Q684 PolarHBondContact NE2-OE1 2.94Å; H647-D685 WeakPolarHBondContact CB-OD2 3.41Å; H647-D685 IonicContact CG-OD2 3.7Å; H647-D685 IonicContact ND1-OD1 3.73Å; H647-D685 PolarHBondContact ND1-OD1 3.45Å; H647-D685 IonicContact ND1-OD2 3.45Å; H647-D685 PolarHBondContact ND1-OD2 2.94Å
648V87.5Confident91.7Very high35 Ų3543.3 Ų43.321%0.21222%0.216CC..  trans-87.285.6179.5-166.90000109.1V643 Q646 E650 F651 Y652V643-V648 HydrophobicContact CG1-CB 4.21Å; V643-V648 WeakPolarHBondContact CG1-O 3.39Å; V643-V648 PolarHBondContact O-N 3.22Å; Q646-V648 VanDerWaalsContact C-N 3.31Å; Q646-V648 HydrophobicContact CB-CG2 3.76Å; Q646-V648 PolarHBondContact O-N 3.49Å; V648-E650 PolarHBondContact O-N 3.12Å; V648-F651 HydrophobicContact CB-CD2 4.17Å; V648-F651 HydrophobicContact CG1-CD2 3.49Å; V648-F651 VanDerWaalsContact CG1-CD2 3.49Å; V648-F651 HydrophobicContact CG1-CE2 3.63Å; V648-F651 PolarHBondContact O-N 3.42Å; V648-Y652 WeakPolarHBondContact O-CD1 3.19Å; V648-Y652 WeakPolarHBondContact O-CE1 3.38Å
649L87.2Confident91.9Very high67 Ų6737 Ų3735%0.35119%0.187SC..G310 helixtrans-53.9-33.8-174.3-70.5158.5000113.8H647 F651 Y652 D685 Y689H647-L649 PolarHBondContact O-N 3.23Å; H647-L649 VanDerWaalsContact O-N 3.16Å; L649-F651 PolarHBondContact O-N 2.88Å; L649-F651 VanDerWaalsContact O-N 3.08Å; L649-Y652 HydrophobicContact CD2-CD2 4.05Å; L649-Y652 HydrophobicContact CD2-CE2 3.56Å; L649-Y652 PolarHBondContact O-N 3.06Å; L649-D685 HydrophobicContact CD2-CB 3.95Å; L649-Y689 HydrophobicContact CD2-CE2 3.95Å; L649-Y689 PolarHBondContact O-OH 3.22Å
650E87.2Confident91.9Very high125 Ų12539.5 Ų39.558%0.58420%0.199SC*.G310 helixtrans-62.2-15-175.7-64.7168.9-168.300114.2M609 V648M609-E650 WeakPolarHBondContact CE-O 3.5Å; V648-E650 PolarHBondContact O-N 3.12Å
651F91.9Very high91.8Very high8 Ų841.1 Ų41.14%0.03521%0.21CC..G310 helixtrans-11713.8-178.3-55-59.1000113.5F588 I592 A608 M609 L612 V643 V648 L649 E654 I655F588-F651 HydrophobicContact CE2-CD2 4.45Å; F588-F651 HydrophobicContact CE2-CG 4.49Å; F588-F651 HydrophobicContact CZ-CD2 4.16Å; F588-F651 HydrophobicContact CZ-CE2 4.44Å; F588-F651 HydrophobicContact CZ-CG 4.43Å; I592-F651 HydrophobicContact CG2-CE2 3.83Å; I592-F651 HydrophobicContact CG2-CZ 4.33Å; A608-F651 HydrophobicContact CB-CE1 3.61Å; A608-F651 HydrophobicContact CB-CZ 3.55Å; M609-F651 HydrophobicContact CE-CD1 4.46Å; M609-F651 HydrophobicContact CE-CE1 4.43Å; M609-F651 HydrophobicContact CG-CD1 3.95Å; M609-F651 HydrophobicContact CG-CE1 3.87Å; L612-F651 HydrophobicContact CD1-CB 4.07Å; L612-F651 HydrophobicContact CD1-CD1 4.16Å; L612-F651 HydrophobicContact CD1-CG 4.29Å; V643-F651 HydrophobicContact CG1-CB 3.92Å; V643-F651 HydrophobicContact CG2-CB 4.47Å; V648-F651 HydrophobicContact CB-CD2 4.17Å; V648-F651 HydrophobicContact CG1-CD2 3.49Å; V648-F651 VanDerWaalsContact CG1-CD2 3.49Å; V648-F651 HydrophobicContact CG1-CE2 3.63Å; V648-F651 PolarHBondContact O-N 3.42Å; L649-F651 PolarHBondContact O-N 2.88Å; L649-F651 VanDerWaalsContact O-N 3.08Å; F651-E654 VanDerWaalsContact CA-OE2 3.26Å; F651-E654 WeakPolarHBondContact CA-OE2 3.22Å; F651-I655 WeakPolarHBondContact O-CD1 3.32Å; F651-I655 VanDerWaalsContact O-CG1 3.27Å; F651-I655 WeakPolarHBondContact O-CG1 3.45Å; F651-I655 WeakPolarHBondContact O-CG2 3.47Å; F651-I655 PolarHBondContact O-N 3.23Å; F651-I655 VanDerWaalsContact O-N 3.12Å
652Y93.5Very high91.9Very high0 Ų041.3 Ų41.30%021%0.208CC..Hα-helixtrans-66.3-36.8-175.5-82.915.7000112.7V643 L644 V648 L649 I655 F656 V681 D685 Y689V643-Y652 HydrophobicContact CG1-CD1 4.19Å; V643-Y652 HydrophobicContact CG1-CE1 4.29Å; L644-Y652 HydrophobicContact CD2-CE1 4.23Å; V648-Y652 WeakPolarHBondContact O-CD1 3.19Å; V648-Y652 WeakPolarHBondContact O-CE1 3.38Å; L649-Y652 HydrophobicContact CD2-CD2 4.05Å; L649-Y652 HydrophobicContact CD2-CE2 3.56Å; L649-Y652 PolarHBondContact O-N 3.06Å; Y652-I655 HydrophobicContact CD1-CD1 3.59Å; Y652-I655 HydrophobicContact CE1-CD1 4.25Å; Y652-I655 HydrophobicContact CG-CD1 4.29Å; Y652-I655 VanDerWaalsContact O-CG1 3.29Å; Y652-I655 WeakPolarHBondContact O-CG1 3.23Å; Y652-F656 HydrophobicContact CD2-CE2 4.42Å; Y652-F656 HydrophobicContact CG-CE2 4.35Å; Y652-F656 WeakPolarHBondContact O-CD2 3.36Å; Y652-F656 WeakPolarHBondContact O-CG 3.35Å; Y652-F656 PolarHBondContact O-N 3.08Å; Y652-F656 VanDerWaalsContact O-N 3.15Å; Y652-V681 HydrophobicContact CD2-CG1 4.23Å; Y652-V681 HydrophobicContact CE1-CG1 4.5Å; Y652-V681 HydrophobicContact CE2-CG1 3.36Å; Y652-V681 WeakPolarHBondContact OH-CG1 3.3Å; Y652-D685 PolarHBondContact OH-OD1 3.06Å; Y652-Y689 HydrophobicContact CD2-CD1 4.49Å; Y652-Y689 AromaticContact CD2-CD2 3.67Å; Y652-Y689 HydrophobicContact CD2-CD2 3.67Å; Y652-Y689 AromaticContact CD2-CE2 3.95Å; Y652-Y689 HydrophobicContact CD2-CE2 3.95Å; Y652-Y689 AromaticContact CD2-CG 3.95Å; Y652-Y689 HydrophobicContact CD2-CG 3.95Å; Y652-Y689 HydrophobicContact CE2-CD2 4.46Å; Y652-Y689 HydrophobicContact CG-CD2 4.5Å
653E94.4Very high92.1Very high110 Ų11039.9 Ų39.951%0.51420%0.2SC..Hα-helixtrans-63.4-49.5177.8-61.9-179.3-166.800110.5I655 F656 S657 Y689E653-I655 PolarHBondContact O-N 3.17Å; E653-F656 PolarHBondContact O-N 2.88Å; E653-S657 PolarHBondContact O-N 2.96Å; E653-Y689 HydrophobicContact CG-CD1 4.17Å; E653-Y689 HydrophobicContact CG-CE1 4.1Å
654E94.8Very high92Very high28 Ų2842.5 Ų42.513%0.13122%0.218CC..Hα-helixtrans-67.6-39-176.8-63.479-177.500112.6L612 F651 S657 L658L612-E654 HydrophobicContact CB-CB 3.9Å; L612-E654 HydrophobicContact CB-CG 4.32Å; L612-E654 HydrophobicContact CD1-CB 3.57Å; L612-E654 HydrophobicContact CD1-CG 4.23Å; L612-E654 HydrophobicContact CG-CB 4.38Å; F651-E654 VanDerWaalsContact CA-OE2 3.26Å; F651-E654 WeakPolarHBondContact CA-OE2 3.22Å; E654-S657 PolarHBondContact O-N 3.3Å; E654-L658 WeakPolarHBondContact O-CG 3.39Å; E654-L658 PolarHBondContact O-N 3.35Å
655I95.5Very high91.9Very high0 Ų046.7 Ų46.70%024%0.237CC..Hα-helixtrans-71.2-31.7178.267.1-162.4000112.4L612 I640 V643 L644 F651 Y652 E653 A659L612-I655 HydrophobicContact CD1-CG2 4.45Å; I640-I655 HydrophobicContact CG1-CB 4.26Å; V643-I655 HydrophobicContact CB-CD1 3.97Å; V643-I655 HydrophobicContact CB-CG2 3.98Å; V643-I655 HydrophobicContact CG1-CD1 3.37Å; V643-I655 HydrophobicContact CG1-CG2 4.03Å; V643-I655 HydrophobicContact CG2-CG2 3.94Å; L644-I655 HydrophobicContact CD2-CD1 3.49Å; L644-I655 VanDerWaalsContact CD2-CD1 3.49Å; L644-I655 HydrophobicContact CD2-CG1 4.4Å; L644-I655 HydrophobicContact CG-CD1 4.02Å; F651-I655 WeakPolarHBondContact O-CD1 3.32Å; F651-I655 VanDerWaalsContact O-CG1 3.27Å; F651-I655 WeakPolarHBondContact O-CG1 3.45Å; F651-I655 WeakPolarHBondContact O-CG2 3.47Å; F651-I655 PolarHBondContact O-N 3.23Å; F651-I655 VanDerWaalsContact O-N 3.12Å; Y652-I655 HydrophobicContact CD1-CD1 3.59Å; Y652-I655 HydrophobicContact CE1-CD1 4.25Å; Y652-I655 HydrophobicContact CG-CD1 4.29Å; Y652-I655 VanDerWaalsContact O-CG1 3.29Å; Y652-I655 WeakPolarHBondContact O-CG1 3.23Å; E653-I655 PolarHBondContact O-N 3.17Å; I655-A659 WeakPolarHBondContact O-CB 3.35Å; I655-A659 PolarHBondContact O-N 3.32Å
656F96.3Very high92Very high4 Ų446.6 Ų46.62%0.01824%0.237CC..Hα-helixtrans-73.5-35.4173.3-68-47.3000111.4L644 Y652 E653 A659 H660 V678 D692 M693 L696L644-F656 HydrophobicContact CD2-CE1 4.37Å; L644-F656 HydrophobicContact CD2-CZ 4.19Å; Y652-F656 HydrophobicContact CD2-CE2 4.42Å; Y652-F656 HydrophobicContact CG-CE2 4.35Å; Y652-F656 WeakPolarHBondContact O-CD2 3.36Å; Y652-F656 WeakPolarHBondContact O-CG 3.35Å; Y652-F656 PolarHBondContact O-N 3.08Å; Y652-F656 VanDerWaalsContact O-N 3.15Å; E653-F656 PolarHBondContact O-N 2.88Å; F656-A659 PolarHBondContact O-N 3.2Å; F656-H660 VanDerWaalsContact O-CB 3.32Å; F656-H660 WeakPolarHBondContact O-CB 3.42Å; F656-H660 PolarHBondContact O-N 3.2Å; F656-V678 HydrophobicContact CE1-CG1 4.02Å; F656-V678 HydrophobicContact CE1-CG2 4.05Å; F656-V678 HydrophobicContact CZ-CG1 4.48Å; F656-D692 HydrophobicContact CB-CB 4.5Å; F656-D692 WeakPolarHBondContact CB-O 3.26Å; F656-D692 HydrophobicContact CD2-CB 3.99Å; F656-M693 HydrophobicContact CD1-CG 4.19Å; F656-M693 HydrophobicContact CD2-CG 3.9Å; F656-M693 HydrophobicContact CE1-CG 3.88Å; F656-M693 HydrophobicContact CE2-CE 3.72Å; F656-M693 HydrophobicContact CE2-CG 3.57Å; F656-M693 HydrophobicContact CG-CG 4.24Å; F656-M693 HydrophobicContact CZ-CE 3.56Å; F656-M693 HydrophobicContact CZ-CG 3.59Å; F656-M693 HydrophobicContact CZ-SD 4.26Å; F656-L696 HydrophobicContact CD1-CD2 4.24Å
657S94.9Very high92.4Very high47 Ų4741.8 Ų41.833%0.32921%0.214SC..Hα-helixtrans-57.7-51.2168.4-167.30000111.4D616 E653 E654 A659 H660 S661D616-S657 PolarHBondContact OD2-OG 2.96Å; D616-S657 VanDerWaalsContact OD2-OG 3.09Å; E653-S657 PolarHBondContact O-N 2.96Å; E654-S657 PolarHBondContact O-N 3.3Å; S657-A659 VanDerWaalsContact C-N 3.32Å; S657-A659 PolarHBondContact O-N 3.14Å; S657-H660 WeakPolarHBondContact O-CA 3.15Å; S657-H660 WeakPolarHBondContact O-CB 3.48Å; S657-H660 PolarHBondContact O-N 3.36Å; S657-S661 PolarHBondContact O-N 3.05Å; S657-S661 PolarHBondContact O-OG 3.43Å
658L95Very high92.8Very high1 Ų139.5 Ų39.51%0.00521%0.205CC..Hα-helixtrans-58.1-42.4177-74.9172.7000112.7L612 I615 D616 L619 I640 E654 H660 L662L612-L658 HydrophobicContact CB-CD1 4.38Å; L612-L658 HydrophobicContact CD2-CD1 3.92Å; I615-L658 HydrophobicContact CB-CD2 4.17Å; I615-L658 HydrophobicContact CG2-CD2 3.76Å; D616-L658 HydrophobicContact CB-CD2 3.69Å; L619-L658 HydrophobicContact CD1-CD2 3.75Å; I640-L658 HydrophobicContact CD1-CB 4.34Å; E654-L658 WeakPolarHBondContact O-CG 3.39Å; E654-L658 PolarHBondContact O-N 3.35Å; L658-H660 VanDerWaalsContact C-N 3.35Å; L658-L662 VanDerWaalsContact O-CG 3.28Å; L658-L662 WeakPolarHBondContact O-CG 3.37Å; L658-L662 PolarHBondContact O-N 2.97Å; L658-L662 VanDerWaalsContact O-N 3.12Å
659A95.9Very high93.1Very high0 Ų042.7 Ų42.70%023%0.227CC..Hα-helixtrans-67.3-36.8177.400000112I640 I655 F656 S657 L662 T663 M671 L674 L696I640-A659 HydrophobicContact CD1-CB 4.16Å; I655-A659 WeakPolarHBondContact O-CB 3.35Å; I655-A659 PolarHBondContact O-N 3.32Å; F656-A659 PolarHBondContact O-N 3.2Å; S657-A659 VanDerWaalsContact C-N 3.32Å; S657-A659 PolarHBondContact O-N 3.14Å; A659-L662 PolarHBondContact O-N 3.37Å; A659-T663 WeakPolarHBondContact O-CG2 3.46Å; A659-T663 PolarHBondContact O-N 2.89Å; A659-T663 PolarHBondContact O-OG1 3.4Å; A659-M671 HydrophobicContact CB-CE 4.05Å; A659-L674 HydrophobicContact CB-CD2 3.85Å; A659-L696 HydrophobicContact CB-CD1 3.99Å; A659-L696 HydrophobicContact CB-CD2 3.74Å; A659-L696 HydrophobicContact CB-CG 4.38Å
660H94.8Very high93.3Very high56 Ų5644.1 Ų44.126%0.25923%0.232SC..Hα-helixtrans-61.4-53172.8169.469.7000110.5F656 S657 L658 L662 T663 C664 P695 N699F656-H660 VanDerWaalsContact O-CB 3.32Å; F656-H660 WeakPolarHBondContact O-CB 3.42Å; F656-H660 PolarHBondContact O-N 3.2Å; S657-H660 WeakPolarHBondContact O-CA 3.15Å; S657-H660 WeakPolarHBondContact O-CB 3.48Å; S657-H660 PolarHBondContact O-N 3.36Å; L658-H660 VanDerWaalsContact C-N 3.35Å; H660-L662 PolarHBondContact O-N 3.32Å; H660-T663 PolarHBondContact O-N 2.83Å; H660-T663 PolarHBondContact O-OG1 2.95Å; H660-C664 PolarHBondContact O-N 3.45Å; H660-C664 PolarHBondContact O-SG 3.46Å; H660-P695 HydrophobicContact CB-CB 4.17Å; H660-P695 WeakPolarHBondContact ND1-CB 3.3Å; H660-P695 PolarHBondContact ND1-O 3.29Å; H660-N699 PolarHBondContact CE1-ND2 3.4Å; H660-N699 PolarHBondContact ND1-ND2 3.14Å; H660-N699 PolarHBondContact O-ND2 2.95Å; H660-N699 VanDerWaalsContact O-ND2 3.15Å
661S92.6Very high93.7Very high36 Ų3638.2 Ų38.225%0.25220%0.204SC..Hα-helixtrans-53.3-39.7177.1-60.10000112.8D616 S657 T663D616-S661 VanDerWaalsContact OD1-CB 3.32Å; D616-S661 WeakPolarHBondContact OD1-CB 3.49Å; D616-S661 PolarHBondContact OD1-OG 3.06Å; S657-S661 PolarHBondContact O-N 3.05Å; S657-S661 PolarHBondContact O-OG 3.43Å; S661-T663 VanDerWaalsContact C-N 3.26Å; S661-T663 PolarHBondContact O-N 3.25Å
662L94Very high93.9Very high13 Ų1338.1 Ų38.17%0.06820%0.203CC..THydrogen-bonded Turntrans-72.2-12.8177.4-70.7170.3000114.7L619 E633 C636 I640 L658 A659 H660 M671L619-L662 HydrophobicContact CD1-CD2 4.03Å; L619-L662 HydrophobicContact CD1-CG 4.03Å; L619-L662 HydrophobicContact CD2-CD2 3.72Å; E633-L662 HydrophobicContact CB-CD2 4.02Å; E633-L662 HydrophobicContact CG-CD1 4.43Å; E633-L662 HydrophobicContact CG-CD2 4.3Å; C636-L662 HydrophobicContact CB-CD1 3.65Å; I640-L662 HydrophobicContact CD1-CD1 4.32Å; L658-L662 VanDerWaalsContact O-CG 3.28Å; L658-L662 WeakPolarHBondContact O-CG 3.37Å; L658-L662 PolarHBondContact O-N 2.97Å; L658-L662 VanDerWaalsContact O-N 3.12Å; A659-L662 PolarHBondContact O-N 3.37Å; H660-L662 PolarHBondContact O-N 3.32Å; L662-M671 HydrophobicContact CB-CE 4.01Å; L662-M671 HydrophobicContact CB-SD 4.26Å; L662-M671 HydrophobicContact CD1-CE 4.38Å; L662-M671 HydrophobicContact CD1-SD 4.24Å
663T94.3Very high93.9Very high0 Ų044.6 Ų44.60%023%0.234CC..THydrogen-bonded Turntrans-113.3-5.7-175.251.90000114.5A659 H660 S661 Q665 V667 M671 L696 N699A659-T663 WeakPolarHBondContact O-CG2 3.46Å; A659-T663 PolarHBondContact O-N 2.89Å; A659-T663 PolarHBondContact O-OG1 3.4Å; H660-T663 PolarHBondContact O-N 2.83Å; H660-T663 PolarHBondContact O-OG1 2.95Å; S661-T663 VanDerWaalsContact C-N 3.26Å; S661-T663 PolarHBondContact O-N 3.25Å; T663-Q665 PolarHBondContact O-N 3.13Å; T663-V667 HydrophobicContact CG2-CG1 4.33Å; T663-V667 HydrophobicContact CG2-CG2 4.4Å; T663-M671 HydrophobicContact CG2-CB 4.05Å; T663-M671 HydrophobicContact CG2-CE 3.73Å; T663-M671 HydrophobicContact CG2-CG 4.08Å; T663-L696 HydrophobicContact CG2-CD1 3.9Å; T663-N699 WeakPolarHBondContact OG1-CB 3.36Å; T663-N699 PolarHBondContact OG1-ND2 3.09Å
664C90.9Very high93.9Very high56 Ų5639.6 Ų39.638%0.37821%0.211SC..SBendtrans-58.8-42.1-177.1-67.60000114H660 N699 V703H660-C664 PolarHBondContact O-N 3.45Å; H660-C664 PolarHBondContact O-SG 3.46Å; C664-N699 PolarHBondContact N-ND2 3.4Å; C664-V703 WeakPolarHBondContact O-CG2 3.36Å
665Q88.6Confident93.9Very high92 Ų9238.3 Ų38.343%0.4320%0.204SC..SBendtrans-95.3-36.8-177.8-64.8-170.97.500113.9E623 T663E623-Q665 PolarHBondContact O-NE2 2.82Å; E623-Q665 PolarHBondContact OE1-NE2 3.45Å; E623-Q665 VanDerWaalsContact OE1-NE2 3.14Å; T663-Q665 PolarHBondContact O-N 3.13Å
666Q91Very high93.9Very high134 Ų13440.6 Ų40.663%0.62622%0.219SC*.  trans-157138.5-178.3179.6176.1400110
667V94.5Very high93.8Very high4 Ų442.9 Ų42.92%0.02423%0.232CC..  trans-91.9114170.5-167.90000110.1T663 M671 W672 Y700 V703 D704T663-V667 HydrophobicContact CG2-CG1 4.33Å; T663-V667 HydrophobicContact CG2-CG2 4.4Å; V667-M671 HydrophobicContact CG1-CB 3.95Å; V667-W672 VanDerWaalsContact CG1-CD1 3.49Å; V667-W672 HydrophobicContact CG1-CD2 4.14Å; V667-W672 HydrophobicContact CG1-CG 4Å; V667-W672 HydrophobicContact CG1-CZ2 4.4Å; V667-W672 VanDerWaalsContact CG1-NE1 3.34Å; V667-Y700 HydrophobicContact CG1-CD1 3.71Å; V667-Y700 HydrophobicContact CG1-CE1 3.53Å; V667-Y700 HydrophobicContact CG2-CD1 4.47Å; V667-V703 HydrophobicContact CG2-CB 4.11Å; V667-V703 HydrophobicContact CG2-CG1 4.18Å; V667-D704 HydrophobicContact CB-CB 3.83Å; V667-D704 HydrophobicContact CG2-CB 3.81Å
668S93.5Very high93.8Very high14 Ų1440.7 Ų40.710%0.09822%0.216CC..  trans-75.6160.8178.399.60000112.2E633 Q670 M671 W672E633-S668 VanDerWaalsContact CD-OG 3.28Å; E633-S668 VanDerWaalsContact OE1-CB 3.27Å; E633-S668 WeakPolarHBondContact OE1-CB 3.35Å; E633-S668 PolarHBondContact OE1-OG 3.4Å; E633-S668 WeakPolarHBondContact OE2-CB 3.35Å; E633-S668 PolarHBondContact OE2-OG 3.36Å; S668-Q670 PolarHBondContact O-N 3.22Å; S668-Q670 PolarHBondContact OG-N 3Å; S668-M671 PolarHBondContact O-N 3.39Å; S668-M671 PolarHBondContact OG-N 2.98Å; S668-M671 VanDerWaalsContact OG-N 3.08Å; S668-W672 PolarHBondContact O-N 2.91Å
669P93.4Very high93.9Very high101 Ų10142.1 Ų42.166%0.65622%0.222SC*.THydrogen-bonded Turntrans-60.6-22171.4-23.734.2000114.6Q673P669-Q673 WeakPolarHBondContact O-CG 3.41Å; P669-Q673 PolarHBondContact O-NE2 2.97Å
670Q92.3Very high93.8Very high98 Ų9846.7 Ų46.746%0.45824%0.244SC..THydrogen-bonded Turntrans-81.4-39.7176.1-57.3179.140.600110.2L637 S668 W672 Q673 L674L637-Q670 HydrophobicContact CD1-CB 3.54Å; L637-Q670 HydrophobicContact CD1-CG 4.48Å; S668-Q670 PolarHBondContact O-N 3.22Å; S668-Q670 PolarHBondContact OG-N 3Å; Q670-W672 VanDerWaalsContact C-N 3.32Å; Q670-W672 PolarHBondContact O-N 3.5Å; Q670-Q673 WeakPolarHBondContact O-CA 3.5Å; Q670-Q673 VanDerWaalsContact O-CB 3.3Å; Q670-Q673 WeakPolarHBondContact O-CB 3.27Å; Q670-Q673 PolarHBondContact O-N 3.06Å; Q670-L674 PolarHBondContact O-N 3.08Å
671M95Very high93.7Very high0 Ų044.2 Ų44.20%023%0.232CC..Hα-helixtrans-60.9-41171.4-65.2-52.3-68.800111.1E633 L637 A659 L662 T663 V667 S668 Q673 L674 Y700E633-M671 HydrophobicContact CG-CG 4.39Å; E633-M671 HydrophobicContact CG-SD 4.18Å; L637-M671 HydrophobicContact CD1-SD 4.4Å; L637-M671 HydrophobicContact CD2-SD 3.72Å; L637-M671 HydrophobicContact CG-SD 4.15Å; A659-M671 HydrophobicContact CB-CE 4.05Å; L662-M671 HydrophobicContact CB-CE 4.01Å; L662-M671 HydrophobicContact CB-SD 4.26Å; L662-M671 HydrophobicContact CD1-CE 4.38Å; L662-M671 HydrophobicContact CD1-SD 4.24Å; T663-M671 HydrophobicContact CG2-CB 4.05Å; T663-M671 HydrophobicContact CG2-CE 3.73Å; T663-M671 HydrophobicContact CG2-CG 4.08Å; V667-M671 HydrophobicContact CG1-CB 3.95Å; S668-M671 PolarHBondContact O-N 3.39Å; S668-M671 PolarHBondContact OG-N 2.98Å; S668-M671 VanDerWaalsContact OG-N 3.08Å; M671-Q673 PolarHBondContact O-N 3.24Å; M671-L674 HydrophobicContact CE-CD2 3.71Å; M671-L674 WeakPolarHBondContact O-CA 3.49Å; M671-L674 WeakPolarHBondContact O-CB 3.24Å; M671-L674 PolarHBondContact O-N 2.88Å; M671-Y700 PolarHBondContact O-OH 3.49Å
672W95.7Very high93.9Very high6 Ų642.6 Ų42.62%0.02322%0.221CC..Hα-helixtrans-59.4-21.1171.5-81.4110.4000114.8V667 S668 Q670 L674 L675 P676 Y700 D704 T707 L708 Y714V667-W672 VanDerWaalsContact CG1-CD1 3.49Å; V667-W672 HydrophobicContact CG1-CD2 4.14Å; V667-W672 HydrophobicContact CG1-CG 4Å; V667-W672 HydrophobicContact CG1-CZ2 4.4Å; V667-W672 VanDerWaalsContact CG1-NE1 3.34Å; S668-W672 PolarHBondContact O-N 2.91Å; Q670-W672 VanDerWaalsContact C-N 3.32Å; Q670-W672 PolarHBondContact O-N 3.5Å; W672-L674 VanDerWaalsContact C-N 3.34Å; W672-L675 HydrophobicContact CE3-CD2 4.19Å; W672-L675 HydrophobicContact CZ3-CD2 3.83Å; W672-P676 WeakPolarHBondContact O-CD 3.32Å; W672-Y700 HydrophobicContact CD2-CD1 4Å; W672-Y700 HydrophobicContact CD2-CE1 4.12Å; W672-Y700 AromaticContact CE3-CD1 3.79Å; W672-Y700 HydrophobicContact CE3-CD1 3.79Å; W672-Y700 HydrophobicContact CE3-CE1 4.02Å; W672-Y700 AromaticContact CH2-CD1 3.71Å; W672-Y700 HydrophobicContact CH2-CD1 3.71Å; W672-Y700 HydrophobicContact CH2-CG 4.25Å; W672-Y700 AromaticContact CZ2-CD1 3.95Å; W672-Y700 HydrophobicContact CZ2-CD1 3.95Å; W672-Y700 AromaticContact CZ3-CD1 3.63Å; W672-Y700 HydrophobicContact CZ3-CD1 3.63Å; W672-Y700 HydrophobicContact CZ3-CE1 4.31Å; W672-Y700 HydrophobicContact CZ3-CG 4.22Å; W672-D704 HydrophobicContact CZ2-CB 4.13Å; W672-D704 WeakPolarHBondContact CZ2-O 3.26Å; W672-D704 PolarHBondContact NE1-OD2 2.93Å; W672-T707 HydrophobicContact CD2-CG2 3.81Å; W672-T707 VanDerWaalsContact CE2-CG2 3.46Å; W672-T707 HydrophobicContact CG-CG2 3.98Å; W672-T707 HydrophobicContact CZ2-CG2 4Å; W672-L708 HydrophobicContact CH2-CB 3.75Å; W672-L708 HydrophobicContact CH2-CD1 4.07Å; W672-L708 HydrophobicContact CZ2-CB 4.35Å; W672-L708 HydrophobicContact CZ3-CD1 4.35Å; W672-Y714 HydrophobicContact CD2-CE2 4.43Å; W672-Y714 AromaticContact CE3-CD1 3.91Å; W672-Y714 HydrophobicContact CE3-CD1 3.91Å; W672-Y714 AromaticContact CE3-CD2 3.91Å; W672-Y714 HydrophobicContact CE3-CD2 3.91Å; W672-Y714 AromaticContact CE3-CE1 3.89Å; W672-Y714 HydrophobicContact CE3-CE1 3.89Å; W672-Y714 AromaticContact CE3-CE2 3.92Å; W672-Y714 HydrophobicContact CE3-CE2 3.92Å; W672-Y714 AromaticContact CE3-CG 3.91Å; W672-Y714 HydrophobicContact CE3-CG 3.91Å; W672-Y714 AromaticContact CE3-CZ 3.89Å; W672-Y714 HydrophobicContact CZ3-CD1 4.07Å; W672-Y714 AromaticContact CZ3-CD2 3.88Å; W672-Y714 HydrophobicContact CZ3-CD2 3.88Å; W672-Y714 HydrophobicContact CZ3-CE1 4.5Å; W672-Y714 HydrophobicContact CZ3-CE2 4.36Å; W672-Y714 AromaticContact CZ3-CG 3.72Å; W672-Y714 HydrophobicContact CZ3-CG 3.72Å
673Q93.5Very high93.8Very high137 Ų13746.9 Ų46.964%0.6424%0.241SC*.Hα-helixtrans-80.8-14.7172.1-64.9171.829.900112.9P669 Q670 M671 P676P669-Q673 WeakPolarHBondContact O-CG 3.41Å; P669-Q673 PolarHBondContact O-NE2 2.97Å; Q670-Q673 WeakPolarHBondContact O-CA 3.5Å; Q670-Q673 VanDerWaalsContact O-CB 3.3Å; Q670-Q673 WeakPolarHBondContact O-CB 3.27Å; Q670-Q673 PolarHBondContact O-N 3.06Å; M671-Q673 PolarHBondContact O-N 3.24Å; Q673-P676 WeakPolarHBondContact O-CD 3.38Å
674L94.9Very high93.6Very high5 Ų552 Ų523%0.02626%0.264CS..Hα-helixtrans-75.7-36.6174.7-174.363.2000111.6I640 L644 A659 Q670 M671 W672 L677 V678 L696I640-L674 HydrophobicContact CG2-CD1 3.66Å; I640-L674 HydrophobicContact CG2-CD2 4.12Å; L644-L674 HydrophobicContact CD1-CD1 3.71Å; A659-L674 HydrophobicContact CB-CD2 3.85Å; Q670-L674 PolarHBondContact O-N 3.08Å; M671-L674 HydrophobicContact CE-CD2 3.71Å; M671-L674 WeakPolarHBondContact O-CA 3.49Å; M671-L674 WeakPolarHBondContact O-CB 3.24Å; M671-L674 PolarHBondContact O-N 2.88Å; W672-L674 VanDerWaalsContact C-N 3.34Å; L674-L677 HydrophobicContact CD1-CB 4.42Å; L674-L677 HydrophobicContact CD1-CD1 4.25Å; L674-L677 WeakPolarHBondContact O-CA 3.31Å; L674-L677 VanDerWaalsContact O-CB 3.31Å; L674-L677 WeakPolarHBondContact O-CB 3.33Å; L674-L677 PolarHBondContact O-N 3.14Å; L674-V678 HydrophobicContact CG-CG2 4.03Å; L674-V678 WeakPolarHBondContact O-CG2 3.39Å; L674-V678 PolarHBondContact O-N 3.12Å; L674-L696 HydrophobicContact CD2-CD2 4.5Å
675L96.2Very high93.4Very high0 Ų051.7 Ų51.70%026%0.259CS..Hα-helixtrans-52.1-44.6-178.7176.261.8000114.2W672 L677 V678 F679 L697 Y700 Y714 M717 I718 M721W672-L675 HydrophobicContact CE3-CD2 4.19Å; W672-L675 HydrophobicContact CZ3-CD2 3.83Å; L675-L677 VanDerWaalsContact C-N 3.29Å; L675-L677 PolarHBondContact O-N 3.08Å; L675-V678 PolarHBondContact O-N 3.42Å; L675-F679 WeakPolarHBondContact O-CB 3.39Å; L675-F679 PolarHBondContact O-N 3.08Å; L675-L697 HydrophobicContact CD1-CD2 3.8Å; L675-Y700 HydrophobicContact CB-CE1 4.44Å; L675-Y700 HydrophobicContact CB-CE2 4.06Å; L675-Y700 HydrophobicContact CD1-CD2 4.26Å; L675-Y700 HydrophobicContact CD1-CE2 4.21Å; L675-Y714 HydrophobicContact CD2-CD1 3.73Å; L675-Y714 HydrophobicContact CD2-CG 4.25Å; L675-M717 HydrophobicContact CG-SD 4.36Å; L675-I718 HydrophobicContact CD1-CG1 4.36Å; L675-I718 HydrophobicContact CD2-CG1 4.46Å; L675-M721 HydrophobicContact CD1-CE 4.21Å
676P95.2Very high93.5Very high48 Ų4847.3 Ų47.331%0.31224%0.238SC..Hα-helixtrans-59.5-34.2172.3-25.934.5000114.7W672 Q673 E680 M717W672-P676 WeakPolarHBondContact O-CD 3.32Å; Q673-P676 WeakPolarHBondContact O-CD 3.38Å; P676-E680 PolarHBondContact O-N 3.36Å; P676-M717 HydrophobicContact CB-CE 4.13Å; P676-M717 HydrophobicContact CB-SD 4.42Å; P676-M717 HydrophobicContact CG-CE 4.14Å; P676-M717 HydrophobicContact CG-SD 4.25Å
677L93.3Very high93.5Very high53 Ų5342.7 Ų42.728%0.27722%0.217SC..Hα-helixtrans-71.8-42.8176.4-64.9171000110.9L644 L674 L675 F679 E680 V681L644-L677 HydrophobicContact CD1-CB 4.49Å; L674-L677 HydrophobicContact CD1-CB 4.42Å; L674-L677 HydrophobicContact CD1-CD1 4.25Å; L674-L677 WeakPolarHBondContact O-CA 3.31Å; L674-L677 VanDerWaalsContact O-CB 3.31Å; L674-L677 WeakPolarHBondContact O-CB 3.33Å; L674-L677 PolarHBondContact O-N 3.14Å; L675-L677 VanDerWaalsContact C-N 3.29Å; L675-L677 PolarHBondContact O-N 3.08Å; L677-F679 VanDerWaalsContact C-N 3.26Å; L677-F679 PolarHBondContact O-N 3.4Å; L677-E680 PolarHBondContact O-N 3.01Å; L677-E680 VanDerWaalsContact O-N 3.15Å; L677-V681 WeakPolarHBondContact O-CG2 3.48Å; L677-V681 PolarHBondContact O-N 2.86Å
678V95.4Very high93.4Very high0 Ų048.3 Ų48.30%025%0.246CC..Hα-helixtrans-57-44.5173.2179.10000110.2F656 L674 L675 E680 V681 F682 M693 L696F656-V678 HydrophobicContact CE1-CG1 4.02Å; F656-V678 HydrophobicContact CE1-CG2 4.05Å; F656-V678 HydrophobicContact CZ-CG1 4.48Å; L674-V678 HydrophobicContact CG-CG2 4.03Å; L674-V678 WeakPolarHBondContact O-CG2 3.39Å; L674-V678 PolarHBondContact O-N 3.12Å; L675-V678 PolarHBondContact O-N 3.42Å; V678-E680 PolarHBondContact O-N 2.78Å; V678-V681 PolarHBondContact O-N 3.08Å; V678-F682 WeakPolarHBondContact O-CB 3.41Å; V678-F682 PolarHBondContact O-N 3.31Å; V678-M693 HydrophobicContact CG1-CG 4.01Å; V678-M693 HydrophobicContact CG1-SD 3.73Å; V678-L696 HydrophobicContact CG2-CD2 4.06Å
679F96.5Very high93.4Very high31 Ų3150.2 Ų50.214%0.13625%0.252CS..Hα-helixtrans-63-41.4176.5-177.5-111.6000112.9L675 L677 Q683 M717 M721L675-F679 WeakPolarHBondContact O-CB 3.39Å; L675-F679 PolarHBondContact O-N 3.08Å; L677-F679 VanDerWaalsContact C-N 3.26Å; L677-F679 PolarHBondContact O-N 3.4Å; F679-Q683 HydrophobicContact CE1-CG 4.35Å; F679-Q683 HydrophobicContact CE2-CG 4.42Å; F679-Q683 HydrophobicContact CZ-CG 4.26Å; F679-Q683 VanDerWaalsContact O-CG 3.31Å; F679-Q683 WeakPolarHBondContact O-CG 3.27Å; F679-Q683 PolarHBondContact O-N 3.28Å; F679-M717 HydrophobicContact CB-CB 4.43Å; F679-M717 HydrophobicContact CB-CG 4.34Å; F679-M717 HydrophobicContact CB-SD 4.4Å; F679-M717 HydrophobicContact CD1-CG 4.05Å; F679-M717 HydrophobicContact CD2-CB 4.04Å; F679-M717 HydrophobicContact CD2-CG 4.29Å; F679-M717 HydrophobicContact CE1-CG 4.38Å; F679-M717 HydrophobicContact CE2-CB 4.46Å; F679-M717 HydrophobicContact CG-CB 4.14Å; F679-M717 HydrophobicContact CG-CG 3.97Å; F679-M721 HydrophobicContact CD2-CE 4.43Å; F679-M721 HydrophobicContact CD2-CG 3.6Å; F679-M721 HydrophobicContact CD2-SD 3.98Å; F679-M721 HydrophobicContact CE2-CG 3.96Å
680E94.5Very high93.6Very high97 Ų9745.4 Ų45.445%0.45322%0.221SC..Hα-helixtrans-62.6-45.9175.6179.1171.2-171.100111.6P676 L677 V678 Q683 Q684P676-E680 PolarHBondContact O-N 3.36Å; L677-E680 PolarHBondContact O-N 3.01Å; L677-E680 VanDerWaalsContact O-N 3.15Å; V678-E680 PolarHBondContact O-N 2.78Å; E680-Q683 WeakPolarHBondContact O-CB 3.39Å; E680-Q683 PolarHBondContact O-N 3.11Å; E680-Q683 VanDerWaalsContact O-N 3.15Å; E680-Q684 VanDerWaalsContact CG-NE2 3.31Å; E680-Q684 WeakPolarHBondContact O-CG 3.26Å; E680-Q684 PolarHBondContact O-N 2.78Å; E680-Q684 VanDerWaalsContact O-N 3.16Å; E680-Q684 PolarHBondContact OE1-NE2 2.83Å
681V93.4Very high93.7Very high4 Ų442.2 Ų42.22%0.02421%0.208CC..Hα-helixtrans-62.3-46.7177.3166.80000111.1L644 Y652 L677 V678 Q683 Q684 D685 G686 M693L644-V681 HydrophobicContact CB-CG2 4.06Å; L644-V681 HydrophobicContact CD2-CB 4.44Å; L644-V681 HydrophobicContact CD2-CG1 4.25Å; L644-V681 HydrophobicContact CD2-CG2 3.96Å; Y652-V681 HydrophobicContact CD2-CG1 4.23Å; Y652-V681 HydrophobicContact CE1-CG1 4.5Å; Y652-V681 HydrophobicContact CE2-CG1 3.36Å; Y652-V681 WeakPolarHBondContact OH-CG1 3.3Å; L677-V681 WeakPolarHBondContact O-CG2 3.48Å; L677-V681 PolarHBondContact O-N 2.86Å; V678-V681 PolarHBondContact O-N 3.08Å; V681-Q683 PolarHBondContact O-N 3.43Å; V681-Q684 PolarHBondContact O-N 3.19Å; V681-D685 PolarHBondContact O-N 3.23Å; V681-D685 VanDerWaalsContact O-N 3.09Å; V681-G686 PolarHBondContact O-N 2.87Å; V681-M693 HydrophobicContact CG1-CE 4.49Å
682F95.2Very high93.8Very high1 Ų144.4 Ų44.40%0.00422%0.219CC..Hα-helixtrans-57.7-33.3173.9174.4-93.8000113.3V678 Q684 F687 F690 M693 M721 K724 V725V678-F682 WeakPolarHBondContact O-CB 3.41Å; V678-F682 PolarHBondContact O-N 3.31Å; F682-Q684 VanDerWaalsContact C-N 3.35Å; F682-F687 HydrophobicContact CE1-CD2 4.48Å; F682-F687 AromaticContact CE2-CD2 3.79Å; F682-F687 HydrophobicContact CE2-CD2 3.79Å; F682-F687 HydrophobicContact CE2-CE2 4.36Å; F682-F687 AromaticContact CZ-CD2 3.71Å; F682-F687 HydrophobicContact CZ-CD2 3.71Å; F682-F687 HydrophobicContact CZ-CE2 4.03Å; F682-F690 HydrophobicContact CD2-CD2 4.24Å; F682-F690 HydrophobicContact CE2-CB 4.16Å; F682-F690 AromaticContact CE2-CD2 3.76Å; F682-F690 HydrophobicContact CE2-CD2 3.76Å; F682-F690 HydrophobicContact CE2-CG 4.35Å; F682-F690 HydrophobicContact CZ-CD2 4.48Å; F682-M693 HydrophobicContact CB-CE 3.99Å; F682-M693 HydrophobicContact CB-SD 3.99Å; F682-M693 HydrophobicContact CD2-CE 4.37Å; F682-M693 HydrophobicContact CD2-SD 4.05Å; F682-M693 HydrophobicContact CG-SD 4.44Å; F682-M721 HydrophobicContact CB-SD 4.06Å; F682-M721 HydrophobicContact CD1-CB 4.1Å; F682-M721 HydrophobicContact CD1-CG 3.51Å; F682-M721 HydrophobicContact CD1-SD 4.15Å; F682-M721 HydrophobicContact CE1-CB 3.82Å; F682-M721 HydrophobicContact CE1-CG 3.72Å; F682-M721 HydrophobicContact CE2-CB 4.44Å; F682-M721 HydrophobicContact CG-CB 4.5Å; F682-M721 HydrophobicContact CG-CG 3.92Å; F682-M721 HydrophobicContact CG-SD 3.98Å; F682-M721 HydrophobicContact CZ-CB 4.01Å; F682-M721 HydrophobicContact CZ-CG 4.33Å; F682-K724 HydrophobicContact CD1-CD 4.37Å; F682-K724 HydrophobicContact CE1-CB 3.95Å; F682-K724 HydrophobicContact CE1-CD 3.46Å; F682-K724 VanDerWaalsContact CE1-CD 3.46Å; F682-K724 HydrophobicContact CE1-CG 4.27Å; F682-K724 HydrophobicContact CZ-CB 4.05Å; F682-K724 HydrophobicContact CZ-CD 3.88Å; F682-K724 HydrophobicContact CZ-CG 4.39Å; F682-K724 PolarHBondContact O-NZ 3.16Å; F682-V725 HydrophobicContact CE2-CG2 3.92Å; F682-V725 HydrophobicContact CZ-CG2 3.83Å
683Q93.5Very high93.8Very high104 Ų10444.1 Ų44.149%0.48622%0.218SC..Hα-helixtrans-73-28.6177-77.6-171.6-21.200113.3F679 E680 V681F679-Q683 HydrophobicContact CE1-CG 4.35Å; F679-Q683 HydrophobicContact CE2-CG 4.42Å; F679-Q683 HydrophobicContact CZ-CG 4.26Å; F679-Q683 VanDerWaalsContact O-CG 3.31Å; F679-Q683 WeakPolarHBondContact O-CG 3.27Å; F679-Q683 PolarHBondContact O-N 3.28Å; E680-Q683 WeakPolarHBondContact O-CB 3.39Å; E680-Q683 PolarHBondContact O-N 3.11Å; E680-Q683 VanDerWaalsContact O-N 3.15Å; V681-Q683 PolarHBondContact O-N 3.43Å
684Q89.9Confident93.9Very high107 Ų10737.6 Ų37.650%0.519%0.188SC..Hα-helixtrans-92.8-81.2-175.5-65.4-174.438.200111.7H647 E680 V681 F682H647-Q684 PolarHBondContact CE1-OE1 2.9Å; H647-Q684 PolarHBondContact NE2-OE1 2.94Å; E680-Q684 VanDerWaalsContact CG-NE2 3.31Å; E680-Q684 WeakPolarHBondContact O-CG 3.26Å; E680-Q684 PolarHBondContact O-N 2.78Å; E680-Q684 VanDerWaalsContact O-N 3.16Å; E680-Q684 PolarHBondContact OE1-NE2 2.83Å; V681-Q684 PolarHBondContact O-N 3.19Å; F682-Q684 VanDerWaalsContact C-N 3.35Å
685D87Confident94Very high49 Ų4939 Ų3926%0.26220%0.197SC..THydrogen-bonded Turntrans-125.5-10.7-169.856.62.8000114H647 L649 Y652 V681 F687H647-D685 WeakPolarHBondContact CB-OD2 3.41Å; H647-D685 IonicContact CG-OD2 3.7Å; H647-D685 IonicContact ND1-OD1 3.73Å; H647-D685 PolarHBondContact ND1-OD1 3.45Å; H647-D685 IonicContact ND1-OD2 3.45Å; H647-D685 PolarHBondContact ND1-OD2 2.94Å; L649-D685 HydrophobicContact CD2-CB 3.95Å; Y652-D685 PolarHBondContact OH-OD1 3.06Å; V681-D685 PolarHBondContact O-N 3.23Å; V681-D685 VanDerWaalsContact O-N 3.09Å; D685-F687 VanDerWaalsContact C-N 3.33Å; D685-F687 PolarHBondContact O-N 3.35Å
686G89.2Confident94.1Very high0 Ų039 Ų390%020%0.197CC..  trans-87.420.417800000115.4V681 D688 Y689 M693V681-G686 PolarHBondContact O-N 2.87Å; G686-D688 VanDerWaalsContact C-N 3.33Å; G686-D688 PolarHBondContact O-N 2.66Å; G686-Y689 PolarHBondContact O-N 3.38Å; G686-M693 WeakPolarHBondContact O-CE 3.38Å
687F92.5Very high94.2Very high38 Ų3836.7 Ų36.717%0.16718%0.182CC..SBendtrans-64.5-37.6-176.9178.2-103.8000112.7F682 D685 Y689 K724 V725 A730F682-F687 HydrophobicContact CE1-CD2 4.48Å; F682-F687 AromaticContact CE2-CD2 3.79Å; F682-F687 HydrophobicContact CE2-CD2 3.79Å; F682-F687 HydrophobicContact CE2-CE2 4.36Å; F682-F687 AromaticContact CZ-CD2 3.71Å; F682-F687 HydrophobicContact CZ-CD2 3.71Å; F682-F687 HydrophobicContact CZ-CE2 4.03Å; D685-F687 VanDerWaalsContact C-N 3.33Å; D685-F687 PolarHBondContact O-N 3.35Å; F687-Y689 VanDerWaalsContact C-N 3.27Å; F687-Y689 PolarHBondContact O-N 3.34Å; F687-K724 HydrophobicContact CD2-CD 4Å; F687-K724 HydrophobicContact CD2-CG 4.41Å; F687-K724 HydrophobicContact CE2-CD 4.03Å; F687-K724 HydrophobicContact CE2-CG 3.93Å; F687-V725 HydrophobicContact CE2-CG2 4.31Å; F687-A730 HydrophobicContact CE1-CB 3.81Å; F687-A730 HydrophobicContact CZ-CB 3.72Å
688D91.8Very high94.4Very high122 Ų12234.8 Ų34.865%0.65217%0.172SC*.THydrogen-bonded Turntrans-77.3-13.5-177.7-60.4-32.2000112.5G686G686-D688 VanDerWaalsContact C-N 3.33Å; G686-D688 PolarHBondContact O-N 2.66Å
689Y94Very high94.4Very high54 Ų5435.3 Ų35.321%0.21218%0.175CC..THydrogen-bonded Turntrans-95.522.4-179.7-65.2-89.6000113.2L649 Y652 E653 G686 F687 T691 D692 M693L649-Y689 HydrophobicContact CD2-CE2 3.95Å; L649-Y689 PolarHBondContact O-OH 3.22Å; Y652-Y689 HydrophobicContact CD2-CD1 4.49Å; Y652-Y689 AromaticContact CD2-CD2 3.67Å; Y652-Y689 HydrophobicContact CD2-CD2 3.67Å; Y652-Y689 AromaticContact CD2-CE2 3.95Å; Y652-Y689 HydrophobicContact CD2-CE2 3.95Å; Y652-Y689 AromaticContact CD2-CG 3.95Å; Y652-Y689 HydrophobicContact CD2-CG 3.95Å; Y652-Y689 HydrophobicContact CE2-CD2 4.46Å; Y652-Y689 HydrophobicContact CG-CD2 4.5Å; E653-Y689 HydrophobicContact CG-CD1 4.17Å; E653-Y689 HydrophobicContact CG-CE1 4.1Å; G686-Y689 PolarHBondContact O-N 3.38Å; F687-Y689 VanDerWaalsContact C-N 3.27Å; F687-Y689 PolarHBondContact O-N 3.34Å; Y689-T691 VanDerWaalsContact C-N 3.28Å; Y689-T691 PolarHBondContact O-N 3.17Å; Y689-D692 VanDerWaalsContact CA-OD2 3.3Å; Y689-D692 WeakPolarHBondContact CA-OD2 3.38Å; Y689-D692 WeakPolarHBondContact CD1-OD2 3.32Å; Y689-D692 PolarHBondContact O-N 3.36Å; Y689-M693 WeakPolarHBondContact O-CG 3.47Å; Y689-M693 PolarHBondContact O-N 2.87Å
690F96.3Very high94.5Very high0 Ų033.8 Ų33.80%017%0.168CC..Hα-helixtrans-64.9-34.4-178179.5-96.3000112.4F682 D692 M693 M694 L697 M721 V725 A734 H737 A738 L741F682-F690 HydrophobicContact CD2-CD2 4.24Å; F682-F690 HydrophobicContact CE2-CB 4.16Å; F682-F690 AromaticContact CE2-CD2 3.76Å; F682-F690 HydrophobicContact CE2-CD2 3.76Å; F682-F690 HydrophobicContact CE2-CG 4.35Å; F682-F690 HydrophobicContact CZ-CD2 4.48Å; F690-D692 VanDerWaalsContact C-N 3.3Å; F690-M693 PolarHBondContact O-N 3.22Å; F690-M694 PolarHBondContact O-N 3.41Å; F690-L697 HydrophobicContact CE2-CD1 4.04Å; F690-M721 HydrophobicContact CD2-CB 4.4Å; F690-M721 HydrophobicContact CE2-CB 3.92Å; F690-V725 HydrophobicContact CB-CG2 4.1Å; F690-V725 HydrophobicContact CD1-CG1 4.36Å; F690-V725 HydrophobicContact CD1-CG2 3.95Å; F690-V725 HydrophobicContact CD2-CG2 3.72Å; F690-V725 HydrophobicContact CE1-CG2 4.34Å; F690-V725 HydrophobicContact CE2-CG2 4.12Å; F690-V725 HydrophobicContact CG-CG2 3.62Å; F690-V725 HydrophobicContact CZ-CG2 4.42Å; F690-A734 HydrophobicContact CD1-CB 4.37Å; F690-H737 HydrophobicContact CD1-CB 4.32Å; F690-H737 HydrophobicContact CE1-CB 3.98Å; F690-A738 HydrophobicContact CE1-CB 3.74Å; F690-A738 HydrophobicContact CZ-CB 3.95Å; F690-L741 HydrophobicContact CZ-CD2 4.47Å
691T95.5Very high94.6Very high31 Ų3129.2 Ų29.219%0.1915%0.147CC..Hα-helixtrans-60.1-41.2174.243.70000110.9Y689 M694 P695 D733 A734Y689-T691 VanDerWaalsContact C-N 3.28Å; Y689-T691 PolarHBondContact O-N 3.17Å; T691-M694 VanDerWaalsContact O-CB 3.3Å; T691-M694 WeakPolarHBondContact O-CB 3.43Å; T691-M694 PolarHBondContact O-N 2.97Å; T691-P695 WeakPolarHBondContact O-CD 3.5Å; T691-D733 WeakPolarHBondContact CG2-OD2 3.48Å; T691-A734 HydrophobicContact CG2-CB 4.22Å
692D95.6Very high94.7Very high45 Ų4530.6 Ų30.624%0.24116%0.155CC..Hα-helixtrans-74-30.1178.7-45.1-69.2000112.3F656 Y689 F690 M694 P695F656-D692 HydrophobicContact CB-CB 4.5Å; F656-D692 WeakPolarHBondContact CB-O 3.26Å; F656-D692 HydrophobicContact CD2-CB 3.99Å; Y689-D692 VanDerWaalsContact CA-OD2 3.3Å; Y689-D692 WeakPolarHBondContact CA-OD2 3.38Å; Y689-D692 WeakPolarHBondContact CD1-OD2 3.32Å; Y689-D692 PolarHBondContact O-N 3.36Å; F690-D692 VanDerWaalsContact C-N 3.3Å; D692-M694 VanDerWaalsContact C-N 3.29Å; D692-P695 WeakPolarHBondContact O-CD 3.5Å
693M97.1Very high94.7Very high0 Ų032.9 Ų32.90%017%0.169CC..Hα-helixtrans-70.9-25.8171.9-66.2174.9-16300112.3F656 V678 V681 F682 G686 Y689 F690 L696 L697F656-M693 HydrophobicContact CD1-CG 4.19Å; F656-M693 HydrophobicContact CD2-CG 3.9Å; F656-M693 HydrophobicContact CE1-CG 3.88Å; F656-M693 HydrophobicContact CE2-CE 3.72Å; F656-M693 HydrophobicContact CE2-CG 3.57Å; F656-M693 HydrophobicContact CG-CG 4.24Å; F656-M693 HydrophobicContact CZ-CE 3.56Å; F656-M693 HydrophobicContact CZ-CG 3.59Å; F656-M693 HydrophobicContact CZ-SD 4.26Å; V678-M693 HydrophobicContact CG1-CG 4.01Å; V678-M693 HydrophobicContact CG1-SD 3.73Å; V681-M693 HydrophobicContact CG1-CE 4.49Å; F682-M693 HydrophobicContact CB-CE 3.99Å; F682-M693 HydrophobicContact CB-SD 3.99Å; F682-M693 HydrophobicContact CD2-CE 4.37Å; F682-M693 HydrophobicContact CD2-SD 4.05Å; F682-M693 HydrophobicContact CG-SD 4.44Å; G686-M693 WeakPolarHBondContact O-CE 3.38Å; Y689-M693 WeakPolarHBondContact O-CG 3.47Å; Y689-M693 PolarHBondContact O-N 2.87Å; F690-M693 PolarHBondContact O-N 3.22Å; M693-L696 WeakPolarHBondContact O-CB 3.3Å; M693-L696 PolarHBondContact O-N 2.92Å; M693-L697 HydrophobicContact CB-CD1 4.23Å; M693-L697 HydrophobicContact CB-CG 4.41Å; M693-L697 WeakPolarHBondContact O-CG 3.46Å; M693-L697 PolarHBondContact O-N 3.35Å
694M95.6Very high94.7Very high0 Ų029.5 Ų29.50%016%0.155CC..Hα-helixtrans-57.8-46.7-169.9178.562.6-175.800113.7F690 T691 D692 L696 L697 H698 H737 K740 L741 Y945F690-M694 PolarHBondContact O-N 3.41Å; T691-M694 VanDerWaalsContact O-CB 3.3Å; T691-M694 WeakPolarHBondContact O-CB 3.43Å; T691-M694 PolarHBondContact O-N 2.97Å; D692-M694 VanDerWaalsContact C-N 3.29Å; M694-L696 VanDerWaalsContact C-N 3.29Å; M694-L696 PolarHBondContact O-N 3.25Å; M694-L697 PolarHBondContact O-N 3.38Å; M694-L697 VanDerWaalsContact O-N 3.13Å; M694-H698 HydrophobicContact CE-CB 4.42Å; M694-H698 WeakPolarHBondContact O-CB 3.41Å; M694-H698 PolarHBondContact O-N 3.33Å; M694-H737 HydrophobicContact CG-CB 4.33Å; M694-K740 HydrophobicContact CE-CG 4.44Å; M694-L741 HydrophobicContact CE-CB 3.65Å; M694-L741 HydrophobicContact CE-CD1 3.8Å; M694-L741 HydrophobicContact CE-CG 4.18Å; M694-L741 HydrophobicContact SD-CB 3.62Å; M694-L741 HydrophobicContact SD-CD1 3.88Å; M694-L741 HydrophobicContact SD-CD2 3.72Å; M694-L741 HydrophobicContact SD-CG 3.92Å; M694-Y945 HydrophobicContact CB-CE1 4.36Å; M694-Y945 HydrophobicContact CE-CD1 3.9Å; M694-Y945 HydrophobicContact CE-CD2 4.33Å; M694-Y945 HydrophobicContact CE-CE1 4.15Å; M694-Y945 HydrophobicContact CE-CG 3.99Å; M694-Y945 HydrophobicContact CG-CD1 4.2Å; M694-Y945 HydrophobicContact CG-CE1 3.51Å; M694-Y945 HydrophobicContact CG-CE2 4.07Å; M694-Y945 VanDerWaalsContact CG-CZ 3.43Å; M694-Y945 WeakPolarHBondContact CG-OH 3.43Å
695P96.7Very high95Very high34 Ų3424.9 Ų24.922%0.22113%0.134CC..Hα-helixtrans-56.8-39.3176.5-26.635.1000113.7H660 T691 D692 N699 Y945H660-P695 HydrophobicContact CB-CB 4.17Å; H660-P695 WeakPolarHBondContact ND1-CB 3.3Å; H660-P695 PolarHBondContact ND1-O 3.29Å; T691-P695 WeakPolarHBondContact O-CD 3.5Å; D692-P695 WeakPolarHBondContact O-CD 3.5Å; P695-N699 PolarHBondContact O-N 2.96Å; P695-N699 VanDerWaalsContact O-N 3.17Å; P695-Y945 HydrophobicContact CG-CE1 4.22Å
696L97.2Very high95.3Very high0 Ų027.6 Ų27.60%015%0.148CC..Hα-helixtrans-69-43.7175.3172.463.1000111.6F656 A659 T663 L674 V678 M693 M694 H698 N699 Y700F656-L696 HydrophobicContact CD1-CD2 4.24Å; A659-L696 HydrophobicContact CB-CD1 3.99Å; A659-L696 HydrophobicContact CB-CD2 3.74Å; A659-L696 HydrophobicContact CB-CG 4.38Å; T663-L696 HydrophobicContact CG2-CD1 3.9Å; L674-L696 HydrophobicContact CD2-CD2 4.5Å; V678-L696 HydrophobicContact CG2-CD2 4.06Å; M693-L696 WeakPolarHBondContact O-CB 3.3Å; M693-L696 PolarHBondContact O-N 2.92Å; M694-L696 VanDerWaalsContact C-N 3.29Å; M694-L696 PolarHBondContact O-N 3.25Å; L696-H698 VanDerWaalsContact C-N 3.32Å; L696-H698 PolarHBondContact O-N 3.31Å; L696-N699 PolarHBondContact O-N 2.77Å; L696-Y700 HydrophobicContact CD1-CD2 4.2Å; L696-Y700 HydrophobicContact CD1-CE2 3.57Å; L696-Y700 HydrophobicContact CD2-CE2 4.09Å; L696-Y700 HydrophobicContact CG-CD2 4.12Å; L696-Y700 HydrophobicContact CG-CE2 3.58Å; L696-Y700 VanDerWaalsContact O-CD2 3.23Å; L696-Y700 WeakPolarHBondContact O-CD2 3.36Å; L696-Y700 PolarHBondContact O-N 3.43Å; L696-Y700 VanDerWaalsContact O-N 3.11Å
697L97.8Very high95.6Very high0 Ų029.5 Ų29.50%016%0.16CC..Hα-helixtrans-65.1-37.1178.5-63.7-179.4000112.2L675 F690 M693 M694 Y700 V701 I718 M721 L741L675-L697 HydrophobicContact CD1-CD2 3.8Å; F690-L697 HydrophobicContact CE2-CD1 4.04Å; M693-L697 HydrophobicContact CB-CD1 4.23Å; M693-L697 HydrophobicContact CB-CG 4.41Å; M693-L697 WeakPolarHBondContact O-CG 3.46Å; M693-L697 PolarHBondContact O-N 3.35Å; M694-L697 PolarHBondContact O-N 3.38Å; M694-L697 VanDerWaalsContact O-N 3.13Å; L697-Y700 HydrophobicContact CD2-CD2 4.35Å; L697-Y700 PolarHBondContact O-N 2.98Å; L697-V701 WeakPolarHBondContact O-CG2 3.23Å; L697-V701 PolarHBondContact O-N 2.82Å; L697-I718 HydrophobicContact CD2-CG1 4.37Å; L697-M721 HydrophobicContact CD1-CE 3.81Å; L697-M721 HydrophobicContact CD1-SD 4.4Å; L697-M721 HydrophobicContact CD2-CE 3.6Å; L697-M721 HydrophobicContact CG-CE 4.38Å; L697-L741 HydrophobicContact CB-CD1 4.48Å; L697-L741 HydrophobicContact CB-CD2 3.73Å; L697-L741 HydrophobicContact CD1-CD2 3.9Å; L697-L741 HydrophobicContact CG-CD2 4.47Å
698H97.3Very high95.8Very high14 Ų1427.7 Ų27.77%0.06515%0.152CC..Hα-helixtrans-59.7-48.5172.4179.6-88.3000110.8M694 L696 Y700 V701 T702 Y945 S946M694-H698 HydrophobicContact CE-CB 4.42Å; M694-H698 WeakPolarHBondContact O-CB 3.41Å; M694-H698 PolarHBondContact O-N 3.33Å; L696-H698 VanDerWaalsContact C-N 3.32Å; L696-H698 PolarHBondContact O-N 3.31Å; H698-Y700 VanDerWaalsContact C-N 3.34Å; H698-Y700 PolarHBondContact O-N 3.17Å; H698-V701 CarbonylContact O-C 3.6Å; H698-V701 WeakPolarHBondContact O-CA 3.46Å; H698-V701 WeakPolarHBondContact O-CB 3.33Å; H698-V701 PolarHBondContact O-N 3.18Å; H698-T702 PolarHBondContact ND1-OG1 3.42Å; H698-T702 PolarHBondContact O-N 2.92Å; H698-T702 PolarHBondContact O-OG1 3.5Å; H698-Y945 HydrophobicContact CB-CD1 4.03Å; H698-Y945 AromaticContact CD2-CD1 3.91Å; H698-Y945 AromaticContact CG-CD1 3.97Å; H698-S946 PolarHBondContact CE1-O 3.39Å; H698-S946 PolarHBondContact NE2-O 3.43Å
699N96.4Very high95.9Very high10 Ų1024.2 Ų24.25%0.05313%0.133CC..Hα-helixtrans-58.9-40.6177-74.5-6000112.9H660 T663 C664 P695 L696 V701 T702 V703H660-N699 PolarHBondContact CE1-ND2 3.4Å; H660-N699 PolarHBondContact ND1-ND2 3.14Å; H660-N699 PolarHBondContact O-ND2 2.95Å; H660-N699 VanDerWaalsContact O-ND2 3.15Å; T663-N699 WeakPolarHBondContact OG1-CB 3.36Å; T663-N699 PolarHBondContact OG1-ND2 3.09Å; C664-N699 PolarHBondContact N-ND2 3.4Å; P695-N699 PolarHBondContact O-N 2.96Å; P695-N699 VanDerWaalsContact O-N 3.17Å; L696-N699 PolarHBondContact O-N 2.77Å; N699-V701 PolarHBondContact O-N 3.37Å; N699-T702 PolarHBondContact O-N 2.82Å; N699-V703 HydrophobicContact CB-CG2 4.16Å; N699-V703 VanDerWaalsContact O-CB 3.26Å; N699-V703 WeakPolarHBondContact O-CB 3.37Å; N699-V703 PolarHBondContact O-N 3.19Å
700Y97.9Very high95.9Very high0 Ų025.9 Ų25.90%015%0.153CC..Hα-helixtrans-58.9-29.4173.8-76.8-60.9000112.9V667 M671 W672 L675 L696 L697 H698V667-Y700 HydrophobicContact CG1-CD1 3.71Å; V667-Y700 HydrophobicContact CG1-CE1 3.53Å; V667-Y700 HydrophobicContact CG2-CD1 4.47Å; M671-Y700 PolarHBondContact O-OH 3.49Å; W672-Y700 HydrophobicContact CD2-CD1 4Å; W672-Y700 HydrophobicContact CD2-CE1 4.12Å; W672-Y700 AromaticContact CE3-CD1 3.79Å; W672-Y700 HydrophobicContact CE3-CD1 3.79Å; W672-Y700 HydrophobicContact CE3-CE1 4.02Å; W672-Y700 AromaticContact CH2-CD1 3.71Å; W672-Y700 HydrophobicContact CH2-CD1 3.71Å; W672-Y700 HydrophobicContact CH2-CG 4.25Å; W672-Y700 AromaticContact CZ2-CD1 3.95Å; W672-Y700 HydrophobicContact CZ2-CD1 3.95Å; W672-Y700 AromaticContact CZ3-CD1 3.63Å; W672-Y700 HydrophobicContact CZ3-CD1 3.63Å; W672-Y700 HydrophobicContact CZ3-CE1 4.31Å; W672-Y700 HydrophobicContact CZ3-CG 4.22Å; L675-Y700 HydrophobicContact CB-CE1 4.44Å; L675-Y700 HydrophobicContact CB-CE2 4.06Å; L675-Y700 HydrophobicContact CD1-CD2 4.26Å; L675-Y700 HydrophobicContact CD1-CE2 4.21Å; L696-Y700 HydrophobicContact CD1-CD2 4.2Å; L696-Y700 HydrophobicContact CD1-CE2 3.57Å; L696-Y700 HydrophobicContact CD2-CE2 4.09Å; L696-Y700 HydrophobicContact CG-CD2 4.12Å; L696-Y700 HydrophobicContact CG-CE2 3.58Å; L696-Y700 VanDerWaalsContact O-CD2 3.23Å; L696-Y700 WeakPolarHBondContact O-CD2 3.36Å; L696-Y700 PolarHBondContact O-N 3.43Å; L696-Y700 VanDerWaalsContact O-N 3.11Å; L697-Y700 HydrophobicContact CD2-CD2 4.35Å; L697-Y700 PolarHBondContact O-N 2.98Å; H698-Y700 VanDerWaalsContact C-N 3.34Å; H698-Y700 PolarHBondContact O-N 3.17Å
701V96.8Very high95.7Very high0 Ų028.6 Ų28.60%017%0.167CC..Hα-helixtrans-84.7-48.7179.5177.40000111.5L697 H698 N699 T705 L708 I718 L741 V744 I745 Q748L697-V701 WeakPolarHBondContact O-CG2 3.23Å; L697-V701 PolarHBondContact O-N 2.82Å; H698-V701 CarbonylContact O-C 3.6Å; H698-V701 WeakPolarHBondContact O-CA 3.46Å; H698-V701 WeakPolarHBondContact O-CB 3.33Å; H698-V701 PolarHBondContact O-N 3.18Å; N699-V701 PolarHBondContact O-N 3.37Å; V701-T705 WeakPolarHBondContact O-CB 3.29Å; V701-T705 PolarHBondContact O-OG1 3.26Å; V701-L708 HydrophobicContact CB-CD2 4.38Å; V701-L708 HydrophobicContact CG1-CD2 4.4Å; V701-L708 HydrophobicContact CG2-CD2 4.02Å; V701-I718 HydrophobicContact CG2-CD1 4.08Å; V701-L741 HydrophobicContact CG2-CD1 4.2Å; V701-V744 HydrophobicContact CG1-CG1 4Å; V701-I745 HydrophobicContact CB-CG1 4.42Å; V701-I745 HydrophobicContact CG1-CB 4.43Å; V701-I745 HydrophobicContact CG1-CG1 3.8Å; V701-I745 HydrophobicContact CG2-CD1 4.28Å; V701-I745 HydrophobicContact CG2-CG1 3.68Å; V701-Q748 HydrophobicContact CG1-CB 4.01Å; V701-Q748 HydrophobicContact CG1-CG 4.08Å; V701-Q748 WeakPolarHBondContact O-CG 3.48Å
702T95.2Very high95.5Very high33 Ų3331.4 Ų31.420%0.20218%0.184CC..Hα-helixtrans-87.7-34.5-168.455.60000113.5H698 N699 V744 Q748H698-T702 PolarHBondContact ND1-OG1 3.42Å; H698-T702 PolarHBondContact O-N 2.92Å; H698-T702 PolarHBondContact O-OG1 3.5Å; N699-T702 PolarHBondContact O-N 2.82Å; T702-V744 HydrophobicContact CG2-CG1 3.8Å; T702-Q748 PolarHBondContact O-NE2 3.31Å
703V94.8Very high95.4Very high50 Ų5034.9 Ų34.930%0.30320%0.197SC..THydrogen-bonded Turntrans-85.7-42.2-174.7-178.60000112.5C664 V667 N699C664-V703 WeakPolarHBondContact O-CG2 3.36Å; V667-V703 HydrophobicContact CG2-CB 4.11Å; V667-V703 HydrophobicContact CG2-CG1 4.18Å; N699-V703 HydrophobicContact CB-CG2 4.16Å; N699-V703 VanDerWaalsContact O-CB 3.26Å; N699-V703 WeakPolarHBondContact O-CB 3.37Å; N699-V703 PolarHBondContact O-N 3.19Å
704D94.7Very high95.3Very high33 Ų3337 Ų3718%0.17621%0.206CC..  trans-131.358.8-179.5-170.98.8000112.8V667 W672 D706 T707 L708V667-D704 HydrophobicContact CB-CB 3.83Å; V667-D704 HydrophobicContact CG2-CB 3.81Å; W672-D704 HydrophobicContact CZ2-CB 4.13Å; W672-D704 WeakPolarHBondContact CZ2-O 3.26Å; W672-D704 PolarHBondContact NE1-OD2 2.93Å; D704-D706 PolarHBondContact O-N 3.27Å; D704-D706 VanDerWaalsContact O-N 3.14Å; D704-T707 PolarHBondContact O-N 3.34Å; D704-T707 PolarHBondContact OD1-N 2.9Å; D704-T707 VanDerWaalsContact OD1-N 3.15Å; D704-T707 PolarHBondContact OD1-OG1 3.34Å; D704-T707 VanDerWaalsContact OD1-OG1 3.08Å; D704-T707 WeakPolarHBondContact OD2-CB 3.27Å; D704-T707 PolarHBondContact OD2-OG1 3.12Å; D704-L708 PolarHBondContact O-N 3.32Å
705T94.7Very high95.3Very high10 Ų1037.8 Ų37.86%0.06121%0.21CC..Hα-helixtrans-57.7-27.5177.4-40.90000112.7V701 L709 Q748V701-T705 WeakPolarHBondContact O-CB 3.29Å; V701-T705 PolarHBondContact O-OG1 3.26Å; T705-L709 HydrophobicContact CG2-CD1 4.16Å; T705-L709 HydrophobicContact CG2-CG 4.49Å; T705-L709 VanDerWaalsContact O-CG 3.32Å; T705-L709 WeakPolarHBondContact O-CG 3.36Å; T705-L709 PolarHBondContact O-N 3.36Å; T705-Q748 HydrophobicContact CG2-CG 3.94Å; T705-Q748 WeakPolarHBondContact OG1-CG 3.46Å; T705-Q748 PolarHBondContact OG1-NE2 2.91Å; T705-Q748 VanDerWaalsContact OG1-NE2 3.15Å
706D95Very high95.3Very high105 Ų10541.5 Ų41.556%0.56122%0.224SC*.Hα-helixtrans-66.4-47.3180-76.20.5000111.7D704 L709 S710 R752D704-D706 PolarHBondContact O-N 3.27Å; D704-D706 VanDerWaalsContact O-N 3.14Å; D706-L709 PolarHBondContact O-N 3.03Å; D706-S710 PolarHBondContact O-N 3.41Å; D706-R752 IonicContact OD1-CZ 3.52Å; D706-R752 IonicContact OD1-NH1 2.7Å; D706-R752 PolarHBondContact OD1-NH1 2.92Å; D706-R752 IonicContact OD1-NH2 3.44Å; D706-R752 PolarHBondContact OD1-NH2 3.39Å
707T95.2Very high95.3Very high41 Ų4143.2 Ų43.225%0.25223%0.233SC..Hα-helixtrans-69.4-38.2177.3-57.30000111.5W672 D704 L709 S710 Y714W672-T707 HydrophobicContact CD2-CG2 3.81Å; W672-T707 VanDerWaalsContact CE2-CG2 3.46Å; W672-T707 HydrophobicContact CG-CG2 3.98Å; W672-T707 HydrophobicContact CZ2-CG2 4Å; D704-T707 PolarHBondContact O-N 3.34Å; D704-T707 PolarHBondContact OD1-N 2.9Å; D704-T707 VanDerWaalsContact OD1-N 3.15Å; D704-T707 PolarHBondContact OD1-OG1 3.34Å; D704-T707 VanDerWaalsContact OD1-OG1 3.08Å; D704-T707 WeakPolarHBondContact OD2-CB 3.27Å; D704-T707 PolarHBondContact OD2-OG1 3.12Å; T707-L709 PolarHBondContact O-N 3.09Å; T707-S710 WeakPolarHBondContact O-CB 3.48Å; T707-S710 PolarHBondContact O-N 2.95Å; T707-S710 PolarHBondContact O-OG 3.44Å; T707-Y714 HydrophobicContact CG2-CE2 4.31Å
708L95.8Very high95.3Very high0 Ų043.2 Ų43.20%023%0.233CC..Hα-helixtrans-51.2-43.8173.6179.166.3000112W672 V701 D704 L715 I718W672-L708 HydrophobicContact CH2-CB 3.75Å; W672-L708 HydrophobicContact CH2-CD1 4.07Å; W672-L708 HydrophobicContact CZ2-CB 4.35Å; W672-L708 HydrophobicContact CZ3-CD1 4.35Å; V701-L708 HydrophobicContact CB-CD2 4.38Å; V701-L708 HydrophobicContact CG1-CD2 4.4Å; V701-L708 HydrophobicContact CG2-CD2 4.02Å; D704-L708 PolarHBondContact O-N 3.32Å; L708-L715 HydrophobicContact CD1-CB 4.42Å; L708-I718 HydrophobicContact CD1-CD1 3.84Å
709L94.9Very high95.3Very high48 Ų4844 Ų4425%0.25124%0.235SC..Hα-helixtrans-84.6-9.2-177.7-63.4177.2000113.6T705 D706 T707 R752 I754T705-L709 HydrophobicContact CG2-CD1 4.16Å; T705-L709 HydrophobicContact CG2-CG 4.49Å; T705-L709 VanDerWaalsContact O-CG 3.32Å; T705-L709 WeakPolarHBondContact O-CG 3.36Å; T705-L709 PolarHBondContact O-N 3.36Å; D706-L709 PolarHBondContact O-N 3.03Å; T707-L709 PolarHBondContact O-N 3.09Å; L709-R752 HydrophobicContact CD1-CB 3.67Å; L709-R752 HydrophobicContact CD1-CG 4.48Å; L709-I754 HydrophobicContact CD2-CG2 3.57Å
710S93.4Very high95.4Very high90 Ų9045.7 Ų45.763%0.62925%0.248SC*.Hα-helixtrans-76.2-29.1-178.577.10000113.6D706 T707D706-S710 PolarHBondContact O-N 3.41Å; T707-S710 WeakPolarHBondContact O-CB 3.48Å; T707-S710 PolarHBondContact O-N 2.95Å; T707-S710 PolarHBondContact O-OG 3.44Å
711D92Very high95.4Very high57 Ų5745.7 Ų45.731%0.30525%0.248SC..SBendtrans-129.5117.9173.6-171-17.9000109.4K713 Y714D711-K713 PolarHBondContact O-N 2.81Å; D711-K713 WeakPolarHBondContact OD1-CB 3.2Å; D711-K713 WeakPolarHBondContact OD1-CG 3.48Å; D711-K713 PolarHBondContact OD1-N 3.4Å; D711-K713 VanDerWaalsContact OD1-N 3.07Å; D711-Y714 HydrophobicContact CB-CD2 3.89Å; D711-Y714 HydrophobicContact CB-CE2 3.92Å; D711-Y714 PolarHBondContact O-N 3.14Å; D711-Y714 VanDerWaalsContact O-N 3.15Å
712T90.5Very high95.4Very high89 Ų8945.7 Ų45.755%0.54625%0.248SC..Hα-helixtrans-59.4-23.3-176.664.10000112.7Y714 L715 E716T712-Y714 VanDerWaalsContact C-N 3.28Å; T712-Y714 PolarHBondContact O-N 3.45Å; T712-L715 PolarHBondContact O-N 3.04Å; T712-E716 WeakPolarHBondContact O-CB 3.5Å; T712-E716 VanDerWaalsContact O-CG 3.24Å; T712-E716 WeakPolarHBondContact O-CG 3.5Å; T712-E716 PolarHBondContact O-N 3.4Å; T712-E716 PolarHBondContact OG1-OE1 3.08Å
713K94.3Very high95.5Very high119 Ų11948.1 Ų48.152%0.51726%0.255SS..Hα-helixtrans-60-35.3178.4-68175.7-173.3168.30113.4D711 E716 M717D711-K713 PolarHBondContact O-N 2.81Å; D711-K713 WeakPolarHBondContact OD1-CB 3.2Å; D711-K713 WeakPolarHBondContact OD1-CG 3.48Å; D711-K713 PolarHBondContact OD1-N 3.4Å; D711-K713 VanDerWaalsContact OD1-N 3.07Å; K713-E716 PolarHBondContact O-N 3.37Å; K713-M717 VanDerWaalsContact O-CG 3.28Å; K713-M717 WeakPolarHBondContact O-CG 3.38Å; K713-M717 PolarHBondContact O-N 3.35Å
714Y96.1Very high95.6Very high44 Ų4449.4 Ų49.417%0.17326%0.257CS..Hα-helixtrans-65.7-49.1-178.6-65.1-46000110.8W672 L675 T707 D711 T712 E716 M717 I718W672-Y714 HydrophobicContact CD2-CE2 4.43Å; W672-Y714 AromaticContact CE3-CD1 3.91Å; W672-Y714 HydrophobicContact CE3-CD1 3.91Å; W672-Y714 AromaticContact CE3-CD2 3.91Å; W672-Y714 HydrophobicContact CE3-CD2 3.91Å; W672-Y714 AromaticContact CE3-CE1 3.89Å; W672-Y714 HydrophobicContact CE3-CE1 3.89Å; W672-Y714 AromaticContact CE3-CE2 3.92Å; W672-Y714 HydrophobicContact CE3-CE2 3.92Å; W672-Y714 AromaticContact CE3-CG 3.91Å; W672-Y714 HydrophobicContact CE3-CG 3.91Å; W672-Y714 AromaticContact CE3-CZ 3.89Å; W672-Y714 HydrophobicContact CZ3-CD1 4.07Å; W672-Y714 AromaticContact CZ3-CD2 3.88Å; W672-Y714 HydrophobicContact CZ3-CD2 3.88Å; W672-Y714 HydrophobicContact CZ3-CE1 4.5Å; W672-Y714 HydrophobicContact CZ3-CE2 4.36Å; W672-Y714 AromaticContact CZ3-CG 3.72Å; W672-Y714 HydrophobicContact CZ3-CG 3.72Å; L675-Y714 HydrophobicContact CD2-CD1 3.73Å; L675-Y714 HydrophobicContact CD2-CG 4.25Å; T707-Y714 HydrophobicContact CG2-CE2 4.31Å; D711-Y714 HydrophobicContact CB-CD2 3.89Å; D711-Y714 HydrophobicContact CB-CE2 3.92Å; D711-Y714 PolarHBondContact O-N 3.14Å; D711-Y714 VanDerWaalsContact O-N 3.15Å; T712-Y714 VanDerWaalsContact C-N 3.28Å; T712-Y714 PolarHBondContact O-N 3.45Å; Y714-E716 VanDerWaalsContact C-N 3.3Å; Y714-E716 PolarHBondContact O-N 2.87Å; Y714-M717 PolarHBondContact O-N 2.82Å; Y714-I718 WeakPolarHBondContact O-CG1 3.29Å; Y714-I718 PolarHBondContact O-N 3.44Å; Y714-I718 VanDerWaalsContact O-N 3.17Å
715L95.4Very high95.7Very high16 Ų1647.8 Ų47.88%0.08425%0.249CC..Hα-helixtrans-63.3-37.5175.2-173.961.2000112L708 T712 I718 Y719 I745 I754 F761L708-L715 HydrophobicContact CD1-CB 4.42Å; T712-L715 PolarHBondContact O-N 3.04Å; L715-I718 PolarHBondContact O-N 3.36Å; L715-Y719 VanDerWaalsContact O-CB 3.31Å; L715-Y719 WeakPolarHBondContact O-CB 3.33Å; L715-Y719 PolarHBondContact O-N 2.84Å; L715-I745 HydrophobicContact CD1-CD1 4.24Å; L715-I745 HydrophobicContact CD1-CG2 3.81Å; L715-I754 HydrophobicContact CD2-CG2 4.15Å; L715-F761 HydrophobicContact CD1-CZ 4.24Å
716E95.9Very high95.8Very high112 Ų11247.4 Ų47.452%0.52325%0.246SC..Hα-helixtrans-62.6-40175.3-74.9168-15400112.6T712 K713 Y714 S720T712-E716 WeakPolarHBondContact O-CB 3.5Å; T712-E716 VanDerWaalsContact O-CG 3.24Å; T712-E716 WeakPolarHBondContact O-CG 3.5Å; T712-E716 PolarHBondContact O-N 3.4Å; T712-E716 PolarHBondContact OG1-OE1 3.08Å; K713-E716 PolarHBondContact O-N 3.37Å; Y714-E716 VanDerWaalsContact C-N 3.3Å; Y714-E716 PolarHBondContact O-N 2.87Å; E716-S720 VanDerWaalsContact O-CB 3.23Å; E716-S720 WeakPolarHBondContact O-CB 3.36Å; E716-S720 PolarHBondContact O-N 3.15Å
717M97.4Very high95.6Very high37 Ų3745.3 Ų45.318%0.18224%0.237CC..Hα-helixtrans-63.1-51.8175.8-73.3171.2-177.400110.9L675 P676 F679 K713 Y714 Y719 S720 M721L675-M717 HydrophobicContact CG-SD 4.36Å; P676-M717 HydrophobicContact CB-CE 4.13Å; P676-M717 HydrophobicContact CB-SD 4.42Å; P676-M717 HydrophobicContact CG-CE 4.14Å; P676-M717 HydrophobicContact CG-SD 4.25Å; F679-M717 HydrophobicContact CB-CB 4.43Å; F679-M717 HydrophobicContact CB-CG 4.34Å; F679-M717 HydrophobicContact CB-SD 4.4Å; F679-M717 HydrophobicContact CD1-CG 4.05Å; F679-M717 HydrophobicContact CD2-CB 4.04Å; F679-M717 HydrophobicContact CD2-CG 4.29Å; F679-M717 HydrophobicContact CE1-CG 4.38Å; F679-M717 HydrophobicContact CE2-CB 4.46Å; F679-M717 HydrophobicContact CG-CB 4.14Å; F679-M717 HydrophobicContact CG-CG 3.97Å; K713-M717 VanDerWaalsContact O-CG 3.28Å; K713-M717 WeakPolarHBondContact O-CG 3.38Å; K713-M717 PolarHBondContact O-N 3.35Å; Y714-M717 PolarHBondContact O-N 2.82Å; M717-Y719 PolarHBondContact O-N 3.2Å; M717-S720 PolarHBondContact O-N 2.72Å; M717-S720 VanDerWaalsContact O-N 3.15Å; M717-M721 WeakPolarHBondContact O-CG 3.47Å; M717-M721 PolarHBondContact O-N 2.91Å
718I97.7Very high95.2Very high0 Ų044.3 Ų44.30%024%0.235CC..Hα-helixtrans-59.8-47.9-179.6-61.5178000110.8L675 L697 V701 L708 Y714 L715 S720 M721 C722 L741 I745L675-I718 HydrophobicContact CD1-CG1 4.36Å; L675-I718 HydrophobicContact CD2-CG1 4.46Å; L697-I718 HydrophobicContact CD2-CG1 4.37Å; V701-I718 HydrophobicContact CG2-CD1 4.08Å; L708-I718 HydrophobicContact CD1-CD1 3.84Å; Y714-I718 WeakPolarHBondContact O-CG1 3.29Å; Y714-I718 PolarHBondContact O-N 3.44Å; Y714-I718 VanDerWaalsContact O-N 3.17Å; L715-I718 PolarHBondContact O-N 3.36Å; I718-S720 VanDerWaalsContact C-N 3.34Å; I718-S720 PolarHBondContact O-N 3.37Å; I718-M721 HydrophobicContact CG1-CE 4.37Å; I718-M721 PolarHBondContact O-N 3.13Å; I718-C722 PolarHBondContact O-N 3.35Å; I718-C722 VanDerWaalsContact O-N 3.07Å; I718-C722 PolarHBondContact O-SG 2.98Å; I718-L741 HydrophobicContact CG2-CD2 3.6Å; I718-L741 HydrophobicContact CG2-CG 4.11Å; I718-I745 HydrophobicContact CG2-CD1 3.84Å
719Y97.6Very high94.6Very high30 Ų3050.8 Ų50.812%0.11827%0.274CS..Hα-helixtrans-60.7-41.9175.7167.7-114.4000112.3L715 M717 M721 C722 K723 L742 L760 F761 A764L715-Y719 VanDerWaalsContact O-CB 3.31Å; L715-Y719 WeakPolarHBondContact O-CB 3.33Å; L715-Y719 PolarHBondContact O-N 2.84Å; M717-Y719 PolarHBondContact O-N 3.2Å; Y719-M721 VanDerWaalsContact C-N 3.25Å; Y719-M721 PolarHBondContact O-N 3.25Å; Y719-C722 PolarHBondContact O-N 3.36Å; Y719-K723 HydrophobicContact CE1-CD 4.3Å; Y719-K723 HydrophobicContact CE2-CB 4.18Å; Y719-K723 VanDerWaalsContact O-CB 3.32Å; Y719-K723 WeakPolarHBondContact O-CB 3.44Å; Y719-K723 PolarHBondContact O-N 3.14Å; Y719-L742 HydrophobicContact CD2-CD2 4.12Å; Y719-L760 HydrophobicContact CE1-CB 4.29Å; Y719-L760 HydrophobicContact CE1-CD1 4.28Å; Y719-L760 HydrophobicContact CE2-CB 4.14Å; Y719-L760 WeakPolarHBondContact OH-CB 3.27Å; Y719-F761 AromaticContact CD2-CD1 3.4Å; Y719-F761 HydrophobicContact CD2-CD1 3.4Å; Y719-F761 VanDerWaalsContact CD2-CD1 3.4Å; Y719-F761 AromaticContact CD2-CE1 3.41Å; Y719-F761 HydrophobicContact CD2-CE1 3.41Å; Y719-F761 VanDerWaalsContact CD2-CE1 3.41Å; Y719-F761 AromaticContact CE2-CD1 3.75Å; Y719-F761 HydrophobicContact CE2-CD1 3.75Å; Y719-F761 HydrophobicContact CE2-CE1 4.16Å; Y719-F761 HydrophobicContact CG-CD1 4.17Å; Y719-F761 AromaticContact CG-CE1 3.73Å; Y719-F761 HydrophobicContact CG-CE1 3.73Å; Y719-A764 HydrophobicContact CE2-CB 4.44Å
720S97.4Very high94.1Very high46 Ų4649.8 Ų49.832%0.32227%0.273SS..Hα-helixtrans-64.3-32.2179.4-176.70000112.1E716 M717 I718 K724E716-S720 VanDerWaalsContact O-CB 3.23Å; E716-S720 WeakPolarHBondContact O-CB 3.36Å; E716-S720 PolarHBondContact O-N 3.15Å; M717-S720 PolarHBondContact O-N 2.72Å; M717-S720 VanDerWaalsContact O-N 3.15Å; I718-S720 VanDerWaalsContact C-N 3.34Å; I718-S720 PolarHBondContact O-N 3.37Å; S720-K724 WeakPolarHBondContact O-CB 3.45Å; S720-K724 PolarHBondContact O-N 3.42Å; S720-K724 VanDerWaalsContact O-N 3.12Å
721M97.9Very high93.9Very high0 Ų047.3 Ų47.30%026%0.262CS..Hα-helixtrans-67.3-54173.2-63.8-173.9-79.800110.3L675 F679 F682 F690 L697 M717 I718 Y719 K723 K724 V725L675-M721 HydrophobicContact CD1-CE 4.21Å; F679-M721 HydrophobicContact CD2-CE 4.43Å; F679-M721 HydrophobicContact CD2-CG 3.6Å; F679-M721 HydrophobicContact CD2-SD 3.98Å; F679-M721 HydrophobicContact CE2-CG 3.96Å; F682-M721 HydrophobicContact CB-SD 4.06Å; F682-M721 HydrophobicContact CD1-CB 4.1Å; F682-M721 HydrophobicContact CD1-CG 3.51Å; F682-M721 HydrophobicContact CD1-SD 4.15Å; F682-M721 HydrophobicContact CE1-CB 3.82Å; F682-M721 HydrophobicContact CE1-CG 3.72Å; F682-M721 HydrophobicContact CE2-CB 4.44Å; F682-M721 HydrophobicContact CG-CB 4.5Å; F682-M721 HydrophobicContact CG-CG 3.92Å; F682-M721 HydrophobicContact CG-SD 3.98Å; F682-M721 HydrophobicContact CZ-CB 4.01Å; F682-M721 HydrophobicContact CZ-CG 4.33Å; F690-M721 HydrophobicContact CD2-CB 4.4Å; F690-M721 HydrophobicContact CE2-CB 3.92Å; L697-M721 HydrophobicContact CD1-CE 3.81Å; L697-M721 HydrophobicContact CD1-SD 4.4Å; L697-M721 HydrophobicContact CD2-CE 3.6Å; L697-M721 HydrophobicContact CG-CE 4.38Å; M717-M721 WeakPolarHBondContact O-CG 3.47Å; M717-M721 PolarHBondContact O-N 2.91Å; I718-M721 HydrophobicContact CG1-CE 4.37Å; I718-M721 PolarHBondContact O-N 3.13Å; Y719-M721 VanDerWaalsContact C-N 3.25Å; Y719-M721 PolarHBondContact O-N 3.25Å; M721-K723 VanDerWaalsContact C-N 3.28Å; M721-K723 PolarHBondContact O-N 3.29Å; M721-K724 PolarHBondContact O-N 3.05Å; M721-V725 WeakPolarHBondContact O-CG2 3.46Å; M721-V725 PolarHBondContact O-N 3.43Å
722C98Very high93.9Very high0 Ų046.2 Ų46.20%026%0.255CS..Hα-helixtrans-54.3-44.8178.1-610000111.9I718 Y719 V725 L726 A738 L742I718-C722 PolarHBondContact O-N 3.35Å; I718-C722 VanDerWaalsContact O-N 3.07Å; I718-C722 PolarHBondContact O-SG 2.98Å; Y719-C722 PolarHBondContact O-N 3.36Å; C722-V725 PolarHBondContact O-N 3.29Å; C722-L726 WeakPolarHBondContact O-CB 3.25Å; C722-L726 WeakPolarHBondContact O-CG 3.35Å; C722-L726 PolarHBondContact O-N 2.69Å; C722-A738 HydrophobicContact CB-CB 4.17Å; C722-L742 HydrophobicContact CB-CD1 4.26Å; C722-L742 HydrophobicContact CB-CD2 3.84Å; C722-L742 HydrophobicContact CB-CG 3.95Å
723K97.4Very high94Very high83 Ų8346.5 Ų46.536%0.36125%0.253SS..Hα-helixtrans-62.4-44.3177.8-175.9178.5-172.8161.20112Y719 M721 V725 L726 T727Y719-K723 HydrophobicContact CE1-CD 4.3Å; Y719-K723 HydrophobicContact CE2-CB 4.18Å; Y719-K723 VanDerWaalsContact O-CB 3.32Å; Y719-K723 WeakPolarHBondContact O-CB 3.44Å; Y719-K723 PolarHBondContact O-N 3.14Å; M721-K723 VanDerWaalsContact C-N 3.28Å; M721-K723 PolarHBondContact O-N 3.29Å; K723-V725 VanDerWaalsContact C-N 3.3Å; K723-V725 PolarHBondContact O-N 3.48Å; K723-L726 PolarHBondContact O-N 3.32Å; K723-T727 HydrophobicContact CG-CG2 4.35Å; K723-T727 WeakPolarHBondContact O-CB 3.48Å; K723-T727 WeakPolarHBondContact O-CG2 3.47Å; K723-T727 PolarHBondContact O-N 3.48Å; K723-T727 PolarHBondContact O-OG1 3.25Å
724K96.4Very high94Very high77 Ų7741.2 Ų41.234%0.33523%0.231SC..Hα-helixtrans-64-38.7179.8-169-170.9176.4-170.20110.6F682 F687 S720 M721 G728F682-K724 HydrophobicContact CD1-CD 4.37Å; F682-K724 HydrophobicContact CE1-CB 3.95Å; F682-K724 HydrophobicContact CE1-CD 3.46Å; F682-K724 VanDerWaalsContact CE1-CD 3.46Å; F682-K724 HydrophobicContact CE1-CG 4.27Å; F682-K724 HydrophobicContact CZ-CB 4.05Å; F682-K724 HydrophobicContact CZ-CD 3.88Å; F682-K724 HydrophobicContact CZ-CG 4.39Å; F682-K724 PolarHBondContact O-NZ 3.16Å; F687-K724 HydrophobicContact CD2-CD 4Å; F687-K724 HydrophobicContact CD2-CG 4.41Å; F687-K724 HydrophobicContact CE2-CD 4.03Å; F687-K724 HydrophobicContact CE2-CG 3.93Å; S720-K724 WeakPolarHBondContact O-CB 3.45Å; S720-K724 PolarHBondContact O-N 3.42Å; S720-K724 VanDerWaalsContact O-N 3.12Å; M721-K724 PolarHBondContact O-N 3.05Å; K724-G728 VanDerWaalsContact O-CA 3.32Å; K724-G728 WeakPolarHBondContact O-CA 3.38Å; K724-G728 PolarHBondContact O-N 2.88Å
725V97Very high94Very high0 Ų039.3 Ų39.30%022%0.224CC..Hα-helixtrans-64-54.9173.9176.30000110.8F682 F687 F690 M721 C722 K723 T727 G728 A730 A734 E735 A738F682-V725 HydrophobicContact CE2-CG2 3.92Å; F682-V725 HydrophobicContact CZ-CG2 3.83Å; F687-V725 HydrophobicContact CE2-CG2 4.31Å; F690-V725 HydrophobicContact CB-CG2 4.1Å; F690-V725 HydrophobicContact CD1-CG1 4.36Å; F690-V725 HydrophobicContact CD1-CG2 3.95Å; F690-V725 HydrophobicContact CD2-CG2 3.72Å; F690-V725 HydrophobicContact CE1-CG2 4.34Å; F690-V725 HydrophobicContact CE2-CG2 4.12Å; F690-V725 HydrophobicContact CG-CG2 3.62Å; F690-V725 HydrophobicContact CZ-CG2 4.42Å; M721-V725 WeakPolarHBondContact O-CG2 3.46Å; M721-V725 PolarHBondContact O-N 3.43Å; C722-V725 PolarHBondContact O-N 3.29Å; K723-V725 VanDerWaalsContact C-N 3.3Å; K723-V725 PolarHBondContact O-N 3.48Å; V725-T727 PolarHBondContact O-N 3.05Å; V725-T727 VanDerWaalsContact O-N 3.09Å; V725-G728 PolarHBondContact O-N 3.45Å; V725-G728 VanDerWaalsContact O-N 3.15Å; V725-A730 HydrophobicContact CG1-CB 3.83Å; V725-A734 VanDerWaalsContact CG1-C 3.49Å; V725-A734 HydrophobicContact CG1-CB 3.93Å; V725-A734 VanDerWaalsContact CG1-O 3.31Å; V725-A734 WeakPolarHBondContact CG1-O 3.39Å; V725-E735 HydrophobicContact CG1-CG 4.13Å; V725-A738 HydrophobicContact CB-CB 3.97Å; V725-A738 HydrophobicContact CG1-CB 3.82Å
726L95.7Very high94Very high1 Ų138.6 Ų38.61%0.00522%0.22CC..Hα-helixtrans-65.3-14.2-178-72.6170.5000115.2C722 K723 E735 A738 A739 L742 A764 R768 R771C722-L726 WeakPolarHBondContact O-CB 3.25Å; C722-L726 WeakPolarHBondContact O-CG 3.35Å; C722-L726 PolarHBondContact O-N 2.69Å; K723-L726 PolarHBondContact O-N 3.32Å; L726-E735 HydrophobicContact CD2-CB 4.24Å; L726-E735 WeakPolarHBondContact CD2-O 3.35Å; L726-A738 HydrophobicContact CD1-CB 4.37Å; L726-A738 HydrophobicContact CD2-CB 4.32Å; L726-A738 HydrophobicContact CG-CB 3.91Å; L726-A739 HydrophobicContact CD2-CB 4.44Å; L726-L742 HydrophobicContact CD1-CD1 3.69Å; L726-A764 HydrophobicContact CD1-CB 4.25Å; L726-R768 HydrophobicContact CD2-CB 4.33Å; L726-R768 HydrophobicContact CD2-CG 4.3Å; L726-R768 WeakPolarHBondContact O-CD 3.42Å; L726-R771 VanDerWaalsContact C-NH2 3.33Å; L726-R771 PolarHBondContact O-NH2 2.74Å
727T91.8Very high94.1Very high62 Ų6234.3 Ų34.338%0.3820%0.2SC..Hα-helixtrans-113.3-12.117758.30000113K723 V725 R771K723-T727 HydrophobicContact CG-CG2 4.35Å; K723-T727 WeakPolarHBondContact O-CB 3.48Å; K723-T727 WeakPolarHBondContact O-CG2 3.47Å; K723-T727 PolarHBondContact O-N 3.48Å; K723-T727 PolarHBondContact O-OG1 3.25Å; V725-T727 PolarHBondContact O-N 3.05Å; V725-T727 VanDerWaalsContact O-N 3.09Å; T727-R771 PolarHBondContact O-NH1 3.45Å
728G86.5Confident94.1Very high19 Ų1932.5 Ų32.520%0.19619%0.191CC..THydrogen-bonded Turntrans-90.7-154.3-178.200000113.1K724 V725 R771K724-G728 VanDerWaalsContact O-CA 3.32Å; K724-G728 WeakPolarHBondContact O-CA 3.38Å; K724-G728 PolarHBondContact O-N 2.88Å; V725-G728 PolarHBondContact O-N 3.45Å; V725-G728 VanDerWaalsContact O-N 3.15Å; G728-R771 PolarHBondContact O-NH1 2.83Å
729V83.8Confident94.1Very high137 Ų13732.5 Ų32.583%0.8319%0.191SC*.THydrogen-bonded Turntrans-126.659179.4-164.70000108.8
730A83.6Confident94.1Very high27 Ų2731.1 Ų31.122%0.22319%0.186CC..SBendtrans-85.3-16.6-178.700000113.6F687 V725 A734F687-A730 HydrophobicContact CE1-CB 3.81Å; F687-A730 HydrophobicContact CZ-CB 3.72Å; V725-A730 HydrophobicContact CG1-CB 3.83Å; A730-A734 HydrophobicContact CB-CB 3.72Å
731G89.2Confident94.1Very high38 Ų3829 Ų2939%0.39217%0.171SC..  trans96.2155.8-167.600000111.7D733 E735G731-D733 VanDerWaalsContact C-N 3.28Å; G731-D733 PolarHBondContact O-N 3.4Å; G731-E735 VanDerWaalsContact O-CG 3.25Å; G731-E735 WeakPolarHBondContact O-CG 3.25Å; G731-E735 PolarHBondContact O-N 3.18Å
732E91.7Very high94.1Very high34 Ų3429 Ų2916%0.15917%0.171CC..Hα-helixtrans-66.1-30.9-172.6-62.1-160.6158.300112.6E735 C736 R768 K774 T775 L778E732-E735 CarbonylContact O-C 3.59Å; E732-E735 WeakPolarHBondContact O-CB 3.44Å; E732-E735 PolarHBondContact O-N 3Å; E732-C736 PolarHBondContact O-N 2.96Å; E732-C736 PolarHBondContact O-SG 3.44Å; E732-R768 IonicContact OE1-NH2 2.66Å; E732-K774 WeakPolarHBondContact OE1-CB 3.46Å; E732-K774 PolarHBondContact OE1-N 2.98Å; E732-T775 VanDerWaalsContact OE2-CB 3.29Å; E732-T775 WeakPolarHBondContact OE2-CB 3.42Å; E732-T775 WeakPolarHBondContact OE2-CG2 3.38Å; E732-T775 PolarHBondContact OE2-N 3.32Å; E732-T775 PolarHBondContact OE2-OG1 3.42Å; E732-L778 HydrophobicContact CB-CB 4.48Å; E732-L778 HydrophobicContact CB-CD2 4.01Å; E732-L778 HydrophobicContact CG-CD2 3.76Å
733D92.8Very high94.1Very high94 Ų9429 Ų2950%0.50317%0.171SC..Hα-helixtrans-62.3-53178.6179.940.5000112.8T691 G731 E735 C736 H737T691-D733 WeakPolarHBondContact CG2-OD2 3.48Å; G731-D733 VanDerWaalsContact C-N 3.28Å; G731-D733 PolarHBondContact O-N 3.4Å; D733-E735 VanDerWaalsContact C-N 3.26Å; D733-E735 PolarHBondContact O-N 3.32Å; D733-C736 WeakPolarHBondContact O-CB 3.4Å; D733-C736 PolarHBondContact O-N 2.87Å; D733-C736 VanDerWaalsContact O-N 3.13Å; D733-H737 PolarHBondContact O-N 3.08Å; D733-H737 PolarHBondContact O-ND1 3.25Å; D733-H737 IonicContact OD1-CE1 2.94Å; D733-H737 PolarHBondContact OD1-CE1 3.33Å; D733-H737 IonicContact OD1-ND1 3.83Å; D733-H737 PolarHBondContact OD1-ND1 3.18Å
734A94.7Very high94Very high8 Ų825 Ų257%0.06615%0.153CC..Hα-helixtrans-60.9-3617400000112F690 T691 V725 A730 H737 A738F690-A734 HydrophobicContact CD1-CB 4.37Å; T691-A734 HydrophobicContact CG2-CB 4.22Å; V725-A734 VanDerWaalsContact CG1-C 3.49Å; V725-A734 HydrophobicContact CG1-CB 3.93Å; V725-A734 VanDerWaalsContact CG1-O 3.31Å; V725-A734 WeakPolarHBondContact CG1-O 3.39Å; A730-A734 HydrophobicContact CB-CB 3.72Å; A734-H737 PolarHBondContact O-N 3.15Å; A734-A738 WeakPolarHBondContact O-CB 3.34Å; A734-A738 PolarHBondContact O-N 2.88Å
735E96.5Very high94.1Very high5 Ų521.3 Ų21.32%0.02314%0.137CC..Hα-helixtrans-65.5-38175.4-68.2173.5147.700112.3V725 L726 G731 E732 D733 A738 A739 R768 R771 L778V725-E735 HydrophobicContact CG1-CG 4.13Å; L726-E735 HydrophobicContact CD2-CB 4.24Å; L726-E735 WeakPolarHBondContact CD2-O 3.35Å; G731-E735 VanDerWaalsContact O-CG 3.25Å; G731-E735 WeakPolarHBondContact O-CG 3.25Å; G731-E735 PolarHBondContact O-N 3.18Å; E732-E735 CarbonylContact O-C 3.59Å; E732-E735 WeakPolarHBondContact O-CB 3.44Å; E732-E735 PolarHBondContact O-N 3Å; D733-E735 VanDerWaalsContact C-N 3.26Å; D733-E735 PolarHBondContact O-N 3.32Å; E735-A738 PolarHBondContact O-N 3.45Å; E735-A739 PolarHBondContact O-N 2.96Å; E735-R768 IonicContact OE1-CZ 2.79Å; E735-R768 IonicContact OE1-NE 2.91Å; E735-R768 PolarHBondContact OE1-NE 3.07Å; E735-R768 IonicContact OE1-NH2 2.82Å; E735-R768 IonicContact OE2-CZ 3.34Å; E735-R768 IonicContact OE2-NE 3.39Å; E735-R768 PolarHBondContact OE2-NE 2.9Å; E735-R768 IonicContact OE2-NH2 3.84Å; E735-R768 PolarHBondContact OE2-NH2 3.08Å; E735-R771 IonicContact OE1-NH2 3.15Å; E735-R771 PolarHBondContact OE1-NH2 3.22Å; E735-L778 HydrophobicContact CB-CD1 3.65Å; E735-L778 WeakPolarHBondContact OE2-CD2 3.36Å
736C95.7Very high94.1Very high1 Ų121.3 Ų21.31%0.00714%0.137CC..Hα-helixtrans-61.8-48.4171.5-67.70000111.1E732 D733 A738 A739 K740 L778 M781 L942E732-C736 PolarHBondContact O-N 2.96Å; E732-C736 PolarHBondContact O-SG 3.44Å; D733-C736 WeakPolarHBondContact O-CB 3.4Å; D733-C736 PolarHBondContact O-N 2.87Å; D733-C736 VanDerWaalsContact O-N 3.13Å; C736-A738 VanDerWaalsContact C-N 3.3Å; C736-A738 PolarHBondContact O-N 3.4Å; C736-A739 PolarHBondContact O-N 3.32Å; C736-K740 WeakPolarHBondContact O-CB 3.42Å; C736-K740 PolarHBondContact O-N 3.09Å; C736-L778 WeakPolarHBondContact SG-CA 3.32Å; C736-M781 HydrophobicContact CB-CG 4.17Å; C736-L942 HydrophobicContact CB-CD1 3.76Å
737H96.7Very high94.1Very high21 Ų2121.4 Ų21.410%0.09714%0.138CC..Hα-helixtrans-58.7-41.1176.3-74.274.5000112F690 M694 D733 A734 K740 L741 Y945F690-H737 HydrophobicContact CD1-CB 4.32Å; F690-H737 HydrophobicContact CE1-CB 3.98Å; M694-H737 HydrophobicContact CG-CB 4.33Å; D733-H737 PolarHBondContact O-N 3.08Å; D733-H737 PolarHBondContact O-ND1 3.25Å; D733-H737 IonicContact OD1-CE1 2.94Å; D733-H737 PolarHBondContact OD1-CE1 3.33Å; D733-H737 IonicContact OD1-ND1 3.83Å; D733-H737 PolarHBondContact OD1-ND1 3.18Å; A734-H737 PolarHBondContact O-N 3.15Å; H737-K740 PolarHBondContact O-N 3.34Å; H737-L741 WeakPolarHBondContact O-CB 3.5Å; H737-L741 PolarHBondContact O-N 2.96Å; H737-Y945 AromaticContact CD2-CE2 3.7Å; H737-Y945 AromaticContact CD2-CZ 3.92Å; H737-Y945 PolarHBondContact CD2-OH 3.37Å; H737-Y945 AromaticContact NE2-CE2 3.8Å
738A97.9Very high94.3Very high0 Ų020 Ų200%013%0.127CC..Hα-helixtrans-66.2-42177.900000111.8F690 C722 V725 L726 A734 E735 C736 L741 L742F690-A738 HydrophobicContact CE1-CB 3.74Å; F690-A738 HydrophobicContact CZ-CB 3.95Å; C722-A738 HydrophobicContact CB-CB 4.17Å; V725-A738 HydrophobicContact CB-CB 3.97Å; V725-A738 HydrophobicContact CG1-CB 3.82Å; L726-A738 HydrophobicContact CD1-CB 4.37Å; L726-A738 HydrophobicContact CD2-CB 4.32Å; L726-A738 HydrophobicContact CG-CB 3.91Å; A734-A738 WeakPolarHBondContact O-CB 3.34Å; A734-A738 PolarHBondContact O-N 2.88Å; E735-A738 PolarHBondContact O-N 3.45Å; C736-A738 VanDerWaalsContact C-N 3.3Å; C736-A738 PolarHBondContact O-N 3.4Å; A738-L741 PolarHBondContact O-N 2.99Å; A738-L742 WeakPolarHBondContact O-CG 3.48Å; A738-L742 PolarHBondContact O-N 2.61Å; A738-L742 VanDerWaalsContact O-N 3.16Å
739A97.4Very high94.6Very high0 Ų019.1 Ų19.10%012%0.118CC..Hα-helixtrans-63.6-44.2173.600000111.2L726 E735 C736 L741 L742 E743 M781 V785L726-A739 HydrophobicContact CD2-CB 4.44Å; E735-A739 PolarHBondContact O-N 2.96Å; C736-A739 PolarHBondContact O-N 3.32Å; A739-L741 VanDerWaalsContact C-N 3.35Å; A739-L741 PolarHBondContact O-N 3.22Å; A739-L742 PolarHBondContact O-N 2.96Å; A739-E743 PolarHBondContact O-N 3.42Å; A739-M781 HydrophobicContact CB-CB 3.88Å; A739-V785 HydrophobicContact CB-CG2 4.06Å; A739-V785 WeakPolarHBondContact O-CG2 3.11Å
740K97.1Very high95Very high1 Ų116.4 Ų16.40%0.00410%0.095CC..Hα-helixtrans-58.2-44.7175.8-175.460.4178.3178.60111.8M694 C736 H737 L742 E743 V744 M781 H832 Y945M694-K740 HydrophobicContact CE-CG 4.44Å; C736-K740 WeakPolarHBondContact O-CB 3.42Å; C736-K740 PolarHBondContact O-N 3.09Å; H737-K740 PolarHBondContact O-N 3.34Å; K740-L742 PolarHBondContact O-N 2.94Å; K740-E743 WeakPolarHBondContact CD-OE2 3.42Å; K740-E743 IonicContact NZ-OE2 3.02Å; K740-E743 PolarHBondContact NZ-OE2 2.71Å; K740-E743 WeakPolarHBondContact O-CB 3.46Å; K740-E743 PolarHBondContact O-N 2.93Å; K740-V744 HydrophobicContact CD-CG2 4.47Å; K740-V744 HydrophobicContact CG-CG2 4.38Å; K740-V744 WeakPolarHBondContact O-CG2 3.31Å; K740-V744 PolarHBondContact O-N 3.07Å; K740-M781 HydrophobicContact CD-SD 4.41Å; K740-H832 PolarHBondContact NZ-CD2 2.88Å; K740-H832 PolarHBondContact NZ-NE2 3.07Å; K740-Y945 HydrophobicContact CG-CD2 4.32Å
741L97.8Very high95.2Very high0 Ų018.6 Ų18.60%012%0.12CC..Hα-helixtrans-62.7-41.4177.6-16951.5000112.6F690 M694 L697 V701 I718 H737 A738 A739 E743 V744 I745F690-L741 HydrophobicContact CZ-CD2 4.47Å; M694-L741 HydrophobicContact CE-CB 3.65Å; M694-L741 HydrophobicContact CE-CD1 3.8Å; M694-L741 HydrophobicContact CE-CG 4.18Å; M694-L741 HydrophobicContact SD-CB 3.62Å; M694-L741 HydrophobicContact SD-CD1 3.88Å; M694-L741 HydrophobicContact SD-CD2 3.72Å; M694-L741 HydrophobicContact SD-CG 3.92Å; L697-L741 HydrophobicContact CB-CD1 4.48Å; L697-L741 HydrophobicContact CB-CD2 3.73Å; L697-L741 HydrophobicContact CD1-CD2 3.9Å; L697-L741 HydrophobicContact CG-CD2 4.47Å; V701-L741 HydrophobicContact CG2-CD1 4.2Å; I718-L741 HydrophobicContact CG2-CD2 3.6Å; I718-L741 HydrophobicContact CG2-CG 4.11Å; H737-L741 WeakPolarHBondContact O-CB 3.5Å; H737-L741 PolarHBondContact O-N 2.96Å; A738-L741 PolarHBondContact O-N 2.99Å; A739-L741 VanDerWaalsContact C-N 3.35Å; A739-L741 PolarHBondContact O-N 3.22Å; L741-E743 VanDerWaalsContact C-N 3.32Å; L741-E743 PolarHBondContact O-N 3.19Å; L741-V744 PolarHBondContact O-N 2.92Å; L741-I745 HydrophobicContact CG-CD1 4.28Å; L741-I745 WeakPolarHBondContact O-CD1 3.33Å; L741-I745 VanDerWaalsContact O-CG1 3.22Å; L741-I745 WeakPolarHBondContact O-CG1 3.42Å; L741-I745 PolarHBondContact O-N 3.37Å
742L98.2Very high95.4Very high0 Ų021.8 Ų21.80%012%0.121CC..Hα-helixtrans-63-40.7175.3-67-179.3000111.5Y719 C722 L726 A738 A739 K740 I745 I746 F761 V785Y719-L742 HydrophobicContact CD2-CD2 4.12Å; C722-L742 HydrophobicContact CB-CD1 4.26Å; C722-L742 HydrophobicContact CB-CD2 3.84Å; C722-L742 HydrophobicContact CB-CG 3.95Å; L726-L742 HydrophobicContact CD1-CD1 3.69Å; A738-L742 WeakPolarHBondContact O-CG 3.48Å; A738-L742 PolarHBondContact O-N 2.61Å; A738-L742 VanDerWaalsContact O-N 3.16Å; A739-L742 PolarHBondContact O-N 2.96Å; K740-L742 PolarHBondContact O-N 2.94Å; L742-I745 PolarHBondContact O-N 3.3Å; L742-I746 VanDerWaalsContact O-CG1 3.24Å; L742-I746 WeakPolarHBondContact O-CG1 3.42Å; L742-I746 PolarHBondContact O-N 2.95Å; L742-I746 VanDerWaalsContact O-N 3.11Å; L742-F761 HydrophobicContact CD1-CB 4.35Å; L742-F761 HydrophobicContact CD2-CB 4.42Å; L742-F761 HydrophobicContact CD2-CD1 3.82Å; L742-F761 HydrophobicContact CD2-CD2 4.25Å; L742-F761 HydrophobicContact CD2-CE1 4.08Å; L742-F761 HydrophobicContact CD2-CE2 4.48Å; L742-F761 HydrophobicContact CD2-CG 3.92Å; L742-F761 HydrophobicContact CD2-CZ 4.4Å; L742-V785 HydrophobicContact CB-CG1 4.2Å; L742-V785 HydrophobicContact CB-CG2 4.1Å
743E97.2Very high95.2Very high0 Ų022.3 Ų22.30%014%0.135CC..Hα-helixtrans-59.8-51.6173.8-170.4-154.7-162.300111.6A739 K740 L741 I745 I746 L747 Q784 V785 A788 H832 M836A739-E743 PolarHBondContact O-N 3.42Å; K740-E743 WeakPolarHBondContact CD-OE2 3.42Å; K740-E743 IonicContact NZ-OE2 3.02Å; K740-E743 PolarHBondContact NZ-OE2 2.71Å; K740-E743 WeakPolarHBondContact O-CB 3.46Å; K740-E743 PolarHBondContact O-N 2.93Å; L741-E743 VanDerWaalsContact C-N 3.32Å; L741-E743 PolarHBondContact O-N 3.19Å; E743-I745 VanDerWaalsContact C-N 3.28Å; E743-I745 PolarHBondContact O-N 2.83Å; E743-I746 WeakPolarHBondContact O-CB 3.23Å; E743-I746 PolarHBondContact O-N 3.09Å; E743-L747 HydrophobicContact CG-CD1 4.06Å; E743-L747 WeakPolarHBondContact O-CG 3.33Å; E743-L747 PolarHBondContact O-N 3.48Å; E743-Q784 HydrophobicContact CG-CB 4.47Å; E743-V785 HydrophobicContact CB-CG2 4.4Å; E743-A788 HydrophobicContact CG-CB 3.71Å; E743-H832 IonicContact OE1-NE2 3.42Å; E743-H832 PolarHBondContact OE1-NE2 3.03Å; E743-H832 IonicContact OE2-NE2 3.54Å; E743-H832 PolarHBondContact OE2-NE2 3.29Å; E743-M836 WeakPolarHBondContact OE1-CG 3.29Å
744V97.1Very high95.2Very high0 Ų018 Ų180%011%0.112CC..Hα-helixtrans-53.2-46.8177.8172.50000110.3V701 T702 K740 L741 I746 L747 Q748 T947V701-V744 HydrophobicContact CG1-CG1 4Å; T702-V744 HydrophobicContact CG2-CG1 3.8Å; K740-V744 HydrophobicContact CD-CG2 4.47Å; K740-V744 HydrophobicContact CG-CG2 4.38Å; K740-V744 WeakPolarHBondContact O-CG2 3.31Å; K740-V744 PolarHBondContact O-N 3.07Å; L741-V744 PolarHBondContact O-N 2.92Å; V744-I746 PolarHBondContact O-N 2.9Å; V744-L747 PolarHBondContact O-N 3.33Å; V744-Q748 WeakPolarHBondContact O-CB 3.25Å; V744-Q748 PolarHBondContact O-N 3.47Å; V744-T947 HydrophobicContact CB-CG2 4.42Å; V744-T947 HydrophobicContact CG2-CG2 3.84Å
745I97.6Very high95.2Very high0 Ų021.1 Ų21.10%013%0.127CC..Hα-helixtrans-60.4-45.3178-66.7163.2000111.4V701 L715 I718 L741 L742 E743 L747 C749 I754 F761V701-I745 HydrophobicContact CB-CG1 4.42Å; V701-I745 HydrophobicContact CG1-CB 4.43Å; V701-I745 HydrophobicContact CG1-CG1 3.8Å; V701-I745 HydrophobicContact CG2-CD1 4.28Å; V701-I745 HydrophobicContact CG2-CG1 3.68Å; L715-I745 HydrophobicContact CD1-CD1 4.24Å; L715-I745 HydrophobicContact CD1-CG2 3.81Å; I718-I745 HydrophobicContact CG2-CD1 3.84Å; L741-I745 HydrophobicContact CG-CD1 4.28Å; L741-I745 WeakPolarHBondContact O-CD1 3.33Å; L741-I745 VanDerWaalsContact O-CG1 3.22Å; L741-I745 WeakPolarHBondContact O-CG1 3.42Å; L741-I745 PolarHBondContact O-N 3.37Å; L742-I745 PolarHBondContact O-N 3.3Å; E743-I745 VanDerWaalsContact C-N 3.28Å; E743-I745 PolarHBondContact O-N 2.83Å; I745-L747 VanDerWaalsContact C-N 3.32Å; I745-L747 PolarHBondContact O-N 3.49Å; I745-C749 WeakPolarHBondContact O-CB 3.32Å; I745-C749 PolarHBondContact O-N 3.43Å; I745-C749 PolarHBondContact O-SG 3.28Å; I745-I754 HydrophobicContact CG2-CD1 4.33Å; I745-F761 HydrophobicContact CB-CE2 4.24Å; I745-F761 HydrophobicContact CG2-CE2 3.65Å; I745-F761 HydrophobicContact CG2-CZ 4.12Å
746I97.4Very high95.1Very high0 Ų027 Ų270%016%0.155CC..Hα-helixtrans-60.2-45.3179.9-67.5165.7000110.5L742 E743 V744 K750 I758 F761 V785 A788 A789 Y792L742-I746 VanDerWaalsContact O-CG1 3.24Å; L742-I746 WeakPolarHBondContact O-CG1 3.42Å; L742-I746 PolarHBondContact O-N 2.95Å; L742-I746 VanDerWaalsContact O-N 3.11Å; E743-I746 WeakPolarHBondContact O-CB 3.23Å; E743-I746 PolarHBondContact O-N 3.09Å; V744-I746 PolarHBondContact O-N 2.9Å; I746-K750 PolarHBondContact O-N 3.36Å; I746-I758 HydrophobicContact CB-CD1 4.5Å; I746-I758 HydrophobicContact CG1-CD1 3.85Å; I746-I758 HydrophobicContact CG2-CD1 4.19Å; I746-F761 HydrophobicContact CD1-CB 4.37Å; I746-F761 HydrophobicContact CD1-CD2 4.1Å; I746-F761 HydrophobicContact CG1-CD2 3.77Å; I746-F761 HydrophobicContact CG1-CE2 4.38Å; I746-V785 HydrophobicContact CD1-CG1 3.85Å; I746-V785 WeakPolarHBondContact CD1-O 3.3Å; I746-A788 HydrophobicContact CB-CB 4.19Å; I746-A788 HydrophobicContact CD1-CB 4.41Å; I746-A788 HydrophobicContact CG2-CB 3.91Å; I746-A788 WeakPolarHBondContact CG2-O 3.47Å; I746-A789 HydrophobicContact CD1-CB 4.38Å; I746-Y792 HydrophobicContact CG2-CD2 4.11Å; I746-Y792 HydrophobicContact CG2-CG 4.12Å; I746-Y792 WeakPolarHBondContact O-CD2 3.36Å
747L95.4Very high95Very high3 Ų328 Ų282%0.01616%0.162CC..Hα-helixtrans-69.3-52-178.5-65.4175.6000111.2E743 V744 I745 C749 K750 A788 Y791 M836 T947 I948 I949E743-L747 HydrophobicContact CG-CD1 4.06Å; E743-L747 WeakPolarHBondContact O-CG 3.33Å; E743-L747 PolarHBondContact O-N 3.48Å; V744-L747 PolarHBondContact O-N 3.33Å; I745-L747 VanDerWaalsContact C-N 3.32Å; I745-L747 PolarHBondContact O-N 3.49Å; L747-C749 PolarHBondContact O-N 3.41Å; L747-K750 WeakPolarHBondContact O-CB 3.46Å; L747-K750 PolarHBondContact O-N 2.95Å; L747-K750 VanDerWaalsContact O-N 3.17Å; L747-A788 HydrophobicContact CD2-CB 4.06Å; L747-A788 HydrophobicContact CG-CB 4.16Å; L747-Y791 HydrophobicContact CD2-CD1 3.87Å; L747-Y791 HydrophobicContact CD2-CE1 4.37Å; L747-M836 HydrophobicContact CD1-CE 4.09Å; L747-M836 HydrophobicContact CD1-SD 3.8Å; L747-M836 HydrophobicContact CD2-CE 3.83Å; L747-M836 HydrophobicContact CD2-SD 3.92Å; L747-M836 HydrophobicContact CG-CE 4.43Å; L747-T947 HydrophobicContact CD1-CG2 4.09Å; L747-I948 WeakPolarHBondContact O-CD1 3.49Å; L747-I949 HydrophobicContact CD1-CD1 4.4Å; L747-I949 HydrophobicContact CD1-CG1 4.3Å
748Q95Very high95Very high32 Ų3227 Ų2715%0.1516%0.157CC..Hα-helixtrans-59-36.2-179.3-168.867.111.300112.5V701 T702 T705 V744V701-Q748 HydrophobicContact CG1-CB 4.01Å; V701-Q748 HydrophobicContact CG1-CG 4.08Å; V701-Q748 WeakPolarHBondContact O-CG 3.48Å; T702-Q748 PolarHBondContact O-NE2 3.31Å; T705-Q748 HydrophobicContact CG2-CG 3.94Å; T705-Q748 WeakPolarHBondContact OG1-CG 3.46Å; T705-Q748 PolarHBondContact OG1-NE2 2.91Å; T705-Q748 VanDerWaalsContact OG1-NE2 3.15Å; V744-Q748 WeakPolarHBondContact O-CB 3.25Å; V744-Q748 PolarHBondContact O-N 3.47Å
749C94.4Very high94.9Very high0 Ų029 Ų290%017%0.17CC..THydrogen-bonded Turntrans-96.115.4-176.8-61.50000113.5I745 L747 G751 R752 I754I745-C749 WeakPolarHBondContact O-CB 3.32Å; I745-C749 PolarHBondContact O-N 3.43Å; I745-C749 PolarHBondContact O-SG 3.28Å; L747-C749 PolarHBondContact O-N 3.41Å; C749-G751 PolarHBondContact O-N 2.85Å; C749-G751 VanDerWaalsContact O-N 3.15Å; C749-R752 HydrophobicContact CB-CB 4.4Å; C749-R752 VanDerWaalsContact O-CB 3.29Å; C749-R752 WeakPolarHBondContact O-CB 3.29Å; C749-R752 PolarHBondContact O-N 3.09Å; C749-I754 HydrophobicContact CB-CD1 3.53Å; C749-I754 HydrophobicContact CB-CG1 3.85Å; C749-I754 HydrophobicContact CB-CG2 4.02Å
750K92.1Very high94.8Very high80 Ų8032.3 Ų32.335%0.34819%0.187SC..THydrogen-bonded Turntrans-55.7119.1179.9-172.7170.8174.8173.20112.3I746 L747 R752 Y791 Y792I746-K750 PolarHBondContact O-N 3.36Å; L747-K750 WeakPolarHBondContact O-CB 3.46Å; L747-K750 PolarHBondContact O-N 2.95Å; L747-K750 VanDerWaalsContact O-N 3.17Å; K750-R752 VanDerWaalsContact C-N 3.29Å; K750-R752 PolarHBondContact O-N 3.28Å; K750-Y791 HydrophobicContact CD-CD1 4.2Å; K750-Y791 HydrophobicContact CD-CE1 3.94Å; K750-Y791 VanDerWaalsContact CE-O 3.3Å; K750-Y791 WeakPolarHBondContact CE-O 3.23Å; K750-Y791 PolarHBondContact NZ-O 2.94Å; K750-Y792 VanDerWaalsContact CA-CE2 3.5Å; K750-Y792 HydrophobicContact CB-CD2 4.01Å; K750-Y792 HydrophobicContact CB-CE2 4.41Å; K750-Y792 HydrophobicContact CG-CD2 4.02Å
751G88Confident94.8Very high74 Ų7432.3 Ų32.376%0.76319%0.187SC*.THydrogen-bonded Turntrans76.610.4-178.500000114.9C749C749-G751 PolarHBondContact O-N 2.85Å; C749-G751 VanDerWaalsContact O-N 3.15Å
752R92.2Very high94.7Very high105 Ų10532.3 Ų32.340%0.39619%0.187SC..SBendtrans-100.89.5-177.5-53.4-159.964.7-173.9-7.6114.9D706 L709 C749 K750D706-R752 IonicContact OD1-CZ 3.52Å; D706-R752 IonicContact OD1-NH1 2.7Å; D706-R752 PolarHBondContact OD1-NH1 2.92Å; D706-R752 IonicContact OD1-NH2 3.44Å; D706-R752 PolarHBondContact OD1-NH2 3.39Å; L709-R752 HydrophobicContact CD1-CB 3.67Å; L709-R752 HydrophobicContact CD1-CG 4.48Å; C749-R752 HydrophobicContact CB-CB 4.4Å; C749-R752 VanDerWaalsContact O-CB 3.29Å; C749-R752 WeakPolarHBondContact O-CB 3.29Å; C749-R752 PolarHBondContact O-N 3.09Å; K750-R752 VanDerWaalsContact C-N 3.29Å; K750-R752 PolarHBondContact O-N 3.28Å
753G88.1Confident94.6Very high45 Ų4536.1 Ų36.146%0.46421%0.205SC..SBendtrans89.131.1169.800000115.8Q756G753-Q756 PolarHBondContact O-NE2 2.81Å; G753-Q756 PolarHBondContact O-OE1 3.28Å
754I93.4Very high94.4Very high4 Ų436.2 Ų36.22%0.02121%0.206CC..  trans-96.819.1175.962.9155.1000113.3L709 L715 I745 C749 Q756 C757 I758 Y792L709-I754 HydrophobicContact CD2-CG2 3.57Å; L715-I754 HydrophobicContact CD2-CG2 4.15Å; I745-I754 HydrophobicContact CG2-CD1 4.33Å; C749-I754 HydrophobicContact CB-CD1 3.53Å; C749-I754 HydrophobicContact CB-CG1 3.85Å; C749-I754 HydrophobicContact CB-CG2 4.02Å; I754-Q756 PolarHBondContact O-N 3.04Å; I754-Q756 VanDerWaalsContact O-N 3.09Å; I754-C757 HydrophobicContact CB-CB 4.43Å; I754-C757 WeakPolarHBondContact O-CB 3.45Å; I754-C757 PolarHBondContact O-N 3.4Å; I754-I758 HydrophobicContact CD1-CD1 3.8Å; I754-I758 HydrophobicContact CG1-CD1 4.19Å; I754-I758 PolarHBondContact O-N 3.32Å; I754-Y792 HydrophobicContact CD1-CE2 4.27Å; I754-Y792 HydrophobicContact CG1-CE2 3.87Å
755D94.5Very high94.4Very high72 Ų7236.2 Ų36.239%0.38521%0.206SC..THydrogen-bonded Turntrans-53.1-35.8-174.8-708.3000113.1C757 P759 Y792 L796D755-C757 VanDerWaalsContact C-N 3.26Å; D755-C757 PolarHBondContact O-N 2.93Å; D755-P759 WeakPolarHBondContact O-CD 3.18Å; D755-Y792 VanDerWaalsContact OD1-CE1 3.23Å; D755-Y792 WeakPolarHBondContact OD1-CE1 3.33Å; D755-Y792 VanDerWaalsContact OD1-CZ 3.32Å; D755-Y792 PolarHBondContact OD1-OH 3.24Å; D755-L796 HydrophobicContact CB-CD2 3.92Å
756Q93.4Very high94.2Very high130 Ų13036.4 Ų36.461%0.60721%0.207SC*.THydrogen-bonded Turntrans-68.1-21.9177.362.5-813.900114.1G753 I754G753-Q756 PolarHBondContact O-NE2 2.81Å; G753-Q756 PolarHBondContact O-OE1 3.28Å; I754-Q756 PolarHBondContact O-N 3.04Å; I754-Q756 VanDerWaalsContact O-N 3.09Å
757C94.6Very high93.9Very high21 Ų2140.1 Ų40.114%0.14222%0.224CC..THydrogen-bonded Turntrans-87.7-30-179.5-58.50000111.8I754 D755 L760 F761I754-C757 HydrophobicContact CB-CB 4.43Å; I754-C757 WeakPolarHBondContact O-CB 3.45Å; I754-C757 PolarHBondContact O-N 3.4Å; D755-C757 VanDerWaalsContact C-N 3.26Å; D755-C757 PolarHBondContact O-N 2.93Å; C757-L760 WeakPolarHBondContact O-CA 3.49Å; C757-L760 VanDerWaalsContact O-CB 3.32Å; C757-L760 WeakPolarHBondContact O-CB 3.47Å; C757-L760 PolarHBondContact O-N 2.92Å; C757-F761 HydrophobicContact CB-CE1 3.98Å; C757-F761 HydrophobicContact CB-CE2 4.18Å; C757-F761 HydrophobicContact CB-CZ 3.77Å; C757-F761 WeakPolarHBondContact O-CD1 3.4Å; C757-F761 PolarHBondContact O-N 2.89Å; C757-F761 VanDerWaalsContact O-N 3.08Å
758I95.8Very high93.8Very high1 Ų140.7 Ų40.71%0.00523%0.226CC..Hα-helixtrans-53.6-46.6-177.1-55-58000112.9I746 I754 L760 F761 V762 A789 Y792 L796I746-I758 HydrophobicContact CB-CD1 4.5Å; I746-I758 HydrophobicContact CG1-CD1 3.85Å; I746-I758 HydrophobicContact CG2-CD1 4.19Å; I754-I758 HydrophobicContact CD1-CD1 3.8Å; I754-I758 HydrophobicContact CG1-CD1 4.19Å; I754-I758 PolarHBondContact O-N 3.32Å; I758-L760 PolarHBondContact O-N 2.6Å; I758-F761 PolarHBondContact O-N 3.21Å; I758-V762 HydrophobicContact CG2-CG2 4.24Å; I758-V762 WeakPolarHBondContact O-CG2 3.26Å; I758-V762 PolarHBondContact O-N 2.98Å; I758-V762 VanDerWaalsContact O-N 3.08Å; I758-A789 HydrophobicContact CG2-CB 3.69Å; I758-Y792 HydrophobicContact CD1-CD1 4.12Å; I758-Y792 HydrophobicContact CD1-CD2 4.46Å; I758-Y792 HydrophobicContact CD1-CE1 4.2Å; I758-Y792 HydrophobicContact CD1-CE2 4.47Å; I758-Y792 HydrophobicContact CD1-CG 4.31Å; I758-Y792 HydrophobicContact CG1-CD1 4.01Å; I758-Y792 HydrophobicContact CG1-CE1 3.87Å; I758-L796 HydrophobicContact CB-CD2 3.89Å; I758-L796 HydrophobicContact CG1-CD2 3.93Å; I758-L796 HydrophobicContact CG2-CD2 4.23Å
759P96Very high93.6Very high40 Ų4040.7 Ų40.726%0.2623%0.227SC..Hα-helixtrans-58.9-36.9177.2-23.633.6000113.5D755 E763 T800D755-P759 WeakPolarHBondContact O-CD 3.18Å; P759-E763 VanDerWaalsContact O-CB 3.25Å; P759-E763 WeakPolarHBondContact O-CB 3.37Å; P759-E763 PolarHBondContact O-N 3.25Å; P759-T800 HydrophobicContact CB-CG2 3.93Å
760L95.8Very high93.2Very high70 Ų7044.2 Ų44.237%0.36625%0.249SC..Hα-helixtrans-69.8-40.4-179-62.2177.2000111.7Y719 C757 I758 A764Y719-L760 HydrophobicContact CE1-CB 4.29Å; Y719-L760 HydrophobicContact CE1-CD1 4.28Å; Y719-L760 HydrophobicContact CE2-CB 4.14Å; Y719-L760 WeakPolarHBondContact OH-CB 3.27Å; C757-L760 WeakPolarHBondContact O-CA 3.49Å; C757-L760 VanDerWaalsContact O-CB 3.32Å; C757-L760 WeakPolarHBondContact O-CB 3.47Å; C757-L760 PolarHBondContact O-N 2.92Å; I758-L760 PolarHBondContact O-N 2.6Å; L760-A764 PolarHBondContact O-N 3.36Å; L760-A764 VanDerWaalsContact O-N 3.09Å
761F97.1Very high93Very high2 Ų244.7 Ų44.71%0.00925%0.248CC..Hα-helixtrans-67.7-45.6179.1-62.6-3.8000111L715 Y719 L742 I745 I746 C757 I758 A764 A765 V785L715-F761 HydrophobicContact CD1-CZ 4.24Å; Y719-F761 AromaticContact CD2-CD1 3.4Å; Y719-F761 HydrophobicContact CD2-CD1 3.4Å; Y719-F761 VanDerWaalsContact CD2-CD1 3.4Å; Y719-F761 AromaticContact CD2-CE1 3.41Å; Y719-F761 HydrophobicContact CD2-CE1 3.41Å; Y719-F761 VanDerWaalsContact CD2-CE1 3.41Å; Y719-F761 AromaticContact CE2-CD1 3.75Å; Y719-F761 HydrophobicContact CE2-CD1 3.75Å; Y719-F761 HydrophobicContact CE2-CE1 4.16Å; Y719-F761 HydrophobicContact CG-CD1 4.17Å; Y719-F761 AromaticContact CG-CE1 3.73Å; Y719-F761 HydrophobicContact CG-CE1 3.73Å; L742-F761 HydrophobicContact CD1-CB 4.35Å; L742-F761 HydrophobicContact CD2-CB 4.42Å; L742-F761 HydrophobicContact CD2-CD1 3.82Å; L742-F761 HydrophobicContact CD2-CD2 4.25Å; L742-F761 HydrophobicContact CD2-CE1 4.08Å; L742-F761 HydrophobicContact CD2-CE2 4.48Å; L742-F761 HydrophobicContact CD2-CG 3.92Å; L742-F761 HydrophobicContact CD2-CZ 4.4Å; I745-F761 HydrophobicContact CB-CE2 4.24Å; I745-F761 HydrophobicContact CG2-CE2 3.65Å; I745-F761 HydrophobicContact CG2-CZ 4.12Å; I746-F761 HydrophobicContact CD1-CB 4.37Å; I746-F761 HydrophobicContact CD1-CD2 4.1Å; I746-F761 HydrophobicContact CG1-CD2 3.77Å; I746-F761 HydrophobicContact CG1-CE2 4.38Å; C757-F761 HydrophobicContact CB-CE1 3.98Å; C757-F761 HydrophobicContact CB-CE2 4.18Å; C757-F761 HydrophobicContact CB-CZ 3.77Å; C757-F761 WeakPolarHBondContact O-CD1 3.4Å; C757-F761 PolarHBondContact O-N 2.89Å; C757-F761 VanDerWaalsContact O-N 3.08Å; I758-F761 PolarHBondContact O-N 3.21Å; F761-A764 PolarHBondContact O-N 2.98Å; F761-A765 PolarHBondContact O-N 3.03Å; F761-V785 HydrophobicContact CB-CG1 4.3Å
762V96.3Very high93Very high0 Ų048.5 Ų48.50%025%0.246CC..Hα-helixtrans-64.1-41.8177.9173.80000111.3I758 L766 A789 L797 T800 L801 L804I758-V762 HydrophobicContact CG2-CG2 4.24Å; I758-V762 WeakPolarHBondContact O-CG2 3.26Å; I758-V762 PolarHBondContact O-N 2.98Å; I758-V762 VanDerWaalsContact O-N 3.08Å; V762-L766 HydrophobicContact CG1-CD1 3.65Å; V762-L766 HydrophobicContact CG1-CG 4.18Å; V762-L766 WeakPolarHBondContact O-CB 3.45Å; V762-L766 WeakPolarHBondContact O-CG 3.44Å; V762-L766 PolarHBondContact O-N 3.23Å; V762-A789 HydrophobicContact CG2-CB 3.62Å; V762-L797 HydrophobicContact CG1-CD1 3.93Å; V762-L797 HydrophobicContact CG2-CD1 3.85Å; V762-T800 HydrophobicContact CB-CG2 4.35Å; V762-T800 HydrophobicContact CG1-CG2 4.25Å; V762-L801 HydrophobicContact CG1-CD2 3.97Å; V762-L804 HydrophobicContact CG1-CD1 4.26Å
763E94.7Very high92.9Very high79 Ų7945.3 Ų45.337%0.36924%0.238SC..Hα-helixtrans-60.2-48.9176.1-176.2175.2-169.600111.2P759 E767 L804P759-E763 VanDerWaalsContact O-CB 3.25Å; P759-E763 WeakPolarHBondContact O-CB 3.37Å; P759-E763 PolarHBondContact O-N 3.25Å; E763-E767 WeakPolarHBondContact O-CB 3.4Å; E763-E767 PolarHBondContact O-N 3.27Å; E763-L804 HydrophobicContact CB-CD1 4.37Å; E763-L804 HydrophobicContact CB-CD2 3.99Å; E763-L804 HydrophobicContact CG-CD2 3.78Å
764A94.6Very high92.9Very high2 Ų251.3 Ų51.32%0.01725%0.251CS..Hα-helixtrans-61.6-46.5-179.600000112.8Y719 L726 L760 F761 R768Y719-A764 HydrophobicContact CE2-CB 4.44Å; L726-A764 HydrophobicContact CD1-CB 4.25Å; L760-A764 PolarHBondContact O-N 3.36Å; L760-A764 VanDerWaalsContact O-N 3.09Å; F761-A764 PolarHBondContact O-N 2.98Å; A764-R768 PolarHBondContact O-N 3.43Å
765A95.8Very high92.6Very high0 Ų053.7 Ų53.70%027%0.266CS..Hα-helixtrans-68.3-43.1-179.400000112.5F761 R768 V785F761-A765 PolarHBondContact O-N 3.03Å; A765-R768 WeakPolarHBondContact O-CB 3.05Å; A765-R768 PolarHBondContact O-N 3.05Å; A765-V785 HydrophobicContact CB-CB 3.72Å; A765-V785 HydrophobicContact CB-CG1 3.83Å; A765-V785 HydrophobicContact CB-CG2 3.89Å
766L94Very high92.3Very high5 Ų552.8 Ų52.83%0.02627%0.266CS..Hα-helixtrans-78.5-28.8-179.1-62.4-176.8000112.7V762 R768 L769 A786 L801 F806 V813 F817V762-L766 HydrophobicContact CG1-CD1 3.65Å; V762-L766 HydrophobicContact CG1-CG 4.18Å; V762-L766 WeakPolarHBondContact O-CB 3.45Å; V762-L766 WeakPolarHBondContact O-CG 3.44Å; V762-L766 PolarHBondContact O-N 3.23Å; L766-R768 PolarHBondContact O-N 2.88Å; L766-L769 HydrophobicContact CD2-CD1 4Å; L766-L769 WeakPolarHBondContact O-CB 3.43Å; L766-L769 PolarHBondContact O-N 3.22Å; L766-A786 HydrophobicContact CD1-CB 4.33Å; L766-A786 HydrophobicContact CD2-CB 4.2Å; L766-A786 HydrophobicContact CG-CB 4.47Å; L766-L801 HydrophobicContact CD1-CD2 3.61Å; L766-F806 VanDerWaalsContact C-CZ 3.4Å; L766-F806 HydrophobicContact CB-CE2 4.14Å; L766-F806 HydrophobicContact CB-CZ 3.54Å; L766-F806 WeakPolarHBondContact O-CZ 3.34Å; L766-V813 HydrophobicContact CD1-CG1 3.96Å; L766-F817 HydrophobicContact CD2-CD2 4.32Å
767E91.4Very high92.2Very high78 Ų7849.9 Ų49.936%0.36425%0.252SS..Hα-helixtrans-61.2-36.7171-177.3177.3-171.700110.8E763 L769 T770 F806E763-E767 WeakPolarHBondContact O-CB 3.4Å; E763-E767 PolarHBondContact O-N 3.27Å; E767-L769 PolarHBondContact O-N 3.44Å; E767-T770 WeakPolarHBondContact O-CB 2.76Å; E767-T770 WeakPolarHBondContact O-CG2 3.38Å; E767-T770 PolarHBondContact O-N 3.34Å; E767-T770 PolarHBondContact O-OG1 3.44Å; E767-F806 HydrophobicContact CB-CE1 4.04Å
768R92.4Very high92.1Very high14 Ų1448.9 Ų48.95%0.05325%0.246CC..Hα-helixtrans-55.7-37.6175.6175.459.9-168.884.1-3.5112.5L726 E732 E735 A764 A765 L766 T770 R771 E772 L778L726-R768 HydrophobicContact CD2-CB 4.33Å; L726-R768 HydrophobicContact CD2-CG 4.3Å; L726-R768 WeakPolarHBondContact O-CD 3.42Å; E732-R768 IonicContact OE1-NH2 2.66Å; E735-R768 IonicContact OE1-CZ 2.79Å; E735-R768 IonicContact OE1-NE 2.91Å; E735-R768 PolarHBondContact OE1-NE 3.07Å; E735-R768 IonicContact OE1-NH2 2.82Å; E735-R768 IonicContact OE2-CZ 3.34Å; E735-R768 IonicContact OE2-NE 3.39Å; E735-R768 PolarHBondContact OE2-NE 2.9Å; E735-R768 IonicContact OE2-NH2 3.84Å; E735-R768 PolarHBondContact OE2-NH2 3.08Å; A764-R768 PolarHBondContact O-N 3.43Å; A765-R768 WeakPolarHBondContact O-CB 3.05Å; A765-R768 PolarHBondContact O-N 3.05Å; L766-R768 PolarHBondContact O-N 2.88Å; R768-T770 PolarHBondContact O-N 2.72Å; R768-R771 PolarHBondContact O-N 3.45Å; R768-E772 PolarHBondContact NH1-O 3.05Å; R768-E772 PolarHBondContact NH2-O 3.34Å; R768-L778 VanDerWaalsContact NH2-CD2 3.33Å
769L90.4Very high92Very high33 Ų3351.5 Ų51.517%0.17326%0.255CS..THydrogen-bonded Turntrans-69.2-8.4178.9-61.2-179.1000114.2L766 E767 R771 V773 R779 C782 L783L766-L769 HydrophobicContact CD2-CD1 4Å; L766-L769 WeakPolarHBondContact O-CB 3.43Å; L766-L769 PolarHBondContact O-N 3.22Å; E767-L769 PolarHBondContact O-N 3.44Å; L769-R771 VanDerWaalsContact C-N 3.32Å; L769-V773 HydrophobicContact CD2-CG2 4.19Å; L769-R779 HydrophobicContact CD2-CB 4.42Å; L769-R779 HydrophobicContact CD2-CG 4.11Å; L769-C782 HydrophobicContact CD1-CB 3.92Å; L769-C782 HydrophobicContact CD2-CB 3.69Å; L769-C782 HydrophobicContact CG-CB 3.75Å; L769-L783 HydrophobicContact CD1-CD2 4.08Å; L769-L783 HydrophobicContact CD1-CG 4.3Å
770T87.5Confident91.8Very high74 Ų7449.7 Ų49.745%0.45424%0.244SC..THydrogen-bonded Turntrans-81.9-13.6174710000113.3E767 R768 F806E767-T770 WeakPolarHBondContact O-CB 2.76Å; E767-T770 WeakPolarHBondContact O-CG2 3.38Å; E767-T770 PolarHBondContact O-N 3.34Å; E767-T770 PolarHBondContact O-OG1 3.44Å; R768-T770 PolarHBondContact O-N 2.72Å; T770-F806 HydrophobicContact CG2-CB 3.94Å; T770-F806 HydrophobicContact CG2-CD1 3.64Å; T770-F806 HydrophobicContact CG2-CD2 3.83Å; T770-F806 HydrophobicContact CG2-CE1 4.12Å; T770-F806 HydrophobicContact CG2-CE2 4.26Å; T770-F806 HydrophobicContact CG2-CG 3.52Å; T770-F806 HydrophobicContact CG2-CZ 4.42Å
771R88.1Confident91.8Very high89 Ų8946.4 Ų46.434%0.33623%0.226SC..SBendtrans-94.2171.3174.4-56.6-172.7-70.8155.96.4109.6L726 T727 G728 E735 R768 L769 V773L726-R771 VanDerWaalsContact C-NH2 3.33Å; L726-R771 PolarHBondContact O-NH2 2.74Å; T727-R771 PolarHBondContact O-NH1 3.45Å; G728-R771 PolarHBondContact O-NH1 2.83Å; E735-R771 IonicContact OE1-NH2 3.15Å; E735-R771 PolarHBondContact OE1-NH2 3.22Å; R768-R771 PolarHBondContact O-N 3.45Å; L769-R771 VanDerWaalsContact C-N 3.32Å; R771-V773 PolarHBondContact O-N 3.39Å
772E88.1Confident91.7Very high155 Ų15546.3 Ų46.372%0.72423%0.226SC*.  trans-58.6137.9176.2-172176.1-168.900110.8R768R768-E772 PolarHBondContact NH1-O 3.05Å; R768-E772 PolarHBondContact NH2-O 3.34Å
773V88.9Confident91.7Very high38 Ų3846.4 Ų46.423%0.2323%0.226CC..  trans-129.2120.1178177.10000107L769 R771 T775 L778 R779L769-V773 HydrophobicContact CD2-CG2 4.19Å; R771-V773 PolarHBondContact O-N 3.39Å; V773-T775 WeakPolarHBondContact CG1-O 3.24Å; V773-L778 HydrophobicContact CG1-CB 4.33Å; V773-L778 HydrophobicContact CG1-CD2 4.34Å; V773-L778 HydrophobicContact CG1-CG 4.47Å; V773-R779 HydrophobicContact CG1-CB 4.13Å
774K87.4Confident91.7Very high170 Ų17042.7 Ų42.774%0.73921%0.209SC*.  trans-93.7-38.2-176.4-59176.3179.6176.80111.3E732E732-K774 WeakPolarHBondContact OE1-CB 3.46Å; E732-K774 PolarHBondContact OE1-N 2.98Å
775T88.1Confident91.8Very high54 Ų5442.6 Ų42.633%0.33121%0.208SC..  trans-99.7146.4-179.358.20000112.8E732 V773 E777 L778E732-T775 VanDerWaalsContact OE2-CB 3.29Å; E732-T775 WeakPolarHBondContact OE2-CB 3.42Å; E732-T775 WeakPolarHBondContact OE2-CG2 3.38Å; E732-T775 PolarHBondContact OE2-N 3.32Å; E732-T775 PolarHBondContact OE2-OG1 3.42Å; V773-T775 WeakPolarHBondContact CG1-O 3.24Å; T775-E777 VanDerWaalsContact C-N 3.3Å; T775-L778 WeakPolarHBondContact OG1-CB 3.43Å; T775-L778 PolarHBondContact OG1-N 2.86Å
776S88.6Confident91.9Very high54 Ų5442.6 Ų42.638%0.37821%0.208SC..Hα-helixtrans-65.6-35.3168.1440000111.4L778 R779 T780S776-L778 PolarHBondContact O-N 3.1Å; S776-R779 WeakPolarHBondContact O-CA 3.41Å; S776-R779 VanDerWaalsContact O-CB 3.3Å; S776-R779 WeakPolarHBondContact O-CB 3.46Å; S776-R779 PolarHBondContact O-N 3.44Å; S776-R779 VanDerWaalsContact O-N 3.11Å; S776-T780 WeakPolarHBondContact O-CG2 3.49Å; S776-T780 PolarHBondContact O-N 3.17Å; S776-T780 PolarHBondContact O-OG1 3.21Å
777E90.8Very high92Very high69 Ų6942.3 Ų42.332%0.32221%0.207SC..Hα-helixtrans-55.7-53.6-180-172175.3-161.800112.4T775 R779 T780 M781T775-E777 VanDerWaalsContact C-N 3.3Å; E777-R779 PolarHBondContact O-N 2.89Å; E777-T780 WeakPolarHBondContact CA-OG1 3.29Å; E777-T780 PolarHBondContact O-N 2.9Å; E777-T780 PolarHBondContact O-OG1 3.15Å; E777-M781 HydrophobicContact CG-CG 4.42Å; E777-M781 WeakPolarHBondContact O-CG 3.43Å; E777-M781 PolarHBondContact O-N 3.23Å
778L92.7Very high92.3Very high0 Ų038.6 Ų38.60%019%0.19CC..Hα-helixtrans-56.7-39.1177176.160.6000112.2E732 E735 C736 R768 V773 T775 S776 C782E732-L778 HydrophobicContact CB-CB 4.48Å; E732-L778 HydrophobicContact CB-CD2 4.01Å; E732-L778 HydrophobicContact CG-CD2 3.76Å; E735-L778 HydrophobicContact CB-CD1 3.65Å; E735-L778 WeakPolarHBondContact OE2-CD2 3.36Å; C736-L778 WeakPolarHBondContact SG-CA 3.32Å; R768-L778 VanDerWaalsContact NH2-CD2 3.33Å; V773-L778 HydrophobicContact CG1-CB 4.33Å; V773-L778 HydrophobicContact CG1-CD2 4.34Å; V773-L778 HydrophobicContact CG1-CG 4.47Å; T775-L778 WeakPolarHBondContact OG1-CB 3.43Å; T775-L778 PolarHBondContact OG1-N 2.86Å; S776-L778 PolarHBondContact O-N 3.1Å; L778-C782 WeakPolarHBondContact O-CB 3.41Å; L778-C782 PolarHBondContact O-N 2.93Å; L778-C782 VanDerWaalsContact O-N 3.07Å; L778-C782 PolarHBondContact O-SG 2.94Å
779R92.7Very high92.5Very high56 Ų5638 Ų3821%0.21119%0.187CC..Hα-helixtrans-62.7-47.6177.2-167.5162.666.7-105.81.6110.7L769 V773 S776 E777 C782 L783 D824L769-R779 HydrophobicContact CD2-CB 4.42Å; L769-R779 HydrophobicContact CD2-CG 4.11Å; V773-R779 HydrophobicContact CG1-CB 4.13Å; S776-R779 WeakPolarHBondContact O-CA 3.41Å; S776-R779 VanDerWaalsContact O-CB 3.3Å; S776-R779 WeakPolarHBondContact O-CB 3.46Å; S776-R779 PolarHBondContact O-N 3.44Å; S776-R779 VanDerWaalsContact O-N 3.11Å; E777-R779 PolarHBondContact O-N 2.89Å; R779-C782 PolarHBondContact O-N 3.02Å; R779-L783 HydrophobicContact CG-CD1 4.39Å; R779-L783 VanDerWaalsContact O-CG 3.27Å; R779-L783 WeakPolarHBondContact O-CG 3.42Å; R779-L783 PolarHBondContact O-N 3.08Å; R779-L783 VanDerWaalsContact O-N 3.08Å; R779-D824 VanDerWaalsContact CD-OD2 3.26Å; R779-D824 WeakPolarHBondContact CD-OD2 3.48Å; R779-D824 IonicContact CZ-OD1 3.77Å; R779-D824 IonicContact CZ-OD2 2.79Å; R779-D824 IonicContact NE-OD1 2.71Å; R779-D824 PolarHBondContact NE-OD1 2.86Å; R779-D824 IonicContact NE-OD2 2.75Å; R779-D824 PolarHBondContact NE-OD2 2.86Å; R779-D824 IonicContact NH2-OD1 3.06Å; R779-D824 PolarHBondContact NH2-OD1 3.46Å
780T92.7Very high92.7Very high2 Ų236.4 Ų36.41%0.01218%0.179CC..Hα-helixtrans-64.4-44.7179.358.90000112.3S776 E777 C782 L783 Q784 C827 F828S776-T780 WeakPolarHBondContact O-CG2 3.49Å; S776-T780 PolarHBondContact O-N 3.17Å; S776-T780 PolarHBondContact O-OG1 3.21Å; E777-T780 WeakPolarHBondContact CA-OG1 3.29Å; E777-T780 PolarHBondContact O-N 2.9Å; E777-T780 PolarHBondContact O-OG1 3.15Å; T780-C782 PolarHBondContact O-N 3.13Å; T780-L783 CarbonylContact O-C 3.59Å; T780-L783 WeakPolarHBondContact O-CB 3.46Å; T780-L783 PolarHBondContact O-N 3.08Å; T780-L783 VanDerWaalsContact O-N 3.12Å; T780-Q784 WeakPolarHBondContact O-CG 3.38Å; T780-Q784 PolarHBondContact O-N 3.4Å; T780-C827 HydrophobicContact CG2-CB 3.66Å; T780-C827 WeakPolarHBondContact CG2-O 3.39Å; T780-F828 HydrophobicContact CG2-CD2 4.21Å; T780-F828 HydrophobicContact CG2-CE2 4.16Å; T780-F828 HydrophobicContact CG2-CZ 4.48Å
781M94.6Very high93Very high1 Ų134.9 Ų34.91%0.00517%0.165CC..Hα-helixtrans-60.8-43.6177.4-68.1-61.4111.400112.2C736 A739 K740 E777 L783 Q784 V785 D833 L942C736-M781 HydrophobicContact CB-CG 4.17Å; A739-M781 HydrophobicContact CB-CB 3.88Å; K740-M781 HydrophobicContact CD-SD 4.41Å; E777-M781 HydrophobicContact CG-CG 4.42Å; E777-M781 WeakPolarHBondContact O-CG 3.43Å; E777-M781 PolarHBondContact O-N 3.23Å; M781-L783 VanDerWaalsContact C-N 3.32Å; M781-L783 PolarHBondContact O-N 3.31Å; M781-Q784 VanDerWaalsContact CE-CD 3.49Å; M781-Q784 WeakPolarHBondContact O-CB 3.37Å; M781-Q784 PolarHBondContact O-N 3.22Å; M781-Q784 PolarHBondContact SD-OE1 2.94Å; M781-V785 PolarHBondContact O-N 2.81Å; M781-D833 WeakPolarHBondContact CE-OD1 3.39Å; M781-L942 HydrophobicContact CG-CD1 3.91Å; M781-L942 HydrophobicContact SD-CD1 3.72Å
782C95.8Very high93.3Very high0 Ų031.7 Ų31.70%015%0.153CC..Hα-helixtrans-63.9-37.8175.5-69.30000112.4L769 L778 R779 T780L769-C782 HydrophobicContact CD1-CB 3.92Å; L769-C782 HydrophobicContact CD2-CB 3.69Å; L769-C782 HydrophobicContact CG-CB 3.75Å; L778-C782 WeakPolarHBondContact O-CB 3.41Å; L778-C782 PolarHBondContact O-N 2.93Å; L778-C782 VanDerWaalsContact O-N 3.07Å; L778-C782 PolarHBondContact O-SG 2.94Å; R779-C782 PolarHBondContact O-N 3.02Å; T780-C782 PolarHBondContact O-N 3.13Å
783L95.8Very high93.6Very high2 Ų226.6 Ų26.61%0.0113%0.131CC..Hα-helixtrans-67-38.6174.1-69.4172.3000111.1L769 R779 T780 M781 V785 A786 I787 F817 Q820 D824 F828L769-L783 HydrophobicContact CD1-CD2 4.08Å; L769-L783 HydrophobicContact CD1-CG 4.3Å; R779-L783 HydrophobicContact CG-CD1 4.39Å; R779-L783 VanDerWaalsContact O-CG 3.27Å; R779-L783 WeakPolarHBondContact O-CG 3.42Å; R779-L783 PolarHBondContact O-N 3.08Å; R779-L783 VanDerWaalsContact O-N 3.08Å; T780-L783 CarbonylContact O-C 3.59Å; T780-L783 WeakPolarHBondContact O-CB 3.46Å; T780-L783 PolarHBondContact O-N 3.08Å; T780-L783 VanDerWaalsContact O-N 3.12Å; M781-L783 VanDerWaalsContact C-N 3.32Å; M781-L783 PolarHBondContact O-N 3.31Å; L783-V785 VanDerWaalsContact C-N 3.31Å; L783-V785 PolarHBondContact O-N 2.89Å; L783-A786 WeakPolarHBondContact O-CA 3.36Å; L783-A786 WeakPolarHBondContact O-CB 3.43Å; L783-A786 PolarHBondContact O-N 2.98Å; L783-I787 HydrophobicContact CB-CD1 4.37Å; L783-I787 VanDerWaalsContact O-CG1 3.25Å; L783-I787 WeakPolarHBondContact O-CG1 3.28Å; L783-I787 PolarHBondContact O-N 3.22Å; L783-F817 HydrophobicContact CD2-CD2 3.7Å; L783-F817 HydrophobicContact CD2-CE2 3.81Å; L783-Q820 HydrophobicContact CD1-CG 4.49Å; L783-D824 HydrophobicContact CD1-CB 4.35Å; L783-F828 HydrophobicContact CB-CZ 4.35Å
784Q95.7Very high93.8Very high0 Ų026.5 Ų26.50%013%0.131CC..Hα-helixtrans-58.7-38.1177.9-79-179-11.200113.2E743 T780 M781 A786 I787 A788 F828 D833E743-Q784 HydrophobicContact CG-CB 4.47Å; T780-Q784 WeakPolarHBondContact O-CG 3.38Å; T780-Q784 PolarHBondContact O-N 3.4Å; M781-Q784 VanDerWaalsContact CE-CD 3.49Å; M781-Q784 WeakPolarHBondContact O-CB 3.37Å; M781-Q784 PolarHBondContact O-N 3.22Å; M781-Q784 PolarHBondContact SD-OE1 2.94Å; Q784-A786 VanDerWaalsContact C-N 3.26Å; Q784-A786 PolarHBondContact O-N 3.48Å; Q784-I787 CarbonylContact O-C 3.45Å; Q784-I787 PolarHBondContact O-N 3.03Å; Q784-I787 VanDerWaalsContact O-N 3.09Å; Q784-A788 WeakPolarHBondContact O-CB 3.27Å; Q784-A788 PolarHBondContact O-N 3.29Å; Q784-F828 HydrophobicContact CG-CD1 4.48Å; Q784-F828 HydrophobicContact CG-CE1 3.75Å; Q784-D833 PolarHBondContact NE2-OD1 3.02Å
785V97.4Very high94.1Very high0 Ų024.1 Ų24.10%012%0.122CC..Hα-helixtrans-56.2-43.5173.3178.80000111.3A739 L742 E743 I746 F761 A765 M781 L783 A789A739-V785 HydrophobicContact CB-CG2 4.06Å; A739-V785 WeakPolarHBondContact O-CG2 3.11Å; L742-V785 HydrophobicContact CB-CG1 4.2Å; L742-V785 HydrophobicContact CB-CG2 4.1Å; E743-V785 HydrophobicContact CB-CG2 4.4Å; I746-V785 HydrophobicContact CD1-CG1 3.85Å; I746-V785 WeakPolarHBondContact CD1-O 3.3Å; F761-V785 HydrophobicContact CB-CG1 4.3Å; A765-V785 HydrophobicContact CB-CB 3.72Å; A765-V785 HydrophobicContact CB-CG1 3.83Å; A765-V785 HydrophobicContact CB-CG2 3.89Å; M781-V785 PolarHBondContact O-N 2.81Å; L783-V785 VanDerWaalsContact C-N 3.31Å; L783-V785 PolarHBondContact O-N 2.89Å; V785-A789 WeakPolarHBondContact O-CB 3.38Å; V785-A789 PolarHBondContact O-N 3.04Å
786A96.4Very high94.3Very high0 Ų023.2 Ų23.20%012%0.115CC..Hα-helixtrans-72.3-35.3176.600000112.4L766 L783 Q784 A789 L790 L797 F817L766-A786 HydrophobicContact CD1-CB 4.33Å; L766-A786 HydrophobicContact CD2-CB 4.2Å; L766-A786 HydrophobicContact CG-CB 4.47Å; L783-A786 WeakPolarHBondContact O-CA 3.36Å; L783-A786 WeakPolarHBondContact O-CB 3.43Å; L783-A786 PolarHBondContact O-N 2.98Å; Q784-A786 VanDerWaalsContact C-N 3.26Å; Q784-A786 PolarHBondContact O-N 3.48Å; A786-A789 PolarHBondContact O-N 3.22Å; A786-L790 PolarHBondContact O-N 3.27Å; A786-L797 WeakPolarHBondContact O-CD2 3.38Å; A786-F817 HydrophobicContact CB-CD2 4.04Å; A786-F817 HydrophobicContact CB-CE1 4.47Å; A786-F817 HydrophobicContact CB-CE2 3.43Å; A786-F817 VanDerWaalsContact CB-CE2 3.43Å; A786-F817 HydrophobicContact CB-CZ 3.69Å
787I96.6Very high94.6Very high0 Ų020.7 Ų20.70%010%0.097CC..Hα-helixtrans-66.1-42.4175.5-64.9167000110.9L783 Q784 L790 Y791 F817 W821 F828 M836L783-I787 HydrophobicContact CB-CD1 4.37Å; L783-I787 VanDerWaalsContact O-CG1 3.25Å; L783-I787 WeakPolarHBondContact O-CG1 3.28Å; L783-I787 PolarHBondContact O-N 3.22Å; Q784-I787 CarbonylContact O-C 3.45Å; Q784-I787 PolarHBondContact O-N 3.03Å; Q784-I787 VanDerWaalsContact O-N 3.09Å; I787-L790 VanDerWaalsContact O-CB 3.3Å; I787-L790 WeakPolarHBondContact O-CB 3.44Å; I787-L790 PolarHBondContact O-N 2.8Å; I787-L790 VanDerWaalsContact O-N 3.17Å; I787-Y791 PolarHBondContact O-N 3.36Å; I787-F817 HydrophobicContact CG1-CE2 4.46Å; I787-F817 HydrophobicContact CG1-CZ 4.07Å; I787-W821 HydrophobicContact CD1-CD2 4.04Å; I787-W821 VanDerWaalsContact CD1-CE2 3.47Å; I787-W821 HydrophobicContact CD1-CG 4.21Å; I787-W821 HydrophobicContact CD1-CZ2 3.84Å; I787-W821 VanDerWaalsContact CD1-NE1 3.3Å; I787-W821 HydrophobicContact CG1-CD2 4.05Å; I787-W821 HydrophobicContact CG1-CE3 4.4Å; I787-W821 HydrophobicContact CG1-CH2 4.12Å; I787-W821 HydrophobicContact CG1-CZ2 3.76Å; I787-W821 HydrophobicContact CG1-CZ3 4.43Å; I787-W821 HydrophobicContact CG2-CH2 4.39Å; I787-W821 HydrophobicContact CG2-CZ2 4.07Å; I787-F828 HydrophobicContact CD1-CE1 3.81Å; I787-F828 HydrophobicContact CD1-CZ 3.68Å; I787-M836 HydrophobicContact CG2-CE 4.35Å; I787-M836 WeakPolarHBondContact CG2-O 3.42Å
788A96.7Very high94.6Very high0 Ų018.9 Ų18.90%09%0.09CC..Hα-helixtrans-62-42.5172.500000111.4E743 I746 L747 Q784 L790 Y791 Y792 M836E743-A788 HydrophobicContact CG-CB 3.71Å; I746-A788 HydrophobicContact CB-CB 4.19Å; I746-A788 HydrophobicContact CD1-CB 4.41Å; I746-A788 HydrophobicContact CG2-CB 3.91Å; I746-A788 WeakPolarHBondContact CG2-O 3.47Å; L747-A788 HydrophobicContact CD2-CB 4.06Å; L747-A788 HydrophobicContact CG-CB 4.16Å; Q784-A788 WeakPolarHBondContact O-CB 3.27Å; Q784-A788 PolarHBondContact O-N 3.29Å; A788-L790 VanDerWaalsContact C-N 3.28Å; A788-L790 PolarHBondContact O-N 3.08Å; A788-Y791 CarbonylContact O-C 3.42Å; A788-Y791 PolarHBondContact O-N 2.85Å; A788-Y792 VanDerWaalsContact O-CB 3.29Å; A788-Y792 WeakPolarHBondContact O-CB 3.47Å; A788-Y792 PolarHBondContact O-N 3.33Å; A788-M836 HydrophobicContact CB-CE 3.69Å
789A96.8Very high94.6Very high0 Ų023.6 Ų23.60%012%0.115CC..Hα-helixtrans-62.5-35.1173.700000112.6I746 I758 V762 V785 A786 Y792 N793 L797I746-A789 HydrophobicContact CD1-CB 4.38Å; I758-A789 HydrophobicContact CG2-CB 3.69Å; V762-A789 HydrophobicContact CG2-CB 3.62Å; V785-A789 WeakPolarHBondContact O-CB 3.38Å; V785-A789 PolarHBondContact O-N 3.04Å; A786-A789 PolarHBondContact O-N 3.22Å; A789-Y792 PolarHBondContact O-N 2.93Å; A789-N793 PolarHBondContact O-N 3.43Å; A789-L797 HydrophobicContact CB-CD1 3.96Å
790L95.2Very high94.6Very high1 Ų121.5 Ų21.51%0.00511%0.109CC..Hα-helixtrans-65.5-47.4174.7-176.759.1000110.2A786 I787 A788 Y792 P794 L797 W821 G840 A843 L844 M847A786-L790 PolarHBondContact O-N 3.27Å; I787-L790 VanDerWaalsContact O-CB 3.3Å; I787-L790 WeakPolarHBondContact O-CB 3.44Å; I787-L790 PolarHBondContact O-N 2.8Å; I787-L790 VanDerWaalsContact O-N 3.17Å; A788-L790 VanDerWaalsContact C-N 3.28Å; A788-L790 PolarHBondContact O-N 3.08Å; L790-Y792 VanDerWaalsContact C-N 3.29Å; L790-Y792 PolarHBondContact O-N 3.32Å; L790-P794 HydrophobicContact CD1-CB 3.9Å; L790-P794 HydrophobicContact CD1-CG 4.44Å; L790-P794 VanDerWaalsContact O-CD 3.23Å; L790-P794 WeakPolarHBondContact O-CD 3.42Å; L790-P794 VanDerWaalsContact O-CG 3.27Å; L790-P794 WeakPolarHBondContact O-CG 3.45Å; L790-L797 HydrophobicContact CB-CD2 3.44Å; L790-L797 VanDerWaalsContact CB-CD2 3.44Å; L790-L797 HydrophobicContact CD1-CD2 4.01Å; L790-L797 HydrophobicContact CG-CD2 4.22Å; L790-W821 HydrophobicContact CD2-CH2 3.97Å; L790-W821 HydrophobicContact CD2-CZ3 3.82Å; L790-G840 WeakPolarHBondContact CD2-O 3.35Å; L790-A843 HydrophobicContact CG-CB 4.08Å; L790-L844 HydrophobicContact CD1-CD1 4.39Å; L790-L844 HydrophobicContact CD2-CB 3.87Å; L790-L844 HydrophobicContact CD2-CD1 3.76Å; L790-L844 HydrophobicContact CD2-CG 4.35Å; L790-M847 HydrophobicContact CD1-SD 4.42Å
791Y94.3Very high94.6Very high42 Ų4221.5 Ų21.517%0.16511%0.108CC..Hα-helixtrans-64.8-32.4176.3179.4-111.7000112.6L747 K750 I787 A788 L839 I949L747-Y791 HydrophobicContact CD2-CD1 3.87Å; L747-Y791 HydrophobicContact CD2-CE1 4.37Å; K750-Y791 HydrophobicContact CD-CD1 4.2Å; K750-Y791 HydrophobicContact CD-CE1 3.94Å; K750-Y791 VanDerWaalsContact CE-O 3.3Å; K750-Y791 WeakPolarHBondContact CE-O 3.23Å; K750-Y791 PolarHBondContact NZ-O 2.94Å; I787-Y791 PolarHBondContact O-N 3.36Å; A788-Y791 CarbonylContact O-C 3.42Å; A788-Y791 PolarHBondContact O-N 2.85Å; Y791-L839 HydrophobicContact CD2-CB 4.04Å; Y791-L839 HydrophobicContact CE2-CB 4.23Å; Y791-L839 HydrophobicContact CE2-CD1 4.44Å; Y791-L839 HydrophobicContact CE2-CD2 4.39Å; Y791-I949 HydrophobicContact CE1-CG2 4.36Å
792Y94.6Very high94.3Very high22 Ų2225.3 Ų25.39%0.08613%0.126CC..Hα-helixtrans-67-56.7176.1175.8-85000111.5I746 K750 I754 D755 I758 A788 A789 L790 L796I746-Y792 HydrophobicContact CG2-CD2 4.11Å; I746-Y792 HydrophobicContact CG2-CG 4.12Å; I746-Y792 WeakPolarHBondContact O-CD2 3.36Å; K750-Y792 VanDerWaalsContact CA-CE2 3.5Å; K750-Y792 HydrophobicContact CB-CD2 4.01Å; K750-Y792 HydrophobicContact CB-CE2 4.41Å; K750-Y792 HydrophobicContact CG-CD2 4.02Å; I754-Y792 HydrophobicContact CD1-CE2 4.27Å; I754-Y792 HydrophobicContact CG1-CE2 3.87Å; D755-Y792 VanDerWaalsContact OD1-CE1 3.23Å; D755-Y792 WeakPolarHBondContact OD1-CE1 3.33Å; D755-Y792 VanDerWaalsContact OD1-CZ 3.32Å; D755-Y792 PolarHBondContact OD1-OH 3.24Å; I758-Y792 HydrophobicContact CD1-CD1 4.12Å; I758-Y792 HydrophobicContact CD1-CD2 4.46Å; I758-Y792 HydrophobicContact CD1-CE1 4.2Å; I758-Y792 HydrophobicContact CD1-CE2 4.47Å; I758-Y792 HydrophobicContact CD1-CG 4.31Å; I758-Y792 HydrophobicContact CG1-CD1 4.01Å; I758-Y792 HydrophobicContact CG1-CE1 3.87Å; A788-Y792 VanDerWaalsContact O-CB 3.29Å; A788-Y792 WeakPolarHBondContact O-CB 3.47Å; A788-Y792 PolarHBondContact O-N 3.33Å; A789-Y792 PolarHBondContact O-N 2.93Å; L790-Y792 VanDerWaalsContact C-N 3.29Å; L790-Y792 PolarHBondContact O-N 3.32Å; Y792-L796 HydrophobicContact CE1-CD2 4.36Å
793N94.1Very high93.9Very high48 Ų4830.8 Ų30.826%0.25716%0.156SC..  trans-157.1100.5179.5-175.6-22.7000111.1A789 H795 L796 L797A789-N793 PolarHBondContact O-N 3.43Å; N793-H795 VanDerWaalsContact C-N 3.32Å; N793-H795 PolarHBondContact O-N 2.9Å; N793-H795 PolarHBondContact OD1-N 3.11Å; N793-L796 HydrophobicContact CB-CB 3.87Å; N793-L796 HydrophobicContact CB-CD2 4.5Å; N793-L796 PolarHBondContact O-N 3.46Å; N793-L796 VanDerWaalsContact O-N 3.17Å; N793-L796 PolarHBondContact OD1-N 2.91Å; N793-L797 PolarHBondContact O-N 3.4Å; N793-L797 VanDerWaalsContact O-N 3.08Å
794P93Very high93.5Very high36 Ų3631.8 Ų31.823%0.23416%0.161CC..Hα-helixtrans-59.9-37.8-175.3-24.530.8000114.6L790 L798 A843 M847L790-P794 HydrophobicContact CD1-CB 3.9Å; L790-P794 HydrophobicContact CD1-CG 4.44Å; L790-P794 VanDerWaalsContact O-CD 3.23Å; L790-P794 WeakPolarHBondContact O-CD 3.42Å; L790-P794 VanDerWaalsContact O-CG 3.27Å; L790-P794 WeakPolarHBondContact O-CG 3.45Å; P794-L798 WeakPolarHBondContact O-CB 3.26Å; P794-L798 WeakPolarHBondContact O-CG 3.36Å; P794-L798 PolarHBondContact O-N 3.41Å; P794-A843 HydrophobicContact CG-CB 4.45Å; P794-M847 HydrophobicContact CB-CG 4.2Å; P794-M847 HydrophobicContact CB-SD 4.12Å
795H92.5Very high92.9Very high119 Ų11937.3 Ų37.355%0.55118%0.182SC*.Hα-helixtrans-68.7-38-179.9-67.7-62.6000112.1N793 N799N793-H795 VanDerWaalsContact C-N 3.32Å; N793-H795 PolarHBondContact O-N 2.9Å; N793-H795 PolarHBondContact OD1-N 3.11Å; H795-N799 WeakPolarHBondContact O-CB 3.45Å; H795-N799 PolarHBondContact O-N 3.31Å; H795-N799 VanDerWaalsContact O-N 3.13Å
796L94Very high92Very high35 Ų3538.5 Ų38.518%0.18319%0.187CC..Hα-helixtrans-66.3-48.7176.8179.158.9000110.6D755 I758 Y792 N793 L798 N799 T800D755-L796 HydrophobicContact CB-CD2 3.92Å; I758-L796 HydrophobicContact CB-CD2 3.89Å; I758-L796 HydrophobicContact CG1-CD2 3.93Å; I758-L796 HydrophobicContact CG2-CD2 4.23Å; Y792-L796 HydrophobicContact CE1-CD2 4.36Å; N793-L796 HydrophobicContact CB-CB 3.87Å; N793-L796 HydrophobicContact CB-CD2 4.5Å; N793-L796 PolarHBondContact O-N 3.46Å; N793-L796 VanDerWaalsContact O-N 3.17Å; N793-L796 PolarHBondContact OD1-N 2.91Å; L796-L798 PolarHBondContact O-N 3.06Å; L796-N799 PolarHBondContact O-N 3.48Å; L796-T800 PolarHBondContact O-N 3.4Å; L796-T800 PolarHBondContact O-OG1 2.89Å
797L94.5Very high90.8Very high1 Ų143.1 Ų43.11%0.00522%0.217CC..Hα-helixtrans-60.5-47.9178.3178.167.1000111.8V762 A786 A789 L790 N793 N799 T800 L801V762-L797 HydrophobicContact CG1-CD1 3.93Å; V762-L797 HydrophobicContact CG2-CD1 3.85Å; A786-L797 WeakPolarHBondContact O-CD2 3.38Å; A789-L797 HydrophobicContact CB-CD1 3.96Å; L790-L797 HydrophobicContact CB-CD2 3.44Å; L790-L797 VanDerWaalsContact CB-CD2 3.44Å; L790-L797 HydrophobicContact CD1-CD2 4.01Å; L790-L797 HydrophobicContact CG-CD2 4.22Å; N793-L797 PolarHBondContact O-N 3.4Å; N793-L797 VanDerWaalsContact O-N 3.08Å; L797-N799 VanDerWaalsContact C-N 3.28Å; L797-N799 PolarHBondContact O-N 3.14Å; L797-T800 CarbonylContact O-C 3.3Å; L797-T800 WeakPolarHBondContact O-CA 3.47Å; L797-T800 WeakPolarHBondContact O-CB 3.21Å; L797-T800 PolarHBondContact O-N 3.11Å; L797-L801 HydrophobicContact CD1-CD1 4Å; L797-L801 HydrophobicContact CD1-CD2 4.15Å; L797-L801 HydrophobicContact CD1-CG 3.8Å; L797-L801 HydrophobicContact CD2-CD1 4.13Å; L797-L801 HydrophobicContact CG-CD1 3.8Å; L797-L801 HydrophobicContact CG-CG 4.01Å; L797-L801 WeakPolarHBondContact O-CG 3.42Å; L797-L801 PolarHBondContact O-N 2.93Å
798L91.5Very high89.5Confident31 Ų3151.1 Ų51.116%0.16226%0.26CS..Hα-helixtrans-57.4-44.6179.1-78.2-178.1000111.4P794 L796 T800 L801 E802 T814 M847 P851P794-L798 WeakPolarHBondContact O-CB 3.26Å; P794-L798 WeakPolarHBondContact O-CG 3.36Å; P794-L798 PolarHBondContact O-N 3.41Å; L796-L798 PolarHBondContact O-N 3.06Å; L798-T800 VanDerWaalsContact C-N 3.31Å; L798-T800 PolarHBondContact O-N 3.11Å; L798-L801 PolarHBondContact O-N 3.01Å; L798-E802 WeakPolarHBondContact O-CB 3.28Å; L798-E802 VanDerWaalsContact O-CG 3.26Å; L798-E802 WeakPolarHBondContact O-CG 3.41Å; L798-E802 PolarHBondContact O-N 3.41Å; L798-T814 HydrophobicContact CD2-CG2 4.24Å; L798-M847 HydrophobicContact CD1-CE 4.15Å; L798-M847 HydrophobicContact CD1-SD 3.44Å; L798-M847 WeakPolarHBondContact CD1-SD 3.45Å; L798-M847 HydrophobicContact CD2-CE 4.5Å; L798-M847 HydrophobicContact CD2-SD 4.43Å; L798-M847 HydrophobicContact CG-SD 4.02Å; L798-P851 HydrophobicContact CD1-CG 4.44Å; L798-P851 HydrophobicContact CD2-CG 4Å
799N91.9Very high88.2Confident99 Ų9955.8 Ų55.853%0.52928%0.284SS..Hα-helixtrans-63-39176.5-171.528.5000111.7H795 L796 L797 N803H795-N799 WeakPolarHBondContact O-CB 3.45Å; H795-N799 PolarHBondContact O-N 3.31Å; H795-N799 VanDerWaalsContact O-N 3.13Å; L796-N799 PolarHBondContact O-N 3.48Å; L797-N799 VanDerWaalsContact C-N 3.28Å; L797-N799 PolarHBondContact O-N 3.14Å; N799-N803 PolarHBondContact O-N 3.08Å; N799-N803 PolarHBondContact O-ND2 3.01Å; N799-N803 PolarHBondContact OD1-ND2 3.23Å
800T92.7Very high87Confident12 Ų1262.4 Ų62.47%0.07433%0.325CS..Hα-helixtrans-60.5-53.7174.2-62.20000111.5P759 V762 L796 L797 L798 E802 N803 L804P759-T800 HydrophobicContact CB-CG2 3.93Å; V762-T800 HydrophobicContact CB-CG2 4.35Å; V762-T800 HydrophobicContact CG1-CG2 4.25Å; L796-T800 PolarHBondContact O-N 3.4Å; L796-T800 PolarHBondContact O-OG1 2.89Å; L797-T800 CarbonylContact O-C 3.3Å; L797-T800 WeakPolarHBondContact O-CA 3.47Å; L797-T800 WeakPolarHBondContact O-CB 3.21Å; L797-T800 PolarHBondContact O-N 3.11Å; L798-T800 VanDerWaalsContact C-N 3.31Å; L798-T800 PolarHBondContact O-N 3.11Å; T800-E802 VanDerWaalsContact C-N 3.31Å; T800-E802 PolarHBondContact O-N 3.12Å; T800-N803 PolarHBondContact O-N 2.84Å; T800-L804 HydrophobicContact CG2-CD1 3.72Å; T800-L804 HydrophobicContact CG2-CG 4.25Å; T800-L804 WeakPolarHBondContact O-CG 3.3Å; T800-L804 PolarHBondContact O-N 2.93Å
801L92.1Very high86.3Confident2 Ų268.1 Ų68.11%0.0135%0.351CS..Hα-helixtrans-63.3-35-178.7-64.1179.3000112.7V762 L766 L797 L798 N803 V813 T814 F817V762-L801 HydrophobicContact CG1-CD2 3.97Å; L766-L801 HydrophobicContact CD1-CD2 3.61Å; L797-L801 HydrophobicContact CD1-CD1 4Å; L797-L801 HydrophobicContact CD1-CD2 4.15Å; L797-L801 HydrophobicContact CD1-CG 3.8Å; L797-L801 HydrophobicContact CD2-CD1 4.13Å; L797-L801 HydrophobicContact CG-CD1 3.8Å; L797-L801 HydrophobicContact CG-CG 4.01Å; L797-L801 WeakPolarHBondContact O-CG 3.42Å; L797-L801 PolarHBondContact O-N 2.93Å; L798-L801 PolarHBondContact O-N 3.01Å; L801-N803 VanDerWaalsContact C-N 3.25Å; L801-N803 PolarHBondContact O-N 2.95Å; L801-V813 HydrophobicContact CD2-CG1 4.22Å; L801-V813 PolarHBondContact O-N 3Å; L801-T814 WeakPolarHBondContact CB-OG1 3.41Å; L801-F817 HydrophobicContact CD1-CD1 3.71Å; L801-F817 HydrophobicContact CD1-CE1 4.31Å; L801-F817 HydrophobicContact CD1-CG 4.32Å
802E88.7Confident85.7Confident81 Ų8167.3 Ų67.338%0.37935%0.351SS..Hα-helixtrans-69.3-21.6175.5-75.5-57.5141.600113.4L798 T800 R805 P812 T814L798-E802 WeakPolarHBondContact O-CB 3.28Å; L798-E802 VanDerWaalsContact O-CG 3.26Å; L798-E802 WeakPolarHBondContact O-CG 3.41Å; L798-E802 PolarHBondContact O-N 3.41Å; T800-E802 VanDerWaalsContact C-N 3.31Å; T800-E802 PolarHBondContact O-N 3.12Å; E802-R805 VanDerWaalsContact O-CZ 3.3Å; E802-R805 PolarHBondContact O-NH1 3.24Å; E802-R805 PolarHBondContact O-NH2 3.32Å; E802-P812 WeakPolarHBondContact OE2-CG 3.27Å; E802-T814 WeakPolarHBondContact OE1-CB 3.5Å; E802-T814 PolarHBondContact OE1-OG1 3.42Å
803N88.5Confident85.4Confident116 Ų11666.5 Ų66.562%0.6235%0.349SS*.Hα-helixtrans-99.1-21.1177.8-69.9-49.7000113.4N799 T800 L801N799-N803 PolarHBondContact O-N 3.08Å; N799-N803 PolarHBondContact O-ND2 3.01Å; N799-N803 PolarHBondContact OD1-ND2 3.23Å; T800-N803 PolarHBondContact O-N 2.84Å; L801-N803 VanDerWaalsContact C-N 3.25Å; L801-N803 PolarHBondContact O-N 2.95Å
804L87.4Confident85.1Confident22 Ų2264.2 Ų64.212%0.11534%0.337CS..  trans-75.1136.8176-73.8172.8000111.8V762 E763 T800 V813V762-L804 HydrophobicContact CG1-CD1 4.26Å; E763-L804 HydrophobicContact CB-CD1 4.37Å; E763-L804 HydrophobicContact CB-CD2 3.99Å; E763-L804 HydrophobicContact CG-CD2 3.78Å; T800-L804 HydrophobicContact CG2-CD1 3.72Å; T800-L804 HydrophobicContact CG2-CG 4.25Å; T800-L804 WeakPolarHBondContact O-CG 3.3Å; T800-L804 PolarHBondContact O-N 2.93Å; L804-V813 HydrophobicContact CB-CB 4.37Å; L804-V813 HydrophobicContact CB-CG2 3.91Å; L804-V813 WeakPolarHBondContact O-CG2 3.48Å
805R83.1Confident84.8Confident117 Ų11764.9 Ų64.944%0.44234%0.338SS..  trans-137.9120.1174.9-64.5-65.8179.2-71.4-5109.2E802 V810 E811E802-R805 VanDerWaalsContact O-CZ 3.3Å; E802-R805 PolarHBondContact O-NH1 3.24Å; E802-R805 PolarHBondContact O-NH2 3.32Å; R805-V810 PolarHBondContact NE-O 3.15Å; R805-E811 WeakPolarHBondContact CD-O 3.35Å
806F77.2Confident84.5Confident25 Ų2563.3 Ų63.311%0.1133%0.331CS..  trans-81.2155.2175.4-67.8-48.6000112.5L766 E767 T770 N808 N809 V813L766-F806 VanDerWaalsContact C-CZ 3.4Å; L766-F806 HydrophobicContact CB-CE2 4.14Å; L766-F806 HydrophobicContact CB-CZ 3.54Å; L766-F806 WeakPolarHBondContact O-CZ 3.34Å; E767-F806 HydrophobicContact CB-CE1 4.04Å; T770-F806 HydrophobicContact CG2-CB 3.94Å; T770-F806 HydrophobicContact CG2-CD1 3.64Å; T770-F806 HydrophobicContact CG2-CD2 3.83Å; T770-F806 HydrophobicContact CG2-CE1 4.12Å; T770-F806 HydrophobicContact CG2-CE2 4.26Å; T770-F806 HydrophobicContact CG2-CG 3.52Å; T770-F806 HydrophobicContact CG2-CZ 4.42Å; F806-N808 PolarHBondContact O-N 3.18Å; F806-N809 PolarHBondContact O-N 3.05Å; F806-N809 VanDerWaalsContact O-N 3.17Å; F806-V813 HydrophobicContact CD2-CB 4.49Å; F806-V813 HydrophobicContact CD2-CG1 4.21Å; F806-V813 HydrophobicContact CD2-CG2 3.46Å; F806-V813 VanDerWaalsContact CD2-CG2 3.46Å; F806-V813 HydrophobicContact CE2-CB 4.11Å; F806-V813 HydrophobicContact CE2-CG1 3.48Å; F806-V813 VanDerWaalsContact CE2-CG1 3.48Å; F806-V813 HydrophobicContact CE2-CG2 3.39Å; F806-V813 HydrophobicContact CG-CG2 4.13Å; F806-V813 HydrophobicContact CZ-CG1 4.16Å; F806-V813 HydrophobicContact CZ-CG2 3.98Å
807P70.7Confident84.3Confident97 Ų9761.9 Ų61.963%0.6332%0.323SS*.THydrogen-bonded Turntrans-52133.6174.6-22.932.6000110.8N809P807-N809 VanDerWaalsContact C-N 3.32Å; P807-N809 PolarHBondContact O-N 3.2Å
808N70.7Confident84.2Confident168 Ų16861.9 Ų61.990%0.89832%0.323SS*.THydrogen-bonded Turntrans73.70.1-180-47.3-43.8000117.4F806F806-N808 PolarHBondContact O-N 3.18Å
809N69.1Low84.1Confident97 Ų9762.9 Ų62.952%0.51933%0.331SS..  trans-111.5127.4173.9-89-34.8000112.1F806 P807F806-N809 PolarHBondContact O-N 3.05Å; F806-N809 VanDerWaalsContact O-N 3.17Å; P807-N809 VanDerWaalsContact C-N 3.32Å; P807-N809 PolarHBondContact O-N 3.2Å
810V71.2Confident83.9Confident140 Ų14060.6 Ų60.685%0.84832%0.317SS*.  trans-82.9-27.5177.2-171.50000111.2R805R805-V810 PolarHBondContact NE-O 3.15Å
811E80.1Confident84Confident120 Ų12060 Ų6056%0.56131%0.313SS*.SBendtrans-79.4150.2-177.6-63.9-165.9179.800112.3R805 N815R805-E811 WeakPolarHBondContact CD-O 3.35Å; E811-N815 PolarHBondContact OE2-ND2 3.01Å
812P82.9Confident84Confident25 Ų2560.6 Ų60.616%0.16232%0.316CS..  trans-57.2147.7168.9-9.418.3000112.3E802 T814 N815E802-P812 WeakPolarHBondContact OE2-CG 3.27Å; P812-T814 PolarHBondContact O-N 3.4Å; P812-T814 VanDerWaalsContact O-N 3.1Å; P812-N815 PolarHBondContact O-N 3.18Å
813V88Confident84.1Confident6 Ų661 Ų614%0.03632%0.321CS..Hα-helixtrans-61.7-21.5-179.7177.60000111.8L766 L801 L804 F806 N815 H816 F817L766-V813 HydrophobicContact CD1-CG1 3.96Å; L801-V813 HydrophobicContact CD2-CG1 4.22Å; L801-V813 PolarHBondContact O-N 3Å; L804-V813 HydrophobicContact CB-CB 4.37Å; L804-V813 HydrophobicContact CB-CG2 3.91Å; L804-V813 WeakPolarHBondContact O-CG2 3.48Å; F806-V813 HydrophobicContact CD2-CB 4.49Å; F806-V813 HydrophobicContact CD2-CG1 4.21Å; F806-V813 HydrophobicContact CD2-CG2 3.46Å; F806-V813 VanDerWaalsContact CD2-CG2 3.46Å; F806-V813 HydrophobicContact CE2-CB 4.11Å; F806-V813 HydrophobicContact CE2-CG1 3.48Å; F806-V813 VanDerWaalsContact CE2-CG1 3.48Å; F806-V813 HydrophobicContact CE2-CG2 3.39Å; F806-V813 HydrophobicContact CG-CG2 4.13Å; F806-V813 HydrophobicContact CZ-CG1 4.16Å; F806-V813 HydrophobicContact CZ-CG2 3.98Å; V813-N815 VanDerWaalsContact C-N 3.28Å; V813-N815 PolarHBondContact O-N 3.19Å; V813-H816 PolarHBondContact O-N 2.88Å; V813-H816 VanDerWaalsContact O-N 3.08Å; V813-F817 WeakPolarHBondContact O-CB 3.32Å; V813-F817 PolarHBondContact O-N 3.29Å
814T87.1Confident84.2Confident0 Ų056 Ų560%030%0.295CS..Hα-helixtrans-46.8-46.6177.6-40.40000113.4L798 L801 E802 P812 I818L798-T814 HydrophobicContact CD2-CG2 4.24Å; L801-T814 WeakPolarHBondContact CB-OG1 3.41Å; E802-T814 WeakPolarHBondContact OE1-CB 3.5Å; E802-T814 PolarHBondContact OE1-OG1 3.42Å; P812-T814 PolarHBondContact O-N 3.4Å; P812-T814 VanDerWaalsContact O-N 3.1Å; T814-I818 HydrophobicContact CG2-CD1 4.08Å; T814-I818 WeakPolarHBondContact O-CG1 3.44Å; T814-I818 PolarHBondContact O-N 3.2Å; T814-I818 VanDerWaalsContact O-N 3.16Å
815N86.5Confident84.4Confident50 Ų5055.3 Ų55.327%0.26729%0.291SS..Hα-helixtrans-67.5-44-177.6-71.2-14.4000111.5E811 P812 V813 T819 V853E811-N815 PolarHBondContact OE2-ND2 3.01Å; P812-N815 PolarHBondContact O-N 3.18Å; V813-N815 VanDerWaalsContact C-N 3.28Å; V813-N815 PolarHBondContact O-N 3.19Å; N815-T819 WeakPolarHBondContact O-CB 3.37Å; N815-T819 PolarHBondContact O-N 2.66Å; N815-T819 VanDerWaalsContact O-N 3.17Å; N815-T819 PolarHBondContact O-OG1 3Å; N815-V853 WeakPolarHBondContact OD1-CB 3.25Å
816H85.8Confident84.8Confident86 Ų8654.5 Ų54.540%0.39830%0.296SS..Hα-helixtrans-66.8-46.5-179.4-17758000110.9V813 T819 Q820V813-H816 PolarHBondContact O-N 2.88Å; V813-H816 VanDerWaalsContact O-N 3.08Å; H816-T819 PolarHBondContact O-N 3.03Å; H816-Q820 WeakPolarHBondContact O-CB 3.33Å; H816-Q820 PolarHBondContact O-N 2.94Å
817F90.8Very high85.4Confident5 Ų554.6 Ų54.62%0.02230%0.299CS..Hα-helixtrans-57.7-53.5178169.6-112.1000112.3L766 L783 A786 I787 L801 V813 T819 Q820 W821L766-F817 HydrophobicContact CD2-CD2 4.32Å; L783-F817 HydrophobicContact CD2-CD2 3.7Å; L783-F817 HydrophobicContact CD2-CE2 3.81Å; A786-F817 HydrophobicContact CB-CD2 4.04Å; A786-F817 HydrophobicContact CB-CE1 4.47Å; A786-F817 HydrophobicContact CB-CE2 3.43Å; A786-F817 VanDerWaalsContact CB-CE2 3.43Å; A786-F817 HydrophobicContact CB-CZ 3.69Å; I787-F817 HydrophobicContact CG1-CE2 4.46Å; I787-F817 HydrophobicContact CG1-CZ 4.07Å; L801-F817 HydrophobicContact CD1-CD1 3.71Å; L801-F817 HydrophobicContact CD1-CE1 4.31Å; L801-F817 HydrophobicContact CD1-CG 4.32Å; V813-F817 WeakPolarHBondContact O-CB 3.32Å; V813-F817 PolarHBondContact O-N 3.29Å; F817-T819 VanDerWaalsContact C-N 3.32Å; F817-T819 PolarHBondContact O-N 3.05Å; F817-Q820 PolarHBondContact O-N 3.27Å; F817-W821 AromaticContact CE1-CE3 3.87Å; F817-W821 HydrophobicContact CE1-CE3 3.87Å; F817-W821 HydrophobicContact CE1-CZ3 4.21Å; F817-W821 HydrophobicContact CE2-CB 4.43Å; F817-W821 HydrophobicContact CZ-CD2 4.31Å; F817-W821 AromaticContact CZ-CE3 3.73Å; F817-W821 HydrophobicContact CZ-CE3 3.73Å; F817-W821 HydrophobicContact CZ-CZ3 4.19Å; F817-W821 WeakPolarHBondContact O-CB 3.44Å; F817-W821 PolarHBondContact O-N 3.18Å
818I91.4Very high86.3Confident1 Ų150 Ų501%0.00527%0.269CS..Hα-helixtrans-63.9-39.2-177.2-69.4172.2000111.3T814 L822 L844 V853 L854 V857T814-I818 HydrophobicContact CG2-CD1 4.08Å; T814-I818 WeakPolarHBondContact O-CG1 3.44Å; T814-I818 PolarHBondContact O-N 3.2Å; T814-I818 VanDerWaalsContact O-N 3.16Å; I818-L822 HydrophobicContact CG2-CD1 4.22Å; I818-L822 WeakPolarHBondContact O-CB 3.32Å; I818-L822 WeakPolarHBondContact O-CG 3.3Å; I818-L822 PolarHBondContact O-N 3.25Å; I818-L822 VanDerWaalsContact O-N 3.15Å; I818-L844 HydrophobicContact CD1-CD1 4.3Å; I818-V853 HydrophobicContact CB-CG1 4.36Å; I818-V853 HydrophobicContact CD1-CG1 3.61Å; I818-V853 HydrophobicContact CG2-CG1 4.49Å; I818-V853 HydrophobicContact CG2-CG2 4.4Å; I818-L854 HydrophobicContact CG2-CD1 4.24Å; I818-V857 HydrophobicContact CG2-CG2 4.02Å
819T89.3Confident87Confident52 Ų5245.3 Ų45.332%0.31924%0.243SC..Hα-helixtrans-71-44.8-179.9-51.60000111.3N815 H816 F817 L822 N823N815-T819 WeakPolarHBondContact O-CB 3.37Å; N815-T819 PolarHBondContact O-N 2.66Å; N815-T819 VanDerWaalsContact O-N 3.17Å; N815-T819 PolarHBondContact O-OG1 3Å; H816-T819 PolarHBondContact O-N 3.03Å; F817-T819 VanDerWaalsContact C-N 3.32Å; F817-T819 PolarHBondContact O-N 3.05Å; T819-L822 PolarHBondContact O-N 2.96Å; T819-N823 WeakPolarHBondContact O-CB 3.49Å; T819-N823 PolarHBondContact O-N 3.24Å; T819-N823 VanDerWaalsContact O-N 3.07Å; T819-N823 PolarHBondContact O-ND2 3.33Å
820Q88.9Confident87.8Confident50 Ų5040.7 Ų40.723%0.23422%0.219CC..Hα-helixtrans-63.5-47.4178.5-170.965.933.300110.7L783 H816 F817 L822 N823 D824L783-Q820 HydrophobicContact CD1-CG 4.49Å; H816-Q820 WeakPolarHBondContact O-CB 3.33Å; H816-Q820 PolarHBondContact O-N 2.94Å; F817-Q820 PolarHBondContact O-N 3.27Å; Q820-L822 PolarHBondContact O-N 3.46Å; Q820-N823 PolarHBondContact O-N 3.03Å; Q820-N823 VanDerWaalsContact O-N 3.13Å; Q820-D824 WeakPolarHBondContact CG-OD2 3.41Å; Q820-D824 PolarHBondContact NE2-OD2 3.03Å; Q820-D824 PolarHBondContact O-N 3.07Å
821W93.9Very high88.6Confident0 Ų035.6 Ų35.60%019%0.187CC..Hα-helixtrans-56.9-46.7177.7176.722.9000112.3I787 L790 F817 N823 D824 V825 F828 C837 G840 L841 L844I787-W821 HydrophobicContact CD1-CD2 4.04Å; I787-W821 VanDerWaalsContact CD1-CE2 3.47Å; I787-W821 HydrophobicContact CD1-CG 4.21Å; I787-W821 HydrophobicContact CD1-CZ2 3.84Å; I787-W821 VanDerWaalsContact CD1-NE1 3.3Å; I787-W821 HydrophobicContact CG1-CD2 4.05Å; I787-W821 HydrophobicContact CG1-CE3 4.4Å; I787-W821 HydrophobicContact CG1-CH2 4.12Å; I787-W821 HydrophobicContact CG1-CZ2 3.76Å; I787-W821 HydrophobicContact CG1-CZ3 4.43Å; I787-W821 HydrophobicContact CG2-CH2 4.39Å; I787-W821 HydrophobicContact CG2-CZ2 4.07Å; L790-W821 HydrophobicContact CD2-CH2 3.97Å; L790-W821 HydrophobicContact CD2-CZ3 3.82Å; F817-W821 AromaticContact CE1-CE3 3.87Å; F817-W821 HydrophobicContact CE1-CE3 3.87Å; F817-W821 HydrophobicContact CE1-CZ3 4.21Å; F817-W821 HydrophobicContact CE2-CB 4.43Å; F817-W821 HydrophobicContact CZ-CD2 4.31Å; F817-W821 AromaticContact CZ-CE3 3.73Å; F817-W821 HydrophobicContact CZ-CE3 3.73Å; F817-W821 HydrophobicContact CZ-CZ3 4.19Å; F817-W821 WeakPolarHBondContact O-CB 3.44Å; F817-W821 PolarHBondContact O-N 3.18Å; W821-N823 VanDerWaalsContact C-N 3.31Å; W821-N823 PolarHBondContact O-N 3.43Å; W821-D824 PolarHBondContact O-N 3.48Å; W821-V825 VanDerWaalsContact O-CG2 3.26Å; W821-V825 WeakPolarHBondContact O-CG2 3.49Å; W821-V825 PolarHBondContact O-N 3.37Å; W821-F828 AromaticContact CD1-CE2 3.96Å; W821-F828 AromaticContact CD1-CZ 3.94Å; W821-C837 PolarHBondContact NE1-SG 2.97Å; W821-G840 VanDerWaalsContact CH2-C 3.46Å; W821-L841 HydrophobicContact CH2-CD2 3.76Å; W821-L841 HydrophobicContact CH2-CG 3.98Å; W821-L841 HydrophobicContact CZ2-CB 4.47Å; W821-L841 HydrophobicContact CZ2-CD2 3.69Å; W821-L841 HydrophobicContact CZ2-CG 3.62Å; W821-L841 HydrophobicContact CZ3-CD2 4.23Å; W821-L844 HydrophobicContact CE3-CD2 4.46Å; W821-L844 HydrophobicContact CH2-CD2 4.49Å; W821-L844 HydrophobicContact CZ3-CD2 3.83Å
822L92.3Very high89.1Confident15 Ų1530.1 Ų30.18%0.07916%0.161CC..Hα-helixtrans-68.3-28.6178.4-73176.3000113.8I818 T819 Q820 V825 L841 V857 I861 A864I818-L822 HydrophobicContact CG2-CD1 4.22Å; I818-L822 WeakPolarHBondContact O-CB 3.32Å; I818-L822 WeakPolarHBondContact O-CG 3.3Å; I818-L822 PolarHBondContact O-N 3.25Å; I818-L822 VanDerWaalsContact O-N 3.15Å; T819-L822 PolarHBondContact O-N 2.96Å; Q820-L822 PolarHBondContact O-N 3.46Å; L822-V825 HydrophobicContact CD2-CG2 4.44Å; L822-V825 WeakPolarHBondContact O-CG2 3.37Å; L822-L841 HydrophobicContact CD2-CD2 3.97Å; L822-V857 HydrophobicContact CD1-CB 3.76Å; L822-V857 HydrophobicContact CD1-CG2 3.34Å; L822-I861 HydrophobicContact CD1-CG1 4.38Å; L822-A864 HydrophobicContact CD2-CB 4.25Å
823N90.6Very high89.5Confident89 Ų8929.2 Ų29.248%0.47616%0.155SC..Hα-helixtrans-76.6-27.8176.2-71-21.6000112.7T819 Q820 W821T819-N823 WeakPolarHBondContact O-CB 3.49Å; T819-N823 PolarHBondContact O-N 3.24Å; T819-N823 VanDerWaalsContact O-N 3.07Å; T819-N823 PolarHBondContact O-ND2 3.33Å; Q820-N823 PolarHBondContact O-N 3.03Å; Q820-N823 VanDerWaalsContact O-N 3.13Å; W821-N823 VanDerWaalsContact C-N 3.31Å; W821-N823 PolarHBondContact O-N 3.43Å
824D91.3Very high89.7Confident12 Ų1230.1 Ų30.16%0.06416%0.158CC..THydrogen-bonded Turntrans-99.312.9-178.1-70.8-40.4000113R779 L783 Q820 W821 D826 C827 F828R779-D824 VanDerWaalsContact CD-OD2 3.26Å; R779-D824 WeakPolarHBondContact CD-OD2 3.48Å; R779-D824 IonicContact CZ-OD1 3.77Å; R779-D824 IonicContact CZ-OD2 2.79Å; R779-D824 IonicContact NE-OD1 2.71Å; R779-D824 PolarHBondContact NE-OD1 2.86Å; R779-D824 IonicContact NE-OD2 2.75Å; R779-D824 PolarHBondContact NE-OD2 2.86Å; R779-D824 IonicContact NH2-OD1 3.06Å; R779-D824 PolarHBondContact NH2-OD1 3.46Å; L783-D824 HydrophobicContact CD1-CB 4.35Å; Q820-D824 WeakPolarHBondContact CG-OD2 3.41Å; Q820-D824 PolarHBondContact NE2-OD2 3.03Å; Q820-D824 PolarHBondContact O-N 3.07Å; W821-D824 PolarHBondContact O-N 3.48Å; D824-D826 PolarHBondContact O-N 2.94Å; D824-C827 HydrophobicContact CB-CB 4.43Å; D824-C827 VanDerWaalsContact O-CB 3.28Å; D824-C827 WeakPolarHBondContact O-CB 3.36Å; D824-C827 PolarHBondContact O-N 3.36Å; D824-F828 VanDerWaalsContact O-CD2 3.25Å; D824-F828 WeakPolarHBondContact O-CD2 3.45Å
825V92.1Very high90Very high7 Ų730.9 Ų30.94%0.04216%0.161CC..G310 helixtrans-59.8-33.2-177.2176.20000112.2W821 L822 C827 F828 A864 L867 L868W821-V825 VanDerWaalsContact O-CG2 3.26Å; W821-V825 WeakPolarHBondContact O-CG2 3.49Å; W821-V825 PolarHBondContact O-N 3.37Å; L822-V825 HydrophobicContact CD2-CG2 4.44Å; L822-V825 WeakPolarHBondContact O-CG2 3.37Å; V825-C827 PolarHBondContact O-N 2.72Å; V825-F828 PolarHBondContact O-N 3.21Å; V825-A864 HydrophobicContact CB-CB 4.37Å; V825-A864 HydrophobicContact CG1-CB 3.94Å; V825-A864 HydrophobicContact CG2-CB 3.92Å; V825-L867 HydrophobicContact CG1-CD2 4.19Å; V825-L868 HydrophobicContact CG1-CD1 3.86Å; V825-L868 HydrophobicContact CG1-CD2 3.77Å; V825-L868 HydrophobicContact CG1-CG 3.58Å
826D90.5Very high90.4Very high100 Ų10028.5 Ų28.554%0.53515%0.148SC..G310 helixtrans-67.2-20.6174.858.1-17.9000113.3D824 L867D824-D826 PolarHBondContact O-N 2.94Å; D826-L867 HydrophobicContact CB-CD2 3.89Å
827C90.4Very high90.8Very high26 Ų2624.4 Ų24.418%0.17613%0.129CC..G310 helixtrans-83.1-6.8177.2-56.80000113.7T780 D824 V825 L829T780-C827 HydrophobicContact CG2-CB 3.66Å; T780-C827 WeakPolarHBondContact CG2-O 3.39Å; D824-C827 HydrophobicContact CB-CB 4.43Å; D824-C827 VanDerWaalsContact O-CB 3.28Å; D824-C827 WeakPolarHBondContact O-CB 3.36Å; D824-C827 PolarHBondContact O-N 3.36Å; V825-C827 PolarHBondContact O-N 2.72Å; C827-L829 PolarHBondContact O-N 3.38Å
828F90.2Very high91.1Very high2 Ų224.2 Ų24.21%0.00913%0.128CC..  trans-81.796.4175.9-72-105.9000109.1T780 L783 Q784 I787 W821 D824 V825 D833 R834 C837 L868T780-F828 HydrophobicContact CG2-CD2 4.21Å; T780-F828 HydrophobicContact CG2-CE2 4.16Å; T780-F828 HydrophobicContact CG2-CZ 4.48Å; L783-F828 HydrophobicContact CB-CZ 4.35Å; Q784-F828 HydrophobicContact CG-CD1 4.48Å; Q784-F828 HydrophobicContact CG-CE1 3.75Å; I787-F828 HydrophobicContact CD1-CE1 3.81Å; I787-F828 HydrophobicContact CD1-CZ 3.68Å; W821-F828 AromaticContact CD1-CE2 3.96Å; W821-F828 AromaticContact CD1-CZ 3.94Å; D824-F828 VanDerWaalsContact O-CD2 3.25Å; D824-F828 WeakPolarHBondContact O-CD2 3.45Å; V825-F828 PolarHBondContact O-N 3.21Å; F828-D833 HydrophobicContact CB-CB 4.22Å; F828-D833 HydrophobicContact CD1-CB 4.01Å; F828-D833 WeakPolarHBondContact CD1-O 3.47Å; F828-R834 HydrophobicContact CB-CG 4.32Å; F828-R834 WeakPolarHBondContact O-CG 3.38Å; F828-R834 PolarHBondContact O-NE 3.46Å; F828-C837 HydrophobicContact CD1-CB 3.82Å; F828-C837 HydrophobicContact CE1-CB 4.11Å; F828-C837 HydrophobicContact CG-CB 4.17Å; F828-L868 HydrophobicContact CB-CD2 4.27Å
829L84.9Confident91.3Very high68 Ų6824.2 Ų24.236%0.35613%0.129SC..  trans-95.3-39.1-170.5-57.9179.2000113C827 R834 T940C827-L829 PolarHBondContact O-N 3.38Å; L829-R834 PolarHBondContact O-NE 3.16Å; L829-R834 PolarHBondContact O-NH1 3.22Å; L829-R834 PolarHBondContact O-NH2 3.46Å; L829-T940 HydrophobicContact CB-CG2 4.43Å
830G84.9Confident91.6Very high1 Ų121.8 Ų21.81%0.0111%0.113CC..SBendtrans-63.5153.4-179.800000114.2D833 R834 E943G830-D833 PolarHBondContact N-OD2 3.03Å; G830-D833 PolarHBondContact O-N 3.46Å; G830-R834 WeakPolarHBondContact O-CB 3.49Å; G830-R834 WeakPolarHBondContact O-CD 3.48Å; G830-R834 WeakPolarHBondContact O-CG 3.3Å; G830-R834 PolarHBondContact O-N 3.28Å; G830-E943 WeakPolarHBondContact CA-OE1 3.45Å
831L87.8Confident91.9Very high33 Ų3319.4 Ų19.417%0.17310%0.102CC..Hα-helixtrans-56.2-49168.2-176.2144.8000111.2K835 L872 A875 Y876 E943L831-K835 WeakPolarHBondContact O-CB 3.47Å; L831-K835 PolarHBondContact O-N 3.49Å; L831-L872 WeakPolarHBondContact O-CD2 3.5Å; L831-A875 HydrophobicContact CB-CB 4.17Å; L831-A875 HydrophobicContact CD1-CB 4.1Å; L831-A875 HydrophobicContact CG-CB 4.4Å; L831-Y876 HydrophobicContact CD1-CD1 3.76Å; L831-Y876 HydrophobicContact CD1-CE1 3.74Å; L831-Y876 HydrophobicContact CD1-CG 4.36Å; L831-Y876 HydrophobicContact CD2-CE1 4.18Å; L831-Y876 HydrophobicContact CG-CE1 4.23Å; L831-E943 WeakPolarHBondContact CA-OE1 3.3Å; L831-E943 PolarHBondContact N-OE1 2.95Å
832H91.2Very high91.9Very high5 Ų519.4 Ų19.42%0.02310%0.103CC..Hα-helixtrans-59.9-47.4174.517788.6000110.7K740 E743 R834 K835 M836 E943 T947 D950K740-H832 PolarHBondContact NZ-CD2 2.88Å; K740-H832 PolarHBondContact NZ-NE2 3.07Å; E743-H832 IonicContact OE1-NE2 3.42Å; E743-H832 PolarHBondContact OE1-NE2 3.03Å; E743-H832 IonicContact OE2-NE2 3.54Å; E743-H832 PolarHBondContact OE2-NE2 3.29Å; H832-R834 VanDerWaalsContact C-N 3.34Å; H832-R834 PolarHBondContact O-N 3.03Å; H832-K835 WeakPolarHBondContact O-CB 3.39Å; H832-K835 PolarHBondContact O-N 3.21Å; H832-K835 VanDerWaalsContact O-N 3.12Å; H832-M836 WeakPolarHBondContact NE2-CG 3.3Å; H832-M836 WeakPolarHBondContact O-CB 3.36Å; H832-M836 PolarHBondContact O-N 3.3Å; H832-E943 WeakPolarHBondContact CB-OE1 3.23Å; H832-E943 PolarHBondContact N-OE1 3.39Å; H832-T947 PolarHBondContact CE1-OG1 2.93Å; H832-D950 IonicContact CE1-OD1 2.89Å; H832-D950 IonicContact CE1-OD2 3.9Å; H832-D950 PolarHBondContact CE1-OD2 3.31Å; H832-D950 IonicContact CG-OD1 3.17Å; H832-D950 IonicContact ND1-OD1 2.72Å; H832-D950 PolarHBondContact ND1-OD1 2.99Å; H832-D950 IonicContact ND1-OD2 3.9Å; H832-D950 PolarHBondContact ND1-OD2 3.31Å
833D91.5Very high92Very high5 Ų519.5 Ų19.53%0.02711%0.106CC..Hα-helixtrans-59.7-46.7-175.4-60.9-14.7000111.9M781 Q784 F828 G830 M836 C837M781-D833 WeakPolarHBondContact CE-OD1 3.39Å; Q784-D833 PolarHBondContact NE2-OD1 3.02Å; F828-D833 HydrophobicContact CB-CB 4.22Å; F828-D833 HydrophobicContact CD1-CB 4.01Å; F828-D833 WeakPolarHBondContact CD1-O 3.47Å; G830-D833 PolarHBondContact N-OD2 3.03Å; G830-D833 PolarHBondContact O-N 3.46Å; D833-M836 PolarHBondContact O-N 2.83Å; D833-C837 VanDerWaalsContact O-CB 3.28Å; D833-C837 WeakPolarHBondContact O-CB 3.44Å; D833-C837 PolarHBondContact O-N 3.01Å
834R93.2Very high92.1Very high26 Ų2615.4 Ų15.410%0.0988%0.083CC..Hα-helixtrans-66.8-40.8177.7-67167.6177.1151.3-2.1110.8F828 L829 G830 H832 C837 V838 L868 L872F828-R834 HydrophobicContact CB-CG 4.32Å; F828-R834 WeakPolarHBondContact O-CG 3.38Å; F828-R834 PolarHBondContact O-NE 3.46Å; L829-R834 PolarHBondContact O-NE 3.16Å; L829-R834 PolarHBondContact O-NH1 3.22Å; L829-R834 PolarHBondContact O-NH2 3.46Å; G830-R834 WeakPolarHBondContact O-CB 3.49Å; G830-R834 WeakPolarHBondContact O-CD 3.48Å; G830-R834 WeakPolarHBondContact O-CG 3.3Å; G830-R834 PolarHBondContact O-N 3.28Å; H832-R834 VanDerWaalsContact C-N 3.34Å; H832-R834 PolarHBondContact O-N 3.03Å; R834-C837 PolarHBondContact O-N 3.4Å; R834-V838 WeakPolarHBondContact O-CG2 3.35Å; R834-V838 PolarHBondContact O-N 3.38Å; R834-L868 HydrophobicContact CB-CD2 4.21Å; R834-L868 HydrophobicContact CG-CD2 4.13Å; R834-L872 HydrophobicContact CB-CD1 4.34Å; R834-L872 HydrophobicContact CB-CD2 3.66Å; R834-L872 HydrophobicContact CB-CG 3.68Å
835K93.3Very high92.2Very high16 Ų1614.9 Ų14.97%0.078%0.081CC..Hα-helixtrans-60.5-48.4176.6-175.8172.5-174.5169.80110.8L831 H832 C837 V838 L839 L872 I949 V956 E958L831-K835 WeakPolarHBondContact O-CB 3.47Å; L831-K835 PolarHBondContact O-N 3.49Å; H832-K835 WeakPolarHBondContact O-CB 3.39Å; H832-K835 PolarHBondContact O-N 3.21Å; H832-K835 VanDerWaalsContact O-N 3.12Å; K835-C837 PolarHBondContact O-N 3.29Å; K835-V838 PolarHBondContact O-N 3.06Å; K835-L839 HydrophobicContact CG-CD1 4.28Å; K835-L839 WeakPolarHBondContact O-CG 3.47Å; K835-L839 PolarHBondContact O-N 3.38Å; K835-L872 HydrophobicContact CB-CD2 4.32Å; K835-I949 HydrophobicContact CD-CD1 4.46Å; K835-I949 VanDerWaalsContact CE-O 3.26Å; K835-I949 WeakPolarHBondContact CE-O 3.47Å; K835-I949 PolarHBondContact NZ-O 3.48Å; K835-V956 PolarHBondContact NZ-O 2.84Å; K835-E958 WeakPolarHBondContact CE-OE2 3.48Å; K835-E958 HydrophobicContact CG-CB 4.26Å; K835-E958 HydrophobicContact CG-CG 4.22Å; K835-E958 IonicContact NZ-OE2 3.71Å
836M94Very high92.2Very high0 Ų017.5 Ų17.50%09%0.094CC..Hα-helixtrans-61.3-43.7176.3-85.5-56.7-63.100112.7E743 L747 I787 A788 H832 D833 V838 L839 G840 I949E743-M836 WeakPolarHBondContact OE1-CG 3.29Å; L747-M836 HydrophobicContact CD1-CE 4.09Å; L747-M836 HydrophobicContact CD1-SD 3.8Å; L747-M836 HydrophobicContact CD2-CE 3.83Å; L747-M836 HydrophobicContact CD2-SD 3.92Å; L747-M836 HydrophobicContact CG-CE 4.43Å; I787-M836 HydrophobicContact CG2-CE 4.35Å; I787-M836 WeakPolarHBondContact CG2-O 3.42Å; A788-M836 HydrophobicContact CB-CE 3.69Å; H832-M836 WeakPolarHBondContact NE2-CG 3.3Å; H832-M836 WeakPolarHBondContact O-CB 3.36Å; H832-M836 PolarHBondContact O-N 3.3Å; D833-M836 PolarHBondContact O-N 2.83Å; M836-V838 VanDerWaalsContact C-N 3.34Å; M836-V838 PolarHBondContact O-N 2.87Å; M836-L839 PolarHBondContact O-N 3.44Å; M836-L839 HydrophobicContact SD-CD1 4.49Å; M836-G840 PolarHBondContact O-N 2.91Å; M836-I949 HydrophobicContact CG-CD1 3.45Å; M836-I949 VanDerWaalsContact CG-CD1 3.45Å; M836-I949 HydrophobicContact SD-CD1 3.25Å; M836-I949 WeakPolarHBondContact SD-CD1 3.33Å; M836-I949 HydrophobicContact SD-CG1 4.34Å
837C95Very high92.1Very high0 Ų013.6 Ų13.60%07%0.073CC..Hα-helixtrans-60.5-43.2176.1-1700000111.7W821 F828 D833 R834 K835 G840 L841 L868W821-C837 PolarHBondContact NE1-SG 2.97Å; F828-C837 HydrophobicContact CD1-CB 3.82Å; F828-C837 HydrophobicContact CE1-CB 4.11Å; F828-C837 HydrophobicContact CG-CB 4.17Å; D833-C837 VanDerWaalsContact O-CB 3.28Å; D833-C837 WeakPolarHBondContact O-CB 3.44Å; D833-C837 PolarHBondContact O-N 3.01Å; R834-C837 PolarHBondContact O-N 3.4Å; K835-C837 PolarHBondContact O-N 3.29Å; C837-G840 PolarHBondContact O-N 3.43Å; C837-L841 WeakPolarHBondContact O-CB 3.49Å; C837-L841 WeakPolarHBondContact O-CG 3.33Å; C837-L841 PolarHBondContact O-N 3.42Å; C837-L868 HydrophobicContact CB-CD1 3.97Å; C837-L868 HydrophobicContact CB-CD2 3.91Å; C837-L868 WeakPolarHBondContact SG-CD1 3.38Å
838V96.5Very high91.8Very high0 Ų018.6 Ų18.60%09%0.094CC..Hα-helixtrans-63.4-47.3175.6171.10000111.6R834 K835 M836 G840 L841 C842 F865 L868 F869 L872 E958R834-V838 WeakPolarHBondContact O-CG2 3.35Å; R834-V838 PolarHBondContact O-N 3.38Å; K835-V838 PolarHBondContact O-N 3.06Å; M836-V838 VanDerWaalsContact C-N 3.34Å; M836-V838 PolarHBondContact O-N 2.87Å; V838-G840 VanDerWaalsContact C-N 3.31Å; V838-G840 PolarHBondContact O-N 3.26Å; V838-L841 PolarHBondContact O-N 3.37Å; V838-C842 WeakPolarHBondContact O-CB 3.39Å; V838-C842 PolarHBondContact O-N 3.02Å; V838-C842 PolarHBondContact O-SG 3Å; V838-F865 HydrophobicContact CG1-CD1 4.25Å; V838-F865 HydrophobicContact CG1-CE1 4.07Å; V838-L868 HydrophobicContact CG2-CB 3.65Å; V838-L868 HydrophobicContact CG2-CD1 3.89Å; V838-L868 HydrophobicContact CG2-CG 4.36Å; V838-F869 HydrophobicContact CG1-CE1 3.89Å; V838-F869 HydrophobicContact CG1-CE2 4.23Å; V838-F869 HydrophobicContact CG1-CZ 3.53Å; V838-F869 HydrophobicContact CG2-CE1 4.32Å; V838-F869 HydrophobicContact CG2-CZ 4.37Å; V838-L872 HydrophobicContact CG2-CD1 3.94Å; V838-E958 HydrophobicContact CB-CB 4.35Å; V838-E958 HydrophobicContact CG1-CB 3.85Å; V838-E958 HydrophobicContact CG1-CG 4.37Å
839L95.2Very high91.5Very high2 Ų226 Ų261%0.0113%0.129CC..Hα-helixtrans-62.4-39.8179.2-69.2176.5000111.8Y791 K835 M836 C842 A843 I949 V956 E958 I961Y791-L839 HydrophobicContact CD2-CB 4.04Å; Y791-L839 HydrophobicContact CE2-CB 4.23Å; Y791-L839 HydrophobicContact CE2-CD1 4.44Å; Y791-L839 HydrophobicContact CE2-CD2 4.39Å; K835-L839 HydrophobicContact CG-CD1 4.28Å; K835-L839 WeakPolarHBondContact O-CG 3.47Å; K835-L839 PolarHBondContact O-N 3.38Å; M836-L839 PolarHBondContact O-N 3.44Å; M836-L839 HydrophobicContact SD-CD1 4.49Å; L839-C842 WeakPolarHBondContact O-CB 3.36Å; L839-C842 PolarHBondContact O-N 2.71Å; L839-A843 PolarHBondContact O-N 3.26Å; L839-I949 HydrophobicContact CD1-CD1 4.41Å; L839-I949 HydrophobicContact CD1-CG2 4.46Å; L839-V956 HydrophobicContact CD1-CG1 3.78Å; L839-V956 HydrophobicContact CD2-CG1 4.06Å; L839-E958 HydrophobicContact CD2-CB 4.11Å; L839-E958 HydrophobicContact CG-CB 4.35Å; L839-I961 HydrophobicContact CD2-CB 4.47Å; L839-I961 HydrophobicContact CD2-CD1 3.61Å; L839-I961 HydrophobicContact CD2-CG2 4.34Å
840G95.2Very high91.5Very high0 Ų024.5 Ų24.50%012%0.12CC..Hα-helixtrans-61.7-50.9172.700000112.9L790 W821 M836 C837 V838 C842 A843 L844L790-G840 WeakPolarHBondContact CD2-O 3.35Å; W821-G840 VanDerWaalsContact CH2-C 3.46Å; M836-G840 PolarHBondContact O-N 2.91Å; C837-G840 PolarHBondContact O-N 3.43Å; V838-G840 VanDerWaalsContact C-N 3.31Å; V838-G840 PolarHBondContact O-N 3.26Å; G840-C842 PolarHBondContact O-N 3.1Å; G840-A843 WeakPolarHBondContact O-CB 3.39Å; G840-A843 PolarHBondContact O-N 3.22Å; G840-A843 VanDerWaalsContact O-N 3.12Å; G840-L844 PolarHBondContact O-N 3.26Å
841L95.1Very high91.4Very high0 Ų025.4 Ų25.40%013%0.126CC..Hα-helixtrans-61.4-36.7178.9-74175.8000110.9W821 L822 C837 V838 L844 I845 A864 F865 L868W821-L841 HydrophobicContact CH2-CD2 3.76Å; W821-L841 HydrophobicContact CH2-CG 3.98Å; W821-L841 HydrophobicContact CZ2-CB 4.47Å; W821-L841 HydrophobicContact CZ2-CD2 3.69Å; W821-L841 HydrophobicContact CZ2-CG 3.62Å; W821-L841 HydrophobicContact CZ3-CD2 4.23Å; L822-L841 HydrophobicContact CD2-CD2 3.97Å; C837-L841 WeakPolarHBondContact O-CB 3.49Å; C837-L841 WeakPolarHBondContact O-CG 3.33Å; C837-L841 PolarHBondContact O-N 3.42Å; V838-L841 PolarHBondContact O-N 3.37Å; L841-L844 HydrophobicContact CD2-CD2 4.32Å; L841-L844 WeakPolarHBondContact O-CB 3.25Å; L841-L844 PolarHBondContact O-N 3.22Å; L841-I845 WeakPolarHBondContact O-CG1 3.38Å; L841-I845 PolarHBondContact O-N 2.7Å; L841-A864 HydrophobicContact CD1-CB 4.17Å; L841-F865 HydrophobicContact CB-CD1 4.45Å; L841-F865 HydrophobicContact CB-CE1 3.62Å; L841-F865 HydrophobicContact CB-CE2 3.93Å; L841-F865 HydrophobicContact CB-CZ 3.33Å; L841-F865 HydrophobicContact CD1-CD1 4.38Å; L841-F865 HydrophobicContact CD1-CE1 4.33Å; L841-F865 HydrophobicContact CD1-CZ 4.43Å; L841-L868 HydrophobicContact CD1-CD1 3.68Å
842C95.8Very high91.3Very high1 Ų131.7 Ų31.71%0.00716%0.155CC..Hα-helixtrans-59.2-48.9172.5-74.80000111.7V838 L839 G840 L844 I845 D846 I961 F962 I965V838-C842 WeakPolarHBondContact O-CB 3.39Å; V838-C842 PolarHBondContact O-N 3.02Å; V838-C842 PolarHBondContact O-SG 3Å; L839-C842 WeakPolarHBondContact O-CB 3.36Å; L839-C842 PolarHBondContact O-N 2.71Å; G840-C842 PolarHBondContact O-N 3.1Å; C842-L844 VanDerWaalsContact C-N 3.27Å; C842-L844 PolarHBondContact O-N 3.16Å; C842-I845 WeakPolarHBondContact O-CG1 3.42Å; C842-I845 PolarHBondContact O-N 2.88Å; C842-D846 WeakPolarHBondContact O-CB 3.37Å; C842-D846 PolarHBondContact O-N 2.98Å; C842-I961 HydrophobicContact CB-CG2 4.16Å; C842-F962 VanDerWaalsContact SG-CA 3.53Å; C842-I965 HydrophobicContact CB-CD1 3.72Å
843A93.8Very high91.1Very high17 Ų1731.7 Ų31.714%0.1416%0.155CC..Hα-helixtrans-61.9-35.5175.600000112.2L790 P794 L839 G840 M847L790-A843 HydrophobicContact CG-CB 4.08Å; P794-A843 HydrophobicContact CG-CB 4.45Å; L839-A843 PolarHBondContact O-N 3.26Å; G840-A843 WeakPolarHBondContact O-CB 3.39Å; G840-A843 PolarHBondContact O-N 3.22Å; G840-A843 VanDerWaalsContact O-N 3.12Å; A843-M847 VanDerWaalsContact O-CG 3.28Å; A843-M847 WeakPolarHBondContact O-CG 3.13Å
844L92.2Very high90.9Very high2 Ų231.5 Ų31.51%0.0115%0.154CC..Hα-helixtrans-66.2-44.9177.8-162.768.8000112.4L790 I818 W821 G840 L841 C842 M847 L854L790-L844 HydrophobicContact CD1-CD1 4.39Å; L790-L844 HydrophobicContact CD2-CB 3.87Å; L790-L844 HydrophobicContact CD2-CD1 3.76Å; L790-L844 HydrophobicContact CD2-CG 4.35Å; I818-L844 HydrophobicContact CD1-CD1 4.3Å; W821-L844 HydrophobicContact CE3-CD2 4.46Å; W821-L844 HydrophobicContact CH2-CD2 4.49Å; W821-L844 HydrophobicContact CZ3-CD2 3.83Å; G840-L844 PolarHBondContact O-N 3.26Å; L841-L844 HydrophobicContact CD2-CD2 4.32Å; L841-L844 WeakPolarHBondContact O-CB 3.25Å; L841-L844 PolarHBondContact O-N 3.22Å; C842-L844 VanDerWaalsContact C-N 3.27Å; C842-L844 PolarHBondContact O-N 3.16Å; L844-M847 HydrophobicContact CD1-CE 3.55Å; L844-M847 HydrophobicContact CG-CE 4.13Å; L844-M847 WeakPolarHBondContact O-CE 3.3Å; L844-M847 WeakPolarHBondContact O-CG 3.39Å; L844-L854 HydrophobicContact CD2-CD1 3.47Å; L844-L854 VanDerWaalsContact CD2-CD1 3.47Å; L844-L854 HydrophobicContact CD2-CD2 4.29Å; L844-L854 HydrophobicContact CG-CD1 3.96Å; L844-L854 HydrophobicContact CG-CD2 3.83Å
845I92.8Very high90.6Very high2 Ų233.9 Ų33.91%0.0117%0.169CC..Hα-helixtrans-79.1-21.9-176.464.6172.4000113.8L841 C842 M847 I861 F865 I965 I969 W976L841-I845 WeakPolarHBondContact O-CG1 3.38Å; L841-I845 PolarHBondContact O-N 2.7Å; C842-I845 WeakPolarHBondContact O-CG1 3.42Å; C842-I845 PolarHBondContact O-N 2.88Å; I845-M847 VanDerWaalsContact C-N 3.3Å; I845-I861 HydrophobicContact CG2-CD1 4.33Å; I845-I861 HydrophobicContact CG2-CG2 3.78Å; I845-F865 HydrophobicContact CD1-CE2 3.95Å; I845-F865 HydrophobicContact CD1-CZ 4.04Å; I845-I965 HydrophobicContact CD1-CG2 3.95Å; I845-I965 HydrophobicContact CG1-CG2 3.87Å; I845-I969 HydrophobicContact CB-CD1 3.9Å; I845-I969 HydrophobicContact CD1-CD1 3.72Å; I845-I969 HydrophobicContact CG1-CD1 3.68Å; I845-I969 WeakPolarHBondContact O-CD1 3.47Å; I845-W976 PolarHBondContact O-NE1 3.4Å
846D93Very high90.4Very high61 Ų6140.5 Ų40.533%0.32620%0.2SC..THydrogen-bonded Turntrans-82.7-5.5179.5-162.137.1000113.4C842 E848 I965C842-D846 WeakPolarHBondContact O-CB 3.37Å; C842-D846 PolarHBondContact O-N 2.98Å; D846-E848 PolarHBondContact O-N 2.99Å; D846-I965 HydrophobicContact CB-CD1 4.36Å; D846-I965 HydrophobicContact CB-CG1 4.41Å; D846-I965 HydrophobicContact CB-CG2 3.79Å
847M88.1Confident90.2Very high18 Ų1841.2 Ų41.29%0.08920%0.204CC..  trans-60136.7-179.8-64.4-167.1-64.800112.6L790 P794 L798 A843 L844 I845 Q849 P851 L854L790-M847 HydrophobicContact CD1-SD 4.42Å; P794-M847 HydrophobicContact CB-CG 4.2Å; P794-M847 HydrophobicContact CB-SD 4.12Å; L798-M847 HydrophobicContact CD1-CE 4.15Å; L798-M847 HydrophobicContact CD1-SD 3.44Å; L798-M847 WeakPolarHBondContact CD1-SD 3.45Å; L798-M847 HydrophobicContact CD2-CE 4.5Å; L798-M847 HydrophobicContact CD2-SD 4.43Å; L798-M847 HydrophobicContact CG-SD 4.02Å; A843-M847 VanDerWaalsContact O-CG 3.28Å; A843-M847 WeakPolarHBondContact O-CG 3.13Å; L844-M847 HydrophobicContact CD1-CE 3.55Å; L844-M847 HydrophobicContact CG-CE 4.13Å; L844-M847 WeakPolarHBondContact O-CE 3.3Å; L844-M847 WeakPolarHBondContact O-CG 3.39Å; I845-M847 VanDerWaalsContact C-N 3.3Å; M847-Q849 VanDerWaalsContact C-N 3.34Å; M847-Q849 PolarHBondContact O-N 2.91Å; M847-P851 VanDerWaalsContact CE-CD 3.48Å; M847-P851 HydrophobicContact CE-CG 3.81Å; M847-L854 HydrophobicContact CE-CD2 4.35Å
848E83.9Confident90Very high132 Ų13242 Ų4262%0.61721%0.21SC*.SBendtrans-67.8-35.3178.6-48.3-160.2139.600112.8D846 R972D846-E848 PolarHBondContact O-N 2.99Å; E848-R972 IonicContact OE1-CZ 2.64Å; E848-R972 IonicContact OE1-NH1 3.73Å; E848-R972 IonicContact OE1-NH2 2.63Å; E848-R972 PolarHBondContact OE1-NH2 2.89Å
849Q84.4Confident89.7Confident157 Ų15743.9 Ų43.973%0.73423%0.229SC*.SBendtrans-110.594.7179.3-66.6-177.2-0.700109.3M847 P851M847-Q849 VanDerWaalsContact C-N 3.34Å; M847-Q849 PolarHBondContact O-N 2.91Å; Q849-P851 VanDerWaalsContact O-CD 3.31Å; Q849-P851 WeakPolarHBondContact O-CD 3.47Å
850I84.9Confident89.5Confident36 Ų3648 Ų4819%0.18525%0.248CC..  trans-70.8119.3-178-62159.6000109.6L854 N855 W976I850-L854 HydrophobicContact CG2-CB 4.02Å; I850-L854 HydrophobicContact CG2-CD2 4.09Å; I850-L854 HydrophobicContact CG2-CG 4.34Å; I850-N855 WeakPolarHBondContact CG2-ND2 3.4Å; I850-W976 HydrophobicContact CD1-CB 3.93Å; I850-W976 HydrophobicContact CD1-CD2 3.48Å; I850-W976 VanDerWaalsContact CD1-CD2 3.48Å; I850-W976 HydrophobicContact CD1-CE3 3.94Å; I850-W976 HydrophobicContact CD1-CG 3.45Å; I850-W976 VanDerWaalsContact CD1-CG 3.45Å; I850-W976 HydrophobicContact CG1-CD2 4.43Å; I850-W976 HydrophobicContact CG2-CE3 4.46Å; I850-W976 HydrophobicContact CG2-CH2 4.07Å; I850-W976 HydrophobicContact CG2-CZ2 4.23Å; I850-W976 HydrophobicContact CG2-CZ3 4.18Å
851P83.5Confident89.4Confident21 Ų2148 Ų4814%0.13625%0.248CC..  trans-57.4149.2175.6-2534.8000112.1L798 M847 Q849 V853 L854 N855L798-P851 HydrophobicContact CD1-CG 4.44Å; L798-P851 HydrophobicContact CD2-CG 4Å; M847-P851 VanDerWaalsContact CE-CD 3.48Å; M847-P851 HydrophobicContact CE-CG 3.81Å; Q849-P851 VanDerWaalsContact O-CD 3.31Å; Q849-P851 WeakPolarHBondContact O-CD 3.47Å; P851-V853 VanDerWaalsContact C-N 3.3Å; P851-V853 HydrophobicContact CB-CG1 4.08Å; P851-V853 PolarHBondContact O-N 2.93Å; P851-L854 HydrophobicContact CB-CB 4.38Å; P851-L854 WeakPolarHBondContact O-CB 3.44Å; P851-L854 PolarHBondContact O-N 3.38Å; P851-L854 VanDerWaalsContact O-N 3.1Å; P851-N855 PolarHBondContact O-N 2.88Å; P851-N855 PolarHBondContact O-ND2 3.47Å
852Q86Confident89.4Confident164 Ų16448 Ų4877%0.76625%0.248SC*.Hα-helixtrans-61.3-39.6-179.3-72.5-172.2-1.400112.4L854 N855 Q856Q852-L854 VanDerWaalsContact C-N 3.28Å; Q852-L854 PolarHBondContact O-N 3.1Å; Q852-N855 WeakPolarHBondContact O-CB 3.35Å; Q852-N855 PolarHBondContact O-N 3.37Å; Q852-Q856 WeakPolarHBondContact O-CG 3.36Å; Q852-Q856 PolarHBondContact O-N 3.29Å
853V86Confident89.3Confident6 Ų649.9 Ų49.94%0.03626%0.261CS..Hα-helixtrans-58.9-39.817560.90000111.7N815 I818 P851 N855 Q856 V857N815-V853 WeakPolarHBondContact OD1-CB 3.25Å; I818-V853 HydrophobicContact CB-CG1 4.36Å; I818-V853 HydrophobicContact CD1-CG1 3.61Å; I818-V853 HydrophobicContact CG2-CG1 4.49Å; I818-V853 HydrophobicContact CG2-CG2 4.4Å; P851-V853 VanDerWaalsContact C-N 3.3Å; P851-V853 HydrophobicContact CB-CG1 4.08Å; P851-V853 PolarHBondContact O-N 2.93Å; V853-N855 VanDerWaalsContact C-N 3.28Å; V853-N855 PolarHBondContact O-N 2.97Å; V853-Q856 WeakPolarHBondContact O-CA 3.25Å; V853-Q856 WeakPolarHBondContact O-CB 3.12Å; V853-Q856 PolarHBondContact O-N 3.49Å; V853-V857 WeakPolarHBondContact O-CG2 3.27Å; V853-V857 PolarHBondContact O-N 2.96Å
854L87.9Confident89.4Confident0 Ų049.5 Ų49.50%026%0.257CS..Hα-helixtrans-64-34.4179.1-163.463.6000112.1I818 L844 M847 I850 P851 Q852 Q856 V857 S858 I861 W976I818-L854 HydrophobicContact CG2-CD1 4.24Å; L844-L854 HydrophobicContact CD2-CD1 3.47Å; L844-L854 VanDerWaalsContact CD2-CD1 3.47Å; L844-L854 HydrophobicContact CD2-CD2 4.29Å; L844-L854 HydrophobicContact CG-CD1 3.96Å; L844-L854 HydrophobicContact CG-CD2 3.83Å; M847-L854 HydrophobicContact CE-CD2 4.35Å; I850-L854 HydrophobicContact CG2-CB 4.02Å; I850-L854 HydrophobicContact CG2-CD2 4.09Å; I850-L854 HydrophobicContact CG2-CG 4.34Å; P851-L854 HydrophobicContact CB-CB 4.38Å; P851-L854 WeakPolarHBondContact O-CB 3.44Å; P851-L854 PolarHBondContact O-N 3.38Å; P851-L854 VanDerWaalsContact O-N 3.1Å; Q852-L854 VanDerWaalsContact C-N 3.28Å; Q852-L854 PolarHBondContact O-N 3.1Å; L854-Q856 VanDerWaalsContact C-N 3.33Å; L854-V857 HydrophobicContact CD1-CG2 4.26Å; L854-S858 WeakPolarHBondContact O-CA 3.32Å; L854-S858 WeakPolarHBondContact O-CB 3.36Å; L854-S858 PolarHBondContact O-N 3.48Å; L854-I861 HydrophobicContact CD1-CD1 3.49Å; L854-I861 VanDerWaalsContact CD1-CD1 3.49Å; L854-I861 HydrophobicContact CD1-CG1 4.39Å; L854-I861 HydrophobicContact CG-CD1 3.97Å; L854-W976 HydrophobicContact CD2-CH2 4.33Å; L854-W976 HydrophobicContact CD2-CZ2 3.99Å; L854-W976 HydrophobicContact CG-CH2 3.97Å; L854-W976 HydrophobicContact CG-CZ2 4.1Å
855N86.9Confident89.5Confident77 Ų7749.4 Ų49.441%0.41226%0.257SS..Hα-helixtrans-65.3-36.8171.9-78.4-72.2000112.2I850 P851 Q852 V853 S858I850-N855 WeakPolarHBondContact CG2-ND2 3.4Å; P851-N855 PolarHBondContact O-N 2.88Å; P851-N855 PolarHBondContact O-ND2 3.47Å; Q852-N855 WeakPolarHBondContact O-CB 3.35Å; Q852-N855 PolarHBondContact O-N 3.37Å; V853-N855 VanDerWaalsContact C-N 3.28Å; V853-N855 PolarHBondContact O-N 2.97Å; N855-S858 WeakPolarHBondContact O-CB 3.4Å; N855-S858 PolarHBondContact O-OG 3.42Å
856Q88.8Confident89.6Confident155 Ų15549.6 Ų49.672%0.72426%0.258SS*.Hα-helixtrans-69-37.8-179.8-64.4172.66.200112.1Q852 V853 L854Q852-Q856 WeakPolarHBondContact O-CG 3.36Å; Q852-Q856 PolarHBondContact O-N 3.29Å; V853-Q856 WeakPolarHBondContact O-CA 3.25Å; V853-Q856 WeakPolarHBondContact O-CB 3.12Å; V853-Q856 PolarHBondContact O-N 3.49Å; L854-Q856 VanDerWaalsContact C-N 3.33Å
857V89.9Confident89.7Confident14 Ų1450.8 Ų50.89%0.08526%0.264CS..SBendtrans-97.17.9179.9-56.10000113.6I818 L822 V853 L854 G859 Q860I818-V857 HydrophobicContact CG2-CG2 4.02Å; L822-V857 HydrophobicContact CD1-CB 3.76Å; L822-V857 HydrophobicContact CD1-CG2 3.34Å; V853-V857 WeakPolarHBondContact O-CG2 3.27Å; V853-V857 PolarHBondContact O-N 2.96Å; L854-V857 HydrophobicContact CD1-CG2 4.26Å; V857-G859 PolarHBondContact O-N 3.07Å; V857-Q860 WeakPolarHBondContact O-CB 3.26Å; V857-Q860 PolarHBondContact O-N 3.03Å
858S90.3Very high90Very high17 Ų1750 Ų5012%0.11926%0.26CS..Hα-helixtrans-52.3-32.2-174.354.20000114.6L854 N855 Q860L854-S858 WeakPolarHBondContact O-CA 3.32Å; L854-S858 WeakPolarHBondContact O-CB 3.36Å; L854-S858 PolarHBondContact O-N 3.48Å; N855-S858 WeakPolarHBondContact O-CB 3.4Å; N855-S858 PolarHBondContact O-OG 3.42Å; S858-Q860 VanDerWaalsContact C-N 3.29Å; S858-Q860 PolarHBondContact O-N 3.4Å
859G89.8Confident90.6Very high39 Ų3943.9 Ų43.940%0.40223%0.231SC..Hα-helixtrans-70.8-15.1176.900000115.6V857 P863V857-G859 PolarHBondContact O-N 3.07Å; G859-P863 WeakPolarHBondContact O-CD 3.46Å; G859-P863 WeakPolarHBondContact O-CG 3.46Å
860Q92.1Very high90.9Very high89 Ų8939.1 Ų39.142%0.41621%0.211SC..Hα-helixtrans-92-20.1-179.9-60.4177.513.900112.9V857 S858 P863 A864V857-Q860 WeakPolarHBondContact O-CB 3.26Å; V857-Q860 PolarHBondContact O-N 3.03Å; S858-Q860 VanDerWaalsContact C-N 3.29Å; S858-Q860 PolarHBondContact O-N 3.4Å; Q860-P863 WeakPolarHBondContact O-CD 3.48Å; Q860-A864 WeakPolarHBondContact O-CB 3.39Å; Q860-A864 PolarHBondContact O-N 3.22Å
861I93.4Very high91.1Very high0 Ų037.9 Ų37.90%021%0.207CC..Hα-helixtrans-66.3-48.4-170.9-60.4172.2000112.5L822 I845 L854 A864 F865 W976 L980L822-I861 HydrophobicContact CD1-CG1 4.38Å; I845-I861 HydrophobicContact CG2-CD1 4.33Å; I845-I861 HydrophobicContact CG2-CG2 3.78Å; L854-I861 HydrophobicContact CD1-CD1 3.49Å; L854-I861 VanDerWaalsContact CD1-CD1 3.49Å; L854-I861 HydrophobicContact CD1-CG1 4.39Å; L854-I861 HydrophobicContact CG-CD1 3.97Å; I861-A864 WeakPolarHBondContact O-CB 3.4Å; I861-A864 PolarHBondContact O-N 3.45Å; I861-F865 HydrophobicContact CG2-CD2 3.93Å; I861-F865 HydrophobicContact CG2-CE2 3.67Å; I861-F865 VanDerWaalsContact O-CD2 3.28Å; I861-F865 WeakPolarHBondContact O-CD2 3.06Å; I861-F865 PolarHBondContact O-N 2.93Å; I861-W976 HydrophobicContact CD1-CH2 4.23Å; I861-W976 HydrophobicContact CD1-CZ2 4.28Å; I861-L980 HydrophobicContact CB-CD2 4.12Å; I861-L980 HydrophobicContact CD1-CD2 3.75Å; I861-L980 HydrophobicContact CG1-CD2 4.49Å; I861-L980 HydrophobicContact CG2-CD2 4.28Å
862L94.6Very high91.4Very high0 Ų036.9 Ų36.90%020%0.201CC..Hα-helixtrans-69.4-39.4179.4-70.8-175.9000113.1A864 F865 I866 F962 F966 L980 T981 L984 L992L862-A864 VanDerWaalsContact C-N 3.29Å; L862-A864 PolarHBondContact O-N 3.33Å; L862-F865 HydrophobicContact CD2-CD2 4.04Å; L862-F865 PolarHBondContact O-N 3.32Å; L862-I866 WeakPolarHBondContact O-CG1 3.12Å; L862-I866 PolarHBondContact O-N 3.14Å; L862-F962 HydrophobicContact CD2-CE2 4.38Å; L862-F962 HydrophobicContact CD2-CZ 4.34Å; L862-F966 HydrophobicContact CD1-CE2 3.96Å; L862-F966 HydrophobicContact CD1-CZ 3.94Å; L862-F966 HydrophobicContact CD2-CD2 4.36Å; L862-F966 HydrophobicContact CD2-CE2 3.76Å; L862-F966 HydrophobicContact CD2-CZ 4.25Å; L862-F966 HydrophobicContact CG-CE2 4.47Å; L862-L980 HydrophobicContact CD1-CB 4.05Å; L862-L980 VanDerWaalsContact CD1-O 3.27Å; L862-L980 WeakPolarHBondContact CD1-O 3.37Å; L862-L980 HydrophobicContact CG-CB 4.32Å; L862-T981 HydrophobicContact CD1-CG2 3.87Å; L862-L984 HydrophobicContact CB-CD2 3.81Å; L862-L984 HydrophobicContact CD1-CD1 3.64Å; L862-L984 HydrophobicContact CD1-CD2 4.4Å; L862-L984 HydrophobicContact CD1-CG 4.27Å; L862-L992 HydrophobicContact CD1-CD1 4.19Å; L862-L992 HydrophobicContact CD2-CD2 4.46Å
863P94.1Very high91.5Very high41 Ų4135.4 Ų35.427%0.26619%0.191SC..Hα-helixtrans-54-42.6166-29.135.4000113.7G859 Q860 I866 L867G859-P863 WeakPolarHBondContact O-CD 3.46Å; G859-P863 WeakPolarHBondContact O-CG 3.46Å; Q860-P863 WeakPolarHBondContact O-CD 3.48Å; P863-I866 PolarHBondContact O-N 3.28Å; P863-L867 PolarHBondContact O-N 2.89Å
864A94.4Very high91.4Very high8 Ų844 Ų447%0.06622%0.223CC..Hα-helixtrans-60.9-46.5175.400000112.3L822 V825 L841 Q860 I861 L862 I866 L867 L868L822-A864 HydrophobicContact CD2-CB 4.25Å; V825-A864 HydrophobicContact CB-CB 4.37Å; V825-A864 HydrophobicContact CG1-CB 3.94Å; V825-A864 HydrophobicContact CG2-CB 3.92Å; L841-A864 HydrophobicContact CD1-CB 4.17Å; Q860-A864 WeakPolarHBondContact O-CB 3.39Å; Q860-A864 PolarHBondContact O-N 3.22Å; I861-A864 WeakPolarHBondContact O-CB 3.4Å; I861-A864 PolarHBondContact O-N 3.45Å; L862-A864 VanDerWaalsContact C-N 3.29Å; L862-A864 PolarHBondContact O-N 3.33Å; A864-I866 VanDerWaalsContact C-N 3.31Å; A864-I866 PolarHBondContact O-N 3.44Å; A864-L867 PolarHBondContact O-N 3.16Å; A864-L868 VanDerWaalsContact O-CG 3.31Å; A864-L868 WeakPolarHBondContact O-CG 3.33Å; A864-L868 PolarHBondContact O-N 2.91Å
865F95.9Very high91.1Very high0 Ų044.5 Ų44.50%023%0.227CC..Hα-helixtrans-56.7-44.2173.4-82.8-67.4000112.5V838 L841 I845 I861 L862 L867 L868 F869 F962V838-F865 HydrophobicContact CG1-CD1 4.25Å; V838-F865 HydrophobicContact CG1-CE1 4.07Å; L841-F865 HydrophobicContact CB-CD1 4.45Å; L841-F865 HydrophobicContact CB-CE1 3.62Å; L841-F865 HydrophobicContact CB-CE2 3.93Å; L841-F865 HydrophobicContact CB-CZ 3.33Å; L841-F865 HydrophobicContact CD1-CD1 4.38Å; L841-F865 HydrophobicContact CD1-CE1 4.33Å; L841-F865 HydrophobicContact CD1-CZ 4.43Å; I845-F865 HydrophobicContact CD1-CE2 3.95Å; I845-F865 HydrophobicContact CD1-CZ 4.04Å; I861-F865 HydrophobicContact CG2-CD2 3.93Å; I861-F865 HydrophobicContact CG2-CE2 3.67Å; I861-F865 VanDerWaalsContact O-CD2 3.28Å; I861-F865 WeakPolarHBondContact O-CD2 3.06Å; I861-F865 PolarHBondContact O-N 2.93Å; L862-F865 HydrophobicContact CD2-CD2 4.04Å; L862-F865 PolarHBondContact O-N 3.32Å; F865-L867 VanDerWaalsContact C-N 3.35Å; F865-L867 PolarHBondContact O-N 3.36Å; F865-L868 PolarHBondContact O-N 3.11Å; F865-F869 HydrophobicContact CB-CD2 4.24Å; F865-F869 HydrophobicContact CB-CE2 4.28Å; F865-F869 AromaticContact CD1-CE2 3.87Å; F865-F869 HydrophobicContact CD1-CE2 3.87Å; F865-F869 HydrophobicContact CG-CE2 4.47Å; F865-F869 WeakPolarHBondContact O-CB 3.34Å; F865-F869 WeakPolarHBondContact O-CD2 3.36Å; F865-F869 PolarHBondContact O-N 3.47Å; F865-F962 HydrophobicContact CB-CE2 4.27Å; F865-F962 AromaticContact CD1-CD2 3.68Å; F865-F962 HydrophobicContact CD1-CD2 3.68Å; F865-F962 AromaticContact CD1-CE2 3.79Å; F865-F962 HydrophobicContact CD1-CE2 3.79Å; F865-F962 HydrophobicContact CD2-CD2 4.29Å; F865-F962 AromaticContact CD2-CE2 3.68Å; F865-F962 HydrophobicContact CD2-CE2 3.68Å; F865-F962 AromaticContact CE1-CD2 3.52Å; F865-F962 HydrophobicContact CE1-CD2 3.52Å; F865-F962 AromaticContact CE1-CE2 3.92Å; F865-F962 HydrophobicContact CE1-CE2 3.92Å; F865-F962 HydrophobicContact CE1-CG 4.47Å; F865-F962 HydrophobicContact CE2-CD2 4.14Å; F865-F962 AromaticContact CE2-CE2 3.81Å; F865-F962 HydrophobicContact CE2-CE2 3.81Å; F865-F962 HydrophobicContact CG-CD2 4.06Å; F865-F962 AromaticContact CG-CE2 3.66Å; F865-F962 HydrophobicContact CG-CE2 3.66Å; F865-F962 HydrophobicContact CG-CZ 4.37Å; F865-F962 AromaticContact CZ-CD2 3.74Å; F865-F962 HydrophobicContact CZ-CD2 3.74Å; F865-F962 AromaticContact CZ-CE2 3.9Å; F865-F962 HydrophobicContact CZ-CE2 3.9Å
866I94.7Very high91Very high7 Ų743.5 Ų43.54%0.03622%0.218CC..Hα-helixtrans-61.6-44.9179.9-70.1165.8000110.8L862 P863 A864 N870 Q988 Q991 L992 I995L862-I866 WeakPolarHBondContact O-CG1 3.12Å; L862-I866 PolarHBondContact O-N 3.14Å; P863-I866 PolarHBondContact O-N 3.28Å; A864-I866 VanDerWaalsContact C-N 3.31Å; A864-I866 PolarHBondContact O-N 3.44Å; I866-N870 WeakPolarHBondContact O-CB 3.45Å; I866-N870 PolarHBondContact O-N 3.07Å; I866-N870 PolarHBondContact O-ND2 3.02Å; I866-Q988 HydrophobicContact CD1-CB 3.54Å; I866-Q988 HydrophobicContact CD1-CG 3.79Å; I866-Q991 HydrophobicContact CG1-CB 4.41Å; I866-Q991 HydrophobicContact CG2-CB 4.02Å; I866-Q991 HydrophobicContact CG2-CG 4.37Å; I866-L992 HydrophobicContact CD1-CD1 4.28Å; I866-L992 HydrophobicContact CD1-CD2 4.42Å; I866-L992 HydrophobicContact CD1-CG 3.95Å; I866-L992 HydrophobicContact CG1-CD2 4.01Å; I866-L992 HydrophobicContact CG1-CG 3.99Å; I866-I995 HydrophobicContact CG1-CD1 4.32Å
867L93.5Very high90.5Very high85 Ų8538.4 Ų38.445%0.44520%0.203SC..Hα-helixtrans-58.9-51.5177.3-177.164.6000110.9V825 D826 P863 A864 F865 F869 N870 G871V825-L867 HydrophobicContact CG1-CD2 4.19Å; D826-L867 HydrophobicContact CB-CD2 3.89Å; P863-L867 PolarHBondContact O-N 2.89Å; A864-L867 PolarHBondContact O-N 3.16Å; F865-L867 VanDerWaalsContact C-N 3.35Å; F865-L867 PolarHBondContact O-N 3.36Å; L867-F869 PolarHBondContact O-N 3.47Å; L867-N870 PolarHBondContact O-N 2.93Å; L867-G871 PolarHBondContact O-N 3.17Å
868L94.9Very high89.8Confident3 Ų339.2 Ų39.22%0.01621%0.209CC..Hα-helixtrans-61.2-44.1179.9-67.7165.2000112.6V825 F828 R834 C837 V838 L841 A864 F865 G871 L872V825-L868 HydrophobicContact CG1-CD1 3.86Å; V825-L868 HydrophobicContact CG1-CD2 3.77Å; V825-L868 HydrophobicContact CG1-CG 3.58Å; F828-L868 HydrophobicContact CB-CD2 4.27Å; R834-L868 HydrophobicContact CB-CD2 4.21Å; R834-L868 HydrophobicContact CG-CD2 4.13Å; C837-L868 HydrophobicContact CB-CD1 3.97Å; C837-L868 HydrophobicContact CB-CD2 3.91Å; C837-L868 WeakPolarHBondContact SG-CD1 3.38Å; V838-L868 HydrophobicContact CG2-CB 3.65Å; V838-L868 HydrophobicContact CG2-CD1 3.89Å; V838-L868 HydrophobicContact CG2-CG 4.36Å; L841-L868 HydrophobicContact CD1-CD1 3.68Å; A864-L868 VanDerWaalsContact O-CG 3.31Å; A864-L868 WeakPolarHBondContact O-CG 3.33Å; A864-L868 PolarHBondContact O-N 2.91Å; F865-L868 PolarHBondContact O-N 3.11Å; L868-G871 PolarHBondContact O-N 2.96Å; L868-L872 WeakPolarHBondContact O-CB 3.42Å; L868-L872 WeakPolarHBondContact O-CG 3.5Å; L868-L872 PolarHBondContact O-N 2.97Å
869F96Very high88.9Confident2 Ų241.6 Ų41.61%0.00922%0.218CC..Hα-helixtrans-69.2-34.7178.8-78.3-56.1000112.8V838 F865 L867 G871 L872 K873 E958 Y959 F962 I995V838-F869 HydrophobicContact CG1-CE1 3.89Å; V838-F869 HydrophobicContact CG1-CE2 4.23Å; V838-F869 HydrophobicContact CG1-CZ 3.53Å; V838-F869 HydrophobicContact CG2-CE1 4.32Å; V838-F869 HydrophobicContact CG2-CZ 4.37Å; F865-F869 HydrophobicContact CB-CD2 4.24Å; F865-F869 HydrophobicContact CB-CE2 4.28Å; F865-F869 AromaticContact CD1-CE2 3.87Å; F865-F869 HydrophobicContact CD1-CE2 3.87Å; F865-F869 HydrophobicContact CG-CE2 4.47Å; F865-F869 WeakPolarHBondContact O-CB 3.34Å; F865-F869 WeakPolarHBondContact O-CD2 3.36Å; F865-F869 PolarHBondContact O-N 3.47Å; L867-F869 PolarHBondContact O-N 3.47Å; F869-G871 VanDerWaalsContact C-N 3.34Å; F869-L872 HydrophobicContact CD1-CD1 4.05Å; F869-L872 HydrophobicContact CE1-CD1 4.43Å; F869-K873 WeakPolarHBondContact O-CB 3.43Å; F869-K873 PolarHBondContact O-N 3.49Å; F869-E958 HydrophobicContact CE1-CG 4.25Å; F869-Y959 HydrophobicContact CB-CE1 4.24Å; F869-Y959 AromaticContact CD1-CD1 3.66Å; F869-Y959 HydrophobicContact CD1-CD1 3.66Å; F869-Y959 HydrophobicContact CD1-CD2 4.12Å; F869-Y959 AromaticContact CD1-CE1 3.26Å; F869-Y959 HydrophobicContact CD1-CE1 3.26Å; F869-Y959 AromaticContact CD1-CE2 3.77Å; F869-Y959 HydrophobicContact CD1-CE2 3.77Å; F869-Y959 HydrophobicContact CD1-CG 4.07Å; F869-Y959 AromaticContact CD1-CZ 3.35Å; F869-Y959 AromaticContact CE1-CD1 3.64Å; F869-Y959 HydrophobicContact CE1-CD1 3.64Å; F869-Y959 AromaticContact CE1-CD2 3.84Å; F869-Y959 HydrophobicContact CE1-CD2 3.84Å; F869-Y959 AromaticContact CE1-CE1 3.76Å; F869-Y959 HydrophobicContact CE1-CE1 3.76Å; F869-Y959 AromaticContact CE1-CE2 3.95Å; F869-Y959 HydrophobicContact CE1-CE2 3.95Å; F869-Y959 AromaticContact CE1-CG 3.69Å; F869-Y959 HydrophobicContact CE1-CG 3.69Å; F869-Y959 AromaticContact CE1-CZ 3.94Å; F869-Y959 HydrophobicContact CG-CD1 4.48Å; F869-Y959 AromaticContact CG-CE1 3.97Å; F869-Y959 HydrophobicContact CG-CE1 3.97Å; F869-Y959 HydrophobicContact CZ-CD1 4.47Å; F869-Y959 PolarHBondContact O-OH 2.93Å; F869-F962 HydrophobicContact CE2-CB 4.08Å; F869-F962 AromaticContact CE2-CD1 3.61Å; F869-F962 HydrophobicContact CE2-CD1 3.61Å; F869-F962 HydrophobicContact CE2-CD2 4.12Å; F869-F962 HydrophobicContact CE2-CE1 4.04Å; F869-F962 AromaticContact CE2-CG 3.65Å; F869-F962 HydrophobicContact CE2-CG 3.65Å; F869-F962 HydrophobicContact CE2-CZ 4.47Å; F869-F962 HydrophobicContact CZ-CB 3.64Å; F869-F962 AromaticContact CZ-CD1 3.9Å; F869-F962 HydrophobicContact CZ-CD1 3.9Å; F869-F962 AromaticContact CZ-CG 3.76Å; F869-F962 HydrophobicContact CZ-CG 3.76Å; F869-I995 HydrophobicContact CB-CD1 3.72Å; F869-I995 HydrophobicContact CB-CG1 3.83Å; F869-I995 HydrophobicContact CD1-CG2 4.37Å; F869-I995 HydrophobicContact CD2-CD1 3.63Å; F869-I995 HydrophobicContact CD2-CG1 4.08Å; F869-I995 HydrophobicContact CD2-CG2 3.67Å; F869-I995 HydrophobicContact CE1-CG2 4.42Å; F869-I995 HydrophobicContact CE2-CG2 3.75Å; F869-I995 HydrophobicContact CG-CD1 3.98Å; F869-I995 HydrophobicContact CG-CG1 4.07Å; F869-I995 HydrophobicContact CG-CG2 4Å; F869-I995 HydrophobicContact CZ-CG2 4.13Å
870N91.2Very high88Confident58 Ų5841.7 Ų41.731%0.3121%0.214SC..Hα-helixtrans-64.1-42.4172.1-72.5-25000110.9I866 L867 K873 R874 Q991I866-N870 WeakPolarHBondContact O-CB 3.45Å; I866-N870 PolarHBondContact O-N 3.07Å; I866-N870 PolarHBondContact O-ND2 3.02Å; L867-N870 PolarHBondContact O-N 2.93Å; N870-K873 PolarHBondContact O-N 3.11Å; N870-R874 WeakPolarHBondContact O-CG 3.32Å; N870-R874 PolarHBondContact O-N 3.37Å; N870-Q991 PolarHBondContact ND2-NE2 3.49Å
871G89.3Confident86.9Confident10 Ų1043.4 Ų43.410%0.10322%0.222CC..Hα-helixtrans-60.9-51.4173.200000112.4L867 L868 F869 K873 R874 A875L867-G871 PolarHBondContact O-N 3.17Å; L868-G871 PolarHBondContact O-N 2.96Å; F869-G871 VanDerWaalsContact C-N 3.34Å; G871-K873 VanDerWaalsContact C-N 3.29Å; G871-K873 PolarHBondContact O-N 3.38Å; G871-R874 WeakPolarHBondContact O-CB 3.43Å; G871-R874 PolarHBondContact O-N 2.66Å; G871-A875 PolarHBondContact O-N 2.82Å
872L90.6Very high85.4Confident0 Ų049.9 Ų49.90%025%0.252CS..Hα-helixtrans-56.3-41.8176.5-77.8168000112.4L831 R834 K835 V838 L868 F869 R874 A875 Y876 E958 Y959L831-L872 WeakPolarHBondContact O-CD2 3.5Å; R834-L872 HydrophobicContact CB-CD1 4.34Å; R834-L872 HydrophobicContact CB-CD2 3.66Å; R834-L872 HydrophobicContact CB-CG 3.68Å; K835-L872 HydrophobicContact CB-CD2 4.32Å; V838-L872 HydrophobicContact CG2-CD1 3.94Å; L868-L872 WeakPolarHBondContact O-CB 3.42Å; L868-L872 WeakPolarHBondContact O-CG 3.5Å; L868-L872 PolarHBondContact O-N 2.97Å; F869-L872 HydrophobicContact CD1-CD1 4.05Å; F869-L872 HydrophobicContact CE1-CD1 4.43Å; L872-R874 VanDerWaalsContact C-N 3.27Å; L872-R874 PolarHBondContact O-N 2.69Å; L872-A875 PolarHBondContact O-N 3.42Å; L872-Y876 HydrophobicContact CB-CD2 4.32Å; L872-Y876 HydrophobicContact CB-CE2 4.25Å; L872-Y876 HydrophobicContact CD2-CE2 4.09Å; L872-Y876 WeakPolarHBondContact O-CB 3.41Å; L872-Y876 WeakPolarHBondContact O-CD2 3.47Å; L872-Y876 PolarHBondContact O-N 3.44Å; L872-E958 HydrophobicContact CD1-CG 3.91Å; L872-Y959 HydrophobicContact CB-CE2 4.45Å; L872-Y959 HydrophobicContact CD1-CE2 4.47Å
873K87.4Confident83.5Confident132 Ų13255.5 Ų55.557%0.57428%0.279SS*.Hα-helixtrans-61.8-37.1178.2-177-177.8174.6-171.20112F869 N870 G871 A877F869-K873 WeakPolarHBondContact O-CB 3.43Å; F869-K873 PolarHBondContact O-N 3.49Å; N870-K873 PolarHBondContact O-N 3.11Å; G871-K873 VanDerWaalsContact C-N 3.29Å; G871-K873 PolarHBondContact O-N 3.38Å; K873-A877 PolarHBondContact O-N 2.98Å
874R84Confident81.4Confident188 Ų18859.3 Ų59.371%0.70930%0.297SS*.Hα-helixtrans-71.2-48.4175.1-67176.2-176.1-179.9-2.1110.7N870 G871 L872 Y876 A877 C878N870-R874 WeakPolarHBondContact O-CG 3.32Å; N870-R874 PolarHBondContact O-N 3.37Å; G871-R874 WeakPolarHBondContact O-CB 3.43Å; G871-R874 PolarHBondContact O-N 2.66Å; L872-R874 VanDerWaalsContact C-N 3.27Å; L872-R874 PolarHBondContact O-N 2.69Å; R874-Y876 PolarHBondContact O-N 3.2Å; R874-A877 WeakPolarHBondContact O-CB 3.39Å; R874-A877 PolarHBondContact O-N 2.8Å; R874-C878 PolarHBondContact O-N 3.23Å
875A81.7Confident79Confident9 Ų963.8 Ų63.87%0.07432%0.32CS..Hα-helixtrans-57.4-45.3178.800000112.2L831 G871 L872 A877 C878 H879L831-A875 HydrophobicContact CB-CB 4.17Å; L831-A875 HydrophobicContact CD1-CB 4.1Å; L831-A875 HydrophobicContact CG-CB 4.4Å; G871-A875 PolarHBondContact O-N 2.82Å; L872-A875 PolarHBondContact O-N 3.42Å; A875-A877 VanDerWaalsContact C-N 3.28Å; A875-A877 PolarHBondContact O-N 2.82Å; A875-C878 PolarHBondContact O-N 3.23Å; A875-H879 WeakPolarHBondContact O-CB 3.49Å; A875-H879 PolarHBondContact O-N 3.12Å
876Y83.7Confident76.3Confident56 Ų5668.4 Ų68.422%0.2235%0.352CS..Hα-helixtrans-64.9-28.3175-78.4-55.8000114L831 L872 R874 A880 E958 Y959L831-Y876 HydrophobicContact CD1-CD1 3.76Å; L831-Y876 HydrophobicContact CD1-CE1 3.74Å; L831-Y876 HydrophobicContact CD1-CG 4.36Å; L831-Y876 HydrophobicContact CD2-CE1 4.18Å; L831-Y876 HydrophobicContact CG-CE1 4.23Å; L872-Y876 HydrophobicContact CB-CD2 4.32Å; L872-Y876 HydrophobicContact CB-CE2 4.25Å; L872-Y876 HydrophobicContact CD2-CE2 4.09Å; L872-Y876 WeakPolarHBondContact O-CB 3.41Å; L872-Y876 WeakPolarHBondContact O-CD2 3.47Å; L872-Y876 PolarHBondContact O-N 3.44Å; R874-Y876 PolarHBondContact O-N 3.2Å; Y876-A880 WeakPolarHBondContact O-CB 3.35Å; Y876-A880 PolarHBondContact O-N 3.39Å; Y876-E958 WeakPolarHBondContact CE2-OE1 3.09Å; Y876-E958 PolarHBondContact OH-OE1 3.29Å; Y876-Y959 HydrophobicContact CE2-CE2 4.34Å
877A79.6Confident73.5Confident49 Ų4975 Ų7541%0.40539%0.387SS..Hα-helixtrans-74.4-44.4176.100000110.8K873 R874 A875 A880 E881K873-A877 PolarHBondContact O-N 2.98Å; R874-A877 WeakPolarHBondContact O-CB 3.39Å; R874-A877 PolarHBondContact O-N 2.8Å; A875-A877 VanDerWaalsContact C-N 3.28Å; A875-A877 PolarHBondContact O-N 2.82Å; A877-A880 PolarHBondContact O-N 3.21Å; A877-E881 WeakPolarHBondContact O-CG 3.47Å; A877-E881 PolarHBondContact O-N 3.38Å
878C74.3Confident70.5Confident31 Ų3177.8 Ų77.821%0.20940%0.402CS..Hα-helixtrans-59.9-50.6175.6-170.30000111.6R874 A875 A880 E881 H882 A937R874-C878 PolarHBondContact O-N 3.23Å; A875-C878 PolarHBondContact O-N 3.23Å; C878-A880 VanDerWaalsContact C-N 3.26Å; C878-A880 PolarHBondContact O-N 2.79Å; C878-E881 PolarHBondContact O-N 3.14Å; C878-H882 PolarHBondContact O-CD2 3.16Å; C878-H882 PolarHBondContact O-N 2.94Å; C878-A937 HydrophobicContact CB-CB 4.37Å
879H71.3Confident67.4Low67 Ų6785.2 Ų85.231%0.3144%0.442SS..Hα-helixtrans-59.7-36.7178.2-169.982000112.2A875 E883 E939A875-H879 WeakPolarHBondContact O-CB 3.49Å; A875-H879 PolarHBondContact O-N 3.12Å; H879-E883 IonicContact NE2-OE1 3.29Å; H879-E883 PolarHBondContact O-N 3.32Å; H879-E939 IonicContact CE1-OE1 2.89Å; H879-E939 PolarHBondContact CE1-OE1 3.25Å; H879-E939 IonicContact ND1-OE1 2.56Å; H879-E939 PolarHBondContact ND1-OE1 3.29Å
880A72.4Confident64.4Low40 Ų4092.3 Ų92.333%0.33148%0.48SS..Hα-helixtrans-72.9-25.9175.400000113.7Y876 A877 C878 N884Y876-A880 WeakPolarHBondContact O-CB 3.35Å; Y876-A880 PolarHBondContact O-N 3.39Å; A877-A880 PolarHBondContact O-N 3.21Å; C878-A880 VanDerWaalsContact C-N 3.26Å; C878-A880 PolarHBondContact O-N 2.79Å; A880-N884 PolarHBondContact O-N 3.04Å; A880-N884 PolarHBondContact O-ND2 3.13Å
881E68.7Low61.6Low126 Ų12697.3 Ų97.359%0.58950%0.502SS*.Hα-helixtrans-73.5-46.1172.8-75.2172.7178.800109.9A877 C878 E883 N884 D885A877-E881 WeakPolarHBondContact O-CG 3.47Å; A877-E881 PolarHBondContact O-N 3.38Å; C878-E881 PolarHBondContact O-N 3.14Å; E881-E883 PolarHBondContact O-N 3.06Å; E881-N884 PolarHBondContact O-N 3.5Å; E881-D885 PolarHBondContact O-N 3.11Å
882H60.6Low58.8Low136 Ų136101.2 Ų101.263%0.6353%0.533SS*.Hα-helixtrans-59.1-39.2174-82-71.6000113.8C878 N884C878-H882 PolarHBondContact O-CD2 3.16Å; C878-H882 PolarHBondContact O-N 2.94Å; H882-N884 PolarHBondContact O-N 3.09Å
883E56.2Low56Low117 Ų117108.8 Ų108.855%0.54757%0.568SS.*Hα-helixtrans-65.4-25.1173.5-78.8-170153.700113.2H879 E881 S886H879-E883 IonicContact NE2-OE1 3.29Å; H879-E883 PolarHBondContact O-N 3.32Å; E881-E883 PolarHBondContact O-N 3.06Å; E883-S886 PolarHBondContact O-OG 3.18Å
884N49.4Very low53.4Low121 Ų121108.9 Ų108.965%0.64758%0.575SS**Hα-helixtrans-92.7-28.6179.3-73.9-55000113.4A880 E881 H882 S886A880-N884 PolarHBondContact O-N 3.04Å; A880-N884 PolarHBondContact O-ND2 3.13Å; E881-N884 PolarHBondContact O-N 3.5Å; H882-N884 PolarHBondContact O-N 3.09Å; N884-S886 VanDerWaalsContact C-N 3.3Å; N884-S886 PolarHBondContact O-N 3.21Å
885D44Very low51.1Low103 Ų103107.3 Ų107.355%0.55158%0.581SS**Hα-helixtrans-80.7-8.5-176.2-74.9-15.5000113.5E881 D887 D888E881-D885 PolarHBondContact O-N 3.11Å; D885-D887 PolarHBondContact O-N 3.32Å; D885-D888 PolarHBondContact O-N 2.86Å
886S38Very low49.2Very low96 Ų96113.3 Ų113.367%0.67161%0.612SS**THydrogen-bonded Turntrans-67.13.3174.847.30000115.1E883 N884E883-S886 PolarHBondContact O-OG 3.18Å; N884-S886 VanDerWaalsContact C-N 3.3Å; N884-S886 PolarHBondContact O-N 3.21Å
887D36.1Very low47.5Very low147 Ų147119 Ų11979%0.78664%0.64SS**THydrogen-bonded Turntrans-113.3-0.8178.8-86.3-20.5000115.2D885D885-D887 PolarHBondContact O-N 3.32Å
888D30.9Very low46.3Very low142 Ų142119.1 Ų119.176%0.75964%0.636SS**  trans-129.529.8-167-90.2-21.4000117D885D885-D888 PolarHBondContact O-N 2.86Å
889D30.9Very low45.7Very low160 Ų160126.3 Ų126.386%0.85667%0.666SS**  trans-99.967.1173.5-79.9-27.5000113.1
890D31.5Very low45.8Very low150 Ų150126 Ų12680%0.80267%0.666SS**  trans-115.2108.7171.7-88.3-23.3000113.1
891E32.5Very low45.9Very low163 Ų163125 Ų12576%0.76265%0.654SS**  trans63.487.8141.4-57.3-170.8167.900119.3E893E891-E893 PolarHBondContact O-N 2.64Å
892A30.9Very low45.8Very low92 Ų92119.4 Ų119.476%0.7663%0.63SS**  trans-79.193.9150.600000109.8D894A892-D894 VanDerWaalsContact C-N 3.32Å; A892-D894 PolarHBondContact O-N 2.92Å
893E31Very low46.3Very low159 Ų159115.5 Ų115.574%0.74362%0.619SS**  trans-69.987.3165.6-77.6-170.7147.200109.4E891 D895E891-E893 PolarHBondContact O-N 2.64Å; E893-D895 PolarHBondContact O-N 3.13Å
894D34.1Very low47.1Very low135 Ų135116.4 Ų116.472%0.72263%0.627SS**  trans-73.794169.3-76.6-34.2000110.1A892 D896A892-D894 VanDerWaalsContact C-N 3.32Å; A892-D894 PolarHBondContact O-N 2.92Å; D894-D896 PolarHBondContact O-N 3.23Å
895D35.6Very low48.4Very low155 Ų155115.3 Ų115.383%0.82962%0.618SS**  trans-70.455.4167.4-111.4-8000110.1E893 E897E893-D895 PolarHBondContact O-N 3.13Å; D895-E897 VanDerWaalsContact C-N 3.29Å; D895-E897 PolarHBondContact O-N 3.06Å
896D42.1Very low50.2Low134 Ų134113.9 Ų113.972%0.71761%0.61SS**  trans-73.788.9168.3-84.8-20.6000108.5D894 T898D894-D896 PolarHBondContact O-N 3.23Å; D896-T898 VanDerWaalsContact C-N 3.25Å; D896-T898 PolarHBondContact O-N 3.46Å
897E47.9Very low52.2Low176 Ų176111.3 Ų111.382%0.82259%0.589SS**  trans-52.795.3162.6-77.1-169.1159.500107.9D895 E899D895-E897 VanDerWaalsContact C-N 3.29Å; D895-E897 PolarHBondContact O-N 3.06Å; E897-E899 WeakPolarHBondContact O-CA 3.47Å; E897-E899 PolarHBondContact O-N 3.38Å
898T53.3Low53.9Low51 Ų51108.2 Ų108.231%0.31357%0.572SS.*  trans-39102.3-177.9-34.30000109.9S402 D896 E900S402-T898 WeakPolarHBondContact OG-CG2 3.37Å; D896-T898 VanDerWaalsContact C-N 3.25Å; D896-T898 PolarHBondContact O-N 3.46Å; T898-E900 PolarHBondContact O-N 2.9Å
899E62.1Low55.7Low182 Ų182105.5 Ų105.585%0.8556%0.558SS**  trans-65.7102.9-168.2-72-160.9155.200109.3E897 L901E897-E899 WeakPolarHBondContact O-CA 3.47Å; E897-E899 PolarHBondContact O-N 3.38Å; E899-L901 PolarHBondContact O-N 2.82Å
900E74.1Confident57.3Low62 Ų62104.8 Ų104.829%0.2955%0.549SS..  trans-70.6115.7178.8-69.8-175.9170.300109.9K405 K446 T898 G902K405-E900 WeakPolarHBondContact CE-O 3.48Å; K405-E900 HydrophobicContact CG-CB 3.97Å; K405-E900 WeakPolarHBondContact CG-OE2 3.19Å; K405-E900 PolarHBondContact NZ-O 3.15Å; K446-E900 IonicContact NZ-OE1 2.85Å; K446-E900 PolarHBondContact NZ-OE1 3.14Å; T898-E900 PolarHBondContact O-N 2.9Å; E900-G902 PolarHBondContact O-N 3.21Å
901L73.3Confident58.6Low17 Ų17103.8 Ų103.89%0.08954%0.543CS..BIsolated β-bridgetrans-58.4132.6178.9-57169000111.7K403 E899 E905 D907K403-L901 HydrophobicContact CB-CD1 4.12Å; K403-L901 WeakPolarHBondContact O-CB 3.5Å; K403-L901 PolarHBondContact O-N 3.07Å; E899-L901 PolarHBondContact O-N 2.82Å; L901-E905 HydrophobicContact CB-CB 4.18Å; L901-E905 HydrophobicContact CD2-CB 4.12Å; L901-D907 HydrophobicContact CD1-CB 3.76Å
902G68Low59.8Low9 Ų996.9 Ų96.99%0.09352%0.516CS..  trans-55.3168.2162.500000112.6R404 E900 D904 E905R404-G902 PolarHBondContact NH1-O 3.44Å; E900-G902 PolarHBondContact O-N 3.21Å; G902-D904 PolarHBondContact O-N 2.68Å; G902-E905 PolarHBondContact N-OE2 2.96Å; G902-E905 PolarHBondContact O-N 3.22Å
903S71Confident61.3Low55 Ų5594.9 Ų94.939%0.38549%0.491SS..THydrogen-bonded Turntrans-69.5-14-179.4-170.10000113.3
904D72.3Confident62.8Low136 Ų13693.4 Ų93.473%0.72748%0.484SS*.THydrogen-bonded Turntrans-119.65.6-174.249.8-34.3000112.9G902G902-D904 PolarHBondContact O-N 2.68Å
905E77.4Confident64.3Low98 Ų9893.9 Ų93.946%0.45848%0.477SS..  trans-100.5138.8177.5-70.6164.1-164.600111R404 L901 G902R404-E905 PolarHBondContact NH1-O 2.93Å; R404-E905 PolarHBondContact NH2-O 3.44Å; L901-E905 HydrophobicContact CB-CB 4.18Å; L901-E905 HydrophobicContact CD2-CB 4.12Å; G902-E905 PolarHBondContact N-OE2 2.96Å; G902-E905 PolarHBondContact O-N 3.22Å
906D81.6Confident65.5Low72 Ų7290.8 Ų90.839%0.38546%0.46SS..  trans-100.1146.3173.9-66.4-42.5000108.8H335 A336H335-D906 VanDerWaalsContact CA-OD1 3.27Å; H335-D906 WeakPolarHBondContact CA-OD1 3.33Å; A336-D906 VanDerWaalsContact CB-OD1 3.3Å; A336-D906 WeakPolarHBondContact CB-OD1 3.19Å; A336-D906 PolarHBondContact N-OD1 3.29Å
907D79.1Confident66.5Low43 Ų4388.3 Ų88.323%0.2344%0.444CS..  trans-85.1114173.5-164.844.5000110.2N280 S334 K403 L901N280-D907 PolarHBondContact ND2-O 3.01Å; N280-D907 VanDerWaalsContact ND2-O 3.15Å; S334-D907 PolarHBondContact O-N 3.38Å; K403-D907 WeakPolarHBondContact CE-OD2 3.18Å; K403-D907 IonicContact NZ-OD2 3.14Å; K403-D907 PolarHBondContact NZ-OD2 3.46Å; L901-D907 HydrophobicContact CD1-CB 3.76Å
908I71.5Confident67.4Low81 Ų8183.8 Ų83.842%0.41542%0.424SS..  trans-115.2117.6177-59.3175.3000107E910I908-E910 VanDerWaalsContact C-N 3.29Å; I908-E910 HydrophobicContact CG2-CG 4Å; I908-E910 PolarHBondContact O-N 2.89Å
909D69.8Low67.7Low86 Ų8684.5 Ų84.546%0.4643%0.426SS..  trans-79.579.2175.6-175.95.6000108.7N280 D911 G912 Q913N280-D909 PolarHBondContact OD1-N 3.22Å; D909-D911 VanDerWaalsContact C-N 3.31Å; D909-D911 PolarHBondContact O-N 3.28Å; D909-G912 PolarHBondContact O-N 2.89Å; D909-G912 WeakPolarHBondContact OD1-CA 2.96Å; D909-G912 PolarHBondContact OD1-N 3.42Å; D909-Q913 PolarHBondContact O-N 2.98Å
910E63.6Low67.6Low145 Ų14578.9 Ų78.968%0.67841%0.411SS*.Hα-helixtrans-60.8-41.4-178.2-66.5-172172.400111.1I908 Q913 E914I908-E910 VanDerWaalsContact C-N 3.29Å; I908-E910 HydrophobicContact CG2-CG 4Å; I908-E910 PolarHBondContact O-N 2.89Å; E910-Q913 WeakPolarHBondContact O-CB 3.18Å; E910-Q913 PolarHBondContact O-N 3.47Å; E910-E914 PolarHBondContact O-N 2.63Å
911D60.2Low66.7Low128 Ų12882.6 Ų82.668%0.68443%0.426SS*.Hα-helixtrans-65.3-45.2178.4-59.6-32.6000111.6D909 Q913 E914 Y915D909-D911 VanDerWaalsContact C-N 3.31Å; D909-D911 PolarHBondContact O-N 3.28Å; D911-Q913 VanDerWaalsContact C-N 3.29Å; D911-Q913 PolarHBondContact O-N 2.87Å; D911-E914 PolarHBondContact O-N 3.44Å; D911-Y915 WeakPolarHBondContact O-CB 3.47Å; D911-Y915 PolarHBondContact O-N 3.09Å
912G58Low65.7Low18 Ų1887.4 Ų87.419%0.18645%0.448CS..Hα-helixtrans-62.7-34.6174.700000112.7D909 L916D909-G912 PolarHBondContact O-N 2.89Å; D909-G912 WeakPolarHBondContact OD1-CA 2.96Å; D909-G912 PolarHBondContact OD1-N 3.42Å; G912-L916 WeakPolarHBondContact O-CB 3.33Å; G912-L916 WeakPolarHBondContact O-CG 3.45Å; G912-L916 PolarHBondContact O-N 3.35Å
913Q61.4Low65Low50 Ų5090.6 Ų90.623%0.23447%0.474CS..Hα-helixtrans-67.5-45.1172.9-99.8-167.6-16.800112.4G279 D909 E910 D911 Y915 L916 E917G279-Q913 VanDerWaalsContact O-CG 3.25Å; G279-Q913 WeakPolarHBondContact O-CG 3.26Å; G279-Q913 PolarHBondContact O-NE2 3.47Å; D909-Q913 PolarHBondContact O-N 2.98Å; E910-Q913 WeakPolarHBondContact O-CB 3.18Å; E910-Q913 PolarHBondContact O-N 3.47Å; D911-Q913 VanDerWaalsContact C-N 3.29Å; D911-Q913 PolarHBondContact O-N 2.87Å; Q913-Y915 VanDerWaalsContact C-N 3.34Å; Q913-L916 PolarHBondContact O-N 3.17Å; Q913-E917 WeakPolarHBondContact O-CG 3.15Å; Q913-E917 PolarHBondContact O-N 2.91Å
914E61.5Low63.7Low129 Ų12990.8 Ų90.860%0.60348%0.484SS*.Hα-helixtrans-61.6-44.6177.4-173.6164.1-162.600110.9E910 D911 L916 E917 I918E910-E914 PolarHBondContact O-N 2.63Å; D911-E914 PolarHBondContact O-N 3.44Å; E914-L916 PolarHBondContact O-N 3.48Å; E914-E917 WeakPolarHBondContact O-CB 3.48Å; E914-E917 PolarHBondContact O-N 3.03Å; E914-E917 VanDerWaalsContact O-N 3.14Å; E914-I918 HydrophobicContact CG-CD1 4.27Å; E914-I918 WeakPolarHBondContact O-CG1 3.49Å; E914-I918 PolarHBondContact O-N 2.7Å
915Y66.1Low62.1Low145 Ų14590.7 Ų90.757%0.56948%0.479SS*.Hα-helixtrans-60.5-44.6174.9-176.2-109.7000112.8D911 Q913 E917 I918 L919D911-Y915 WeakPolarHBondContact O-CB 3.47Å; D911-Y915 PolarHBondContact O-N 3.09Å; Q913-Y915 VanDerWaalsContact C-N 3.34Å; Y915-E917 VanDerWaalsContact C-N 3.29Å; Y915-E917 PolarHBondContact O-N 3.01Å; Y915-I918 PolarHBondContact O-N 2.8Å; Y915-L919 HydrophobicContact CD1-CD1 3.87Å; Y915-L919 HydrophobicContact CD1-CG 4.47Å; Y915-L919 HydrophobicContact CE1-CD1 3.36Å; Y915-L919 HydrophobicContact CE1-CG 4.08Å; Y915-L919 HydrophobicContact CE2-CG 4.47Å; Y915-L919 PolarHBondContact O-N 2.67Å
916L61.8Low60.2Low89 Ų8994 Ų9447%0.46650%0.5SS..Hα-helixtrans-63.9-33.5175-75.7171.6000112.6G912 Q913 E914 A920G912-L916 WeakPolarHBondContact O-CB 3.33Å; G912-L916 WeakPolarHBondContact O-CG 3.45Å; G912-L916 PolarHBondContact O-N 3.35Å; Q913-L916 PolarHBondContact O-N 3.17Å; E914-L916 PolarHBondContact O-N 3.48Å; L916-A920 VanDerWaalsContact O-CB 3.25Å; L916-A920 WeakPolarHBondContact O-CB 3.48Å; L916-A920 PolarHBondContact O-N 3.24Å
917E63.2Low58Low83 Ų8393.3 Ų93.339%0.38851%0.509SS..Hα-helixtrans-68.6-37.6174.1-74.9-168.3-168.900112.4K283 Q913 E914 Y915 A920 K921K283-E917 WeakPolarHBondContact CE-OE1 3.24Å; K283-E917 IonicContact NZ-OE1 2.61Å; K283-E917 PolarHBondContact NZ-OE1 3.37Å; K283-E917 IonicContact NZ-OE2 2.87Å; K283-E917 PolarHBondContact NZ-OE2 3.38Å; Q913-E917 WeakPolarHBondContact O-CG 3.15Å; Q913-E917 PolarHBondContact O-N 2.91Å; E914-E917 WeakPolarHBondContact O-CB 3.48Å; E914-E917 PolarHBondContact O-N 3.03Å; E914-E917 VanDerWaalsContact O-N 3.14Å; Y915-E917 VanDerWaalsContact C-N 3.29Å; Y915-E917 PolarHBondContact O-N 3.01Å; E917-A920 PolarHBondContact O-N 3.34Å; E917-K921 PolarHBondContact O-N 3Å
918I65.6Low55.7Low80 Ų8098.6 Ų98.641%0.4154%0.538SS..Hα-helixtrans-64.2-49.8173.9-66.5164.5000110E914 Y915 A920 K921 Q922E914-I918 HydrophobicContact CG-CD1 4.27Å; E914-I918 WeakPolarHBondContact O-CG1 3.49Å; E914-I918 PolarHBondContact O-N 2.7Å; Y915-I918 PolarHBondContact O-N 2.8Å; I918-A920 VanDerWaalsContact C-N 3.31Å; I918-A920 PolarHBondContact O-N 3.14Å; I918-K921 WeakPolarHBondContact O-CB 3.4Å; I918-K921 PolarHBondContact O-N 3.05Å; I918-K921 VanDerWaalsContact O-N 3.16Å; I918-Q922 PolarHBondContact O-N 2.83Å
919L59.8Low54Low66 Ų66102.1 Ų102.135%0.34656%0.558SS.*Hα-helixtrans-60.6-39.5176.8-74.1176.5000112.5Y915 K921 Q922 A923Y915-L919 HydrophobicContact CD1-CD1 3.87Å; Y915-L919 HydrophobicContact CD1-CG 4.47Å; Y915-L919 HydrophobicContact CE1-CD1 3.36Å; Y915-L919 HydrophobicContact CE1-CG 4.08Å; Y915-L919 HydrophobicContact CE2-CG 4.47Å; Y915-L919 PolarHBondContact O-N 2.67Å; L919-K921 VanDerWaalsContact C-N 3.34Å; L919-Q922 PolarHBondContact O-N 3.33Å; L919-A923 WeakPolarHBondContact O-CB 3.43Å; L919-A923 PolarHBondContact O-N 2.9Å
920A59.3Low52.2Low64 Ų64105.9 Ų105.953%0.52957%0.572SS.*Hα-helixtrans-68.1-32.8177.900000112.6L916 E917 I918 G924L916-A920 VanDerWaalsContact O-CB 3.25Å; L916-A920 WeakPolarHBondContact O-CB 3.48Å; L916-A920 PolarHBondContact O-N 3.24Å; E917-A920 PolarHBondContact O-N 3.34Å; I918-A920 VanDerWaalsContact C-N 3.31Å; I918-A920 PolarHBondContact O-N 3.14Å; A920-G924 PolarHBondContact O-N 3.35Å
921K55.8Low50.6Low141 Ų141106.4 Ų106.461%0.61358%0.58SS**Hα-helixtrans-66.2-49.7170.5-82.2176.9172.5-179.40111.1E917 I918 L919 A923 G924 E925E917-K921 PolarHBondContact O-N 3Å; I918-K921 WeakPolarHBondContact O-CB 3.4Å; I918-K921 PolarHBondContact O-N 3.05Å; I918-K921 VanDerWaalsContact O-N 3.16Å; L919-K921 VanDerWaalsContact C-N 3.34Å; K921-A923 VanDerWaalsContact C-N 3.28Å; K921-A923 PolarHBondContact O-N 3.31Å; K921-G924 PolarHBondContact O-N 3.14Å; K921-E925 PolarHBondContact O-N 3.22Å; K921-E925 VanDerWaalsContact O-N 3.09Å
922Q53.1Low49.1Very low118 Ų118109.1 Ų109.155%0.55158%0.581SS**Hα-helixtrans-59-37.9178.1-73.5178.3-18.900112.5I918 L919 G924I918-Q922 PolarHBondContact O-N 2.83Å; L919-Q922 PolarHBondContact O-N 3.33Å; Q922-G924 VanDerWaalsContact C-N 3.34Å
923A53.3Low47.9Very low76 Ų76116.1 Ų116.163%0.62861%0.608SS**Hα-helixtrans-77.4-16.417700000114.3L919 K921L919-A923 WeakPolarHBondContact O-CB 3.43Å; L919-A923 PolarHBondContact O-N 2.9Å; K921-A923 VanDerWaalsContact C-N 3.28Å; K921-A923 PolarHBondContact O-N 3.31Å
924G43.8Very low46.5Very low58 Ų58122.9 Ų122.960%0.59864%0.64SS**Hα-helixtrans-98.7-16.3-177.400000114.5A920 K921 Q922 D926A920-G924 PolarHBondContact O-N 3.35Å; K921-G924 PolarHBondContact O-N 3.14Å; Q922-G924 VanDerWaalsContact C-N 3.34Å; G924-D926 PolarHBondContact O-N 3.15Å; G924-D926 VanDerWaalsContact O-N 3.12Å
925E37.6Very low45.3Very low135 Ų135121.6 Ų121.663%0.63164%0.638SS**  trans-86.759.4176.9-74.1172.9-177.400111.1K921 G927K921-E925 PolarHBondContact O-N 3.22Å; K921-E925 VanDerWaalsContact O-N 3.09Å; E925-G927 PolarHBondContact O-N 3.38Å
926D38.3Very low44Very low167 Ų167119.2 Ų119.289%0.89364%0.635SS**  trans-72.485.3153.7-81.1-33.4000107.6G924G924-D926 PolarHBondContact O-N 3.15Å; G924-D926 VanDerWaalsContact O-N 3.12Å
927G34.9Very low43Very low57 Ų57116.8 Ų116.859%0.58863%0.627SS**SBendtrans128.336.3149.100000120.8E925E925-G927 PolarHBondContact O-N 3.38Å
928D30.9Very low42.3Very low155 Ų155120.2 Ų120.283%0.82964%0.643SS**  trans-138.788.9158.4-82-38.1000109.9E930D928-E930 VanDerWaalsContact C-N 3.29Å; D928-E930 PolarHBondContact O-N 2.85Å
929D35.9Very low41.8Very low155 Ų155122 Ų12283%0.82965%0.65SS**  trans-67.466.9177.8-64.1-42.7000112.7
930E32.5Very low42.2Very low164 Ų164120.2 Ų120.277%0.76664%0.642SS**  trans-128.6-2.6176.9-75-169.9179.300116.9D928D928-E930 VanDerWaalsContact C-N 3.29Å; D928-E930 PolarHBondContact O-N 2.85Å
931D30.1Very low43Very low157 Ų157121.7 Ų121.784%0.8465%0.654SS**SBendtrans-107.97.8179.3-77.3-19.2000115.1
932W29Very low44.4Very low184 Ų184115.1 Ų115.170%0.69763%0.626SS**  trans-100.715.6178.7-66.388.5000114.7E934W932-E934 VanDerWaalsContact C-N 3.33Å; W932-E934 PolarHBondContact O-N 3.39Å
933E31Very low45.7Very low165 Ų165111 Ų11177%0.77161%0.606SS**THydrogen-bonded Turntrans-80.2-1.8-177.3-73.5-166.1172.100115.1
934E32.2Very low47.1Very low193 Ų193110.5 Ų110.590%0.90261%0.608SS**THydrogen-bonded Turntrans-96.2-15.1-180-82.5-174.9168.700115.6W932W932-E934 VanDerWaalsContact C-N 3.33Å; W932-E934 PolarHBondContact O-N 3.39Å
935D37Very low49.3Very low102 Ų102109.3 Ų109.355%0.54559%0.586SS.*  trans-996.9-177.5-70.5-24000115A937 E938D935-A937 PolarHBondContact O-N 2.88Å; D935-E938 PolarHBondContact O-N 3.42Å
936D38.1Very low51.6Low95 Ų95106 Ų10651%0.50858%0.578SS.*THydrogen-bonded Turntrans-64.513-179.3-82.7-18.9000115.7
937A41.5Very low54Low38 Ų3898.5 Ų98.531%0.31454%0.538SS..THydrogen-bonded Turntrans-121.57.3-177.900000114.6C878 D935C878-A937 HydrophobicContact CB-CB 4.37Å; D935-A937 PolarHBondContact O-N 2.88Å
938E48.7Very low56.5Low154 Ų15498.6 Ų98.672%0.7253%0.525SS*.SBendtrans-65.1137.8166.9-71.2-171.7162.200110.7D935 T940D935-E938 PolarHBondContact O-N 3.42Å; E938-T940 PolarHBondContact O-N 3.49Å
939E55.4Low59.2Low118 Ų11891.3 Ų91.355%0.55149%0.486SS*.PPolyproline II helixtrans-57.8128.5172.7-67.7-176.2170.500109H879 E943H879-E939 IonicContact CE1-OE1 2.89Å; H879-E939 PolarHBondContact CE1-OE1 3.25Å; H879-E939 IonicContact ND1-OE1 2.56Å; H879-E939 PolarHBondContact ND1-OE1 3.29Å; E939-E943 WeakPolarHBondContact CA-OE2 3.47Å; E939-E943 WeakPolarHBondContact CB-OE2 3.47Å
940T68.9Low61.6Low29 Ų2986.1 Ų86.118%0.17846%0.458CS..PPolyproline II helixtrans-67.8145.7176.965.60000108.8L829 E938 L942 E943L829-T940 HydrophobicContact CB-CG2 4.43Å; E938-T940 PolarHBondContact O-N 3.49Å; T940-L942 PolarHBondContact O-N 3.34Å; T940-E943 WeakPolarHBondContact O-CB 3.34Å; T940-E943 WeakPolarHBondContact O-CG 3.49Å; T940-E943 PolarHBondContact O-N 3.48Å; T940-E943 VanDerWaalsContact OG1-CG 3.31Å; T940-E943 WeakPolarHBondContact OG1-CG 3.41Å
941A74.6Confident63.8Low94 Ų9482.5 Ų82.578%0.77744%0.444SS*.G310 helixtrans-54.3-26.1-174.700000113.7
942L84.7Confident65.7Low4 Ų481.4 Ų81.42%0.02143%0.434CS..G310 helixtrans-80.2-8.7178.1-64.5172.3000114.5C736 M781 T940 G944 Y945C736-L942 HydrophobicContact CB-CD1 3.76Å; M781-L942 HydrophobicContact CG-CD1 3.91Å; M781-L942 HydrophobicContact SD-CD1 3.72Å; T940-L942 PolarHBondContact O-N 3.34Å; L942-G944 PolarHBondContact O-N 3.21Å; L942-Y945 HydrophobicContact CD2-CD2 4Å; L942-Y945 HydrophobicContact CD2-CE2 3.86Å; L942-Y945 PolarHBondContact O-N 3.01Å
943E80.4Confident67.6Low30 Ų3077.5 Ų77.514%0.1443%0.427CS..G310 helixtrans-69.4-19.4174.8-58.3-154.6121.200112.5G830 L831 H832 E939 T940 Y945G830-E943 WeakPolarHBondContact CA-OE1 3.45Å; L831-E943 WeakPolarHBondContact CA-OE1 3.3Å; L831-E943 PolarHBondContact N-OE1 2.95Å; H832-E943 WeakPolarHBondContact CB-OE1 3.23Å; H832-E943 PolarHBondContact N-OE1 3.39Å; E939-E943 WeakPolarHBondContact CA-OE2 3.47Å; E939-E943 WeakPolarHBondContact CB-OE2 3.47Å; T940-E943 WeakPolarHBondContact O-CB 3.34Å; T940-E943 WeakPolarHBondContact O-CG 3.49Å; T940-E943 PolarHBondContact O-N 3.48Å; T940-E943 VanDerWaalsContact OG1-CG 3.31Å; T940-E943 WeakPolarHBondContact OG1-CG 3.41Å; E943-Y945 PolarHBondContact O-N 3.05Å; E943-Y945 VanDerWaalsContact O-N 3.14Å
944G82.9Confident69.5Low66 Ų6671.5 Ų71.568%0.6840%0.4SS*.G310 helixtrans-58.3-22.9169.400000113.5L942 S946L942-G944 PolarHBondContact O-N 3.21Å; G944-S946 VanDerWaalsContact C-N 3.33Å; G944-S946 PolarHBondContact O-N 2.93Å; G944-S946 VanDerWaalsContact O-N 3.1Å
945Y89.9Confident71.4Confident33 Ų3367.4 Ų67.413%0.12939%0.39CS..SBendtrans-8770.7175.1-59.5-68.8000111.8M694 P695 H698 H737 K740 L942 E943M694-Y945 HydrophobicContact CB-CE1 4.36Å; M694-Y945 HydrophobicContact CE-CD1 3.9Å; M694-Y945 HydrophobicContact CE-CD2 4.33Å; M694-Y945 HydrophobicContact CE-CE1 4.15Å; M694-Y945 HydrophobicContact CE-CG 3.99Å; M694-Y945 HydrophobicContact CG-CD1 4.2Å; M694-Y945 HydrophobicContact CG-CE1 3.51Å; M694-Y945 HydrophobicContact CG-CE2 4.07Å; M694-Y945 VanDerWaalsContact CG-CZ 3.43Å; M694-Y945 WeakPolarHBondContact CG-OH 3.43Å; P695-Y945 HydrophobicContact CG-CE1 4.22Å; H698-Y945 HydrophobicContact CB-CD1 4.03Å; H698-Y945 AromaticContact CD2-CD1 3.91Å; H698-Y945 AromaticContact CG-CD1 3.97Å; H737-Y945 AromaticContact CD2-CE2 3.7Å; H737-Y945 AromaticContact CD2-CZ 3.92Å; H737-Y945 PolarHBondContact CD2-OH 3.37Å; H737-Y945 AromaticContact NE2-CE2 3.8Å; K740-Y945 HydrophobicContact CG-CD2 4.32Å; L942-Y945 HydrophobicContact CD2-CD2 4Å; L942-Y945 HydrophobicContact CD2-CE2 3.86Å; L942-Y945 PolarHBondContact O-N 3.01Å; E943-Y945 PolarHBondContact O-N 3.05Å; E943-Y945 VanDerWaalsContact O-N 3.14Å
946S87.1Confident73.5Confident67 Ų6763.6 Ų63.647%0.46937%0.37SS..  trans-56.4149.9-178.963.60000113.5H698 G944H698-S946 PolarHBondContact CE1-O 3.39Å; H698-S946 PolarHBondContact NE2-O 3.43Å; G944-S946 VanDerWaalsContact C-N 3.33Å; G944-S946 PolarHBondContact O-N 2.93Å; G944-S946 VanDerWaalsContact O-N 3.1Å
947T89.1Confident75.9Confident8 Ų860 Ų605%0.04935%0.351CS..  trans-126.2170.2176.472.10000110.5V744 L747 H832 I949 D950V744-T947 HydrophobicContact CB-CG2 4.42Å; V744-T947 HydrophobicContact CG2-CG2 3.84Å; L747-T947 HydrophobicContact CD1-CG2 4.09Å; H832-T947 PolarHBondContact CE1-OG1 2.93Å; T947-I949 PolarHBondContact O-N 3.3Å; T947-I949 WeakPolarHBondContact OG1-CG1 3.38Å; T947-I949 PolarHBondContact OG1-N 3.46Å; T947-D950 WeakPolarHBondContact CB-OD2 3.49Å; T947-D950 PolarHBondContact N-OD2 3.04Å; T947-D950 PolarHBondContact O-N 2.86Å; T947-D950 PolarHBondContact OG1-OD2 2.94Å
948I87Confident78.4Confident60 Ų6058.2 Ų58.231%0.30834%0.336SS..THydrogen-bonded Turntrans-54.7-27.3175.152162.5000113.7L747 D950 N954L747-I948 WeakPolarHBondContact O-CD1 3.49Å; I948-D950 VanDerWaalsContact C-N 3.27Å; I948-N954 WeakPolarHBondContact O-CB 3.46Å; I948-N954 PolarHBondContact O-ND2 3.33Å
949I86.9Confident80.5Confident2 Ų251 Ų511%0.0130%0.302CS..THydrogen-bonded Turntrans-77.8-16.2179.959148.6000112.5L747 Y791 K835 M836 L839 T947 V956L747-I949 HydrophobicContact CD1-CD1 4.4Å; L747-I949 HydrophobicContact CD1-CG1 4.3Å; Y791-I949 HydrophobicContact CE1-CG2 4.36Å; K835-I949 HydrophobicContact CD-CD1 4.46Å; K835-I949 VanDerWaalsContact CE-O 3.26Å; K835-I949 WeakPolarHBondContact CE-O 3.47Å; K835-I949 PolarHBondContact NZ-O 3.48Å; M836-I949 HydrophobicContact CG-CD1 3.45Å; M836-I949 VanDerWaalsContact CG-CD1 3.45Å; M836-I949 HydrophobicContact SD-CD1 3.25Å; M836-I949 WeakPolarHBondContact SD-CD1 3.33Å; M836-I949 HydrophobicContact SD-CG1 4.34Å; L839-I949 HydrophobicContact CD1-CD1 4.41Å; L839-I949 HydrophobicContact CD1-CG2 4.46Å; T947-I949 PolarHBondContact O-N 3.3Å; T947-I949 WeakPolarHBondContact OG1-CG1 3.38Å; T947-I949 PolarHBondContact OG1-N 3.46Å; I949-V956 HydrophobicContact CG2-CG1 4.41Å
950D86.1Confident82.2Confident46 Ų4646.9 Ų46.925%0.24628%0.283CS..THydrogen-bonded Turntrans-88.6-21.5-178.9-51.4-49000111.4H832 T947 I948 E952H832-D950 IonicContact CE1-OD1 2.89Å; H832-D950 IonicContact CE1-OD2 3.9Å; H832-D950 PolarHBondContact CE1-OD2 3.31Å; H832-D950 IonicContact CG-OD1 3.17Å; H832-D950 IonicContact ND1-OD1 2.72Å; H832-D950 PolarHBondContact ND1-OD1 2.99Å; H832-D950 IonicContact ND1-OD2 3.9Å; H832-D950 PolarHBondContact ND1-OD2 3.31Å; T947-D950 WeakPolarHBondContact CB-OD2 3.49Å; T947-D950 PolarHBondContact N-OD2 3.04Å; T947-D950 PolarHBondContact O-N 2.86Å; T947-D950 PolarHBondContact OG1-OD2 2.94Å; I948-D950 VanDerWaalsContact C-N 3.27Å; D950-E952 PolarHBondContact O-N 3.13Å
951D78.6Confident83.4Confident88 Ų8847.7 Ų47.747%0.47129%0.286SS..  trans-56.3120.6174.8-176.6-3.6000111.8D953 N954D951-D953 PolarHBondContact O-N 2.94Å; D951-D953 PolarHBondContact OD1-N 3.24Å; D951-N954 HydrophobicContact CB-CB 4.25Å; D951-N954 VanDerWaalsContact O-CB 3.31Å; D951-N954 WeakPolarHBondContact O-CB 3.42Å; D951-N954 PolarHBondContact O-N 3.11Å
952E70.8Confident84.4Confident133 Ų13343.4 Ų43.462%0.62125%0.25SC*.THydrogen-bonded Turntrans-56.4-29.2177.4-72.1-139.9127.600113.2D950 N954 K1009D950-E952 PolarHBondContact O-N 3.13Å; E952-N954 VanDerWaalsContact C-N 3.31Å; E952-K1009 IonicContact OE2-NZ 3.75Å
953D68.2Low84.8Confident103 Ų10344.2 Ų44.255%0.55125%0.253SS*.THydrogen-bonded Turntrans-84.8-5.5-179.2-79.7-16.7000112.9D951 K1013D951-D953 PolarHBondContact O-N 2.94Å; D951-D953 PolarHBondContact OD1-N 3.24Å; D953-K1013 IonicContact OD1-NZ 3.62Å; D953-K1013 PolarHBondContact OD1-NZ 3.4Å; D953-K1013 IonicContact OD2-NZ 2.76Å; D953-K1013 PolarHBondContact OD2-NZ 3.16Å
954N71.5Confident85.5Confident39 Ų3944.7 Ų44.721%0.20926%0.263CS..SBendtrans-76.2129.6174.9-166.9-28.3000110.9I948 D951 E952 V956I948-N954 WeakPolarHBondContact O-CB 3.46Å; I948-N954 PolarHBondContact O-ND2 3.33Å; D951-N954 HydrophobicContact CB-CB 4.25Å; D951-N954 VanDerWaalsContact O-CB 3.31Å; D951-N954 WeakPolarHBondContact O-CB 3.42Å; D951-N954 PolarHBondContact O-N 3.11Å; E952-N954 VanDerWaalsContact C-N 3.31Å; N954-V956 PolarHBondContact O-N 3.13Å; N954-V956 WeakPolarHBondContact OD1-CG2 3.45Å; N954-V956 PolarHBondContact OD1-N 3.4Å
955P72.4Confident85.9Confident107 Ų10742.7 Ų42.770%0.69524%0.236SC*.  trans-64.93.1176.427.6-38.5000115.6D957P955-D957 PolarHBondContact O-N 3.46Å
956V81.5Confident86.1Confident22 Ų2242.6 Ų42.613%0.13324%0.236CC..  trans-78.697.5179.5175.90000110.3K835 L839 I949 N954 I961K835-V956 PolarHBondContact NZ-O 2.84Å; L839-V956 HydrophobicContact CD1-CG1 3.78Å; L839-V956 HydrophobicContact CD2-CG1 4.06Å; I949-V956 HydrophobicContact CG2-CG1 4.41Å; N954-V956 PolarHBondContact O-N 3.13Å; N954-V956 WeakPolarHBondContact OD1-CG2 3.45Å; N954-V956 PolarHBondContact OD1-N 3.4Å; V956-I961 HydrophobicContact CG1-CD1 3.9Å
957D88.4Confident86.3Confident19 Ų1943.9 Ų43.910%0.10224%0.235CC..  trans-111.4114.5172.9178.6-49.7000110.2P955 Y959 Q960 I961 R1002P955-D957 PolarHBondContact O-N 3.46Å; D957-Y959 VanDerWaalsContact C-N 3.33Å; D957-Y959 PolarHBondContact O-N 3.26Å; D957-Y959 WeakPolarHBondContact OD1-CA 3.37Å; D957-Y959 WeakPolarHBondContact OD1-CB 3.46Å; D957-Y959 PolarHBondContact OD1-N 2.74Å; D957-Q960 HydrophobicContact CB-CB 4.02Å; D957-Q960 HydrophobicContact CB-CG 4.05Å; D957-Q960 VanDerWaalsContact CG-NE2 3.33Å; D957-Q960 PolarHBondContact O-N 3.4Å; D957-Q960 WeakPolarHBondContact OD1-CG 3.32Å; D957-Q960 PolarHBondContact OD1-N 2.79Å; D957-Q960 PolarHBondContact OD2-NE2 3.49Å; D957-I961 WeakPolarHBondContact O-CB 3.29Å; D957-I961 VanDerWaalsContact O-CG1 3.23Å; D957-I961 WeakPolarHBondContact O-CG1 3.31Å; D957-I961 PolarHBondContact O-N 3.47Å; D957-R1002 WeakPolarHBondContact OD2-CB 3.22Å; D957-R1002 IonicContact OD2-NE 3.93Å
958E92.6Very high86.5Confident0 Ų046.7 Ų46.70%025%0.252CS..Hα-helixtrans-64.5-31.8-17567.2-69157.600113.5K835 V838 L839 F869 L872 Y876 F962 R1002K835-E958 WeakPolarHBondContact CE-OE2 3.48Å; K835-E958 HydrophobicContact CG-CB 4.26Å; K835-E958 HydrophobicContact CG-CG 4.22Å; K835-E958 IonicContact NZ-OE2 3.71Å; V838-E958 HydrophobicContact CB-CB 4.35Å; V838-E958 HydrophobicContact CG1-CB 3.85Å; V838-E958 HydrophobicContact CG1-CG 4.37Å; L839-E958 HydrophobicContact CD2-CB 4.11Å; L839-E958 HydrophobicContact CG-CB 4.35Å; F869-E958 HydrophobicContact CE1-CG 4.25Å; L872-E958 HydrophobicContact CD1-CG 3.91Å; Y876-E958 WeakPolarHBondContact CE2-OE1 3.09Å; Y876-E958 PolarHBondContact OH-OE1 3.29Å; E958-F962 VanDerWaalsContact O-CB 3.23Å; E958-F962 WeakPolarHBondContact O-CB 3.49Å; E958-F962 PolarHBondContact O-N 3.25Å; E958-R1002 IonicContact OE1-CZ 3.89Å; E958-R1002 IonicContact OE1-NH1 3.6Å; E958-R1002 PolarHBondContact OE1-NH1 2.96Å; E958-R1002 IonicContact OE1-NH2 3.92Å
959Y93.1Very high86.7Confident2 Ų244.1 Ų44.11%0.00824%0.239CC..Hα-helixtrans-71.1-43.8175.2-73.2-100.1000110.9F869 L872 Y876 D957 K963 I995 L998 A999F869-Y959 HydrophobicContact CB-CE1 4.24Å; F869-Y959 AromaticContact CD1-CD1 3.66Å; F869-Y959 HydrophobicContact CD1-CD1 3.66Å; F869-Y959 HydrophobicContact CD1-CD2 4.12Å; F869-Y959 AromaticContact CD1-CE1 3.26Å; F869-Y959 HydrophobicContact CD1-CE1 3.26Å; F869-Y959 AromaticContact CD1-CE2 3.77Å; F869-Y959 HydrophobicContact CD1-CE2 3.77Å; F869-Y959 HydrophobicContact CD1-CG 4.07Å; F869-Y959 AromaticContact CD1-CZ 3.35Å; F869-Y959 AromaticContact CE1-CD1 3.64Å; F869-Y959 HydrophobicContact CE1-CD1 3.64Å; F869-Y959 AromaticContact CE1-CD2 3.84Å; F869-Y959 HydrophobicContact CE1-CD2 3.84Å; F869-Y959 AromaticContact CE1-CE1 3.76Å; F869-Y959 HydrophobicContact CE1-CE1 3.76Å; F869-Y959 AromaticContact CE1-CE2 3.95Å; F869-Y959 HydrophobicContact CE1-CE2 3.95Å; F869-Y959 AromaticContact CE1-CG 3.69Å; F869-Y959 HydrophobicContact CE1-CG 3.69Å; F869-Y959 AromaticContact CE1-CZ 3.94Å; F869-Y959 HydrophobicContact CG-CD1 4.48Å; F869-Y959 AromaticContact CG-CE1 3.97Å; F869-Y959 HydrophobicContact CG-CE1 3.97Å; F869-Y959 HydrophobicContact CZ-CD1 4.47Å; F869-Y959 PolarHBondContact O-OH 2.93Å; L872-Y959 HydrophobicContact CB-CE2 4.45Å; L872-Y959 HydrophobicContact CD1-CE2 4.47Å; Y876-Y959 HydrophobicContact CE2-CE2 4.34Å; D957-Y959 VanDerWaalsContact C-N 3.33Å; D957-Y959 PolarHBondContact O-N 3.26Å; D957-Y959 WeakPolarHBondContact OD1-CA 3.37Å; D957-Y959 WeakPolarHBondContact OD1-CB 3.46Å; D957-Y959 PolarHBondContact OD1-N 2.74Å; Y959-K963 WeakPolarHBondContact O-CB 3.41Å; Y959-K963 PolarHBondContact O-N 3.39Å; Y959-I995 HydrophobicContact CD1-CG2 3.93Å; Y959-I995 HydrophobicContact CE1-CG2 4.3Å; Y959-L998 HydrophobicContact CD1-CB 4.37Å; Y959-L998 HydrophobicContact CD1-CD2 4.14Å; Y959-L998 HydrophobicContact CD1-CG 4.26Å; Y959-L998 HydrophobicContact CE1-CB 4.48Å; Y959-L998 HydrophobicContact CE1-CD2 3.54Å; Y959-L998 HydrophobicContact CE1-CG 4.16Å; Y959-A999 WeakPolarHBondContact O-CB 3.28Å
960Q92.6Very high86.9Confident33 Ų3348.3 Ų48.315%0.15426%0.258CS..Hα-helixtrans-68.5-41.9179-68.6-174.661.500112D957 K963 A964 R1003D957-Q960 HydrophobicContact CB-CB 4.02Å; D957-Q960 HydrophobicContact CB-CG 4.05Å; D957-Q960 VanDerWaalsContact CG-NE2 3.33Å; D957-Q960 PolarHBondContact O-N 3.4Å; D957-Q960 WeakPolarHBondContact OD1-CG 3.32Å; D957-Q960 PolarHBondContact OD1-N 2.79Å; D957-Q960 PolarHBondContact OD2-NE2 3.49Å; Q960-K963 PolarHBondContact O-N 3.28Å; Q960-A964 WeakPolarHBondContact O-CB 3.3Å; Q960-A964 PolarHBondContact O-N 3.04Å; Q960-R1003 HydrophobicContact CG-CB 4.24Å
961I93Very high87.1Confident45 Ų4552.4 Ų52.423%0.23128%0.28CS..Hα-helixtrans-62.3-50.3176.6-71.8167000110L839 C842 V956 D957 K963 A964 I965L839-I961 HydrophobicContact CD2-CB 4.47Å; L839-I961 HydrophobicContact CD2-CD1 3.61Å; L839-I961 HydrophobicContact CD2-CG2 4.34Å; C842-I961 HydrophobicContact CB-CG2 4.16Å; V956-I961 HydrophobicContact CG1-CD1 3.9Å; D957-I961 WeakPolarHBondContact O-CB 3.29Å; D957-I961 VanDerWaalsContact O-CG1 3.23Å; D957-I961 WeakPolarHBondContact O-CG1 3.31Å; D957-I961 PolarHBondContact O-N 3.47Å; I961-K963 VanDerWaalsContact C-N 3.34Å; I961-K963 PolarHBondContact O-N 2.97Å; I961-A964 PolarHBondContact O-N 3.35Å; I961-I965 HydrophobicContact CG2-CD1 3.68Å; I961-I965 PolarHBondContact O-N 3.06Å
962F95.8Very high87.7Confident4 Ų454.8 Ų54.82%0.01828%0.283CS..Hα-helixtrans-54.7-49.9176.6169.6-106.3000111.7C842 L862 F865 F869 E958 A964 I965 F966 L992 I995C842-F962 VanDerWaalsContact SG-CA 3.53Å; L862-F962 HydrophobicContact CD2-CE2 4.38Å; L862-F962 HydrophobicContact CD2-CZ 4.34Å; F865-F962 HydrophobicContact CB-CE2 4.27Å; F865-F962 AromaticContact CD1-CD2 3.68Å; F865-F962 HydrophobicContact CD1-CD2 3.68Å; F865-F962 AromaticContact CD1-CE2 3.79Å; F865-F962 HydrophobicContact CD1-CE2 3.79Å; F865-F962 HydrophobicContact CD2-CD2 4.29Å; F865-F962 AromaticContact CD2-CE2 3.68Å; F865-F962 HydrophobicContact CD2-CE2 3.68Å; F865-F962 AromaticContact CE1-CD2 3.52Å; F865-F962 HydrophobicContact CE1-CD2 3.52Å; F865-F962 AromaticContact CE1-CE2 3.92Å; F865-F962 HydrophobicContact CE1-CE2 3.92Å; F865-F962 HydrophobicContact CE1-CG 4.47Å; F865-F962 HydrophobicContact CE2-CD2 4.14Å; F865-F962 AromaticContact CE2-CE2 3.81Å; F865-F962 HydrophobicContact CE2-CE2 3.81Å; F865-F962 HydrophobicContact CG-CD2 4.06Å; F865-F962 AromaticContact CG-CE2 3.66Å; F865-F962 HydrophobicContact CG-CE2 3.66Å; F865-F962 HydrophobicContact CG-CZ 4.37Å; F865-F962 AromaticContact CZ-CD2 3.74Å; F865-F962 HydrophobicContact CZ-CD2 3.74Å; F865-F962 AromaticContact CZ-CE2 3.9Å; F865-F962 HydrophobicContact CZ-CE2 3.9Å; F869-F962 HydrophobicContact CE2-CB 4.08Å; F869-F962 AromaticContact CE2-CD1 3.61Å; F869-F962 HydrophobicContact CE2-CD1 3.61Å; F869-F962 HydrophobicContact CE2-CD2 4.12Å; F869-F962 HydrophobicContact CE2-CE1 4.04Å; F869-F962 AromaticContact CE2-CG 3.65Å; F869-F962 HydrophobicContact CE2-CG 3.65Å; F869-F962 HydrophobicContact CE2-CZ 4.47Å; F869-F962 HydrophobicContact CZ-CB 3.64Å; F869-F962 AromaticContact CZ-CD1 3.9Å; F869-F962 HydrophobicContact CZ-CD1 3.9Å; F869-F962 AromaticContact CZ-CG 3.76Å; F869-F962 HydrophobicContact CZ-CG 3.76Å; E958-F962 VanDerWaalsContact O-CB 3.23Å; E958-F962 WeakPolarHBondContact O-CB 3.49Å; E958-F962 PolarHBondContact O-N 3.25Å; F962-A964 PolarHBondContact O-N 3.4Å; F962-I965 PolarHBondContact O-N 3.29Å; F962-F966 HydrophobicContact CE2-CB 4.49Å; F962-F966 HydrophobicContact CZ-CB 4.47Å; F962-F966 HydrophobicContact CZ-CG 4.34Å; F962-F966 VanDerWaalsContact O-CB 3.23Å; F962-F966 WeakPolarHBondContact O-CB 3.42Å; F962-F966 PolarHBondContact O-N 3.04Å; F962-L992 HydrophobicContact CE1-CD2 4.18Å; F962-L992 HydrophobicContact CZ-CD2 3.86Å; F962-I995 HydrophobicContact CD1-CG2 3.96Å; F962-I995 HydrophobicContact CE1-CG2 4.02Å
963K93.6Very high88.7Confident21 Ų2151.2 Ų51.29%0.09127%0.268CS..Hα-helixtrans-60.1-46180-179.3174.3-176.9170.50112.4Y959 Q960 I961 F966 Q967 A996 A999 D1000Y959-K963 WeakPolarHBondContact O-CB 3.41Å; Y959-K963 PolarHBondContact O-N 3.39Å; Q960-K963 PolarHBondContact O-N 3.28Å; I961-K963 VanDerWaalsContact C-N 3.34Å; I961-K963 PolarHBondContact O-N 2.97Å; K963-F966 PolarHBondContact O-N 3.35Å; K963-Q967 WeakPolarHBondContact O-CB 3.47Å; K963-Q967 VanDerWaalsContact O-CG 3.27Å; K963-Q967 WeakPolarHBondContact O-CG 3.46Å; K963-Q967 PolarHBondContact O-N 3.06Å; K963-A996 HydrophobicContact CD-CB 4.37Å; K963-A996 PolarHBondContact NZ-O 3.15Å; K963-A999 HydrophobicContact CB-CB 4.19Å; K963-A999 HydrophobicContact CD-CB 3.86Å; K963-D1000 IonicContact NZ-OD1 2.81Å; K963-D1000 PolarHBondContact NZ-OD1 3.31Å; K963-D1000 IonicContact NZ-OD2 2.79Å; K963-D1000 PolarHBondContact NZ-OD2 2.85Å
964A93.4Very high89.7Confident41 Ų4150.1 Ų50.134%0.33927%0.266SS..Hα-helixtrans-62.9-44.5-17900000111.7Q960 I961 F962 T968Q960-A964 WeakPolarHBondContact O-CB 3.3Å; Q960-A964 PolarHBondContact O-N 3.04Å; I961-A964 PolarHBondContact O-N 3.35Å; F962-A964 PolarHBondContact O-N 3.4Å; A964-T968 WeakPolarHBondContact O-CB 3.42Å; A964-T968 PolarHBondContact O-N 3.22Å; A964-T968 PolarHBondContact O-OG1 3.11Å
965I93.2Very high90.6Very high24 Ų2453.6 Ų53.612%0.12329%0.289CS..Hα-helixtrans-66.3-46.6177.7-73167.8000110.5C842 I845 D846 I961 F962 Q967 T968 I969C842-I965 HydrophobicContact CB-CD1 3.72Å; I845-I965 HydrophobicContact CD1-CG2 3.95Å; I845-I965 HydrophobicContact CG1-CG2 3.87Å; D846-I965 HydrophobicContact CB-CD1 4.36Å; D846-I965 HydrophobicContact CB-CG1 4.41Å; D846-I965 HydrophobicContact CB-CG2 3.79Å; I961-I965 HydrophobicContact CG2-CD1 3.68Å; I961-I965 PolarHBondContact O-N 3.06Å; F962-I965 PolarHBondContact O-N 3.29Å; I965-Q967 VanDerWaalsContact C-N 3.32Å; I965-Q967 PolarHBondContact O-N 3.44Å; I965-T968 CarbonylContact O-C 3.57Å; I965-T968 WeakPolarHBondContact O-CA 3.39Å; I965-T968 WeakPolarHBondContact O-CB 3.33Å; I965-T968 PolarHBondContact O-N 3.33Å; I965-I969 HydrophobicContact CG2-CD1 3.69Å; I965-I969 HydrophobicContact CG2-CG1 4.32Å; I965-I969 WeakPolarHBondContact O-CG1 3.49Å; I965-I969 PolarHBondContact O-N 3.49Å
966F92.5Very high91.6Very high30 Ų3048.8 Ų48.813%0.13226%0.257CS..Hα-helixtrans-62.1-39.8-178.3-166-117.4000112.4L862 F962 K963 I969 Q970 Y977 T981L862-F966 HydrophobicContact CD1-CE2 3.96Å; L862-F966 HydrophobicContact CD1-CZ 3.94Å; L862-F966 HydrophobicContact CD2-CD2 4.36Å; L862-F966 HydrophobicContact CD2-CE2 3.76Å; L862-F966 HydrophobicContact CD2-CZ 4.25Å; L862-F966 HydrophobicContact CG-CE2 4.47Å; F962-F966 HydrophobicContact CE2-CB 4.49Å; F962-F966 HydrophobicContact CZ-CB 4.47Å; F962-F966 HydrophobicContact CZ-CG 4.34Å; F962-F966 VanDerWaalsContact O-CB 3.23Å; F962-F966 WeakPolarHBondContact O-CB 3.42Å; F962-F966 PolarHBondContact O-N 3.04Å; K963-F966 PolarHBondContact O-N 3.35Å; F966-I969 PolarHBondContact O-N 3.35Å; F966-Q970 PolarHBondContact O-N 3.32Å; F966-Q970 VanDerWaalsContact O-N 3.09Å; F966-Y977 HydrophobicContact CD1-CE2 4.26Å; F966-Y977 HydrophobicContact CD2-CE2 4.49Å; F966-Y977 AromaticContact CE1-CE2 3.67Å; F966-Y977 HydrophobicContact CE1-CE2 3.67Å; F966-Y977 HydrophobicContact CE2-CD2 4.21Å; F966-Y977 AromaticContact CE2-CE2 3.92Å; F966-Y977 HydrophobicContact CE2-CE2 3.92Å; F966-Y977 HydrophobicContact CZ-CD2 4.2Å; F966-Y977 AromaticContact CZ-CE2 3.48Å; F966-Y977 HydrophobicContact CZ-CE2 3.48Å; F966-Y977 VanDerWaalsContact CZ-CE2 3.48Å; F966-T981 HydrophobicContact CZ-CG2 3.89Å
967Q92.1Very high92.1Very high95 Ų9550.4 Ų50.444%0.44426%0.261SS..Hα-helixtrans-66.5-38.4171.9-72.1178.6-1100112.4K963 I965 Q970 N971K963-Q967 WeakPolarHBondContact O-CB 3.47Å; K963-Q967 VanDerWaalsContact O-CG 3.27Å; K963-Q967 WeakPolarHBondContact O-CG 3.46Å; K963-Q967 PolarHBondContact O-N 3.06Å; I965-Q967 VanDerWaalsContact C-N 3.32Å; I965-Q967 PolarHBondContact O-N 3.44Å; Q967-Q970 WeakPolarHBondContact O-CB 3.46Å; Q967-Q970 PolarHBondContact O-N 3.47Å; Q967-N971 PolarHBondContact O-N 3.04Å; Q967-N971 PolarHBondContact O-ND2 2.91Å
968T92.7Very high92.2Very high67 Ų6755.5 Ų55.541%0.41128%0.284SS..Hα-helixtrans-63.9-44176.5-60.80000110.9A964 I965 Q970 N971 R972A964-T968 WeakPolarHBondContact O-CB 3.42Å; A964-T968 PolarHBondContact O-N 3.22Å; A964-T968 PolarHBondContact O-OG1 3.11Å; I965-T968 CarbonylContact O-C 3.57Å; I965-T968 WeakPolarHBondContact O-CA 3.39Å; I965-T968 WeakPolarHBondContact O-CB 3.33Å; I965-T968 PolarHBondContact O-N 3.33Å; T968-Q970 PolarHBondContact O-N 2.99Å; T968-N971 PolarHBondContact O-N 3.25Å; T968-R972 WeakPolarHBondContact O-CB 3.26Å; T968-R972 PolarHBondContact O-N 3.49Å
969I91.5Very high92.2Very high6 Ų657 Ų573%0.03130%0.297CS..Hα-helixtrans-61.6-43.1176.5-68.9167.3000111.2I845 I965 F966 N971 R972 N973 W976 L980I845-I969 HydrophobicContact CB-CD1 3.9Å; I845-I969 HydrophobicContact CD1-CD1 3.72Å; I845-I969 HydrophobicContact CG1-CD1 3.68Å; I845-I969 WeakPolarHBondContact O-CD1 3.47Å; I965-I969 HydrophobicContact CG2-CD1 3.69Å; I965-I969 HydrophobicContact CG2-CG1 4.32Å; I965-I969 WeakPolarHBondContact O-CG1 3.49Å; I965-I969 PolarHBondContact O-N 3.49Å; F966-I969 PolarHBondContact O-N 3.35Å; I969-N971 PolarHBondContact O-N 3.35Å; I969-R972 PolarHBondContact O-N 3.42Å; I969-N973 CarbonylContact O-C 3.58Å; I969-N973 VanDerWaalsContact O-C 3.3Å; I969-N973 PolarHBondContact O-N 2.93Å; I969-W976 HydrophobicContact CG2-CG 4.38Å; I969-L980 HydrophobicContact CG2-CD1 4.41Å
970Q90.9Very high92.1Very high89 Ų8957 Ų5742%0.41630%0.297SS..Hα-helixtrans-55-39176.4-170.8178.422.500112.3F966 Q967 T968 Y977F966-Q970 PolarHBondContact O-N 3.32Å; F966-Q970 VanDerWaalsContact O-N 3.09Å; Q967-Q970 WeakPolarHBondContact O-CB 3.46Å; Q967-Q970 PolarHBondContact O-N 3.47Å; T968-Q970 PolarHBondContact O-N 2.99Å; Q970-Y977 HydrophobicContact CB-CD2 3.6Å; Q970-Y977 HydrophobicContact CB-CE2 3.69Å; Q970-Y977 HydrophobicContact CB-CG 4.05Å; Q970-Y977 HydrophobicContact CG-CD1 4.1Å; Q970-Y977 HydrophobicContact CG-CD2 3.97Å; Q970-Y977 HydrophobicContact CG-CE1 3.98Å; Q970-Y977 HydrophobicContact CG-CE2 3.84Å; Q970-Y977 HydrophobicContact CG-CG 4.09Å
971N90.8Very high92.1Very high132 Ų13256.8 Ų56.871%0.70630%0.297SS*.Hα-helixtrans-84.8-41.2-178.9-66.6-41.9000112.9Q967 T968 I969Q967-N971 PolarHBondContact O-N 3.04Å; Q967-N971 PolarHBondContact O-ND2 2.91Å; T968-N971 PolarHBondContact O-N 3.25Å; I969-N971 PolarHBondContact O-N 3.35Å
972R91.9Very high91.9Very high138 Ų13861.9 Ų61.952%0.52132%0.32SS..Hα-helixtrans-80.6-41.5-172.5-176.2-175.4178178.86.6112.4E848 T968 I969E848-R972 IonicContact OE1-CZ 2.64Å; E848-R972 IonicContact OE1-NH1 3.73Å; E848-R972 IonicContact OE1-NH2 2.63Å; E848-R972 PolarHBondContact OE1-NH2 2.89Å; T968-R972 WeakPolarHBondContact O-CB 3.26Å; T968-R972 PolarHBondContact O-N 3.49Å; I969-R972 PolarHBondContact O-N 3.42Å
973N90.4Very high91.3Very high58 Ų5864.4 Ų64.431%0.3135%0.348SS..  trans-139.777.8-175-168.6-12.8000111.4I969 V975 W976 Y977I969-N973 CarbonylContact O-C 3.58Å; I969-N973 VanDerWaalsContact O-C 3.3Å; I969-N973 PolarHBondContact O-N 2.93Å; N973-V975 PolarHBondContact O-N 3.22Å; N973-V975 VanDerWaalsContact O-N 3.15Å; N973-W976 HydrophobicContact CB-CB 3.99Å; N973-W976 WeakPolarHBondContact ND2-CB 3.34Å; N973-W976 PolarHBondContact O-N 3.13Å; N973-W976 VanDerWaalsContact O-N 3.09Å; N973-W976 PolarHBondContact OD1-N 3.07Å; N973-W976 VanDerWaalsContact OD1-N 3.11Å; N973-Y977 PolarHBondContact O-N 3.12Å
974P90.3Very high91.2Very high80 Ų8064.1 Ų64.152%0.51935%0.347SS..Hα-helixtrans-59.1-28.1-178.5-25.434.5000114.1Q978P974-Q978 WeakPolarHBondContact O-CB 3.41Å; P974-Q978 PolarHBondContact O-N 3.06Å
975V91Very high91.1Very high112 Ų11266 Ų6668%0.67935%0.351SS*.Hα-helixtrans-68.5-45.5177.1178.90000110.3N973 Q978 A979N973-V975 PolarHBondContact O-N 3.22Å; N973-V975 VanDerWaalsContact O-N 3.15Å; V975-Q978 PolarHBondContact O-N 3.27Å; V975-A979 PolarHBondContact O-N 3.4Å
976W92.6Very high90.9Very high7 Ų773.2 Ų73.23%0.02739%0.385CS..Hα-helixtrans-66.1-42.8175.8-179-133.8000111.9I845 I850 L854 I861 I969 N973 Q978 A979 L980I845-W976 PolarHBondContact O-NE1 3.4Å; I850-W976 HydrophobicContact CD1-CB 3.93Å; I850-W976 HydrophobicContact CD1-CD2 3.48Å; I850-W976 VanDerWaalsContact CD1-CD2 3.48Å; I850-W976 HydrophobicContact CD1-CE3 3.94Å; I850-W976 HydrophobicContact CD1-CG 3.45Å; I850-W976 VanDerWaalsContact CD1-CG 3.45Å; I850-W976 HydrophobicContact CG1-CD2 4.43Å; I850-W976 HydrophobicContact CG2-CE3 4.46Å; I850-W976 HydrophobicContact CG2-CH2 4.07Å; I850-W976 HydrophobicContact CG2-CZ2 4.23Å; I850-W976 HydrophobicContact CG2-CZ3 4.18Å; L854-W976 HydrophobicContact CD2-CH2 4.33Å; L854-W976 HydrophobicContact CD2-CZ2 3.99Å; L854-W976 HydrophobicContact CG-CH2 3.97Å; L854-W976 HydrophobicContact CG-CZ2 4.1Å; I861-W976 HydrophobicContact CD1-CH2 4.23Å; I861-W976 HydrophobicContact CD1-CZ2 4.28Å; I969-W976 HydrophobicContact CG2-CG 4.38Å; N973-W976 HydrophobicContact CB-CB 3.99Å; N973-W976 WeakPolarHBondContact ND2-CB 3.34Å; N973-W976 PolarHBondContact O-N 3.13Å; N973-W976 VanDerWaalsContact O-N 3.09Å; N973-W976 PolarHBondContact OD1-N 3.07Å; N973-W976 VanDerWaalsContact OD1-N 3.11Å; W976-Q978 VanDerWaalsContact C-N 3.26Å; W976-Q978 PolarHBondContact O-N 3.17Å; W976-A979 HydrophobicContact CE3-CB 3.84Å; W976-A979 HydrophobicContact CZ3-CB 4.08Å; W976-A979 WeakPolarHBondContact O-CB 3.41Å; W976-A979 PolarHBondContact O-N 3.49Å; W976-L980 HydrophobicContact CD2-CD1 4.36Å; W976-L980 HydrophobicContact CD2-CG 4.17Å; W976-L980 HydrophobicContact CG-CD1 4.49Å; W976-L980 HydrophobicContact CH2-CD2 3.9Å; W976-L980 HydrophobicContact CH2-CG 4.39Å; W976-L980 HydrophobicContact CZ2-CD1 4.29Å; W976-L980 HydrophobicContact CZ2-CD2 3.61Å; W976-L980 HydrophobicContact CZ2-CG 4.01Å; W976-L980 WeakPolarHBondContact O-CG 3.39Å; W976-L980 PolarHBondContact O-N 2.97Å
977Y91.8Very high90.9Very high56 Ų5678.2 Ų78.222%0.2241%0.408CS..Hα-helixtrans-55.2-42.8172.5-177.5-96.8000112.1F966 Q970 N973 L980 T981F966-Y977 HydrophobicContact CD1-CE2 4.26Å; F966-Y977 HydrophobicContact CD2-CE2 4.49Å; F966-Y977 AromaticContact CE1-CE2 3.67Å; F966-Y977 HydrophobicContact CE1-CE2 3.67Å; F966-Y977 HydrophobicContact CE2-CD2 4.21Å; F966-Y977 AromaticContact CE2-CE2 3.92Å; F966-Y977 HydrophobicContact CE2-CE2 3.92Å; F966-Y977 HydrophobicContact CZ-CD2 4.2Å; F966-Y977 AromaticContact CZ-CE2 3.48Å; F966-Y977 HydrophobicContact CZ-CE2 3.48Å; F966-Y977 VanDerWaalsContact CZ-CE2 3.48Å; Q970-Y977 HydrophobicContact CB-CD2 3.6Å; Q970-Y977 HydrophobicContact CB-CE2 3.69Å; Q970-Y977 HydrophobicContact CB-CG 4.05Å; Q970-Y977 HydrophobicContact CG-CD1 4.1Å; Q970-Y977 HydrophobicContact CG-CD2 3.97Å; Q970-Y977 HydrophobicContact CG-CE1 3.98Å; Q970-Y977 HydrophobicContact CG-CE2 3.84Å; Q970-Y977 HydrophobicContact CG-CG 4.09Å; N973-Y977 PolarHBondContact O-N 3.12Å; Y977-L980 PolarHBondContact O-N 3.42Å; Y977-T981 HydrophobicContact CD1-CG2 4.46Å; Y977-T981 HydrophobicContact CE1-CG2 4.06Å; Y977-T981 HydrophobicContact CE2-CG2 4.18Å; Y977-T981 WeakPolarHBondContact O-CB 3.29Å; Y977-T981 WeakPolarHBondContact O-CG2 3.2Å; Y977-T981 PolarHBondContact O-N 3.15Å; Y977-T981 VanDerWaalsContact O-N 3.08Å; Y977-T981 PolarHBondContact O-OG1 2.74Å
978Q91.6Very high90.9Very high126 Ų12675.5 Ų75.559%0.58940%0.396SS*.Hα-helixtrans-66.3-38.7176.5-171.3177.83.900111.9P974 V975 W976 T981 H982P974-Q978 WeakPolarHBondContact O-CB 3.41Å; P974-Q978 PolarHBondContact O-N 3.06Å; V975-Q978 PolarHBondContact O-N 3.27Å; W976-Q978 VanDerWaalsContact C-N 3.26Å; W976-Q978 PolarHBondContact O-N 3.17Å; Q978-T981 PolarHBondContact O-N 2.71Å; Q978-T981 PolarHBondContact O-OG1 3.39Å; Q978-H982 VanDerWaalsContact O-CB 3.3Å; Q978-H982 WeakPolarHBondContact O-CB 3.4Å; Q978-H982 PolarHBondContact O-N 2.82Å
979A91.3Very high90.8Very high32 Ų3278.9 Ų78.926%0.26440%0.401SS..Hα-helixtrans-61.9-45.2176.500000111.7V975 W976 T981V975-A979 PolarHBondContact O-N 3.4Å; W976-A979 HydrophobicContact CE3-CB 3.84Å; W976-A979 HydrophobicContact CZ3-CB 4.08Å; W976-A979 WeakPolarHBondContact O-CB 3.41Å; W976-A979 PolarHBondContact O-N 3.49Å; A979-T981 VanDerWaalsContact C-N 3.33Å; A979-T981 PolarHBondContact O-N 3.27Å
980L92.2Very high90.8Very high1 Ų184.8 Ų84.81%0.00543%0.426CS..Hα-helixtrans-62.7-37.8176.5-68173.4000112.4I861 L862 I969 W976 Y977I861-L980 HydrophobicContact CB-CD2 4.12Å; I861-L980 HydrophobicContact CD1-CD2 3.75Å; I861-L980 HydrophobicContact CG1-CD2 4.49Å; I861-L980 HydrophobicContact CG2-CD2 4.28Å; L862-L980 HydrophobicContact CD1-CB 4.05Å; L862-L980 VanDerWaalsContact CD1-O 3.27Å; L862-L980 WeakPolarHBondContact CD1-O 3.37Å; L862-L980 HydrophobicContact CG-CB 4.32Å; I969-L980 HydrophobicContact CG2-CD1 4.41Å; W976-L980 HydrophobicContact CD2-CD1 4.36Å; W976-L980 HydrophobicContact CD2-CG 4.17Å; W976-L980 HydrophobicContact CG-CD1 4.49Å; W976-L980 HydrophobicContact CH2-CD2 3.9Å; W976-L980 HydrophobicContact CH2-CG 4.39Å; W976-L980 HydrophobicContact CZ2-CD1 4.29Å; W976-L980 HydrophobicContact CZ2-CD2 3.61Å; W976-L980 HydrophobicContact CZ2-CG 4.01Å; W976-L980 WeakPolarHBondContact O-CG 3.39Å; W976-L980 PolarHBondContact O-N 2.97Å; Y977-L980 PolarHBondContact O-N 3.42Å
981T91.9Very high90.8Very high28 Ų2882.8 Ų82.817%0.17242%0.417CS..Hα-helixtrans-94.8-13.3-171.254.80000114.9L862 F966 Y977 Q978 A979 G983 L984L862-T981 HydrophobicContact CD1-CG2 3.87Å; F966-T981 HydrophobicContact CZ-CG2 3.89Å; Y977-T981 HydrophobicContact CD1-CG2 4.46Å; Y977-T981 HydrophobicContact CE1-CG2 4.06Å; Y977-T981 HydrophobicContact CE2-CG2 4.18Å; Y977-T981 WeakPolarHBondContact O-CB 3.29Å; Y977-T981 WeakPolarHBondContact O-CG2 3.2Å; Y977-T981 PolarHBondContact O-N 3.15Å; Y977-T981 VanDerWaalsContact O-N 3.08Å; Y977-T981 PolarHBondContact O-OG1 2.74Å; Q978-T981 PolarHBondContact O-N 2.71Å; Q978-T981 PolarHBondContact O-OG1 3.39Å; A979-T981 VanDerWaalsContact C-N 3.33Å; A979-T981 PolarHBondContact O-N 3.27Å; T981-G983 VanDerWaalsContact C-N 3.3Å; T981-G983 PolarHBondContact O-N 3.35Å; T981-L984 HydrophobicContact CG2-CD1 4.34Å; T981-L984 PolarHBondContact O-N 2.87Å
982H87.5Confident90.9Very high152 Ų15277.3 Ų77.370%0.70439%0.388SS*.THydrogen-bonded Turntrans-60-35.6-171.9-17660.5000113.9Q978Q978-H982 VanDerWaalsContact O-CB 3.3Å; Q978-H982 WeakPolarHBondContact O-CB 3.4Å; Q978-H982 PolarHBondContact O-N 2.82Å
983G84.9Confident90.8Very high58 Ų5877 Ų7760%0.59839%0.392SS*.THydrogen-bonded Turntrans-86.4-4.4-175.400000115.8T981T981-G983 VanDerWaalsContact C-N 3.3Å; T981-G983 PolarHBondContact O-N 3.35Å
984L89.9Confident90.9Very high15 Ų1578.3 Ų78.38%0.07940%0.399CS..  trans-75.7128.1-171-64.3175.9000113.2L862 T981 Q988 R989 L992L862-L984 HydrophobicContact CB-CD2 3.81Å; L862-L984 HydrophobicContact CD1-CD1 3.64Å; L862-L984 HydrophobicContact CD1-CD2 4.4Å; L862-L984 HydrophobicContact CD1-CG 4.27Å; T981-L984 HydrophobicContact CG2-CD1 4.34Å; T981-L984 PolarHBondContact O-N 2.87Å; L984-Q988 HydrophobicContact CB-CB 4.47Å; L984-Q988 HydrophobicContact CD2-CB 3.98Å; L984-R989 HydrophobicContact CB-CG 3.99Å; L984-R989 HydrophobicContact CD1-CG 4.37Å; L984-R989 PolarHBondContact O-NE 3.42Å; L984-R989 PolarHBondContact O-NH2 2.93Å; L984-L992 HydrophobicContact CD1-CD1 3.46Å; L984-L992 VanDerWaalsContact CD1-CD1 3.46Å; L984-L992 HydrophobicContact CD2-CD1 4.39Å
985N91.8Very high91Very high80 Ų8074.9 Ų74.943%0.42838%0.376SS..  trans-74.4173170.173.629.3000111.6E987 Q988 R989N985-E987 VanDerWaalsContact C-N 3.32Å; N985-E987 PolarHBondContact O-N 3.28Å; N985-E987 WeakPolarHBondContact OD1-CB 3.36Å; N985-E987 PolarHBondContact OD1-N 3.28Å; N985-E987 VanDerWaalsContact OD1-N 3.14Å; N985-Q988 VanDerWaalsContact N-OE1 3.09Å; N985-Q988 WeakPolarHBondContact OD1-CB 3.31Å; N985-Q988 VanDerWaalsContact OD1-CG 3.26Å; N985-Q988 WeakPolarHBondContact OD1-CG 3.43Å; N985-Q988 PolarHBondContact OD1-N 3Å; N985-R989 WeakPolarHBondContact O-CG 3.35Å; N985-R989 PolarHBondContact O-N 2.68Å; N985-R989 VanDerWaalsContact O-N 3.17Å
986E89.6Confident90.9Very high176 Ų17671 Ų7182%0.82236%0.356SS*.Hα-helixtrans-67.1-33-174.7-159.4170.5-162.500112.8K990E986-K990 PolarHBondContact O-N 3.46Å
987E91.7Very high90.7Very high134 Ų13474 Ų7463%0.62638%0.375SS*.Hα-helixtrans-68.8-47.8177.1179.8169.4-158.700112.1N985 R989 K990 Q991N985-E987 VanDerWaalsContact C-N 3.32Å; N985-E987 PolarHBondContact O-N 3.28Å; N985-E987 WeakPolarHBondContact OD1-CB 3.36Å; N985-E987 PolarHBondContact OD1-N 3.28Å; N985-E987 VanDerWaalsContact OD1-N 3.14Å; E987-R989 VanDerWaalsContact C-N 3.28Å; E987-R989 PolarHBondContact O-N 2.81Å; E987-K990 WeakPolarHBondContact O-CA 3.31Å; E987-K990 WeakPolarHBondContact O-CB 3.44Å; E987-K990 PolarHBondContact O-N 3.27Å; E987-Q991 PolarHBondContact O-N 3.14Å
988Q92Very high90.6Very high39 Ų3973.5 Ų73.518%0.18238%0.376CS..Hα-helixtrans-60.9-36.9176.4-72.7172.4-3100112I866 L984 N985 K990 Q991 L992I866-Q988 HydrophobicContact CD1-CB 3.54Å; I866-Q988 HydrophobicContact CD1-CG 3.79Å; L984-Q988 HydrophobicContact CB-CB 4.47Å; L984-Q988 HydrophobicContact CD2-CB 3.98Å; N985-Q988 VanDerWaalsContact N-OE1 3.09Å; N985-Q988 WeakPolarHBondContact OD1-CB 3.31Å; N985-Q988 VanDerWaalsContact OD1-CG 3.26Å; N985-Q988 WeakPolarHBondContact OD1-CG 3.43Å; N985-Q988 PolarHBondContact OD1-N 3Å; Q988-K990 VanDerWaalsContact C-N 3.3Å; Q988-K990 PolarHBondContact O-N 3.06Å; Q988-Q991 PolarHBondContact O-N 2.88Å; Q988-L992 WeakPolarHBondContact O-CG 3.41Å; Q988-L992 PolarHBondContact O-N 3.26Å
989R90.6Very high90.5Very high137 Ų13767.5 Ų67.552%0.51735%0.348SS..Hα-helixtrans-63.8-36.5173.7-71.4174.4-167.9-155.1-0.4112.2L984 N985 E987 Q993L984-R989 HydrophobicContact CB-CG 3.99Å; L984-R989 HydrophobicContact CD1-CG 4.37Å; L984-R989 PolarHBondContact O-NE 3.42Å; L984-R989 PolarHBondContact O-NH2 2.93Å; N985-R989 WeakPolarHBondContact O-CG 3.35Å; N985-R989 PolarHBondContact O-N 2.68Å; N985-R989 VanDerWaalsContact O-N 3.17Å; E987-R989 VanDerWaalsContact C-N 3.28Å; E987-R989 PolarHBondContact O-N 2.81Å; R989-Q993 WeakPolarHBondContact O-CG 3.42Å; R989-Q993 PolarHBondContact O-N 3.15Å
990K91.7Very high90.4Very high131 Ų13169.8 Ų69.857%0.5736%0.356SS*.Hα-helixtrans-69.2-46.3175.7-173.6-173.6172.6-166.70110.8E986 E987 Q988 L992 Q993 D994E986-K990 PolarHBondContact O-N 3.46Å; E987-K990 WeakPolarHBondContact O-CA 3.31Å; E987-K990 WeakPolarHBondContact O-CB 3.44Å; E987-K990 PolarHBondContact O-N 3.27Å; Q988-K990 VanDerWaalsContact C-N 3.3Å; Q988-K990 PolarHBondContact O-N 3.06Å; K990-L992 VanDerWaalsContact C-N 3.29Å; K990-L992 PolarHBondContact O-N 2.95Å; K990-Q993 WeakPolarHBondContact O-CA 3.48Å; K990-Q993 WeakPolarHBondContact O-CB 3.27Å; K990-Q993 PolarHBondContact O-N 3.01Å; K990-D994 PolarHBondContact O-N 3.03Å
991Q92.4Very high90.1Very high46 Ų4675.3 Ų75.322%0.21538%0.382CS..Hα-helixtrans-57.2-41.6175.9-70.7171.4-48.400111.9I866 N870 E987 Q988 Q993 D994 I995I866-Q991 HydrophobicContact CG1-CB 4.41Å; I866-Q991 HydrophobicContact CG2-CB 4.02Å; I866-Q991 HydrophobicContact CG2-CG 4.37Å; N870-Q991 PolarHBondContact ND2-NE2 3.49Å; E987-Q991 PolarHBondContact O-N 3.14Å; Q988-Q991 PolarHBondContact O-N 2.88Å; Q991-Q993 VanDerWaalsContact C-N 3.33Å; Q991-Q993 PolarHBondContact O-N 3.21Å; Q991-D994 WeakPolarHBondContact O-CB 3.35Å; Q991-D994 PolarHBondContact O-N 3.3Å; Q991-I995 WeakPolarHBondContact O-CD1 3.49Å; Q991-I995 VanDerWaalsContact O-CG1 3.25Å; Q991-I995 WeakPolarHBondContact O-CG1 3.46Å; Q991-I995 PolarHBondContact O-N 3.37Å
992L91.4Very high89.9Confident18 Ų1877 Ų779%0.09439%0.385CS..Hα-helixtrans-63.4-34.6173.9-74.3168.5000113.6L862 I866 F962 L984 Q988 K990 I995 A996L862-L992 HydrophobicContact CD1-CD1 4.19Å; L862-L992 HydrophobicContact CD2-CD2 4.46Å; I866-L992 HydrophobicContact CD1-CD1 4.28Å; I866-L992 HydrophobicContact CD1-CD2 4.42Å; I866-L992 HydrophobicContact CD1-CG 3.95Å; I866-L992 HydrophobicContact CG1-CD2 4.01Å; I866-L992 HydrophobicContact CG1-CG 3.99Å; F962-L992 HydrophobicContact CE1-CD2 4.18Å; F962-L992 HydrophobicContact CZ-CD2 3.86Å; L984-L992 HydrophobicContact CD1-CD1 3.46Å; L984-L992 VanDerWaalsContact CD1-CD1 3.46Å; L984-L992 HydrophobicContact CD2-CD1 4.39Å; Q988-L992 WeakPolarHBondContact O-CG 3.41Å; Q988-L992 PolarHBondContact O-N 3.26Å; K990-L992 VanDerWaalsContact C-N 3.29Å; K990-L992 PolarHBondContact O-N 2.95Å; L992-I995 HydrophobicContact CD2-CD1 4.33Å; L992-A996 WeakPolarHBondContact O-CB 3.48Å; L992-A996 PolarHBondContact O-N 3.24Å
993Q90.5Very high89.6Confident130 Ų13074.1 Ų74.161%0.60737%0.368SS*.Hα-helixtrans-68.8-38.7173-71.5173.13.300111.5R989 K990 Q991 A996 T997R989-Q993 WeakPolarHBondContact O-CG 3.42Å; R989-Q993 PolarHBondContact O-N 3.15Å; K990-Q993 WeakPolarHBondContact O-CA 3.48Å; K990-Q993 WeakPolarHBondContact O-CB 3.27Å; K990-Q993 PolarHBondContact O-N 3.01Å; Q991-Q993 VanDerWaalsContact C-N 3.33Å; Q991-Q993 PolarHBondContact O-N 3.21Å; Q993-A996 PolarHBondContact O-N 3.26Å; Q993-T997 WeakPolarHBondContact O-CB 3.48Å; Q993-T997 PolarHBondContact O-N 3.38Å; Q993-T997 PolarHBondContact O-OG1 2.94Å
994D91.4Very high89.5Confident86 Ų8674 Ų7446%0.4636%0.361SS..Hα-helixtrans-65.3-43.9177-64.4-22.7000110.6K990 Q991 A996 T997 L998K990-D994 PolarHBondContact O-N 3.03Å; Q991-D994 WeakPolarHBondContact O-CB 3.35Å; Q991-D994 PolarHBondContact O-N 3.3Å; D994-A996 PolarHBondContact O-N 3.44Å; D994-T997 WeakPolarHBondContact O-CB 3.47Å; D994-T997 PolarHBondContact O-N 3.06Å; D994-T997 VanDerWaalsContact O-N 3.13Å; D994-L998 PolarHBondContact O-N 2.93Å
995I92.5Very high89.1Confident9 Ų976 Ų765%0.04638%0.38CS..Hα-helixtrans-57.4-46.4172.6-68.4158.8000110.9I866 F869 Y959 F962 Q991 L992 T997 L998 A999I866-I995 HydrophobicContact CG1-CD1 4.32Å; F869-I995 HydrophobicContact CB-CD1 3.72Å; F869-I995 HydrophobicContact CB-CG1 3.83Å; F869-I995 HydrophobicContact CD1-CG2 4.37Å; F869-I995 HydrophobicContact CD2-CD1 3.63Å; F869-I995 HydrophobicContact CD2-CG1 4.08Å; F869-I995 HydrophobicContact CD2-CG2 3.67Å; F869-I995 HydrophobicContact CE1-CG2 4.42Å; F869-I995 HydrophobicContact CE2-CG2 3.75Å; F869-I995 HydrophobicContact CG-CD1 3.98Å; F869-I995 HydrophobicContact CG-CG1 4.07Å; F869-I995 HydrophobicContact CG-CG2 4Å; F869-I995 HydrophobicContact CZ-CG2 4.13Å; Y959-I995 HydrophobicContact CD1-CG2 3.93Å; Y959-I995 HydrophobicContact CE1-CG2 4.3Å; F962-I995 HydrophobicContact CD1-CG2 3.96Å; F962-I995 HydrophobicContact CE1-CG2 4.02Å; Q991-I995 WeakPolarHBondContact O-CD1 3.49Å; Q991-I995 VanDerWaalsContact O-CG1 3.25Å; Q991-I995 WeakPolarHBondContact O-CG1 3.46Å; Q991-I995 PolarHBondContact O-N 3.37Å; L992-I995 HydrophobicContact CD2-CD1 4.33Å; I995-T997 VanDerWaalsContact C-N 3.26Å; I995-T997 PolarHBondContact O-N 3.11Å; I995-L998 PolarHBondContact O-N 3.04Å; I995-A999 PolarHBondContact O-N 3.13Å
996A89.1Confident88.3Confident30 Ų3075.5 Ų75.525%0.24838%0.375CS..Hα-helixtrans-66.2-29.2178.700000113.1K963 L992 Q993 D994 D1000K963-A996 HydrophobicContact CD-CB 4.37Å; K963-A996 PolarHBondContact NZ-O 3.15Å; L992-A996 WeakPolarHBondContact O-CB 3.48Å; L992-A996 PolarHBondContact O-N 3.24Å; Q993-A996 PolarHBondContact O-N 3.26Å; D994-A996 PolarHBondContact O-N 3.44Å; A996-D1000 PolarHBondContact O-N 3.17Å
997T89.7Confident87.8Confident71 Ų7172.4 Ų72.444%0.43636%0.36SS..Hα-helixtrans-74.2-43.8175-560000110.5Q993 D994 I995 A999 D1000 Q1001Q993-T997 WeakPolarHBondContact O-CB 3.48Å; Q993-T997 PolarHBondContact O-N 3.38Å; Q993-T997 PolarHBondContact O-OG1 2.94Å; D994-T997 WeakPolarHBondContact O-CB 3.47Å; D994-T997 PolarHBondContact O-N 3.06Å; D994-T997 VanDerWaalsContact O-N 3.13Å; I995-T997 VanDerWaalsContact C-N 3.26Å; I995-T997 PolarHBondContact O-N 3.11Å; T997-A999 VanDerWaalsContact C-N 3.3Å; T997-A999 PolarHBondContact O-N 3.09Å; T997-D1000 WeakPolarHBondContact O-CB 3.47Å; T997-D1000 PolarHBondContact O-N 2.94Å; T997-D1000 VanDerWaalsContact O-N 3.12Å; T997-Q1001 WeakPolarHBondContact O-CG 3.45Å; T997-Q1001 PolarHBondContact O-N 3.36Å
998L88.2Confident87Confident44 Ų4469 Ų6923%0.2335%0.351CS..Hα-helixtrans-61.8-39175.4-173.856.9000111.4Y959 D994 I995 D1000 Q1001 R1002Y959-L998 HydrophobicContact CD1-CB 4.37Å; Y959-L998 HydrophobicContact CD1-CD2 4.14Å; Y959-L998 HydrophobicContact CD1-CG 4.26Å; Y959-L998 HydrophobicContact CE1-CB 4.48Å; Y959-L998 HydrophobicContact CE1-CD2 3.54Å; Y959-L998 HydrophobicContact CE1-CG 4.16Å; D994-L998 PolarHBondContact O-N 2.93Å; I995-L998 PolarHBondContact O-N 3.04Å; L998-D1000 VanDerWaalsContact C-N 3.3Å; L998-D1000 PolarHBondContact O-N 3.24Å; L998-Q1001 WeakPolarHBondContact O-CB 3.32Å; L998-Q1001 PolarHBondContact O-N 3.11Å; L998-Q1001 VanDerWaalsContact O-N 3.11Å; L998-R1002 HydrophobicContact CD1-CG 4.48Å; L998-R1002 WeakPolarHBondContact O-CG 3.36Å; L998-R1002 PolarHBondContact O-N 3.28Å
999A90Very high86.1Confident1 Ų172.8 Ų72.81%0.00837%0.367CS..Hα-helixtrans-57.8-38.5172.700000113.2Y959 K963 I995 T997 R1003Y959-A999 WeakPolarHBondContact O-CB 3.28Å; K963-A999 HydrophobicContact CB-CB 4.19Å; K963-A999 HydrophobicContact CD-CB 3.86Å; I995-A999 PolarHBondContact O-N 3.13Å; T997-A999 VanDerWaalsContact C-N 3.3Å; T997-A999 PolarHBondContact O-N 3.09Å; A999-R1003 WeakPolarHBondContact O-CB 3.31Å; A999-R1003 PolarHBondContact O-N 2.94Å; A999-R1003 VanDerWaalsContact O-N 3.08Å
1000D89.4Confident85.3Confident80 Ų8070 Ų7043%0.42836%0.361SS..Hα-helixtrans-70.2-38174.9-75.3-26.4000111.8K963 A996 T997 L998 R1003 A1004K963-D1000 IonicContact NZ-OD1 2.81Å; K963-D1000 PolarHBondContact NZ-OD1 3.31Å; K963-D1000 IonicContact NZ-OD2 2.79Å; K963-D1000 PolarHBondContact NZ-OD2 2.85Å; A996-D1000 PolarHBondContact O-N 3.17Å; T997-D1000 WeakPolarHBondContact O-CB 3.47Å; T997-D1000 PolarHBondContact O-N 2.94Å; T997-D1000 VanDerWaalsContact O-N 3.12Å; L998-D1000 VanDerWaalsContact C-N 3.3Å; L998-D1000 PolarHBondContact O-N 3.24Å; D1000-R1003 PolarHBondContact O-N 3.43Å; D1000-A1004 WeakPolarHBondContact O-CB 3.5Å; D1000-A1004 PolarHBondContact O-N 3.22Å
1001Q86.8Confident84.3Confident116 Ų11668.8 Ų68.854%0.54236%0.36SS..Hα-helixtrans-64.7-47176.7-68.7172.7-8.400111.2T997 L998 R1003 A1004 A1005T997-Q1001 WeakPolarHBondContact O-CG 3.45Å; T997-Q1001 PolarHBondContact O-N 3.36Å; L998-Q1001 WeakPolarHBondContact O-CB 3.32Å; L998-Q1001 PolarHBondContact O-N 3.11Å; L998-Q1001 VanDerWaalsContact O-N 3.11Å; Q1001-R1003 PolarHBondContact O-N 3.18Å; Q1001-A1004 PolarHBondContact O-N 2.91Å; Q1001-A1005 WeakPolarHBondContact O-CB 3.43Å; Q1001-A1005 PolarHBondContact O-N 2.75Å
1002R85.8Confident83.1Confident63 Ų6371.4 Ų71.424%0.23837%0.372CS..Hα-helixtrans-61.2-42.4176.1-68.2-17284.5153.16111.5D957 E958 L998 A1004 A1005 H1006D957-R1002 WeakPolarHBondContact OD2-CB 3.22Å; D957-R1002 IonicContact OD2-NE 3.93Å; E958-R1002 IonicContact OE1-CZ 3.89Å; E958-R1002 IonicContact OE1-NH1 3.6Å; E958-R1002 PolarHBondContact OE1-NH1 2.96Å; E958-R1002 IonicContact OE1-NH2 3.92Å; L998-R1002 HydrophobicContact CD1-CG 4.48Å; L998-R1002 WeakPolarHBondContact O-CG 3.36Å; L998-R1002 PolarHBondContact O-N 3.28Å; R1002-A1004 PolarHBondContact O-N 2.96Å; R1002-A1005 PolarHBondContact O-N 3.2Å; R1002-H1006 WeakPolarHBondContact O-CB 3.28Å; R1002-H1006 PolarHBondContact O-N 3.08Å
1003R82.9Confident81.9Confident92 Ų9276.9 Ų76.935%0.34740%0.395SS..Hα-helixtrans-58.2-49.2173.7-176.1175.4-68.4160.9-0.2112.2Q960 A999 D1000 Q1001 A1005 H1006 E1007Q960-R1003 HydrophobicContact CG-CB 4.24Å; A999-R1003 WeakPolarHBondContact O-CB 3.31Å; A999-R1003 PolarHBondContact O-N 2.94Å; A999-R1003 VanDerWaalsContact O-N 3.08Å; D1000-R1003 PolarHBondContact O-N 3.43Å; Q1001-R1003 PolarHBondContact O-N 3.18Å; R1003-A1005 VanDerWaalsContact C-N 3.32Å; R1003-A1005 PolarHBondContact O-N 3.11Å; R1003-H1006 PolarHBondContact O-N 3.31Å; R1003-E1007 WeakPolarHBondContact O-CB 3.39Å; R1003-E1007 WeakPolarHBondContact O-CG 3.34Å; R1003-E1007 PolarHBondContact O-N 3.27Å
1004A82.3Confident80.8Confident56 Ų5677.9 Ų77.946%0.46340%0.399SS..Hα-helixtrans-63.5-38.3179.400000112.1D1000 Q1001 R1002 S1008D1000-A1004 WeakPolarHBondContact O-CB 3.5Å; D1000-A1004 PolarHBondContact O-N 3.22Å; Q1001-A1004 PolarHBondContact O-N 2.91Å; R1002-A1004 PolarHBondContact O-N 2.96Å; A1004-S1008 WeakPolarHBondContact O-CB 3.42Å; A1004-S1008 PolarHBondContact O-N 3.43Å
1005A80.6Confident78.9Confident56 Ų5676.6 Ų76.646%0.46341%0.406SS..Hα-helixtrans-65.6-45.5175.500000112Q1001 R1002 R1003 S1008 K1009Q1001-A1005 WeakPolarHBondContact O-CB 3.43Å; Q1001-A1005 PolarHBondContact O-N 2.75Å; R1002-A1005 PolarHBondContact O-N 3.2Å; R1003-A1005 VanDerWaalsContact C-N 3.32Å; R1003-A1005 PolarHBondContact O-N 3.11Å; A1005-S1008 CarbonylContact O-C 3.59Å; A1005-S1008 WeakPolarHBondContact O-CB 3.45Å; A1005-S1008 PolarHBondContact O-N 2.87Å; A1005-S1008 VanDerWaalsContact O-N 3.17Å; A1005-K1009 PolarHBondContact O-N 3.04Å
1006H76Confident76.6Confident70 Ų7077.9 Ų77.932%0.32442%0.422SS..Hα-helixtrans-63-44.5175.6178.6-85.1000111.8R1002 R1003 S1008 K1009 M1010R1002-H1006 WeakPolarHBondContact O-CB 3.28Å; R1002-H1006 PolarHBondContact O-N 3.08Å; R1003-H1006 PolarHBondContact O-N 3.31Å; H1006-S1008 PolarHBondContact O-N 3.25Å; H1006-S1008 VanDerWaalsContact C-N 3.26Å; H1006-K1009 PolarHBondContact O-N 3.24Å; H1006-M1010 WeakPolarHBondContact O-CB 3.35Å; H1006-M1010 WeakPolarHBondContact O-CG 3.35Å; H1006-M1010 PolarHBondContact O-N 3.21Å
1007E78.4Confident74.2Confident111 Ų11187 Ų8752%0.51945%0.451SS..Hα-helixtrans-58.7-38.4172.7-74.3176.4-171.600111.6R1003 M1010 I1011R1003-E1007 WeakPolarHBondContact O-CB 3.39Å; R1003-E1007 WeakPolarHBondContact O-CG 3.34Å; R1003-E1007 PolarHBondContact O-N 3.27Å; E1007-M1010 PolarHBondContact O-N 2.7Å; E1007-I1011 WeakPolarHBondContact O-CD1 3.42Å; E1007-I1011 WeakPolarHBondContact O-CG1 3.08Å; E1007-I1011 PolarHBondContact O-N 3.12Å
1008S75.7Confident71.9Confident63 Ų6391.7 Ų91.744%0.44147%0.466SS..Hα-helixtrans-66.8-47.4174.9-165.60000112.6A1004 A1005 H1006 M1010 I1011 E1012A1004-S1008 WeakPolarHBondContact O-CB 3.42Å; A1004-S1008 PolarHBondContact O-N 3.43Å; A1005-S1008 CarbonylContact O-C 3.59Å; A1005-S1008 WeakPolarHBondContact O-CB 3.45Å; A1005-S1008 PolarHBondContact O-N 2.87Å; A1005-S1008 VanDerWaalsContact O-N 3.17Å; H1006-S1008 PolarHBondContact O-N 3.25Å; H1006-S1008 VanDerWaalsContact C-N 3.26Å; S1008-M1010 VanDerWaalsContact C-N 3.29Å; S1008-M1010 PolarHBondContact O-N 2.95Å; S1008-I1011 PolarHBondContact O-N 3.23Å; S1008-E1012 PolarHBondContact O-N 3.26Å
1009K73.3Confident69.6Low119 Ų11998 Ų9852%0.51749%0.491SS..Hα-helixtrans-57.1-42.9174-82.6-168.9175.5-172.60110.5E952 A1005 H1006 E1012 K1013E952-K1009 IonicContact OE2-NZ 3.75Å; A1005-K1009 PolarHBondContact O-N 3.04Å; H1006-K1009 PolarHBondContact O-N 3.24Å; K1009-E1012 PolarHBondContact O-N 3.13Å; K1009-K1013 PolarHBondContact O-N 3.16Å
1010M72.6Confident67.4Low79 Ų79103.8 Ų103.839%0.38953%0.532SS..Hα-helixtrans-65.4-40.1176.8-73.4-63.4-8300112.5H1006 E1007 S1008 E1012 K1013 H1014H1006-M1010 WeakPolarHBondContact O-CB 3.35Å; H1006-M1010 WeakPolarHBondContact O-CG 3.35Å; H1006-M1010 PolarHBondContact O-N 3.21Å; E1007-M1010 PolarHBondContact O-N 2.7Å; S1008-M1010 VanDerWaalsContact C-N 3.29Å; S1008-M1010 PolarHBondContact O-N 2.95Å; M1010-E1012 VanDerWaalsContact C-N 3.33Å; M1010-K1013 PolarHBondContact O-N 2.82Å; M1010-H1014 PolarHBondContact O-N 2.89Å; M1010-H1014 PolarHBondContact O-ND1 3.25Å
1011I71.9Confident64.9Low105 Ų105103.2 Ų103.254%0.53854%0.538SS..Hα-helixtrans-63.5-39.9173.9-70.5162.8000110.9E1007 S1008 H1014 G1015 G1016E1007-I1011 WeakPolarHBondContact O-CD1 3.42Å; E1007-I1011 WeakPolarHBondContact O-CG1 3.08Å; E1007-I1011 PolarHBondContact O-N 3.12Å; S1008-I1011 PolarHBondContact O-N 3.23Å; I1011-H1014 CarbonylContact O-C 3.42Å; I1011-H1014 PolarHBondContact O-N 3.21Å; I1011-G1015 PolarHBondContact O-N 3.1Å; I1011-G1016 WeakPolarHBondContact O-CA 3.19Å; I1011-G1016 PolarHBondContact O-N 3.33Å
1012E66.9Low63.1Low101 Ų101104 Ų10447%0.47255%0.554SS.*Hα-helixtrans-63.6-47.4174.4-75.3-170.4154.400111.8S1008 K1009 M1010 H1014 G1015 K1018S1008-E1012 PolarHBondContact O-N 3.26Å; K1009-E1012 PolarHBondContact O-N 3.13Å; M1010-E1012 VanDerWaalsContact C-N 3.33Å; E1012-H1014 PolarHBondContact O-N 3.09Å; E1012-G1015 PolarHBondContact O-N 3.31Å; E1012-K1018 IonicContact OE1-NZ 2.71Å
1013K66Low61.1Low132 Ų132106.8 Ų106.857%0.57458%0.577SS**Hα-helixtrans-58-32.5174.2-77.7-169.4175.2-173.60112.7D953 K1009 M1010 G1015D953-K1013 IonicContact OD1-NZ 3.62Å; D953-K1013 PolarHBondContact OD1-NZ 3.4Å; D953-K1013 IonicContact OD2-NZ 2.76Å; D953-K1013 PolarHBondContact OD2-NZ 3.16Å; K1009-K1013 PolarHBondContact O-N 3.16Å; M1010-K1013 PolarHBondContact O-N 2.82Å; K1013-G1015 VanDerWaalsContact C-N 3.28Å; K1013-G1015 PolarHBondContact O-N 2.65Å
1014H67.5Low59.5Low152 Ų152109 Ų10970%0.70460%0.601SS**THydrogen-bonded Turntrans-84.48.7175.8-70.480.6000114.2M1010 I1011 E1012M1010-H1014 PolarHBondContact O-N 2.89Å; M1010-H1014 PolarHBondContact O-ND1 3.25Å; I1011-H1014 CarbonylContact O-C 3.42Å; I1011-H1014 PolarHBondContact O-N 3.21Å; E1012-H1014 PolarHBondContact O-N 3.09Å
1015G51.8Low57.6Low59 Ų59110.4 Ų110.461%0.60861%0.605SS**THydrogen-bonded Turntrans87.126.7174.700000115.4I1011 E1012 K1013 Y1017I1011-G1015 PolarHBondContact O-N 3.1Å; E1012-G1015 PolarHBondContact O-N 3.31Å; K1013-G1015 VanDerWaalsContact C-N 3.28Å; K1013-G1015 PolarHBondContact O-N 2.65Å; G1015-Y1017 PolarHBondContact O-N 3.26Å
1016G43.5Very low56.1Low36 Ų36114 Ų11437%0.37163%0.627SS.*PPolyproline II helixtrans-62121.2175.200000113.4I1011 K1018I1011-G1016 WeakPolarHBondContact O-CA 3.19Å; I1011-G1016 PolarHBondContact O-N 3.33Å; G1016-K1018 PolarHBondContact O-N 3.48Å
1017Y38.5Very low54.6Low220 Ų220115.9 Ų115.986%0.86365%0.648SS**PPolyproline II helixtrans-61.7123.6179.5-113-100000112.9G1015 F1019G1015-Y1017 PolarHBondContact O-N 3.26Å; Y1017-F1019 PolarHBondContact O-N 3.05Å
1018K41.3Very low52.8Low170 Ų170117 Ų11774%0.73965%0.651SS**PPolyproline II helixtrans-72.6118.5166.1-113.1174.8-176.7167.40110.1E1012 G1016 S1020E1012-K1018 IonicContact OE1-NZ 2.71Å; G1016-K1018 PolarHBondContact O-N 3.48Å; K1018-S1020 PolarHBondContact O-N 3.16Å; K1018-S1020 VanDerWaalsContact O-N 3.17Å
1019F40.8Very low51.4Low176 Ų176121.2 Ų121.277%0.77267%0.669SS**  trans-76.199.3174.6-81.1-87.4000110.9Y1017 A1021Y1017-F1019 PolarHBondContact O-N 3.05Å; F1019-A1021 VanDerWaalsContact C-N 3.28Å; F1019-A1021 PolarHBondContact O-N 3.19Å; F1019-A1021 VanDerWaalsContact O-N 3.17Å
1020S42.8Very low49.9Very low124 Ų124124.5 Ų124.587%0.86768%0.683SS**  trans-85.359.2170.244.80000112K1018K1018-S1020 PolarHBondContact O-N 3.16Å; K1018-S1020 VanDerWaalsContact O-N 3.17Å
1021A37.5Very low48Very low67 Ų67123.8 Ų123.855%0.55470%0.696SS**SBendtrans-174.6133.2157.900000112.2F1019 V1023F1019-A1021 VanDerWaalsContact C-N 3.28Å; F1019-A1021 PolarHBondContact O-N 3.19Å; F1019-A1021 VanDerWaalsContact O-N 3.17Å; A1021-V1023 VanDerWaalsContact C-N 3.35Å; A1021-V1023 PolarHBondContact O-N 2.88Å
1022P48.1Very low46.2Very low133 Ų133121.8 Ų121.886%0.86470%0.702SS**  trans-8574.6179.335.6-32.6000110.4
1023V44.6Very low45Very low121 Ų121123.2 Ų123.273%0.73372%0.72SS**  trans-136.7102163.8-170.80000108.9A1021 P1025A1021-V1023 VanDerWaalsContact C-N 3.35Å; A1021-V1023 PolarHBondContact O-N 2.88Å; V1023-P1025 VanDerWaalsContact O-CD 3.23Å; V1023-P1025 WeakPolarHBondContact O-CD 3.35Å
1024V48.4Very low43.7Very low139 Ų139121 Ų12184%0.84273%0.726SS**  trans-69.3115.1179-177.80000109.7
1025P43.1Very low42.2Very low85 Ų85120.3 Ų120.355%0.55274%0.735SS**  trans-78.3137.1177.2-9.527.2000111V1023 S1027V1023-P1025 VanDerWaalsContact O-CD 3.23Å; V1023-P1025 WeakPolarHBondContact O-CD 3.35Å; P1025-S1027 PolarHBondContact O-N 2.9Å
1026S50Low41.5Very low131 Ų131121.2 Ų121.292%0.91674%0.744SS**SBendtrans-83.37.4-167.3490000116.7
1027S44.5Very low41Very low110 Ų110128.6 Ų128.677%0.76977%0.772SS**  trans-157.5119.717060.20000111.7P1025P1025-S1027 PolarHBondContact O-N 2.9Å
1028F39.2Very low40.9Very low135 Ų135129.6 Ų129.659%0.59279%0.792SS**  trans-110.4134.8-178.9-129.1-94.5000109.7F1030F1028-F1030 HydrophobicContact CG-CE2 4.32Å; F1028-F1030 VanDerWaalsContact CE1-CZ 3.42Å; F1028-F1030 HydrophobicContact CE1-CZ 3.42Å; F1028-F1030 AromaticContact CE1-CZ 3.42Å; F1028-F1030 HydrophobicContact CE1-CE2 3.75Å; F1028-F1030 HydrophobicContact CD1-CG 4.39Å; F1028-F1030 AromaticContact CE1-CE2 3.75Å; F1028-F1030 HydrophobicContact CE1-CE1 3.82Å; F1028-F1030 AromaticContact CE1-CE1 3.82Å; F1028-F1030 HydrophobicContact CE1-CD2 4.4Å; F1028-F1030 HydrophobicContact CE1-CD1 4.46Å; F1028-F1030 HydrophobicContact CD1-CZ 3.56Å; F1028-F1030 AromaticContact CD1-CZ 3.56Å; F1028-F1030 HydrophobicContact CD1-CE2 3.33Å; F1028-F1030 AromaticContact CD1-CE2 3.33Å; F1028-F1030 HydrophobicContact CD1-CE1 4.19Å; F1028-F1030 HydrophobicContact CD1-CD2 3.79Å; F1028-F1030 AromaticContact CD1-CD2 3.79Å
1029N46.5Very low40.8Very low152 Ų152127.6 Ų127.681%0.81380%0.795SS**  trans-133.3109.4173.4-170.82.4000109.4G1031N1029-G1031 PolarHBondContact O-N 3.05Å
1030F42.6Very low40.8Very low187 Ų187125.1 Ų125.182%0.8280%0.796SS**  trans-80.514-174.8-82.6-81.9000114.6F1028F1028-F1030 HydrophobicContact CG-CE2 4.32Å; F1028-F1030 VanDerWaalsContact CE1-CZ 3.42Å; F1028-F1030 HydrophobicContact CE1-CZ 3.42Å; F1028-F1030 AromaticContact CE1-CZ 3.42Å; F1028-F1030 HydrophobicContact CE1-CE2 3.75Å; F1028-F1030 HydrophobicContact CD1-CG 4.39Å; F1028-F1030 AromaticContact CE1-CE2 3.75Å; F1028-F1030 HydrophobicContact CE1-CE1 3.82Å; F1028-F1030 AromaticContact CE1-CE1 3.82Å; F1028-F1030 HydrophobicContact CE1-CD2 4.4Å; F1028-F1030 HydrophobicContact CE1-CD1 4.46Å; F1028-F1030 HydrophobicContact CD1-CZ 3.56Å; F1028-F1030 AromaticContact CD1-CZ 3.56Å; F1028-F1030 HydrophobicContact CD1-CE2 3.33Å; F1028-F1030 AromaticContact CD1-CE2 3.33Å; F1028-F1030 HydrophobicContact CD1-CE1 4.19Å; F1028-F1030 HydrophobicContact CD1-CD2 3.79Å; F1028-F1030 AromaticContact CD1-CD2 3.79Å
1031G32.7Very low40.7Very low64 Ų64125.1 Ų125.166%0.6679%0.792SS**  trans-10633.7-169.300000116.8N1029N1029-G1031 PolarHBondContact O-N 3.05Å
1032G34.6Very low40.9Very low64 Ų64128.5 Ų128.566%0.6681%0.806SS**PPolyproline II helixtrans-88.2129.7174.600000111.6A1034G1032-A1034 PolarHBondContact O-N 3.49Å
1033P40Very low40.5Very low130 Ų130128.3 Ų128.384%0.84480%0.802SS**PPolyproline II helixtrans-69.1134.1-176.213.6-6.8000111.3
1034A39.6Very low40.2Very low85 Ų85128.7 Ų128.770%0.70281%0.807SS**PPolyproline II helixtrans-56137.2-178.100000112.2G1032 G1036G1032-A1034 PolarHBondContact O-N 3.49Å; A1034-G1036 PolarHBondContact O-N 3.13Å
1035P36Very low39.6Very low138 Ų138128 Ų12890%0.89681%0.805SS**THydrogen-bonded Turntrans-74.7122.5-178.329.7-30.7000110.2
1036G37.9Very low39.3Very low78 Ų78131.3 Ų131.380%0.80482%0.824SS**THydrogen-bonded Turntrans127.7-2.1163.100000117.9A1034 N1038A1034-G1036 PolarHBondContact O-N 3.13Å; G1036-N1038 PolarHBondContact O-N 3.26Å
1037M32.5Very low38.5Very low191 Ų191131.3 Ų131.394%0.94182%0.816SS**  trans-93.195.1171.9-74-170.6168.500111.2
1038N35.6Very low37.9Very low242 Ų242133.3 Ų133.3100%1.29482%0.821SS**  trans-108.70150.6-97.2-12.3000108.5G1036G1036-N1038 PolarHBondContact O-N 3.26Å

Retrieved 1,038 of 1,038 residues in 6880 ms (Link to these results)