A0A096N2L6_PAPAN Loading...

G protein-coupled receptor 88

AlphaFold DB (A0A2K5KVB9), UniProt , Accession A0A096N2L6, Species PAPAN (Papio anubis, Olive baboon), Gene GPR88, Length 384 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.5Very low38.5Very low239 Ų239133.4 Ų133.4100%1.17783%0.832SS**  0105.70-84.3173.715600108.3
2T37.5Very low38.9Very low151 Ų151131.8 Ų131.893%0.92682%0.821SS**  trans-166.7136.8141.731.60000108
3N35.9Very low39.2Very low165 Ų165130.9 Ų130.988%0.88282%0.815SS**  trans-80.7151.1-153.5-88.9-19.8000115.6
4S41.4Very low39.4Very low118 Ų118125.6 Ų125.683%0.82580%0.798SS**  trans-60.7140.3155.9-41.90000112.3
5S35.5Very low39.6Very low107 Ų107120.5 Ų120.575%0.74878%0.779SS**  trans-154.989.4147.757.20000109.3T7S5-T7 PolarHBondContact O-N 3.44Å
6S40.1Very low39.9Very low114 Ų114117.4 Ų117.480%0.79776%0.761SS**  trans-72.5104.6162.546.80000108.6S8S6-S8 PolarHBondContact O-N 2.9Å
7T35.7Very low40.1Very low124 Ų124117.1 Ų117.176%0.76175%0.751SS**  trans-80.497.7171.1-43.90000108.4S5 T9S5-T7 PolarHBondContact O-N 3.44Å; T7-T9 PolarHBondContact O-N 2.99Å
8S35.1Very low40.2Very low108 Ų108116.6 Ų116.676%0.75574%0.74SS**  trans-66.6106.9167.427.30000110S6 S10S6-S8 PolarHBondContact O-N 2.9Å; S8-S10 PolarHBondContact O-N 3.33Å
9T35.7Very low40.6Very low124 Ų124115.8 Ų115.876%0.76173%0.73SS**  trans-74.896.7166.824.30000109.8T7T7-T9 PolarHBondContact O-N 2.99Å
10S41.3Very low41.1Very low117 Ų117115.1 Ų115.182%0.81872%0.719SS**  trans-95.987.1166.5570000109.7S8S8-S10 PolarHBondContact O-N 3.33Å
11S41.3Very low41.6Very low100 Ų100112.5 Ų112.570%0.69971%0.705SS**  trans-150.947.1175.667.60000113.2
12T42.3Very low41.9Very low115 Ų115107.3 Ų107.371%0.70668%0.678SS**SBendtrans-128.411.2-177.5-21.40000114.6
13T43.9Very low42.7Very low120 Ų120105 Ų10574%0.73666%0.657SS**SBendtrans-101.2-27.6178.24.90000113.3
14G40.9Very low43.6Very low56 Ų56101.2 Ų101.258%0.57763%0.634SS**Hα-helixtrans-74.3-36.5179.800000114.3L18G14-L18 WeakPolarHBondContact O-CB 3.41Å; G14-L18 PolarHBondContact O-N 2.84Å
15G43.4Very low44.4Very low50 Ų50102.7 Ų102.752%0.51563%0.627SS.*Hα-helixtrans-72.7-37.6-178.400000114L19G15-L19 WeakPolarHBondContact O-CB 3.5Å; G15-L19 PolarHBondContact O-N 3.07Å
16S43.4Very low45.6Very low70 Ų70100.9 Ų100.949%0.4962%0.615SS.*Hα-helixtrans-72-35.4178.4-63.80000112.8L20S16-L20 WeakPolarHBondContact O-CB 3.39Å; S16-L20 WeakPolarHBondContact O-CG 3.47Å; S16-L20 PolarHBondContact O-N 3.21Å
17L43.5Very low46.7Very low112 Ų11299.2 Ų99.259%0.58659%0.591SS**Hα-helixtrans-72.9-36.3177.7-159149.9000111.2L20 C21L17-L20 PolarHBondContact O-N 3.49Å; L17-C21 VanDerWaalsContact O-CB 3.3Å; L17-C21 WeakPolarHBondContact O-CB 3.25Å; L17-C21 PolarHBondContact O-N 2.85Å; L17-C21 PolarHBondContact O-SG 2.94Å
18L42.8Very low48Very low108 Ų10894.7 Ų94.757%0.56557%0.566SS**Hα-helixtrans-68.5-39.3175.1-150.3162.3000111.5G14 C21 E22G14-L18 WeakPolarHBondContact O-CB 3.41Å; G14-L18 PolarHBondContact O-N 2.84Å; L18-C21 PolarHBondContact O-N 3.11Å; L18-E22 HydrophobicContact CD2-CG 4.12Å; L18-E22 WeakPolarHBondContact O-CB 3.36Å; L18-E22 PolarHBondContact O-N 3.16Å
19L46.8Very low49.8Very low103 Ų10391.9 Ų91.954%0.53956%0.555SS.*Hα-helixtrans-64.4-44.2172-105163.1000112.5G15 C21 E22 E23G15-L19 WeakPolarHBondContact O-CB 3.5Å; G15-L19 PolarHBondContact O-N 3.07Å; L19-C21 VanDerWaalsContact C-N 3.32Å; L19-C21 PolarHBondContact O-N 3.39Å; L19-E22 PolarHBondContact O-N 3.11Å; L19-E23 WeakPolarHBondContact O-CB 3.48Å; L19-E23 WeakPolarHBondContact O-CG 3.01Å; L19-E23 PolarHBondContact O-N 3.22Å
20L51Low51.8Low100 Ų10092.4 Ų92.452%0.52454%0.542SS..Hα-helixtrans-63.4-39174.7-73.2168.3000111.3S16 L17 E24S16-L20 WeakPolarHBondContact O-CB 3.39Å; S16-L20 WeakPolarHBondContact O-CG 3.47Å; S16-L20 PolarHBondContact O-N 3.21Å; L17-L20 PolarHBondContact O-N 3.49Å; L20-E24 WeakPolarHBondContact O-CA 3.34Å; L20-E24 WeakPolarHBondContact O-CB 3.41Å; L20-E24 WeakPolarHBondContact O-CG 3.25Å; L20-E24 PolarHBondContact O-N 3.09Å
21C51Low53.8Low61 Ų6192.5 Ų92.541%0.41253%0.525SS..Hα-helixtrans-67.7-42.9173.5-81.80000112.5L17 L18 L19 E24 E25L17-C21 VanDerWaalsContact O-CB 3.3Å; L17-C21 WeakPolarHBondContact O-CB 3.25Å; L17-C21 PolarHBondContact O-N 2.85Å; L17-C21 PolarHBondContact O-SG 2.94Å; L18-C21 PolarHBondContact O-N 3.11Å; L19-C21 VanDerWaalsContact C-N 3.32Å; L19-C21 PolarHBondContact O-N 3.39Å; C21-E24 WeakPolarHBondContact O-CA 3.2Å; C21-E24 WeakPolarHBondContact O-CB 3.47Å; C21-E24 PolarHBondContact O-N 2.97Å; C21-E25 WeakPolarHBondContact O-CB 3.49Å; C21-E25 WeakPolarHBondContact O-CG 3.27Å; C21-E25 PolarHBondContact O-N 3.2Å
22E52.4Low55.9Low130 Ų13091.6 Ų91.661%0.60751%0.511SS*.Hα-helixtrans-64.9-41.3177.7-99-162.8124.400111.8L18 L19 S26L18-E22 HydrophobicContact CD2-CG 4.12Å; L18-E22 WeakPolarHBondContact O-CB 3.36Å; L18-E22 PolarHBondContact O-N 3.16Å; L19-E22 PolarHBondContact O-N 3.11Å; E22-S26 WeakPolarHBondContact O-CB 3.05Å; E22-S26 PolarHBondContact O-N 3.32Å; E22-S26 VanDerWaalsContact O-N 3.13Å
23E52.8Low58.2Low104 Ų10489 Ų8949%0.48650%0.496SS..Hα-helixtrans-67.8-41.9172.2-59-172.2120.800110L19 E25 S26 W27L19-E23 WeakPolarHBondContact O-CB 3.48Å; L19-E23 WeakPolarHBondContact O-CG 3.01Å; L19-E23 PolarHBondContact O-N 3.22Å; E23-E25 PolarHBondContact O-N 2.87Å; E23-S26 WeakPolarHBondContact O-CB 3.47Å; E23-S26 PolarHBondContact O-N 3.18Å; E23-W27 HydrophobicContact CB-CE3 3.59Å; E23-W27 HydrophobicContact CB-CH2 3.5Å; E23-W27 VanDerWaalsContact CB-CH2 3.5Å; E23-W27 HydrophobicContact CB-CZ3 2.91Å; E23-W27 HydrophobicContact CG-CZ3 4.11Å; E23-W27 WeakPolarHBondContact O-CZ3 3.39Å; E23-W27 PolarHBondContact O-N 3.48Å
24E55.1Low60.4Low85 Ų8584.6 Ų84.640%0.39747%0.469SS..Hα-helixtrans-48.3-52.4171.9-78.2-76.4164.100113.3L20 C21 S26 W27 A28L20-E24 WeakPolarHBondContact O-CA 3.34Å; L20-E24 WeakPolarHBondContact O-CB 3.41Å; L20-E24 WeakPolarHBondContact O-CG 3.25Å; L20-E24 PolarHBondContact O-N 3.09Å; C21-E24 WeakPolarHBondContact O-CA 3.2Å; C21-E24 WeakPolarHBondContact O-CB 3.47Å; C21-E24 PolarHBondContact O-N 2.97Å; E24-S26 VanDerWaalsContact C-N 3.33Å; E24-S26 PolarHBondContact O-N 3.44Å; E24-W27 HydrophobicContact CB-CH2 4.25Å; E24-W27 HydrophobicContact CB-CZ2 3.62Å; E24-W27 VanDerWaalsContact CD-CE2 3.44Å; E24-W27 VanDerWaalsContact CD-NE1 3.25Å; E24-W27 HydrophobicContact CG-CH2 3.9Å; E24-W27 HydrophobicContact CG-CZ2 3.13Å; E24-W27 VanDerWaalsContact N-CZ2 3.32Å; E24-W27 VanDerWaalsContact O-CD1 3.23Å; E24-W27 PolarHBondContact O-N 3.09Å; E24-W27 PolarHBondContact O-NE1 2.84Å; E24-W27 VanDerWaalsContact OE1-CZ2 3.24Å; E24-W27 WeakPolarHBondContact OE1-CZ2 3.39Å; E24-W27 PolarHBondContact OE2-NE1 3.26Å; E24-A28 WeakPolarHBondContact O-CB 3.33Å; E24-A28 PolarHBondContact O-N 3.49Å
25E58.5Low62.8Low149 Ų14982 Ų8270%0.69644%0.443SS*.Hα-helixtrans-64.9-37.6179.2-67.8-66.2143.800111.8C21 E23 G29C21-E25 WeakPolarHBondContact O-CB 3.49Å; C21-E25 WeakPolarHBondContact O-CG 3.27Å; C21-E25 PolarHBondContact O-N 3.2Å; E23-E25 PolarHBondContact O-N 2.87Å; E25-G29 PolarHBondContact O-N 3.39Å
26S60.9Low65.1Low69 Ų6985.1 Ų85.148%0.48345%0.447SS..Hα-helixtrans-69.7-38-179.6-173.40000113.2E22 E23 E24E22-S26 WeakPolarHBondContact O-CB 3.05Å; E22-S26 PolarHBondContact O-N 3.32Å; E22-S26 VanDerWaalsContact O-N 3.13Å; E23-S26 WeakPolarHBondContact O-CB 3.47Å; E23-S26 PolarHBondContact O-N 3.18Å; E24-S26 VanDerWaalsContact C-N 3.33Å; E24-S26 PolarHBondContact O-N 3.44Å
27W62.7Low67.5Low79 Ų7986.4 Ų86.430%0.29945%0.447SS..Hα-helixtrans-81.7-39.7175.86069.7000113.4E23 E24 R30 R31E23-W27 HydrophobicContact CB-CE3 3.59Å; E23-W27 HydrophobicContact CB-CH2 3.5Å; E23-W27 VanDerWaalsContact CB-CH2 3.5Å; E23-W27 HydrophobicContact CB-CZ3 2.91Å; E23-W27 HydrophobicContact CG-CZ3 4.11Å; E23-W27 WeakPolarHBondContact O-CZ3 3.39Å; E23-W27 PolarHBondContact O-N 3.48Å; E24-W27 HydrophobicContact CB-CH2 4.25Å; E24-W27 HydrophobicContact CB-CZ2 3.62Å; E24-W27 VanDerWaalsContact CD-CE2 3.44Å; E24-W27 VanDerWaalsContact CD-NE1 3.25Å; E24-W27 HydrophobicContact CG-CH2 3.9Å; E24-W27 HydrophobicContact CG-CZ2 3.13Å; E24-W27 VanDerWaalsContact N-CZ2 3.32Å; E24-W27 VanDerWaalsContact O-CD1 3.23Å; E24-W27 PolarHBondContact O-N 3.09Å; E24-W27 PolarHBondContact O-NE1 2.84Å; E24-W27 VanDerWaalsContact OE1-CZ2 3.24Å; E24-W27 WeakPolarHBondContact OE1-CZ2 3.39Å; E24-W27 PolarHBondContact OE2-NE1 3.26Å; W27-R30 PolarHBondContact O-N 3.33Å; W27-R31 WeakPolarHBondContact O-CG 3.22Å; W27-R31 PolarHBondContact O-N 3.42Å
28A62.7Low69.9Low28 Ų2881.9 Ų81.923%0.23142%0.423CS..Hα-helixtrans-64.8-42.6179.600000110.6E24 R30 R31 I32E24-A28 WeakPolarHBondContact O-CB 3.33Å; E24-A28 PolarHBondContact O-N 3.49Å; A28-R30 PolarHBondContact O-N 2.94Å; A28-R30 VanDerWaalsContact O-N 3.1Å; A28-R31 PolarHBondContact O-N 2.94Å; A28-I32 HydrophobicContact CB-CD1 4.06Å; A28-I32 WeakPolarHBondContact O-CB 3.46Å; A28-I32 WeakPolarHBondContact O-CD1 3.21Å; A28-I32 WeakPolarHBondContact O-CG1 3.41Å; A28-I32 PolarHBondContact O-N 3.36Å
29G72.7Confident72.4Confident50 Ų5078.8 Ų78.852%0.51541%0.41SS..Hα-helixtrans-58.2-27.7-178.600000114.8E25 P33E25-G29 PolarHBondContact O-N 3.39Å; G29-P33 VanDerWaalsContact O-CD 3.26Å; G29-P33 WeakPolarHBondContact O-CD 3.25Å; G29-P33 WeakPolarHBondContact O-CG 3.43Å
30R78.7Confident74.7Confident134 Ų13476 Ų7651%0.50641%0.407SS..Hα-helixtrans-94.2-31178.9-68.8170.1178.9177.88113.7W27 A28 P33 V34 W315W27-R30 PolarHBondContact O-N 3.33Å; A28-R30 PolarHBondContact O-N 2.94Å; A28-R30 VanDerWaalsContact O-N 3.1Å; R30-P33 WeakPolarHBondContact O-CG 3.48Å; R30-V34 WeakPolarHBondContact O-CG2 3.43Å; R30-W315 HydrophobicContact CB-CH2 3.8Å; R30-W315 HydrophobicContact CB-CZ2 3.89Å; R30-W315 HydrophobicContact CB-CZ3 4.45Å; R30-W315 VanDerWaalsContact CD-CZ2 3.48Å; R30-W315 HydrophobicContact CG-CH2 4.07Å; R30-W315 HydrophobicContact CG-CZ2 3.71Å
31R82.4Confident76.8Confident120 Ų12073 Ų7345%0.45339%0.391SS..Hα-helixtrans-86.4-33.4-175.4-69.4-174.8170.6-146.50.1113.8W27 A28 V34 S35 G92W27-R31 WeakPolarHBondContact O-CG 3.22Å; W27-R31 PolarHBondContact O-N 3.42Å; A28-R31 PolarHBondContact O-N 2.94Å; R31-V34 PolarHBondContact O-N 3.5Å; R31-S35 WeakPolarHBondContact O-CB 3.33Å; R31-S35 PolarHBondContact O-N 2.97Å; R31-S35 PolarHBondContact O-OG 2.89Å; R31-G92 WeakPolarHBondContact CB-O 3.03Å
32I87Confident78.9Confident80 Ų8070.4 Ų70.441%0.4137%0.374SS..Hα-helixtrans-55.1-53.7175.1-66165.1000111.8A28 V34 S35 L36 L93A28-I32 HydrophobicContact CB-CD1 4.06Å; A28-I32 WeakPolarHBondContact O-CB 3.46Å; A28-I32 WeakPolarHBondContact O-CD1 3.21Å; A28-I32 WeakPolarHBondContact O-CG1 3.41Å; A28-I32 PolarHBondContact O-N 3.36Å; I32-V34 VanDerWaalsContact C-N 3.34Å; I32-V34 PolarHBondContact O-N 2.63Å; I32-S35 PolarHBondContact O-N 3.06Å; I32-L36 HydrophobicContact CG2-CD1 4.07Å; I32-L36 HydrophobicContact CG2-CG 4.45Å; I32-L36 WeakPolarHBondContact O-CG 3.45Å; I32-L36 PolarHBondContact O-N 3.35Å; I32-L93 HydrophobicContact CG1-CD2 4.15Å
33P90.2Very high81Confident60 Ų6069.5 Ų69.539%0.3937%0.372SS..Hα-helixtrans-63.5-37.9-178.923.4-34.1000112.7G29 R30 S35 L36 L37G29-P33 VanDerWaalsContact O-CD 3.26Å; G29-P33 WeakPolarHBondContact O-CD 3.25Å; G29-P33 WeakPolarHBondContact O-CG 3.43Å; R30-P33 WeakPolarHBondContact O-CG 3.48Å; P33-S35 VanDerWaalsContact C-N 3.33Å; P33-S35 PolarHBondContact O-N 3.07Å; P33-L36 PolarHBondContact O-N 3.49Å; P33-L37 VanDerWaalsContact O-CG 3.26Å; P33-L37 WeakPolarHBondContact O-CG 3.24Å; P33-L37 PolarHBondContact O-N 2.85Å
34V88.9Confident83Confident29 Ų2966.3 Ų66.318%0.17637%0.367CS..Hα-helixtrans-63.1-41.3176.3173.80000111.1R30 R31 I32 L37 Y38 W315 A319 L323R30-V34 WeakPolarHBondContact O-CG2 3.43Å; R31-V34 PolarHBondContact O-N 3.5Å; I32-V34 VanDerWaalsContact C-N 3.34Å; I32-V34 PolarHBondContact O-N 2.63Å; V34-L37 PolarHBondContact O-N 3.36Å; V34-Y38 HydrophobicContact CG1-CD2 3.75Å; V34-Y38 HydrophobicContact CG1-CE2 3.52Å; V34-Y38 VanDerWaalsContact O-CD2 3.23Å; V34-Y38 WeakPolarHBondContact O-CD2 3.43Å; V34-Y38 PolarHBondContact O-N 3.33Å; V34-W315 HydrophobicContact CG2-CZ3 4.26Å; V34-A319 HydrophobicContact CG2-CB 4.5Å; V34-L323 HydrophobicContact CG1-CD1 4.37Å
35S91.1Very high84.8Confident2 Ų262.3 Ų62.31%0.01435%0.348CS..Hα-helixtrans-67.2-38.9178.4-54.80000112.4R31 I32 P33 Y38 S39 A89 G92R31-S35 WeakPolarHBondContact O-CB 3.33Å; R31-S35 PolarHBondContact O-N 2.97Å; R31-S35 PolarHBondContact O-OG 2.89Å; I32-S35 PolarHBondContact O-N 3.06Å; P33-S35 VanDerWaalsContact C-N 3.33Å; P33-S35 PolarHBondContact O-N 3.07Å; S35-Y38 PolarHBondContact O-N 3.08Å; S35-S39 PolarHBondContact O-N 2.86Å; S35-S39 PolarHBondContact O-OG 3.01Å; S35-A89 WeakPolarHBondContact CB-O 3.26Å; S35-A89 WeakPolarHBondContact O-CB 3.28Å; S35-A89 PolarHBondContact OG-O 2.84Å; S35-G92 WeakPolarHBondContact OG-CA 3.48Å
36L92.6Very high86.6Confident114 Ų11457.4 Ų57.460%0.59733%0.328SS*.Hα-helixtrans-64.1-41.3172.9-69.4174.7000111.6I32 P33 S39 G40I32-L36 HydrophobicContact CG2-CD1 4.07Å; I32-L36 HydrophobicContact CG2-CG 4.45Å; I32-L36 WeakPolarHBondContact O-CG 3.45Å; I32-L36 PolarHBondContact O-N 3.35Å; P33-L36 PolarHBondContact O-N 3.49Å; L36-S39 PolarHBondContact O-N 3.23Å; L36-G40 PolarHBondContact O-N 2.77Å
37L93.9Very high88.2Confident97 Ų9760 Ų6051%0.50834%0.336SS..Hα-helixtrans-63.3-44.9175.2-71.5170.5000111.6P33 V34 S39 G40 L41 L323P33-L37 VanDerWaalsContact O-CG 3.26Å; P33-L37 WeakPolarHBondContact O-CG 3.24Å; P33-L37 PolarHBondContact O-N 2.85Å; V34-L37 PolarHBondContact O-N 3.36Å; L37-S39 VanDerWaalsContact C-N 3.32Å; L37-S39 PolarHBondContact O-N 3.28Å; L37-G40 PolarHBondContact O-N 2.81Å; L37-L41 WeakPolarHBondContact O-CB 3.16Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.21Å; L37-L41 PolarHBondContact O-N 2.91Å; L37-L323 HydrophobicContact CB-CD2 3.86Å; L37-L323 HydrophobicContact CD1-CD1 3.91Å
38Y93.7Very high89.6Confident18 Ų1857.1 Ų57.17%0.07133%0.329CS..Hα-helixtrans-59-42.5173.6-83.4-63.4000112.2V34 S35 L41 A42 W84 M85 E88 W322 L323 C326V34-Y38 HydrophobicContact CG1-CD2 3.75Å; V34-Y38 HydrophobicContact CG1-CE2 3.52Å; V34-Y38 VanDerWaalsContact O-CD2 3.23Å; V34-Y38 WeakPolarHBondContact O-CD2 3.43Å; V34-Y38 PolarHBondContact O-N 3.33Å; S35-Y38 PolarHBondContact O-N 3.08Å; Y38-L41 PolarHBondContact O-N 3.4Å; Y38-A42 VanDerWaalsContact O-CB 3.23Å; Y38-A42 WeakPolarHBondContact O-CB 3.34Å; Y38-A42 PolarHBondContact O-N 2.87Å; Y38-W84 HydrophobicContact CE1-CH2 4.39Å; Y38-W84 HydrophobicContact CE1-CZ3 4.09Å; Y38-M85 HydrophobicContact CD1-CB 4.45Å; Y38-M85 HydrophobicContact CD1-CG 4.34Å; Y38-E88 HydrophobicContact CD1-CB 4.38Å; Y38-E88 HydrophobicContact CD2-CB 4.24Å; Y38-E88 HydrophobicContact CE1-CB 4.47Å; Y38-E88 HydrophobicContact CE2-CB 4.34Å; Y38-E88 HydrophobicContact CG-CB 4.27Å; Y38-W322 WeakPolarHBondContact OH-CB 3.28Å; Y38-L323 HydrophobicContact CD1-CD2 4.15Å; Y38-L323 HydrophobicContact CD2-CD2 4.13Å; Y38-L323 HydrophobicContact CE1-CD2 4.07Å; Y38-L323 HydrophobicContact CE2-CD2 4.07Å; Y38-L323 HydrophobicContact CG-CD2 4.17Å; Y38-C326 HydrophobicContact CE1-CB 4.37Å; Y38-C326 VanDerWaalsContact CE1-SG 3.56Å
39S94.9Very high91.1Very high43 Ų4355.8 Ų55.830%0.30132%0.318SS..Hα-helixtrans-62.9-45.6177.4-58.80000112.1S35 L36 L37 A42 I43 A89S35-S39 PolarHBondContact O-N 2.86Å; S35-S39 PolarHBondContact O-OG 3.01Å; L36-S39 PolarHBondContact O-N 3.23Å; L37-S39 VanDerWaalsContact C-N 3.32Å; L37-S39 PolarHBondContact O-N 3.28Å; S39-A42 WeakPolarHBondContact O-CB 3.32Å; S39-A42 PolarHBondContact O-N 3.48Å; S39-I43 WeakPolarHBondContact O-CG1 3.41Å; S39-I43 PolarHBondContact O-N 2.99Å; S39-A89 WeakPolarHBondContact OG-CB 3.48Å
40G95.3Very high92.1Very high45 Ų4554.7 Ų54.746%0.46431%0.307SS..Hα-helixtrans-62.5-43.5176.700000112.5L36 L37 G44L36-G40 PolarHBondContact O-N 2.77Å; L37-G40 PolarHBondContact O-N 2.81Å; G40-G44 PolarHBondContact O-N 3.46Å
41L95.1Very high92.8Very high37 Ų3751.7 Ų51.719%0.19430%0.3CS..Hα-helixtrans-66.2-37.6175.6-71.1175.8000112.4L37 Y38 G45 M85 L323 C326 A327 A330L37-L41 WeakPolarHBondContact O-CB 3.16Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.21Å; L37-L41 PolarHBondContact O-N 2.91Å; Y38-L41 PolarHBondContact O-N 3.4Å; L41-G45 WeakPolarHBondContact O-CA 3.28Å; L41-G45 PolarHBondContact O-N 2.73Å; L41-M85 HydrophobicContact CB-SD 3.97Å; L41-L323 HydrophobicContact CD1-CD2 4.19Å; L41-C326 HydrophobicContact CD1-CB 3.81Å; L41-A327 HydrophobicContact CD1-CB 4.42Å; L41-A327 HydrophobicContact CD2-CB 4.09Å; L41-A330 HydrophobicContact CD2-CB 4.2Å
42A96.1Very high93.3Very high6 Ų646 Ų465%0.0528%0.279CS..Hα-helixtrans-61.7-50.5176.200000111.2Y38 S39 T46 C81 M85 P86Y38-A42 VanDerWaalsContact O-CB 3.23Å; Y38-A42 WeakPolarHBondContact O-CB 3.34Å; Y38-A42 PolarHBondContact O-N 2.87Å; S39-A42 WeakPolarHBondContact O-CB 3.32Å; S39-A42 PolarHBondContact O-N 3.48Å; A42-T46 WeakPolarHBondContact O-CB 3.4Å; A42-T46 PolarHBondContact O-N 3.38Å; A42-T46 PolarHBondContact O-OG1 3.44Å; A42-C81 WeakPolarHBondContact CA-O 3.31Å; A42-C81 VanDerWaalsContact CB-O 3.24Å; A42-C81 WeakPolarHBondContact CB-O 3.33Å; A42-M85 HydrophobicContact CB-CB 3.82Å; A42-P86 HydrophobicContact CB-CG 4.02Å
43I95.8Very high93.7Very high111 Ų11144.4 Ų44.457%0.56927%0.27SS*.Hα-helixtrans-64.4-54.4179.6-64165.3000110.1S39 G45 T46 L47S39-I43 WeakPolarHBondContact O-CG1 3.41Å; S39-I43 PolarHBondContact O-N 2.99Å; I43-G45 PolarHBondContact O-N 2.82Å; I43-T46 PolarHBondContact O-N 3.05Å; I43-L47 HydrophobicContact CG2-CD1 4.03Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 2.85Å
44G94.2Very high93.8Very high37 Ų3747.4 Ų47.438%0.38128%0.275SS..Hα-helixtrans-61.2-44.3-17800000112.4G40 L47 A48G40-G44 PolarHBondContact O-N 3.46Å; G44-L47 PolarHBondContact O-N 2.92Å; G44-A48 VanDerWaalsContact O-CB 3.24Å; G44-A48 WeakPolarHBondContact O-CB 3.35Å; G44-A48 PolarHBondContact O-N 2.91Å
45G94.1Very high94Very high0 Ų046.1 Ų46.10%027%0.267CS..Hα-helixtrans-66.6-38.2178.300000113.1L41 I43 N49L41-G45 WeakPolarHBondContact O-CA 3.28Å; L41-G45 PolarHBondContact O-N 2.73Å; I43-G45 PolarHBondContact O-N 2.82Å; G45-N49 VanDerWaalsContact O-CB 3.27Å; G45-N49 WeakPolarHBondContact O-CB 3.44Å; G45-N49 PolarHBondContact O-N 3.42Å; G45-N49 PolarHBondContact O-ND2 3.44Å
46T95.7Very high94.1Very high46 Ų4646.6 Ų46.628%0.28227%0.269SS..Hα-helixtrans-64.5-47176-59.90000111.1A42 I43 G50 L78 A82A42-T46 WeakPolarHBondContact O-CB 3.4Å; A42-T46 PolarHBondContact O-N 3.38Å; A42-T46 PolarHBondContact O-OG1 3.44Å; I43-T46 PolarHBondContact O-N 3.05Å; T46-G50 PolarHBondContact O-N 3.45Å; T46-L78 HydrophobicContact CG2-CD2 4.02Å; T46-L78 WeakPolarHBondContact O-CD2 3.25Å; T46-A82 HydrophobicContact CG2-CB 3.97Å; T46-A82 WeakPolarHBondContact OG1-CA 3.46Å; T46-A82 WeakPolarHBondContact OG1-CB 3.39Å; T46-A82 PolarHBondContact OG1-N 2.89Å
47L94.1Very high94.1Very high123 Ų12344.6 Ų44.664%0.64427%0.265SS*.Hα-helixtrans-63.5-46.4177.5-67.1173.4000111.7I43 G44 M51I43-L47 HydrophobicContact CG2-CD1 4.03Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 2.85Å; G44-L47 PolarHBondContact O-N 2.92Å; L47-M51 VanDerWaalsContact O-CB 3.26Å; L47-M51 WeakPolarHBondContact O-CB 3.29Å; L47-M51 PolarHBondContact O-N 3.28Å
48A91.9Very high94Very high19 Ų1942.6 Ų42.616%0.15726%0.259CS..Hα-helixtrans-65.4-47.2-177.900000112.4G44 M51 V52 P333G44-A48 VanDerWaalsContact O-CB 3.24Å; G44-A48 WeakPolarHBondContact O-CB 3.35Å; G44-A48 PolarHBondContact O-N 2.91Å; A48-M51 PolarHBondContact O-N 2.93Å; A48-V52 PolarHBondContact O-N 3.4Å; A48-P333 HydrophobicContact CB-CB 4.15Å; A48-P333 HydrophobicContact CB-CG 4.06Å
49N94.8Very high93.9Very high0 Ų044.6 Ų44.60%027%0.268CS..Hα-helixtrans-67.8-43.2178.6-75.4-65.8000111.3G45 M51 V52 I53 C74 L78 S329 P333G45-N49 VanDerWaalsContact O-CB 3.27Å; G45-N49 WeakPolarHBondContact O-CB 3.44Å; G45-N49 PolarHBondContact O-N 3.42Å; G45-N49 PolarHBondContact O-ND2 3.44Å; N49-M51 VanDerWaalsContact C-N 3.34Å; N49-M51 PolarHBondContact O-N 3.16Å; N49-V52 PolarHBondContact O-N 3.3Å; N49-I53 WeakPolarHBondContact O-CG1 3.42Å; N49-I53 PolarHBondContact O-N 3Å; N49-I53 VanDerWaalsContact O-N 3.15Å; N49-C74 HydrophobicContact CB-CB 4.12Å; N49-C74 WeakPolarHBondContact OD1-CA 3.45Å; N49-C74 PolarHBondContact OD1-SG 2.87Å; N49-C74 VanDerWaalsContact OD1-SG 3.34Å; N49-L78 HydrophobicContact CB-CD2 3.78Å; N49-L78 HydrophobicContact CB-CG 3.77Å; N49-S329 PolarHBondContact ND2-O 3.38Å; N49-P333 HydrophobicContact CB-CG 4.23Å; N49-P333 WeakPolarHBondContact OD1-CD 3.32Å; N49-P333 WeakPolarHBondContact OD1-CG 3.43Å
50G94.5Very high93.7Very high28 Ų2852.9 Ų52.929%0.28929%0.293SS..Hα-helixtrans-58.8-42.9174.900000112.6T46 V52 I53 Y54T46-G50 PolarHBondContact O-N 3.45Å; G50-V52 PolarHBondContact O-N 3.46Å; G50-I53 PolarHBondContact O-N 2.96Å; G50-Y54 WeakPolarHBondContact O-CB 3.47Å; G50-Y54 PolarHBondContact O-N 3.02Å
51M92.3Very high93.4Very high70 Ų7058.9 Ų58.935%0.34531%0.306SS..Hα-helixtrans-60.8-43.2177.2-177.4171.666.400112.1L47 A48 N49 Y54 L55 L351L47-M51 VanDerWaalsContact O-CB 3.26Å; L47-M51 WeakPolarHBondContact O-CB 3.29Å; L47-M51 PolarHBondContact O-N 3.28Å; A48-M51 PolarHBondContact O-N 2.93Å; N49-M51 VanDerWaalsContact C-N 3.34Å; N49-M51 PolarHBondContact O-N 3.16Å; M51-Y54 PolarHBondContact O-N 3.26Å; M51-L55 HydrophobicContact CG-CD1 3.96Å; M51-L55 HydrophobicContact CG-CG 4.3Å; M51-L55 WeakPolarHBondContact O-CB 3.32Å; M51-L55 VanDerWaalsContact O-CG 3.23Å; M51-L55 WeakPolarHBondContact O-CG 3.17Å; M51-L55 PolarHBondContact O-N 2.89Å; M51-L351 HydrophobicContact SD-CD1 4.1Å
52V92.8Very high93Very high2 Ų257.2 Ų57.21%0.01230%0.298CS..Hα-helixtrans-65.1-42.6178.7170.90000111.8A48 N49 G50 Y54 L55 V56 I70 P333 T337 F343A48-V52 PolarHBondContact O-N 3.4Å; N49-V52 PolarHBondContact O-N 3.3Å; G50-V52 PolarHBondContact O-N 3.46Å; V52-Y54 VanDerWaalsContact C-N 3.33Å; V52-Y54 PolarHBondContact O-N 3.46Å; V52-L55 PolarHBondContact O-N 3.16Å; V52-V56 WeakPolarHBondContact O-CG2 3.27Å; V52-V56 PolarHBondContact O-N 2.82Å; V52-I70 HydrophobicContact CG1-CG2 4.11Å; V52-P333 HydrophobicContact CG2-CB 3.63Å; V52-P333 HydrophobicContact CG2-CG 4.36Å; V52-T337 HydrophobicContact CG1-CG2 4.23Å; V52-T337 HydrophobicContact CG2-CG2 3.82Å; V52-F343 HydrophobicContact CG1-CE1 4.15Å
53I94.8Very high92.8Very high45 Ų4561.7 Ų61.723%0.23132%0.318CS..Hα-helixtrans-61.1-45.1175.7-63174.3000110.2N49 G50 V56 S57 V71 C74 A75 L78N49-I53 WeakPolarHBondContact O-CG1 3.42Å; N49-I53 PolarHBondContact O-N 3Å; N49-I53 VanDerWaalsContact O-N 3.15Å; G50-I53 PolarHBondContact O-N 2.96Å; I53-V56 PolarHBondContact O-N 3.04Å; I53-S57 WeakPolarHBondContact O-CB 3.13Å; I53-S57 PolarHBondContact O-N 3.04Å; I53-S57 PolarHBondContact O-OG 3.44Å; I53-V71 HydrophobicContact CG1-CG1 4.28Å; I53-C74 HydrophobicContact CD1-CB 3.96Å; I53-C74 HydrophobicContact CG1-CB 3.75Å; I53-A75 HydrophobicContact CD1-CB 4.48Å; I53-L78 HydrophobicContact CD1-CD1 3.49Å; I53-L78 VanDerWaalsContact CD1-CD1 3.49Å; I53-L78 HydrophobicContact CD1-CG 4.36Å
54Y94.1Very high92.5Very high123 Ų12359.5 Ų59.548%0.48231%0.309SS..Hα-helixtrans-60.1-46.5176.4173.7-101.5000112.4G50 M51 V52 S57 S58 V350G50-Y54 WeakPolarHBondContact O-CB 3.47Å; G50-Y54 PolarHBondContact O-N 3.02Å; M51-Y54 PolarHBondContact O-N 3.26Å; V52-Y54 VanDerWaalsContact C-N 3.33Å; V52-Y54 PolarHBondContact O-N 3.46Å; Y54-S57 WeakPolarHBondContact CA-OG 3.32Å; Y54-S57 PolarHBondContact O-N 2.89Å; Y54-S57 PolarHBondContact O-OG 3.23Å; Y54-S58 VanDerWaalsContact CE2-OG 3.27Å; Y54-S58 WeakPolarHBondContact CE2-OG 3.23Å; Y54-S58 VanDerWaalsContact O-CB 3.22Å; Y54-S58 WeakPolarHBondContact O-CB 3.39Å; Y54-S58 PolarHBondContact O-N 3.37Å; Y54-S58 PolarHBondContact O-OG 2.99Å; Y54-V350 HydrophobicContact CE1-CG1 3.85Å; Y54-V350 HydrophobicContact CE1-CG2 3.95Å
55L92.6Very high92.2Very high3 Ų359.3 Ų59.32%0.01630%0.301CS..Hα-helixtrans-64.7-44.3-179.7-69.8171.4000111.8M51 V52 S57 S58 F59 L62 F343 V347 V350M51-L55 HydrophobicContact CG-CD1 3.96Å; M51-L55 HydrophobicContact CG-CG 4.3Å; M51-L55 WeakPolarHBondContact O-CB 3.32Å; M51-L55 VanDerWaalsContact O-CG 3.23Å; M51-L55 WeakPolarHBondContact O-CG 3.17Å; M51-L55 PolarHBondContact O-N 2.89Å; V52-L55 PolarHBondContact O-N 3.16Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.38Å; L55-S58 PolarHBondContact O-N 2.84Å; L55-F59 HydrophobicContact CD2-CD2 4.15Å; L55-F59 HydrophobicContact CD2-CE2 3.78Å; L55-F59 VanDerWaalsContact O-CD2 3.32Å; L55-F59 WeakPolarHBondContact O-CD2 3.39Å; L55-F59 PolarHBondContact O-N 3.31Å; L55-L62 HydrophobicContact CB-CD1 4.23Å; L55-F343 HydrophobicContact CB-CD1 4.48Å; L55-F343 HydrophobicContact CB-CE1 4.42Å; L55-F343 HydrophobicContact CD1-CD1 4.27Å; L55-V347 HydrophobicContact CD1-CG2 3.47Å; L55-V347 VanDerWaalsContact CD1-CG2 3.47Å; L55-V350 HydrophobicContact CD2-CG2 3.87Å
56V92.9Very high91.9Very high11 Ų1159.6 Ų59.67%0.06730%0.303CS..Hα-helixtrans-66.5-38.4179.1176.70000111.3V52 I53 L62 Q63 N67 V71 F343V52-V56 WeakPolarHBondContact O-CG2 3.27Å; V52-V56 PolarHBondContact O-N 2.82Å; I53-V56 PolarHBondContact O-N 3.04Å; V56-L62 HydrophobicContact CG2-CB 4.37Å; V56-Q63 WeakPolarHBondContact O-CG 3.34Å; V56-N67 HydrophobicContact CG1-CB 4.28Å; V56-N67 HydrophobicContact CG2-CB 4.32Å; V56-V71 HydrophobicContact CB-CG2 3.64Å; V56-V71 HydrophobicContact CG1-CG2 3.67Å; V56-V71 HydrophobicContact CG2-CG2 3.79Å; V56-F343 HydrophobicContact CG2-CE1 3.69Å; V56-F343 HydrophobicContact CG2-CZ 3.45Å; V56-F343 VanDerWaalsContact CG2-CZ 3.45Å
57S93.3Very high91.7Very high72 Ų7257.8 Ų57.850%0.50329%0.292SS..Hα-helixtrans-70.4-35.8177.154.70000112.8I53 Y54 L55 Q63I53-S57 WeakPolarHBondContact O-CB 3.13Å; I53-S57 PolarHBondContact O-N 3.04Å; I53-S57 PolarHBondContact O-OG 3.44Å; Y54-S57 WeakPolarHBondContact CA-OG 3.32Å; Y54-S57 PolarHBondContact O-N 2.89Å; Y54-S57 PolarHBondContact O-OG 3.23Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.38Å; S57-Q63 PolarHBondContact O-NE2 3.28Å
58S91.5Very high91.6Very high56 Ų5653.3 Ų53.339%0.39227%0.272SS..Hα-helixtrans-79.1-36.5-177-58.70000113.6Y54 L55Y54-S58 VanDerWaalsContact CE2-OG 3.27Å; Y54-S58 WeakPolarHBondContact CE2-OG 3.23Å; Y54-S58 VanDerWaalsContact O-CB 3.22Å; Y54-S58 WeakPolarHBondContact O-CB 3.39Å; Y54-S58 PolarHBondContact O-N 3.37Å; Y54-S58 PolarHBondContact O-OG 2.99Å; L55-S58 PolarHBondContact O-N 2.84Å
59F92.1Very high91.7Very high59 Ų5952.4 Ų52.426%0.25927%0.265SS..  trans-104.1108.2-174.3-66.7-85.5000111.7L55 K61 L62 Q63 S349 V350L55-F59 HydrophobicContact CD2-CD2 4.15Å; L55-F59 HydrophobicContact CD2-CE2 3.78Å; L55-F59 VanDerWaalsContact O-CD2 3.32Å; L55-F59 WeakPolarHBondContact O-CD2 3.39Å; L55-F59 PolarHBondContact O-N 3.31Å; F59-K61 PolarHBondContact O-N 3.48Å; F59-L62 HydrophobicContact CB-CB 4.34Å; F59-L62 HydrophobicContact CB-CD1 4.06Å; F59-L62 HydrophobicContact CB-CG 4.06Å; F59-L62 WeakPolarHBondContact O-CA 3.48Å; F59-L62 WeakPolarHBondContact O-CB 3.34Å; F59-L62 PolarHBondContact O-N 2.86Å; F59-Q63 PolarHBondContact O-N 3.35Å; F59-S349 WeakPolarHBondContact CZ-OG 3.39Å; F59-V350 HydrophobicContact CE2-CG2 3.82Å; F59-V350 HydrophobicContact CZ-CG2 3.97Å
60R89.1Confident91.6Very high218 Ų21852.6 Ų52.682%0.82327%0.266SS*.G310 helixtrans-53.8-30.9177.7-70.1-164-179.6177.81.9114L62 Q63R60-L62 PolarHBondContact O-N 3.12Å; R60-Q63 PolarHBondContact O-N 2.93Å
61K89.1Confident91.6Very high170 Ų17053 Ų5374%0.73926%0.262SS*.G310 helixtrans-63.6-26.5175.2-68.6-176.7179178.70113.1F59F59-K61 PolarHBondContact O-N 3.48Å
62L87.3Confident91.8Very high2 Ų250.1 Ų50.11%0.0125%0.248CC..G310 helixtrans-90.3-10.3177.5-62.9-178.1000112.8L55 V56 F59 R60 T64 N67 E342 F343L55-L62 HydrophobicContact CB-CD1 4.23Å; V56-L62 HydrophobicContact CG2-CB 4.37Å; F59-L62 HydrophobicContact CB-CB 4.34Å; F59-L62 HydrophobicContact CB-CD1 4.06Å; F59-L62 HydrophobicContact CB-CG 4.06Å; F59-L62 WeakPolarHBondContact O-CA 3.48Å; F59-L62 WeakPolarHBondContact O-CB 3.34Å; F59-L62 PolarHBondContact O-N 2.86Å; R60-L62 PolarHBondContact O-N 3.12Å; L62-T64 PolarHBondContact O-N 2.99Å; L62-N67 WeakPolarHBondContact O-CB 3.46Å; L62-N67 PolarHBondContact O-ND2 2.92Å; L62-E342 HydrophobicContact CD2-CB 3.63Å; L62-F343 HydrophobicContact CD1-CD1 3.9Å; L62-F343 HydrophobicContact CD1-CD2 4.46Å; L62-F343 HydrophobicContact CD1-CE1 3.95Å; L62-F343 HydrophobicContact CD1-CG 4.18Å; L62-F343 HydrophobicContact CD1-CZ 4.29Å; L62-F343 HydrophobicContact CD2-CD2 3.8Å; L62-F343 HydrophobicContact CD2-CE2 3.94Å; L62-F343 HydrophobicContact CD2-CG 4.21Å; L62-F343 HydrophobicContact CD2-CZ 4.44Å
63Q91.8Very high91.9Very high101 Ų10150.2 Ų50.247%0.47225%0.25SS..  trans-78.767.2-178.3-65.4176.7-7.300112.3V56 S57 F59 R60V56-Q63 WeakPolarHBondContact O-CG 3.34Å; S57-Q63 PolarHBondContact O-NE2 3.28Å; F59-Q63 PolarHBondContact O-N 3.35Å; R60-Q63 PolarHBondContact O-N 2.93Å
64T90.3Very high92Very high64 Ų6448.3 Ų48.339%0.39324%0.241SC..  trans-110.6157.8178.967.70000111.3L62 S66 N67 A68L62-T64 PolarHBondContact O-N 2.99Å; T64-S66 PolarHBondContact O-N 3.49Å; T64-N67 PolarHBondContact O-N 3.15Å; T64-N67 PolarHBondContact OG1-N 3.11Å; T64-N67 PolarHBondContact OG1-ND2 3.43Å; T64-A68 PolarHBondContact O-N 2.68Å
65T87.6Confident92.1Very high33 Ų3344.1 Ų44.120%0.20223%0.232CC..Hα-helixtrans-56.9-37.6175.551.20000112.1N67 A68 F69 T158T65-N67 VanDerWaalsContact C-N 3.31Å; T65-N67 PolarHBondContact O-N 3.3Å; T65-A68 WeakPolarHBondContact O-CB 3.36Å; T65-A68 PolarHBondContact O-N 3.34Å; T65-F69 VanDerWaalsContact O-CD2 3.25Å; T65-F69 WeakPolarHBondContact O-CD2 3.43Å; T65-F69 PolarHBondContact O-N 3.49Å; T65-T158 HydrophobicContact CG2-CG2 4.34Å
66S87.1Confident92.3Very high7 Ų744 Ų445%0.04923%0.231CC..Hα-helixtrans-62.3-37174.9-175.60000113.2T64 N137 R138T64-S66 PolarHBondContact O-N 3.49Å; S66-N137 VanDerWaalsContact CB-ND2 3.33Å; S66-N137 WeakPolarHBondContact CB-ND2 3.37Å; S66-N137 PolarHBondContact OG-ND2 2.87Å; S66-R138 PolarHBondContact OG-NH1 3.32Å; S66-R138 PolarHBondContact OG-NH2 3.38Å
67N90.9Very high92.4Very high7 Ų743.5 Ų43.54%0.03723%0.228CC..Hα-helixtrans-83-22.8-180-67.9-9.3000111.4V56 L62 T64 T65 F69 I70 V71V56-N67 HydrophobicContact CG1-CB 4.28Å; V56-N67 HydrophobicContact CG2-CB 4.32Å; L62-N67 WeakPolarHBondContact O-CB 3.46Å; L62-N67 PolarHBondContact O-ND2 2.92Å; T64-N67 PolarHBondContact O-N 3.15Å; T64-N67 PolarHBondContact OG1-N 3.11Å; T64-N67 PolarHBondContact OG1-ND2 3.43Å; T65-N67 VanDerWaalsContact C-N 3.31Å; T65-N67 PolarHBondContact O-N 3.3Å; N67-F69 VanDerWaalsContact C-N 3.32Å; N67-F69 PolarHBondContact O-N 3.48Å; N67-I70 WeakPolarHBondContact O-CB 3.28Å; N67-I70 PolarHBondContact O-N 2.67Å; N67-I70 VanDerWaalsContact O-N 3.16Å; N67-V71 WeakPolarHBondContact O-CG2 3.4Å; N67-V71 PolarHBondContact O-N 2.87Å
68A93.8Very high92.5Very high29 Ų2942.2 Ų42.224%0.2422%0.215CC..Hα-helixtrans-60.5-39.3171.300000112.1T64 T65 I70 V71 N72 T158T64-A68 PolarHBondContact O-N 2.68Å; T65-A68 WeakPolarHBondContact O-CB 3.36Å; T65-A68 PolarHBondContact O-N 3.34Å; A68-I70 VanDerWaalsContact C-N 3.34Å; A68-V71 PolarHBondContact O-N 2.9Å; A68-N72 PolarHBondContact O-N 3.33Å; A68-T158 HydrophobicContact CB-CG2 4.23Å
69F93.8Very high92.6Very high0 Ų040.3 Ų40.30%020%0.202CC..Hα-helixtrans-66.4-35173.6-62-59.7000113.1T65 N67 N72 G73 L133 V134 N137 Y153 T158 M161 L162T65-F69 VanDerWaalsContact O-CD2 3.25Å; T65-F69 WeakPolarHBondContact O-CD2 3.43Å; T65-F69 PolarHBondContact O-N 3.49Å; N67-F69 VanDerWaalsContact C-N 3.32Å; N67-F69 PolarHBondContact O-N 3.48Å; F69-N72 PolarHBondContact O-N 3.15Å; F69-G73 PolarHBondContact O-N 3Å; F69-G73 VanDerWaalsContact O-N 3.11Å; F69-L133 HydrophobicContact CD1-CB 3.66Å; F69-L133 HydrophobicContact CD1-CD1 3.83Å; F69-L133 HydrophobicContact CD1-CG 4.31Å; F69-L133 HydrophobicContact CE1-CB 4.02Å; F69-L133 HydrophobicContact CE1-CD1 3.94Å; F69-L133 HydrophobicContact CE1-CD2 4.5Å; F69-L133 HydrophobicContact CE1-CG 4.38Å; F69-L133 HydrophobicContact CG-CB 4.11Å; F69-V134 HydrophobicContact CB-CG2 3.65Å; F69-N137 HydrophobicContact CD2-CB 4.01Å; F69-N137 HydrophobicContact CE2-CB 4.03Å; F69-Y153 AromaticContact CE2-CD1 3.72Å; F69-Y153 HydrophobicContact CE2-CD1 3.72Å; F69-Y153 AromaticContact CE2-CE1 3.47Å; F69-Y153 HydrophobicContact CE2-CE1 3.47Å; F69-Y153 VanDerWaalsContact CE2-CE1 3.47Å; F69-Y153 AromaticContact CZ-CD1 3.89Å; F69-Y153 HydrophobicContact CZ-CD1 3.89Å; F69-Y153 AromaticContact CZ-CE1 3.61Å; F69-Y153 HydrophobicContact CZ-CE1 3.61Å; F69-T158 HydrophobicContact CE1-CG2 4.13Å; F69-T158 HydrophobicContact CE2-CG2 4.3Å; F69-T158 HydrophobicContact CZ-CG2 3.83Å; F69-M161 HydrophobicContact CE1-CB 4.09Å; F69-M161 HydrophobicContact CE1-CE 3.99Å; F69-M161 HydrophobicContact CE1-SD 4.48Å; F69-M161 HydrophobicContact CZ-CE 3.69Å; F69-M161 HydrophobicContact CZ-SD 4.07Å; F69-L162 HydrophobicContact CD1-CD1 3.65Å; F69-L162 HydrophobicContact CE1-CD1 3.56Å
70I91.9Very high92.7Very high5 Ų537.6 Ų37.63%0.02619%0.19CC..Hα-helixtrans-66.3-45.9175-61.9169000109.6V52 N67 A68 N72 G73 C74 V134 Y336V52-I70 HydrophobicContact CG1-CG2 4.11Å; N67-I70 WeakPolarHBondContact O-CB 3.28Å; N67-I70 PolarHBondContact O-N 2.67Å; N67-I70 VanDerWaalsContact O-N 3.16Å; A68-I70 VanDerWaalsContact C-N 3.34Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.88Å; I70-G73 PolarHBondContact O-N 3.35Å; I70-G73 VanDerWaalsContact O-N 3.16Å; I70-C74 PolarHBondContact O-N 3.48Å; I70-C74 PolarHBondContact O-SG 3.49Å; I70-V134 HydrophobicContact CG1-CG2 4.14Å; I70-Y336 HydrophobicContact CD1-CG 4.36Å; I70-Y336 HydrophobicContact CG1-CG 4.3Å; I70-Y336 HydrophobicContact CG2-CD2 4.41Å; I70-Y336 HydrophobicContact CG2-CG 4.46Å
71V95.2Very high93.1Very high35 Ų3527.2 Ų27.221%0.21215%0.151CC..Hα-helixtrans-60.7-39.4175.9167.80000111.7I53 V56 N67 A68 G73 C74 A75I53-V71 HydrophobicContact CG1-CG1 4.28Å; V56-V71 HydrophobicContact CB-CG2 3.64Å; V56-V71 HydrophobicContact CG1-CG2 3.67Å; V56-V71 HydrophobicContact CG2-CG2 3.79Å; N67-V71 WeakPolarHBondContact O-CG2 3.4Å; N67-V71 PolarHBondContact O-N 2.87Å; A68-V71 PolarHBondContact O-N 2.9Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-G73 PolarHBondContact O-N 2.68Å; V71-C74 PolarHBondContact O-N 3.3Å; V71-A75 WeakPolarHBondContact O-CB 3.49Å; V71-A75 PolarHBondContact O-N 3.05Å
72N96.4Very high93.4Very high10 Ų1021 Ų215%0.05313%0.132CC..Hα-helixtrans-61.1-42.4174.9-166.169.7000111.9A68 F69 I70 A75 A76 S130 L162 S165 W166A68-N72 PolarHBondContact O-N 3.33Å; F69-N72 PolarHBondContact O-N 3.15Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.88Å; N72-A75 PolarHBondContact O-N 2.6Å; N72-A76 PolarHBondContact O-N 3.38Å; N72-A76 VanDerWaalsContact O-N 3.13Å; N72-S130 PolarHBondContact ND2-OG 3.44Å; N72-L162 HydrophobicContact CB-CD2 4.13Å; N72-L162 HydrophobicContact CB-CG 4.03Å; N72-S165 PolarHBondContact ND2-OG 3.19Å; N72-S165 VanDerWaalsContact ND2-OG 3.16Å; N72-W166 PolarHBondContact OD1-NE1 3.06Å
73G95.3Very high93.6Very high5 Ų525.4 Ų25.45%0.05216%0.155CC..Hα-helixtrans-61-48.3172.100000112.1F69 I70 V71 A75 A76 D77 S130F69-G73 PolarHBondContact O-N 3Å; F69-G73 VanDerWaalsContact O-N 3.11Å; I70-G73 PolarHBondContact O-N 3.35Å; I70-G73 VanDerWaalsContact O-N 3.16Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-G73 PolarHBondContact O-N 2.68Å; G73-A75 VanDerWaalsContact C-N 3.29Å; G73-A75 PolarHBondContact O-N 3.11Å; G73-A76 WeakPolarHBondContact O-CB 3.44Å; G73-A76 PolarHBondContact O-N 3.31Å; G73-A76 VanDerWaalsContact O-N 3.11Å; G73-D77 VanDerWaalsContact O-CG 3.31Å; G73-D77 PolarHBondContact O-N 3.1Å; G73-S130 PolarHBondContact N-OG 3.45Å
74C95.8Very high93.7Very high4 Ų421.1 Ų21.13%0.02713%0.134CC..Hα-helixtrans-61.1-35.4177.3-68.40000113.1N49 I53 I70 V71 D77 L78N49-C74 HydrophobicContact CB-CB 4.12Å; N49-C74 WeakPolarHBondContact OD1-CA 3.45Å; N49-C74 PolarHBondContact OD1-SG 2.87Å; N49-C74 VanDerWaalsContact OD1-SG 3.34Å; I53-C74 HydrophobicContact CD1-CB 3.96Å; I53-C74 HydrophobicContact CG1-CB 3.75Å; I70-C74 PolarHBondContact O-N 3.48Å; I70-C74 PolarHBondContact O-SG 3.49Å; V71-C74 PolarHBondContact O-N 3.3Å; C74-D77 PolarHBondContact O-N 3.06Å; C74-L78 WeakPolarHBondContact O-CB 3.44Å; C74-L78 WeakPolarHBondContact O-CG 3.46Å; C74-L78 PolarHBondContact O-N 2.74Å
75A96.2Very high93.8Very high36 Ų3618 Ų1830%0.29812%0.115SC..Hα-helixtrans-66.5-39.5175.400000111.8I53 V71 N72 G73 S79 W166I53-A75 HydrophobicContact CD1-CB 4.48Å; V71-A75 WeakPolarHBondContact O-CB 3.49Å; V71-A75 PolarHBondContact O-N 3.05Å; N72-A75 PolarHBondContact O-N 2.6Å; G73-A75 VanDerWaalsContact C-N 3.29Å; G73-A75 PolarHBondContact O-N 3.11Å; A75-S79 PolarHBondContact O-N 3.13Å; A75-W166 HydrophobicContact CB-CZ2 4.38Å
76A96.6Very high94.1Very high0 Ų018.9 Ų18.90%012%0.121CC..Hα-helixtrans-67-46.2173.500000111.6N72 G73 L78 S79 V80 V126N72-A76 PolarHBondContact O-N 3.38Å; N72-A76 VanDerWaalsContact O-N 3.13Å; G73-A76 WeakPolarHBondContact O-CB 3.44Å; G73-A76 PolarHBondContact O-N 3.31Å; G73-A76 VanDerWaalsContact O-N 3.11Å; A76-L78 VanDerWaalsContact C-N 3.29Å; A76-L78 PolarHBondContact O-N 3.39Å; A76-S79 WeakPolarHBondContact O-CB 3.11Å; A76-S79 PolarHBondContact O-N 3.11Å; A76-S79 PolarHBondContact O-OG 3.27Å; A76-V80 PolarHBondContact O-N 2.73Å; A76-V126 HydrophobicContact CB-CB 3.79Å; A76-V126 HydrophobicContact CB-CG1 3.7Å
77D95.8Very high94.3Very high1 Ų120.6 Ų20.61%0.00513%0.129CC..Hα-helixtrans-64.1-32.6178.5-66.8-20.8000111.7G73 C74 S79 V80 C81 S127 S329 N332G73-D77 VanDerWaalsContact O-CG 3.31Å; G73-D77 PolarHBondContact O-N 3.1Å; C74-D77 PolarHBondContact O-N 3.06Å; D77-S79 VanDerWaalsContact C-N 3.33Å; D77-S79 PolarHBondContact O-N 3.47Å; D77-V80 PolarHBondContact O-N 3.48Å; D77-V80 VanDerWaalsContact O-N 3.16Å; D77-C81 WeakPolarHBondContact O-CB 3.49Å; D77-C81 PolarHBondContact O-N 2.86Å; D77-C81 PolarHBondContact O-SG 2.83Å; D77-C81 VanDerWaalsContact O-SG 3.39Å; D77-S127 VanDerWaalsContact OD1-CB 3.29Å; D77-S127 WeakPolarHBondContact OD1-CB 3.46Å; D77-S127 PolarHBondContact OD1-OG 3.26Å; D77-S329 WeakPolarHBondContact CB-O 3.46Å; D77-N332 WeakPolarHBondContact OD2-CB 3.4Å; D77-N332 PolarHBondContact OD2-ND2 2.9Å
78L95.5Very high94.1Very high44 Ų4421.6 Ų21.623%0.2313%0.133CC..Hα-helixtrans-60.3-40170.1-83.7-178.6000112.4T46 N49 I53 C74 A76 V80 C81 A82T46-L78 HydrophobicContact CG2-CD2 4.02Å; T46-L78 WeakPolarHBondContact O-CD2 3.25Å; N49-L78 HydrophobicContact CB-CD2 3.78Å; N49-L78 HydrophobicContact CB-CG 3.77Å; I53-L78 HydrophobicContact CD1-CD1 3.49Å; I53-L78 VanDerWaalsContact CD1-CD1 3.49Å; I53-L78 HydrophobicContact CD1-CG 4.36Å; C74-L78 WeakPolarHBondContact O-CB 3.44Å; C74-L78 WeakPolarHBondContact O-CG 3.46Å; C74-L78 PolarHBondContact O-N 2.74Å; A76-L78 VanDerWaalsContact C-N 3.29Å; A76-L78 PolarHBondContact O-N 3.39Å; L78-V80 PolarHBondContact O-N 3.48Å; L78-C81 PolarHBondContact O-N 3.16Å; L78-A82 WeakPolarHBondContact O-CA 3.29Å; L78-A82 WeakPolarHBondContact O-CB 3.4Å; L78-A82 PolarHBondContact O-N 3.26Å
79S94.1Very high93.9Very high17 Ų1720.4 Ų20.412%0.11912%0.123CC..Iπ-helixtrans-63-34176.376.60000111.6A75 A76 D77 L83 W84 G123A75-S79 PolarHBondContact O-N 3.13Å; A76-S79 WeakPolarHBondContact O-CB 3.11Å; A76-S79 PolarHBondContact O-N 3.11Å; A76-S79 PolarHBondContact O-OG 3.27Å; D77-S79 VanDerWaalsContact C-N 3.33Å; D77-S79 PolarHBondContact O-N 3.47Å; S79-L83 VanDerWaalsContact O-CB 3.29Å; S79-L83 WeakPolarHBondContact O-CB 3.2Å; S79-L83 PolarHBondContact O-N 2.79Å; S79-W84 PolarHBondContact O-N 3.45Å; S79-G123 WeakPolarHBondContact OG-CA 3.33Å
80V94.4Very high93.7Very high1 Ų124.5 Ų24.51%0.00615%0.148CC..Iπ-helixtrans-76.1-52176.1-173.90000110.8A76 D77 L78 W84 M85 L124A76-V80 PolarHBondContact O-N 2.73Å; D77-V80 PolarHBondContact O-N 3.48Å; D77-V80 VanDerWaalsContact O-N 3.16Å; L78-V80 PolarHBondContact O-N 3.48Å; V80-W84 HydrophobicContact CG1-CE3 3.94Å; V80-W84 WeakPolarHBondContact O-CB 3.33Å; V80-W84 PolarHBondContact O-N 2.83Å; V80-W84 VanDerWaalsContact O-N 3.14Å; V80-M85 HydrophobicContact CG1-CE 3.75Å; V80-M85 HydrophobicContact CG1-CG 4.37Å; V80-M85 WeakPolarHBondContact O-CG 3.47Å; V80-M85 PolarHBondContact O-N 3.45Å; V80-L124 HydrophobicContact CG2-CD2 4.36Å
81C95.8Very high93.3Very high0 Ų025.6 Ų25.60%015%0.154CC..Iπ-helixtrans-69.5-42.4-175.2-67.70000113.7A42 D77 L78 M85 P86A42-C81 WeakPolarHBondContact CA-O 3.31Å; A42-C81 VanDerWaalsContact CB-O 3.24Å; A42-C81 WeakPolarHBondContact CB-O 3.33Å; D77-C81 WeakPolarHBondContact O-CB 3.49Å; D77-C81 PolarHBondContact O-N 2.86Å; D77-C81 PolarHBondContact O-SG 2.83Å; D77-C81 VanDerWaalsContact O-SG 3.39Å; L78-C81 PolarHBondContact O-N 3.16Å; C81-M85 HydrophobicContact CB-CE 4.43Å; C81-M85 HydrophobicContact CB-SD 4.4Å; C81-M85 VanDerWaalsContact SG-CE 3.51Å; C81-P86 WeakPolarHBondContact O-CD 3.36Å
82A95.3Very high92.6Very high41 Ų4124.8 Ų24.834%0.33915%0.152SC..Iπ-helixtrans-90.4-27.5-17300000113T46 L78T46-A82 HydrophobicContact CG2-CB 3.97Å; T46-A82 WeakPolarHBondContact OG1-CA 3.46Å; T46-A82 WeakPolarHBondContact OG1-CB 3.39Å; T46-A82 PolarHBondContact OG1-N 2.89Å; L78-A82 WeakPolarHBondContact O-CA 3.29Å; L78-A82 WeakPolarHBondContact O-CB 3.4Å; L78-A82 PolarHBondContact O-N 3.26Å
83L92.8Very high92Very high94 Ų9429.1 Ų29.149%0.49218%0.175SC..Iπ-helixtrans-112.6-42.3-173.7-53175.4000112.7S79 Q87 L119S79-L83 VanDerWaalsContact O-CB 3.29Å; S79-L83 WeakPolarHBondContact O-CB 3.2Å; S79-L83 PolarHBondContact O-N 2.79Å; L83-Q87 VanDerWaalsContact O-CD 3.3Å; L83-Q87 WeakPolarHBondContact O-CG 3.34Å; L83-Q87 PolarHBondContact O-NE2 2.84Å; L83-L119 HydrophobicContact CB-CD1 4.23Å; L83-L119 HydrophobicContact CB-CD2 3.48Å; L83-L119 VanDerWaalsContact CB-CD2 3.48Å; L83-L119 HydrophobicContact CB-CG 4.38Å; L83-L119 HydrophobicContact CD1-CD1 4.02Å
84W93.2Very high91.1Very high10 Ų1032 Ų324%0.03819%0.189CC..Iπ-helixtrans-88.3-51-175.6-178.782000113.9Y38 S79 V80 P86 Q87 E88 L119 L120 W322Y38-W84 HydrophobicContact CE1-CH2 4.39Å; Y38-W84 HydrophobicContact CE1-CZ3 4.09Å; S79-W84 PolarHBondContact O-N 3.45Å; V80-W84 HydrophobicContact CG1-CE3 3.94Å; V80-W84 WeakPolarHBondContact O-CB 3.33Å; V80-W84 PolarHBondContact O-N 2.83Å; V80-W84 VanDerWaalsContact O-N 3.14Å; W84-P86 VanDerWaalsContact C-CD 3.46Å; W84-Q87 WeakPolarHBondContact O-CB 3.3Å; W84-Q87 PolarHBondContact O-N 3.47Å; W84-E88 HydrophobicContact CD2-CG 3.88Å; W84-E88 VanDerWaalsContact CE2-OE1 3.28Å; W84-E88 HydrophobicContact CE3-CG 3.93Å; W84-E88 HydrophobicContact CH2-CG 3.43Å; W84-E88 VanDerWaalsContact CH2-CG 3.43Å; W84-E88 HydrophobicContact CZ2-CG 3.34Å; W84-E88 WeakPolarHBondContact CZ2-OE1 3.47Å; W84-E88 HydrophobicContact CZ3-CG 3.71Å; W84-E88 PolarHBondContact NE1-OE1 3.48Å; W84-E88 PolarHBondContact O-N 3.45Å; W84-L119 HydrophobicContact CB-CD2 3.99Å; W84-L119 HydrophobicContact CB-CG 4.32Å; W84-L120 HydrophobicContact CD2-CB 4.43Å; W84-L120 HydrophobicContact CD2-CD1 3.65Å; W84-L120 HydrophobicContact CD2-CG 4.45Å; W84-L120 HydrophobicContact CE3-CD1 3.98Å; W84-L120 HydrophobicContact CG-CB 4.2Å; W84-L120 HydrophobicContact CG-CD1 4.14Å; W84-L120 HydrophobicContact CH2-CD1 4.06Å; W84-L120 HydrophobicContact CH2-CD2 4.46Å; W84-L120 HydrophobicContact CZ2-CD1 3.75Å; W84-L120 HydrophobicContact CZ2-CD2 3.61Å; W84-L120 HydrophobicContact CZ2-CG 4.21Å; W84-L120 HydrophobicContact CZ3-CD1 4.18Å; W84-W322 HydrophobicContact CH2-CE3 4.27Å
85M92.9Very high89.8Confident0 Ų035.1 Ų35.10%021%0.209CC..Hα-helixtrans-57.3-38.8-177.4-67.7-177.6-16300114.2Y38 L41 A42 V80 C81 Q87 E88 A89 C326Y38-M85 HydrophobicContact CD1-CB 4.45Å; Y38-M85 HydrophobicContact CD1-CG 4.34Å; L41-M85 HydrophobicContact CB-SD 3.97Å; A42-M85 HydrophobicContact CB-CB 3.82Å; V80-M85 HydrophobicContact CG1-CE 3.75Å; V80-M85 HydrophobicContact CG1-CG 4.37Å; V80-M85 WeakPolarHBondContact O-CG 3.47Å; V80-M85 PolarHBondContact O-N 3.45Å; C81-M85 HydrophobicContact CB-CE 4.43Å; C81-M85 HydrophobicContact CB-SD 4.4Å; C81-M85 VanDerWaalsContact SG-CE 3.51Å; M85-Q87 VanDerWaalsContact C-N 3.27Å; M85-Q87 PolarHBondContact O-N 3.3Å; M85-E88 WeakPolarHBondContact O-CB 3.37Å; M85-E88 PolarHBondContact O-N 2.98Å; M85-A89 PolarHBondContact O-N 2.72Å; M85-C326 VanDerWaalsContact CE-CA 3.49Å; M85-C326 HydrophobicContact CE-CB 3.39Å; M85-C326 WeakPolarHBondContact CE-O 3.38Å; M85-C326 HydrophobicContact SD-CB 3.98Å
86P93.3Very high87.9Confident50 Ų5037 Ų3733%0.32523%0.225SC..Hα-helixtrans-63.3-34.4175.7-23.836000112.6A42 C81 W84 A89 V90A42-P86 HydrophobicContact CB-CG 4.02Å; C81-P86 WeakPolarHBondContact O-CD 3.36Å; W84-P86 VanDerWaalsContact C-CD 3.46Å; P86-A89 PolarHBondContact O-N 2.95Å; P86-V90 WeakPolarHBondContact O-CG2 3.47Å; P86-V90 PolarHBondContact O-N 3.43Å
87Q90.8Very high85.7Confident43 Ų4341.2 Ų41.220%0.20127%0.268CS..Hα-helixtrans-64.8-43.8175.5-61.1173.92500110.3L83 W84 M85 A89 V90 L91L83-Q87 VanDerWaalsContact O-CD 3.3Å; L83-Q87 WeakPolarHBondContact O-CG 3.34Å; L83-Q87 PolarHBondContact O-NE2 2.84Å; W84-Q87 WeakPolarHBondContact O-CB 3.3Å; W84-Q87 PolarHBondContact O-N 3.47Å; M85-Q87 VanDerWaalsContact C-N 3.27Å; M85-Q87 PolarHBondContact O-N 3.3Å; Q87-A89 VanDerWaalsContact C-N 3.34Å; Q87-A89 PolarHBondContact O-N 2.93Å; Q87-V90 PolarHBondContact O-N 3.26Å; Q87-L91 WeakPolarHBondContact O-CB 3.39Å; Q87-L91 VanDerWaalsContact O-CG 3.23Å; Q87-L91 WeakPolarHBondContact O-CG 3.44Å; Q87-L91 PolarHBondContact O-N 3.43Å
88E87.2Confident83.7Confident29 Ų2944 Ų4414%0.13629%0.288CS..Hα-helixtrans-60.8-41.4174.6-63.5-51.3126.500112.8Y38 W84 M85 L91 G92 R116Y38-E88 HydrophobicContact CD1-CB 4.38Å; Y38-E88 HydrophobicContact CD2-CB 4.24Å; Y38-E88 HydrophobicContact CE1-CB 4.47Å; Y38-E88 HydrophobicContact CE2-CB 4.34Å; Y38-E88 HydrophobicContact CG-CB 4.27Å; W84-E88 HydrophobicContact CD2-CG 3.88Å; W84-E88 VanDerWaalsContact CE2-OE1 3.28Å; W84-E88 HydrophobicContact CE3-CG 3.93Å; W84-E88 HydrophobicContact CH2-CG 3.43Å; W84-E88 VanDerWaalsContact CH2-CG 3.43Å; W84-E88 HydrophobicContact CZ2-CG 3.34Å; W84-E88 WeakPolarHBondContact CZ2-OE1 3.47Å; W84-E88 HydrophobicContact CZ3-CG 3.71Å; W84-E88 PolarHBondContact NE1-OE1 3.48Å; W84-E88 PolarHBondContact O-N 3.45Å; M85-E88 WeakPolarHBondContact O-CB 3.37Å; M85-E88 PolarHBondContact O-N 2.98Å; E88-L91 PolarHBondContact O-N 2.92Å; E88-G92 PolarHBondContact O-N 3.1Å; E88-R116 IonicContact OE1-CZ 2.58Å; E88-R116 IonicContact OE1-NE 3.31Å; E88-R116 PolarHBondContact OE1-NE 3.29Å; E88-R116 IonicContact OE1-NH2 2.81Å; E88-R116 PolarHBondContact OE1-NH2 3.43Å; E88-R116 IonicContact OE2-CZ 3.23Å; E88-R116 IonicContact OE2-NH2 3.6Å; E88-R116 PolarHBondContact OE2-NH2 2.94Å
89A90.1Very high81.6Confident3 Ų343.1 Ų43.13%0.02529%0.286CS..Hα-helixtrans-63.1-42.2178.500000111.8S35 S39 M85 P86 Q87 G92 L93S35-A89 WeakPolarHBondContact CB-O 3.26Å; S35-A89 WeakPolarHBondContact O-CB 3.28Å; S35-A89 PolarHBondContact OG-O 2.84Å; S39-A89 WeakPolarHBondContact OG-CB 3.48Å; M85-A89 PolarHBondContact O-N 2.72Å; P86-A89 PolarHBondContact O-N 2.95Å; Q87-A89 VanDerWaalsContact C-N 3.34Å; Q87-A89 PolarHBondContact O-N 2.93Å; A89-G92 PolarHBondContact O-N 3.4Å; A89-L93 WeakPolarHBondContact O-CG 3.35Å; A89-L93 PolarHBondContact O-N 2.98Å
90V88.4Confident79.7Confident87 Ų8747.2 Ų47.253%0.52730%0.304SS..Hα-helixtrans-67.6-47.6177173.50000110.8P86 Q87 G92 L93 L94P86-V90 WeakPolarHBondContact O-CG2 3.47Å; P86-V90 PolarHBondContact O-N 3.43Å; Q87-V90 PolarHBondContact O-N 3.26Å; V90-G92 PolarHBondContact O-N 3.23Å; V90-L93 PolarHBondContact O-N 2.86Å; V90-L94 PolarHBondContact O-N 3.19Å
91L83.6Confident77.6Confident27 Ų2748.4 Ų48.414%0.14131%0.311CS..Hα-helixtrans-61.2-32178.5-70.2172.9000112.5Q87 E88 L93 L94 R116Q87-L91 WeakPolarHBondContact O-CB 3.39Å; Q87-L91 VanDerWaalsContact O-CG 3.23Å; Q87-L91 WeakPolarHBondContact O-CG 3.44Å; Q87-L91 PolarHBondContact O-N 3.43Å; E88-L91 PolarHBondContact O-N 2.92Å; L91-L93 VanDerWaalsContact C-N 3.26Å; L91-L93 PolarHBondContact O-N 3.45Å; L91-L94 HydrophobicContact CD2-CD1 4.21Å; L91-L94 PolarHBondContact O-N 3.39Å; L91-R116 VanDerWaalsContact CD1-CZ 3.46Å
92G81.3Confident75.5Confident18 Ų1851.9 Ų51.919%0.18633%0.334CS..Hα-helixtrans-67.3-24.3175.100000114.1R31 S35 E88 A89 V90R31-G92 WeakPolarHBondContact CB-O 3.03Å; S35-G92 WeakPolarHBondContact OG-CA 3.48Å; E88-G92 PolarHBondContact O-N 3.1Å; A89-G92 PolarHBondContact O-N 3.4Å; V90-G92 PolarHBondContact O-N 3.23Å
93L83Confident73.3Confident101 Ų10151.8 Ų51.853%0.52933%0.333SS..Hα-helixtrans-94.6-12.1179.7-65.5172.8000113.7I32 A89 V90 L91I32-L93 HydrophobicContact CG1-CD2 4.15Å; A89-L93 WeakPolarHBondContact O-CG 3.35Å; A89-L93 PolarHBondContact O-N 2.98Å; V90-L93 PolarHBondContact O-N 2.86Å; L91-L93 VanDerWaalsContact C-N 3.26Å; L91-L93 PolarHBondContact O-N 3.45Å
94L78Confident71.3Confident66 Ų6653.4 Ų53.435%0.34634%0.342SS..SBendtrans-77.7138178.6-71.6175.5000111.5V90 L91V90-L94 PolarHBondContact O-N 3.19Å; L91-L94 HydrophobicContact CD2-CD1 4.21Å; L91-L94 PolarHBondContact O-N 3.39Å
95P67.5Low69.3Low70 Ų7060.4 Ų60.446%0.45537%0.369SS..  trans-55.5144.5172.6-24.431.5000112G97 S98 A99P95-G97 PolarHBondContact O-N 2.96Å; P95-S98 WeakPolarHBondContact CD-OG 3.49Å; P95-S98 PolarHBondContact O-N 3.38Å; P95-S98 PolarHBondContact O-OG 3.02Å; P95-A99 PolarHBondContact O-N 3.32Å
96A55.5Low67.3Low76 Ų7667.5 Ų67.563%0.62841%0.407SS*.THydrogen-bonded Turntrans-54.7-25.8-173.500000114.6
97G52.1Low65.6Low87 Ų8767.9 Ų67.990%0.89742%0.42SS*.THydrogen-bonded Turntrans-83.8-6.9176.200000116P95P95-G97 PolarHBondContact O-N 2.96Å
98S53.1Low64Low60 Ų6068.9 Ų68.942%0.4244%0.436SS..THydrogen-bonded Turntrans-113-0.917864.40000113.2P95 E100P95-S98 WeakPolarHBondContact CD-OG 3.49Å; P95-S98 PolarHBondContact O-N 3.38Å; P95-S98 PolarHBondContact O-OG 3.02Å; S98-E100 VanDerWaalsContact C-N 3.34Å; S98-E100 PolarHBondContact O-N 2.66Å
99A52.3Low62.9Low25 Ų2567.6 Ų67.621%0.20743%0.43CS..SBendtrans-74.8-16.5-158.100000115P95P95-A99 PolarHBondContact O-N 3.32Å
100E53.1Low61.9Low104 Ų10469.3 Ų69.349%0.48645%0.448SS..SBendtrans-143144.8167.7-70.4-162162.700109.8S98 P102 R113S98-E100 VanDerWaalsContact C-N 3.34Å; S98-E100 PolarHBondContact O-N 2.66Å; E100-P102 WeakPolarHBondContact O-CD 3.32Å; E100-P102 VanDerWaalsContact O-N 3.14Å; E100-R113 IonicContact OE2-NH1 3.49Å
101P51.3Low61.3Low25 Ų2568.8 Ų68.816%0.16245%0.448CS..  trans-50.6123.9165.221.7-32.1000108.8A103 W105 R113P101-A103 PolarHBondContact O-N 2.95Å; P101-W105 HydrophobicContact CB-CB 4.38Å; P101-W105 HydrophobicContact CB-CD2 4.04Å; P101-W105 HydrophobicContact CB-CE3 3.07Å; P101-W105 HydrophobicContact CB-CZ3 3.54Å; P101-R113 PolarHBondContact O-NH1 2.89Å
102P50.2Low61.1Low73 Ų7371.3 Ų71.347%0.47446%0.457SS..  trans-46.2141.517610.3-25.3000109.6E100 D104 W105E100-P102 WeakPolarHBondContact O-CD 3.32Å; E100-P102 VanDerWaalsContact O-N 3.14Å; P102-D104 PolarHBondContact O-N 3.19Å; P102-D104 VanDerWaalsContact O-N 3.08Å; P102-W105 HydrophobicContact CG-CB 4.49Å; P102-W105 HydrophobicContact CG-CE3 4.41Å; P102-W105 WeakPolarHBondContact O-CB 3.44Å; P102-W105 PolarHBondContact O-N 2.9Å
103A50.3Low60.9Low40 Ų4073.2 Ų73.233%0.33146%0.458SS..THydrogen-bonded Turntrans-65.8-17.2-173.200000113.4P101 P183P101-A103 PolarHBondContact O-N 2.95Å; A103-P183 HydrophobicContact CB-CG 3.21Å
104D50.2Low60.7Low127 Ų12773.7 Ų73.768%0.67946%0.461SS*.THydrogen-bonded Turntrans-77.4-2.5171.221-47.7000112.6P102 D106P102-D104 PolarHBondContact O-N 3.19Å; P102-D104 VanDerWaalsContact O-N 3.08Å; D104-D106 PolarHBondContact O-N 3.08Å
105W51.5Low61Low158 Ų15875.9 Ų75.960%0.59847%0.472SS*.SBendtrans-75.877.7165.3-145.7-9.4000108.8P101 P102 G107 G109P101-W105 HydrophobicContact CB-CB 4.38Å; P101-W105 HydrophobicContact CB-CD2 4.04Å; P101-W105 HydrophobicContact CB-CE3 3.07Å; P101-W105 HydrophobicContact CB-CZ3 3.54Å; P102-W105 HydrophobicContact CG-CB 4.49Å; P102-W105 HydrophobicContact CG-CE3 4.41Å; P102-W105 WeakPolarHBondContact O-CB 3.44Å; P102-W105 PolarHBondContact O-N 2.9Å; W105-G107 PolarHBondContact O-N 3.33Å; W105-G109 PolarHBondContact O-N 3.5Å
106D50.4Low61.8Low148 Ų14875 Ų7579%0.79146%0.46SS*.THydrogen-bonded Turntrans-44.2120.6-176.3-71.1-36.9000112.1D104 A108D104-D106 PolarHBondContact O-N 3.08Å; D106-A108 VanDerWaalsContact C-N 3.34Å; D106-A108 PolarHBondContact O-N 3.35Å
107G56.9Low63.1Low59 Ų5973.4 Ų73.461%0.60845%0.451SS*.THydrogen-bonded Turntrans81.7-44171.800000117W105 S111W105-G107 PolarHBondContact O-N 3.33Å; G107-S111 WeakPolarHBondContact O-CB 3.44Å; G107-S111 PolarHBondContact O-OG 3.14Å
108A57.5Low64.7Low64 Ų6470.1 Ų70.153%0.52942%0.416SS..Hα-helixtrans-85.7-43-172.900000113.7D106 S111 Y112D106-A108 VanDerWaalsContact C-N 3.34Å; D106-A108 PolarHBondContact O-N 3.35Å; A108-S111 PolarHBondContact O-N 3.32Å; A108-Y112 PolarHBondContact O-N 2.94Å; A108-Y112 VanDerWaalsContact O-N 3.14Å
109G63.8Low66.3Low2 Ų268.6 Ų68.62%0.02140%0.403CS..Hα-helixtrans-69.5-36.1-178.700000113.7W105 R113W105-G109 PolarHBondContact O-N 3.5Å; G109-R113 PolarHBondContact O-N 2.9Å
110G69.6Low68.1Low38 Ų3868.8 Ų68.839%0.39240%0.401SS..Hα-helixtrans-65.4-45.4174.200000112.7Y112 R113 L114G110-Y112 VanDerWaalsContact C-N 3.33Å; G110-Y112 PolarHBondContact O-N 3.05Å; G110-R113 PolarHBondContact O-N 3.43Å; G110-L114 WeakPolarHBondContact O-CB 3.48Å; G110-L114 PolarHBondContact O-N 3.5Å
111S75.3Confident69.8Low77 Ų7764.9 Ų64.954%0.53839%0.388SS..Hα-helixtrans-60.4-40.2176.8-61.30000112.4G107 A108 L114 L115G107-S111 WeakPolarHBondContact O-CB 3.44Å; G107-S111 PolarHBondContact O-OG 3.14Å; A108-S111 PolarHBondContact O-N 3.32Å; S111-L114 PolarHBondContact O-N 2.84Å; S111-L115 VanDerWaalsContact O-CB 3.28Å; S111-L115 WeakPolarHBondContact O-CB 3.32Å; S111-L115 PolarHBondContact O-N 3.37Å
112Y79.4Confident71.7Confident80 Ų8065.5 Ų65.531%0.31439%0.39SS..Hα-helixtrans-64.7-47.1176.1175.3-110000112.7A108 G110 L114 L115 R116A108-Y112 PolarHBondContact O-N 2.94Å; A108-Y112 VanDerWaalsContact O-N 3.14Å; G110-Y112 VanDerWaalsContact C-N 3.33Å; G110-Y112 PolarHBondContact O-N 3.05Å; Y112-L114 VanDerWaalsContact C-N 3.31Å; Y112-L114 PolarHBondContact O-N 3.41Å; Y112-L115 PolarHBondContact O-N 3.4Å; Y112-R116 WeakPolarHBondContact O-CB 3.32Å; Y112-R116 PolarHBondContact O-N 3.41Å
113R77.6Confident73.8Confident57 Ų5762 Ų6222%0.21537%0.368CS..Hα-helixtrans-60.8-41.4176.7-75.3-171.8-70.5-97.7-7.2112E100 P101 G109 G110 G117E100-R113 IonicContact OE2-NH1 3.49Å; P101-R113 PolarHBondContact O-NH1 2.89Å; G109-R113 PolarHBondContact O-N 2.9Å; G110-R113 PolarHBondContact O-N 3.43Å; R113-G117 PolarHBondContact O-N 3.36Å
114L79.3Confident75.7Confident111 Ų11161.5 Ų61.558%0.58136%0.359SS*.Hα-helixtrans-63.5-46.3175.9-178.264.1000111.5G110 S111 Y112 G118 P178G110-L114 WeakPolarHBondContact O-CB 3.48Å; G110-L114 PolarHBondContact O-N 3.5Å; S111-L114 PolarHBondContact O-N 2.84Å; Y112-L114 VanDerWaalsContact C-N 3.31Å; Y112-L114 PolarHBondContact O-N 3.41Å; L114-G118 WeakPolarHBondContact O-CA 3.45Å; L114-G118 PolarHBondContact O-N 2.95Å; L114-P178 HydrophobicContact CD1-CB 4.08Å
115L83.3Confident77.8Confident112 Ų11256.8 Ų56.859%0.58634%0.335SS*.Hα-helixtrans-61.2-48.3177.9177.563.6000111.3S111 Y112 G118 L119S111-L115 VanDerWaalsContact O-CB 3.28Å; S111-L115 WeakPolarHBondContact O-CB 3.32Å; S111-L115 PolarHBondContact O-N 3.37Å; Y112-L115 PolarHBondContact O-N 3.4Å; L115-G118 PolarHBondContact O-N 2.8Å; L115-L119 WeakPolarHBondContact O-CB 3.23Å; L115-L119 PolarHBondContact O-N 3.2Å
116R84.9Confident79.9Confident53 Ų5349.3 Ų49.320%0.231%0.307CS..Hα-helixtrans-61.1-49.5179.2177.2176.7163.1-122.13.5111.7E88 L91 Y112 L120E88-R116 IonicContact OE1-CZ 2.58Å; E88-R116 IonicContact OE1-NE 3.31Å; E88-R116 PolarHBondContact OE1-NE 3.29Å; E88-R116 IonicContact OE1-NH2 2.81Å; E88-R116 PolarHBondContact OE1-NH2 3.43Å; E88-R116 IonicContact OE2-CZ 3.23Å; E88-R116 IonicContact OE2-NH2 3.6Å; E88-R116 PolarHBondContact OE2-NH2 2.94Å; L91-R116 VanDerWaalsContact CD1-CZ 3.46Å; Y112-R116 WeakPolarHBondContact O-CB 3.32Å; Y112-R116 PolarHBondContact O-N 3.41Å; R116-L120 PolarHBondContact O-N 3.34Å; R116-L120 VanDerWaalsContact O-N 3.13Å
117G82.9Confident82Confident42 Ų4242.4 Ų42.443%0.43327%0.27SS..Hα-helixtrans-65.1-41.1177.600000112.7R113 L120 G121R113-G117 PolarHBondContact O-N 3.36Å; G117-L120 PolarHBondContact O-N 2.98Å; G117-G121 PolarHBondContact O-N 3.47Å
118G85.3Confident83.7Confident17 Ų1741 Ų4118%0.17525%0.248CC..Hα-helixtrans-66.2-41.717800000112.7L114 L115 G121 L122L114-G118 WeakPolarHBondContact O-CA 3.45Å; L114-G118 PolarHBondContact O-N 2.95Å; L115-G118 PolarHBondContact O-N 2.8Å; G118-G121 PolarHBondContact O-N 2.96Å; G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 3.24Å
119L88.2Confident85.5Confident29 Ų2940.4 Ų40.415%0.15224%0.236CC..Hα-helixtrans-61.5-46.8175.4178.766.8000111.5L83 W84 L115 G123L83-L119 HydrophobicContact CB-CD1 4.23Å; L83-L119 HydrophobicContact CB-CD2 3.48Å; L83-L119 VanDerWaalsContact CB-CD2 3.48Å; L83-L119 HydrophobicContact CB-CG 4.38Å; L83-L119 HydrophobicContact CD1-CD1 4.02Å; W84-L119 HydrophobicContact CB-CD2 3.99Å; W84-L119 HydrophobicContact CB-CG 4.32Å; L115-L119 WeakPolarHBondContact O-CB 3.23Å; L115-L119 PolarHBondContact O-N 3.2Å; L119-G123 PolarHBondContact O-N 2.8Å
120L89.3Confident86.9Confident28 Ų2840.4 Ų40.415%0.14724%0.236CC..Hα-helixtrans-60.8-52.5175.1-18060.9000111.6W84 R116 G117 L122 G123 L124 W322W84-L120 HydrophobicContact CD2-CB 4.43Å; W84-L120 HydrophobicContact CD2-CD1 3.65Å; W84-L120 HydrophobicContact CD2-CG 4.45Å; W84-L120 HydrophobicContact CE3-CD1 3.98Å; W84-L120 HydrophobicContact CG-CB 4.2Å; W84-L120 HydrophobicContact CG-CD1 4.14Å; W84-L120 HydrophobicContact CH2-CD1 4.06Å; W84-L120 HydrophobicContact CH2-CD2 4.46Å; W84-L120 HydrophobicContact CZ2-CD1 3.75Å; W84-L120 HydrophobicContact CZ2-CD2 3.61Å; W84-L120 HydrophobicContact CZ2-CG 4.21Å; W84-L120 HydrophobicContact CZ3-CD1 4.18Å; R116-L120 PolarHBondContact O-N 3.34Å; R116-L120 VanDerWaalsContact O-N 3.13Å; G117-L120 PolarHBondContact O-N 2.98Å; L120-L122 PolarHBondContact O-N 3.45Å; L120-G123 PolarHBondContact O-N 2.84Å; L120-L124 HydrophobicContact CD1-CD1 3.5Å; L120-L124 VanDerWaalsContact CD1-CD1 3.5Å; L120-L124 HydrophobicContact CD1-CG 3.85Å; L120-L124 HydrophobicContact CG-CD1 3.92Å; L120-L124 HydrophobicContact CG-CG 4.48Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 WeakPolarHBondContact O-CG 3.48Å; L120-L124 PolarHBondContact O-N 3.08Å; L120-W322 HydrophobicContact CD1-CZ3 4.24Å; L120-W322 HydrophobicContact CD2-CH2 3.96Å; L120-W322 HydrophobicContact CD2-CZ3 4.05Å
121G88.4Confident87.9Confident22 Ų2238.8 Ų38.823%0.22722%0.218CC..Hα-helixtrans-61.3-43.8-177.100000112.1G117 G118 T125G117-G121 PolarHBondContact O-N 3.47Å; G118-G121 PolarHBondContact O-N 2.96Å; G121-T125 WeakPolarHBondContact O-CB 3.26Å; G121-T125 PolarHBondContact O-N 2.88Å; G121-T125 PolarHBondContact O-OG1 3.23Å
122L92.4Very high88.8Confident39 Ų3935.9 Ų35.920%0.20420%0.197CC..Hα-helixtrans-65.4-53.3178-176.769.5000110.5G118 L120 L124 T125 V126 W166 A169 L170 V173G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 3.24Å; L120-L122 PolarHBondContact O-N 3.45Å; L122-L124 PolarHBondContact O-N 2.9Å; L122-T125 PolarHBondContact O-N 3.38Å; L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.33Å; L122-V126 PolarHBondContact O-N 3.39Å; L122-W166 HydrophobicContact CD1-CE3 4.38Å; L122-W166 HydrophobicContact CD2-CE3 4.34Å; L122-W166 HydrophobicContact CD2-CZ3 4.06Å; L122-W166 HydrophobicContact CG-CE3 4.37Å; L122-W166 HydrophobicContact CG-CZ3 4.22Å; L122-A169 HydrophobicContact CD1-CB 3.79Å; L122-L170 HydrophobicContact CD1-CB 4.08Å; L122-V173 HydrophobicContact CB-CG2 4.32Å
123G93.4Very high89.5Confident0 Ų033.1 Ų33.10%019%0.188CC..Hα-helixtrans-58.7-49.1-177.600000112.4S79 L119 L120 S127S79-G123 WeakPolarHBondContact OG-CA 3.33Å; L119-G123 PolarHBondContact O-N 2.8Å; L120-G123 PolarHBondContact O-N 2.84Å; G123-S127 VanDerWaalsContact O-CB 3.28Å; G123-S127 WeakPolarHBondContact O-CB 3.15Å; G123-S127 PolarHBondContact O-N 3.12Å
124L90.9Very high90.1Very high28 Ų2830.6 Ų30.615%0.14718%0.179CC..Hα-helixtrans-62.5-48.9176.7-69.8179.7000111.3V80 L120 L122 V126 S127 L128 W322V80-L124 HydrophobicContact CG2-CD2 4.36Å; L120-L124 HydrophobicContact CD1-CD1 3.5Å; L120-L124 VanDerWaalsContact CD1-CD1 3.5Å; L120-L124 HydrophobicContact CD1-CG 3.85Å; L120-L124 HydrophobicContact CG-CD1 3.92Å; L120-L124 HydrophobicContact CG-CG 4.48Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 WeakPolarHBondContact O-CG 3.48Å; L120-L124 PolarHBondContact O-N 3.08Å; L122-L124 PolarHBondContact O-N 2.9Å; L124-V126 PolarHBondContact O-N 2.99Å; L124-S127 CarbonylContact O-C 3.55Å; L124-S127 WeakPolarHBondContact O-CA 3.29Å; L124-S127 WeakPolarHBondContact O-CB 3.49Å; L124-S127 PolarHBondContact O-N 2.99Å; L124-S127 VanDerWaalsContact O-N 3.1Å; L124-L128 VanDerWaalsContact O-CG 3.29Å; L124-L128 WeakPolarHBondContact O-CG 3.45Å; L124-L128 PolarHBondContact O-N 3.22Å; L124-W322 HydrophobicContact CD1-CH2 4.49Å; L124-W322 HydrophobicContact CD1-CZ3 4Å
125T92.8Very high90.6Very high29 Ų2925.3 Ų25.318%0.17815%0.151CC..Hα-helixtrans-62.3-43.6-176.4-55.50000112.1G121 L122 S127 L128 L129 A169 L172G121-T125 WeakPolarHBondContact O-CB 3.26Å; G121-T125 PolarHBondContact O-N 2.88Å; G121-T125 PolarHBondContact O-OG1 3.23Å; L122-T125 PolarHBondContact O-N 3.38Å; T125-S127 VanDerWaalsContact C-N 3.32Å; T125-S127 PolarHBondContact O-N 3.22Å; T125-L128 PolarHBondContact O-N 3.19Å; T125-L129 HydrophobicContact CG2-CD1 4.22Å; T125-L129 WeakPolarHBondContact O-CG 3.27Å; T125-L129 PolarHBondContact O-N 3.26Å; T125-A169 HydrophobicContact CG2-CB 3.66Å; T125-L172 HydrophobicContact CG2-CD2 4.01Å
126V96.4Very high91Very high0 Ų022.6 Ų22.60%014%0.137CC..Hα-helixtrans-64.4-38.8175.1179.30000111A76 L122 L124 L129 S130 W166 A169A76-V126 HydrophobicContact CB-CB 3.79Å; A76-V126 HydrophobicContact CB-CG1 3.7Å; L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.33Å; L122-V126 PolarHBondContact O-N 3.39Å; L124-V126 PolarHBondContact O-N 2.99Å; V126-L129 PolarHBondContact O-N 3.3Å; V126-S130 VanDerWaalsContact O-CB 3.31Å; V126-S130 WeakPolarHBondContact O-CB 3.33Å; V126-S130 PolarHBondContact O-N 3.11Å; V126-S130 PolarHBondContact O-OG 2.81Å; V126-W166 HydrophobicContact CG1-CD2 4.01Å; V126-W166 HydrophobicContact CG1-CG 4.36Å; V126-W166 HydrophobicContact CG1-CH2 4.49Å; V126-W166 HydrophobicContact CG1-CZ2 3.93Å; V126-W166 HydrophobicContact CG2-CD2 3.84Å; V126-W166 HydrophobicContact CG2-CE3 3.79Å; V126-W166 HydrophobicContact CG2-CG 4.23Å; V126-W166 HydrophobicContact CG2-CZ3 4.21Å; V126-A169 HydrophobicContact CB-CB 4.49Å; V126-A169 HydrophobicContact CG2-CB 3.35Å
127S94.2Very high91.3Very high4 Ų420 Ų203%0.02813%0.127CC..Hα-helixtrans-61.3-46.6174.6-173.70000111.1D77 G123 L124 T125 L129 S130 H131D77-S127 VanDerWaalsContact OD1-CB 3.29Å; D77-S127 WeakPolarHBondContact OD1-CB 3.46Å; D77-S127 PolarHBondContact OD1-OG 3.26Å; G123-S127 VanDerWaalsContact O-CB 3.28Å; G123-S127 WeakPolarHBondContact O-CB 3.15Å; G123-S127 PolarHBondContact O-N 3.12Å; L124-S127 CarbonylContact O-C 3.55Å; L124-S127 WeakPolarHBondContact O-CA 3.29Å; L124-S127 WeakPolarHBondContact O-CB 3.49Å; L124-S127 PolarHBondContact O-N 2.99Å; L124-S127 VanDerWaalsContact O-N 3.1Å; T125-S127 VanDerWaalsContact C-N 3.32Å; T125-S127 PolarHBondContact O-N 3.22Å; S127-L129 PolarHBondContact O-N 3.18Å; S127-S130 WeakPolarHBondContact O-CB 3.04Å; S127-S130 PolarHBondContact O-N 2.98Å; S127-H131 PolarHBondContact O-N 3.49Å; S127-H131 PolarHBondContact O-ND1 2.93Å; S127-H131 PolarHBondContact OG-CE1 3.27Å; S127-H131 VanDerWaalsContact OG-CE1 3.27Å
128L92.6Very high91.6Very high29 Ų2921.2 Ų21.215%0.15212%0.119CC..Hα-helixtrans-59.5-47.5176.1-58.3-171000111.9L124 T125 S130 H131 C132 A200 L201 Q204 F293L124-L128 VanDerWaalsContact O-CG 3.29Å; L124-L128 WeakPolarHBondContact O-CG 3.45Å; L124-L128 PolarHBondContact O-N 3.22Å; T125-L128 PolarHBondContact O-N 3.19Å; L128-S130 VanDerWaalsContact C-N 3.31Å; L128-S130 PolarHBondContact O-N 3.24Å; L128-H131 WeakPolarHBondContact O-CB 3.47Å; L128-H131 PolarHBondContact O-N 2.58Å; L128-C132 PolarHBondContact O-N 3.06Å; L128-C132 VanDerWaalsContact O-N 3.08Å; L128-C132 PolarHBondContact O-SG 2.9Å; L128-C132 VanDerWaalsContact O-SG 3.35Å; L128-A200 HydrophobicContact CD1-CB 4.43Å; L128-L201 HydrophobicContact CD1-CD2 3.76Å; L128-L201 HydrophobicContact CD1-CG 4.23Å; L128-L201 HydrophobicContact CD2-CD2 3.82Å; L128-L201 HydrophobicContact CG-CD2 4.45Å; L128-Q204 VanDerWaalsContact CB-OE1 3.3Å; L128-Q204 PolarHBondContact O-NE2 3.42Å; L128-F293 HydrophobicContact CD2-CZ 4.43Å
129L94.9Very high91.7Very high52 Ų5222.1 Ų22.127%0.27212%0.117SC..Hα-helixtrans-61.8-40.2176.7-69.9172.8000111.3T125 V126 S127 H131 C132 L133 S165 L168T125-L129 HydrophobicContact CG2-CD1 4.22Å; T125-L129 WeakPolarHBondContact O-CG 3.27Å; T125-L129 PolarHBondContact O-N 3.26Å; V126-L129 PolarHBondContact O-N 3.3Å; S127-L129 PolarHBondContact O-N 3.18Å; L129-H131 VanDerWaalsContact C-N 3.33Å; L129-H131 PolarHBondContact O-N 3.31Å; L129-C132 WeakPolarHBondContact O-CB 3.3Å; L129-C132 PolarHBondContact O-N 2.84Å; L129-L133 VanDerWaalsContact O-CG 3.28Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 3.47Å; L129-S165 WeakPolarHBondContact CD1-O 3.44Å; L129-L168 HydrophobicContact CD1-CB 4.19Å
130S94.3Very high91.9Very high1 Ų122 Ų221%0.00712%0.117CC..Hα-helixtrans-61.8-41176.9-60.60000111.8N72 G73 V126 S127 L128 L133 V134N72-S130 PolarHBondContact ND2-OG 3.44Å; G73-S130 PolarHBondContact N-OG 3.45Å; V126-S130 VanDerWaalsContact O-CB 3.31Å; V126-S130 WeakPolarHBondContact O-CB 3.33Å; V126-S130 PolarHBondContact O-N 3.11Å; V126-S130 PolarHBondContact O-OG 2.81Å; S127-S130 WeakPolarHBondContact O-CB 3.04Å; S127-S130 PolarHBondContact O-N 2.98Å; L128-S130 VanDerWaalsContact C-N 3.31Å; L128-S130 PolarHBondContact O-N 3.24Å; S130-L133 PolarHBondContact O-N 3.34Å; S130-V134 WeakPolarHBondContact O-CG2 3.32Å; S130-V134 PolarHBondContact O-N 2.89Å
131H90.5Very high91.7Very high4 Ų424.5 Ų24.52%0.01913%0.129CC..Hα-helixtrans-62.5-42173.8-67.5128.8000112.9S127 L128 L129 L133 V134 A135 F293 N332 Y336S127-H131 PolarHBondContact O-N 3.49Å; S127-H131 PolarHBondContact O-ND1 2.93Å; S127-H131 PolarHBondContact OG-CE1 3.27Å; S127-H131 VanDerWaalsContact OG-CE1 3.27Å; L128-H131 WeakPolarHBondContact O-CB 3.47Å; L128-H131 PolarHBondContact O-N 2.58Å; L129-H131 VanDerWaalsContact C-N 3.33Å; L129-H131 PolarHBondContact O-N 3.31Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 2.81Å; H131-V134 PolarHBondContact O-N 3.36Å; H131-A135 WeakPolarHBondContact O-CB 2.97Å; H131-A135 PolarHBondContact O-N 3.34Å; H131-F293 HydrophobicContact CB-CE2 4.15Å; H131-F293 HydrophobicContact CB-CZ 4.18Å; H131-F293 AromaticContact CD2-CE2 3.97Å; H131-F293 AromaticContact CE1-CE2 3.51Å; H131-F293 AromaticContact CG-CE2 3.49Å; H131-F293 VanDerWaalsContact CG-CE2 3.49Å; H131-F293 AromaticContact CG-CZ 3.86Å; H131-F293 AromaticContact ND1-CE2 3.2Å; H131-F293 WeakPolarHBondContact ND1-CE2 3.37Å; H131-F293 AromaticContact ND1-CZ 3.44Å; H131-F293 WeakPolarHBondContact ND1-CZ 3.26Å; H131-F293 AromaticContact NE2-CE2 3.94Å; H131-N332 PolarHBondContact CE1-ND2 3.37Å; H131-N332 PolarHBondContact NE2-ND2 3.36Å; H131-Y336 AromaticContact CD2-CZ 3.87Å; H131-Y336 PolarHBondContact CD2-OH 3.16Å
132C93.3Very high91.6Very high16 Ų1626.1 Ų26.111%0.10813%0.132CC..Hα-helixtrans-59.1-45.7172.5-67.50000111.5L128 L129 A135 L136 L207L128-C132 PolarHBondContact O-N 3.06Å; L128-C132 VanDerWaalsContact O-N 3.08Å; L128-C132 PolarHBondContact O-SG 2.9Å; L128-C132 VanDerWaalsContact O-SG 3.35Å; L129-C132 WeakPolarHBondContact O-CB 3.3Å; L129-C132 PolarHBondContact O-N 2.84Å; C132-A135 PolarHBondContact O-N 3.43Å; C132-L136 WeakPolarHBondContact O-CB 3.23Å; C132-L136 WeakPolarHBondContact O-CG 3.45Å; C132-L136 PolarHBondContact O-N 3.38Å; C132-L207 HydrophobicContact CB-CD2 3.65Å
133L93.9Very high91.3Very high23 Ų2325.1 Ų25.112%0.1213%0.128CC..Hα-helixtrans-63.8-42.7178.3-67176.7000112F69 L129 S130 H131 L136 N137 M161F69-L133 HydrophobicContact CD1-CB 3.66Å; F69-L133 HydrophobicContact CD1-CD1 3.83Å; F69-L133 HydrophobicContact CD1-CG 4.31Å; F69-L133 HydrophobicContact CE1-CB 4.02Å; F69-L133 HydrophobicContact CE1-CD1 3.94Å; F69-L133 HydrophobicContact CE1-CD2 4.5Å; F69-L133 HydrophobicContact CE1-CG 4.38Å; F69-L133 HydrophobicContact CG-CB 4.11Å; L129-L133 VanDerWaalsContact O-CG 3.28Å; L129-L133 WeakPolarHBondContact O-CG 3.44Å; L129-L133 PolarHBondContact O-N 3.47Å; S130-L133 PolarHBondContact O-N 3.34Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 2.81Å; L133-L136 PolarHBondContact O-N 3.49Å; L133-N137 WeakPolarHBondContact O-CB 3.29Å; L133-N137 PolarHBondContact O-N 3.49Å; L133-M161 HydrophobicContact CD2-CE 3.55Å
134V90.8Very high91Very high3 Ų331.4 Ų31.42%0.01815%0.151CC..Hα-helixtrans-61.4-45.5174.9172.90000110.7F69 I70 S130 H131 N137 R138 Y336F69-V134 HydrophobicContact CB-CG2 3.65Å; I70-V134 HydrophobicContact CG1-CG2 4.14Å; S130-V134 WeakPolarHBondContact O-CG2 3.32Å; S130-V134 PolarHBondContact O-N 2.89Å; H131-V134 PolarHBondContact O-N 3.36Å; V134-N137 PolarHBondContact O-N 2.86Å; V134-R138 HydrophobicContact CG1-CG 4.46Å; V134-R138 VanDerWaalsContact O-CG 3.29Å; V134-R138 WeakPolarHBondContact O-CG 3.49Å; V134-R138 PolarHBondContact O-N 3.03Å; V134-Y336 HydrophobicContact CB-CE1 4.49Å; V134-Y336 HydrophobicContact CG1-CD1 4.07Å; V134-Y336 HydrophobicContact CG1-CE1 3.59Å
135A89.4Confident90.9Very high0 Ų032.6 Ų32.60%017%0.166CC..Hα-helixtrans-63.5-45.7179.500000112.1H131 C132 R138 Y139 L208 C211 Y212H131-A135 WeakPolarHBondContact O-CB 2.97Å; H131-A135 PolarHBondContact O-N 3.34Å; C132-A135 PolarHBondContact O-N 3.43Å; A135-R138 PolarHBondContact O-N 3.14Å; A135-Y139 VanDerWaalsContact O-CB 3.3Å; A135-Y139 WeakPolarHBondContact O-CB 3.08Å; A135-Y139 PolarHBondContact O-N 2.96Å; A135-L208 HydrophobicContact CB-CD2 3.59Å; A135-C211 HydrophobicContact CB-CB 4.17Å; A135-Y212 HydrophobicContact CB-CE2 4.43Å
136L92.5Very high90.6Very high55 Ų5536 Ų3629%0.28819%0.188SC..Hα-helixtrans-62.1-43.7175.3-77.9170.5000111.9C132 L133 R138 Y139 L140 L207C132-L136 WeakPolarHBondContact O-CB 3.23Å; C132-L136 WeakPolarHBondContact O-CG 3.45Å; C132-L136 PolarHBondContact O-N 3.38Å; L133-L136 PolarHBondContact O-N 3.49Å; L136-R138 PolarHBondContact O-N 2.95Å; L136-Y139 PolarHBondContact O-N 2.63Å; L136-L140 WeakPolarHBondContact O-CB 3.15Å; L136-L140 WeakPolarHBondContact O-CG 3.36Å; L136-L140 PolarHBondContact O-N 3.45Å; L136-L207 HydrophobicContact CD1-CD2 4.26Å; L136-L207 HydrophobicContact CD2-CD1 4.2Å; L136-L207 HydrophobicContact CG-CD2 4.41Å
137N91.4Very high90.4Very high0 Ų039.2 Ų39.20%022%0.215CC..Hα-helixtrans-59.9-46.9177.1177.276.3000111.3S66 F69 L133 V134 L141 Y149 Y153S66-N137 VanDerWaalsContact CB-ND2 3.33Å; S66-N137 WeakPolarHBondContact CB-ND2 3.37Å; S66-N137 PolarHBondContact OG-ND2 2.87Å; F69-N137 HydrophobicContact CD2-CB 4.01Å; F69-N137 HydrophobicContact CE2-CB 4.03Å; L133-N137 WeakPolarHBondContact O-CB 3.29Å; L133-N137 PolarHBondContact O-N 3.49Å; V134-N137 PolarHBondContact O-N 2.86Å; N137-L141 WeakPolarHBondContact O-CB 3.28Å; N137-L141 PolarHBondContact O-N 3Å; N137-Y149 WeakPolarHBondContact OD1-CE2 3.44Å; N137-Y149 PolarHBondContact OD1-OH 3.02Å; N137-Y153 VanDerWaalsContact CA-OH 3.25Å; N137-Y153 WeakPolarHBondContact CA-OH 3.19Å; N137-Y153 HydrophobicContact CB-CE1 4.06Å; N137-Y153 PolarHBondContact N-OH 3.28Å
138R87.8Confident90.3Very high67 Ų6742.6 Ų42.625%0.25324%0.235SC..Hα-helixtrans-64.8-42175.9-67.3-66.5178.7-143.3-2.8112S66 V134 A135 L136 I142 I215S66-R138 PolarHBondContact OG-NH1 3.32Å; S66-R138 PolarHBondContact OG-NH2 3.38Å; V134-R138 HydrophobicContact CG1-CG 4.46Å; V134-R138 VanDerWaalsContact O-CG 3.29Å; V134-R138 WeakPolarHBondContact O-CG 3.49Å; V134-R138 PolarHBondContact O-N 3.03Å; A135-R138 PolarHBondContact O-N 3.14Å; L136-R138 PolarHBondContact O-N 2.95Å; R138-I142 WeakPolarHBondContact O-CB 3.46Å; R138-I142 WeakPolarHBondContact O-CD1 3.44Å; R138-I142 VanDerWaalsContact O-CG1 3.28Å; R138-I142 WeakPolarHBondContact O-CG1 3.38Å; R138-I142 PolarHBondContact O-N 3.41Å; R138-I142 VanDerWaalsContact O-N 3.15Å; R138-I215 HydrophobicContact CB-CD1 4.22Å
139Y89.1Confident90.1Very high36 Ų3642.8 Ų42.814%0.14123%0.234CC..Hα-helixtrans-60.9-49.6178.1170.4-101.9000111.4A135 L136 I142 T143 C211 I215A135-Y139 VanDerWaalsContact O-CB 3.3Å; A135-Y139 WeakPolarHBondContact O-CB 3.08Å; A135-Y139 PolarHBondContact O-N 2.96Å; L136-Y139 PolarHBondContact O-N 2.63Å; Y139-I142 PolarHBondContact O-N 2.93Å; Y139-T143 HydrophobicContact CD2-CG2 3.68Å; Y139-T143 HydrophobicContact CE2-CG2 3.62Å; Y139-T143 HydrophobicContact CG-CG2 4.46Å; Y139-T143 VanDerWaalsContact O-CB 3.29Å; Y139-T143 WeakPolarHBondContact O-CB 3.43Å; Y139-T143 VanDerWaalsContact O-CG2 3.32Å; Y139-T143 WeakPolarHBondContact O-CG2 3.19Å; Y139-T143 PolarHBondContact O-N 3.42Å; Y139-T143 PolarHBondContact O-OG1 3.48Å; Y139-C211 VanDerWaalsContact CD2-O 3.32Å; Y139-C211 WeakPolarHBondContact CD2-O 3.37Å; Y139-C211 HydrophobicContact CG-CB 4.36Å; Y139-I215 HydrophobicContact CD2-CG1 4.21Å
140L91.2Very high89.9Confident27 Ų2746.7 Ų46.714%0.14125%0.251CS..Hα-helixtrans-68.4-40.3-178.7-68.5176.3000112.2L136 I142 R144 Y149 L152 Y153L136-L140 WeakPolarHBondContact O-CB 3.15Å; L136-L140 WeakPolarHBondContact O-CG 3.36Å; L136-L140 PolarHBondContact O-N 3.45Å; L140-I142 VanDerWaalsContact C-N 3.26Å; L140-I142 PolarHBondContact O-N 3.26Å; L140-R144 HydrophobicContact CD2-CG 3.56Å; L140-R144 WeakPolarHBondContact O-CB 3.35Å; L140-R144 PolarHBondContact O-N 2.85Å; L140-R144 VanDerWaalsContact O-N 3.11Å; L140-Y149 HydrophobicContact CB-CD2 4.34Å; L140-L152 HydrophobicContact CD1-CD2 3.39Å; L140-Y153 HydrophobicContact CB-CE2 4.12Å; L140-Y153 HydrophobicContact CD1-CE2 3.73Å
141L86.3Confident89.8Confident79 Ų7949.4 Ų49.441%0.41427%0.273SS..Hα-helixtrans-58.8-36.9176.5-17766000112.5N137 Y149N137-L141 WeakPolarHBondContact O-CB 3.28Å; N137-L141 PolarHBondContact O-N 3Å; L141-Y149 HydrophobicContact CB-CD2 3.87Å; L141-Y149 HydrophobicContact CB-CE2 3.64Å; L141-Y149 HydrophobicContact CD1-CD1 3.98Å; L141-Y149 HydrophobicContact CD1-CD2 4.04Å; L141-Y149 HydrophobicContact CD1-CE1 3.79Å; L141-Y149 HydrophobicContact CD1-CE2 3.84Å; L141-Y149 HydrophobicContact CD1-CG 4.1Å; L141-Y149 HydrophobicContact CG-CE2 4.27Å
142I84.6Confident89.9Confident56 Ų5653 Ų5329%0.28729%0.293SS..Hα-helixtrans-91.8-35.9-175.4-62.7167.8000112.2R138 Y139 L140 I215 V219R138-I142 WeakPolarHBondContact O-CB 3.46Å; R138-I142 WeakPolarHBondContact O-CD1 3.44Å; R138-I142 VanDerWaalsContact O-CG1 3.28Å; R138-I142 WeakPolarHBondContact O-CG1 3.38Å; R138-I142 PolarHBondContact O-N 3.41Å; R138-I142 VanDerWaalsContact O-N 3.15Å; Y139-I142 PolarHBondContact O-N 2.93Å; L140-I142 VanDerWaalsContact C-N 3.26Å; L140-I142 PolarHBondContact O-N 3.26Å; I142-I215 HydrophobicContact CB-CG1 4.5Å; I142-I215 HydrophobicContact CD1-CD1 4.2Å; I142-I215 HydrophobicContact CD1-CG1 4.21Å; I142-I215 HydrophobicContact CD1-CG2 3.84Å; I142-I215 HydrophobicContact CG2-CG2 4.19Å; I142-V219 HydrophobicContact CG2-CG2 4.32Å
143T86.6Confident89.9Confident18 Ų1853 Ų5311%0.1129%0.29CS..Hα-helixtrans-97-29-169.266.60000114.7Y139 I215 R218Y139-T143 HydrophobicContact CD2-CG2 3.68Å; Y139-T143 HydrophobicContact CE2-CG2 3.62Å; Y139-T143 HydrophobicContact CG-CG2 4.46Å; Y139-T143 VanDerWaalsContact O-CB 3.29Å; Y139-T143 WeakPolarHBondContact O-CB 3.43Å; Y139-T143 VanDerWaalsContact O-CG2 3.32Å; Y139-T143 WeakPolarHBondContact O-CG2 3.19Å; Y139-T143 PolarHBondContact O-N 3.42Å; Y139-T143 PolarHBondContact O-OG1 3.48Å; T143-I215 HydrophobicContact CG2-CG1 4.45Å; T143-R218 HydrophobicContact CG2-CB 3.86Å; T143-R218 HydrophobicContact CG2-CG 4.18Å
144R87.5Confident89.8Confident132 Ų13255.2 Ų55.250%0.49830%0.3SS..SBendtrans-100.3167.8-175.8-57.7-57179.6100.6-2.6112L140L140-R144 HydrophobicContact CD2-CG 3.56Å; L140-R144 WeakPolarHBondContact O-CB 3.35Å; L140-R144 PolarHBondContact O-N 2.85Å; L140-R144 VanDerWaalsContact O-N 3.11Å
145A88Confident89.8Confident54 Ų5465.5 Ų65.545%0.44634%0.339SS..  trans-65.9146.3176.500000110.7A147 T148 Y149A145-A147 PolarHBondContact O-N 3.4Å; A145-T148 WeakPolarHBondContact O-CB 3.2Å; A145-T148 PolarHBondContact O-N 3.14Å; A145-T148 VanDerWaalsContact O-N 3.09Å; A145-Y149 PolarHBondContact O-N 3.27Å
146P87Confident90Very high100 Ų10074 Ų7465%0.64937%0.371SS*.Hα-helixtrans-55-37.7-179.7-27.235000113.8T148 Y149 Q150P146-T148 PolarHBondContact O-N 3.14Å; P146-Y149 PolarHBondContact O-N 3.31Å; P146-Q150 WeakPolarHBondContact O-CG 3.35Å; P146-Q150 PolarHBondContact O-N 3.46Å
147A91.7Very high90.2Very high68 Ų6875 Ų7556%0.56237%0.374SS*.Hα-helixtrans-60-43.2177.900000112.4A145 Y149 Q150 A151A145-A147 PolarHBondContact O-N 3.4Å; A147-Y149 PolarHBondContact O-N 3.47Å; A147-Q150 PolarHBondContact O-N 3.35Å; A147-A151 WeakPolarHBondContact O-CB 3.29Å; A147-A151 PolarHBondContact O-N 2.63Å
148T91.9Very high90.3Very high74 Ų7475.3 Ų75.345%0.45438%0.376SS..Hα-helixtrans-63.7-42.2176.9-48.40000111.4A145 P146 A151 L152A145-T148 WeakPolarHBondContact O-CB 3.2Å; A145-T148 PolarHBondContact O-N 3.14Å; A145-T148 VanDerWaalsContact O-N 3.09Å; P146-T148 PolarHBondContact O-N 3.14Å; T148-A151 PolarHBondContact O-N 3.39Å; T148-L152 WeakPolarHBondContact O-CB 3.11Å; T148-L152 PolarHBondContact O-N 2.78Å; T148-L152 VanDerWaalsContact O-N 3.11Å
149Y89.9Confident90.7Very high34 Ų3474.9 Ų74.913%0.13339%0.386CS..Hα-helixtrans-64-44.7177.7178.8-89.8000111.6N137 L140 L141 A145 P146 A147 L152 Y153N137-Y149 WeakPolarHBondContact OD1-CE2 3.44Å; N137-Y149 PolarHBondContact OD1-OH 3.02Å; L140-Y149 HydrophobicContact CB-CD2 4.34Å; L141-Y149 HydrophobicContact CB-CD2 3.87Å; L141-Y149 HydrophobicContact CB-CE2 3.64Å; L141-Y149 HydrophobicContact CD1-CD1 3.98Å; L141-Y149 HydrophobicContact CD1-CD2 4.04Å; L141-Y149 HydrophobicContact CD1-CE1 3.79Å; L141-Y149 HydrophobicContact CD1-CE2 3.84Å; L141-Y149 HydrophobicContact CD1-CG 4.1Å; L141-Y149 HydrophobicContact CG-CE2 4.27Å; A145-Y149 PolarHBondContact O-N 3.27Å; P146-Y149 PolarHBondContact O-N 3.31Å; A147-Y149 PolarHBondContact O-N 3.47Å; Y149-L152 PolarHBondContact O-N 3.16Å; Y149-Y153 AromaticContact CD2-CD2 3.44Å; Y149-Y153 HydrophobicContact CD2-CD2 3.44Å; Y149-Y153 VanDerWaalsContact CD2-CD2 3.44Å; Y149-Y153 AromaticContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CG 4.41Å; Y149-Y153 AromaticContact CE2-CD2 3.35Å; Y149-Y153 HydrophobicContact CE2-CD2 3.35Å; Y149-Y153 AromaticContact CE2-CE2 3.74Å; Y149-Y153 HydrophobicContact CE2-CE2 3.74Å; Y149-Y153 AromaticContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CG-CD2 4.11Å; Y149-Y153 AromaticContact CZ-CD2 3.95Å; Y149-Y153 PolarHBondContact O-N 2.79Å
150Q90.8Very high91.1Very high134 Ų13475.1 Ų75.163%0.62640%0.399SS*.Hα-helixtrans-65.6-36.8179-72.6174.1-1200112.8P146 A147 Q154P146-Q150 WeakPolarHBondContact O-CG 3.35Å; P146-Q150 PolarHBondContact O-N 3.46Å; A147-Q150 PolarHBondContact O-N 3.35Å; Q150-Q154 WeakPolarHBondContact O-CG 3.29Å
151A92.6Very high91.4Very high57 Ų5776 Ų7647%0.47140%0.403SS..Hα-helixtrans-66.7-40.9175.700000112A147 T148A147-A151 WeakPolarHBondContact O-CB 3.29Å; A147-A151 PolarHBondContact O-N 2.63Å; T148-A151 PolarHBondContact O-N 3.39Å
152L91.8Very high91.9Very high81 Ų8174 Ų7442%0.42439%0.393SS..Hα-helixtrans-77-51.4-177.8-169.968.6000112.2L140 T148 Y149 Q154 H157L140-L152 HydrophobicContact CD1-CD2 3.39Å; T148-L152 WeakPolarHBondContact O-CB 3.11Å; T148-L152 PolarHBondContact O-N 2.78Å; T148-L152 VanDerWaalsContact O-N 3.11Å; Y149-L152 PolarHBondContact O-N 3.16Å; L152-Q154 VanDerWaalsContact C-N 3.3Å; L152-Q154 PolarHBondContact O-N 3.28Å; L152-Q154 VanDerWaalsContact O-N 3.11Å; L152-H157 WeakPolarHBondContact O-CB 3.37Å; L152-H157 PolarHBondContact O-ND1 3.41Å; L152-H157 VanDerWaalsContact O-ND1 3.16Å
153Y92.4Very high92.5Very high14 Ų1474.3 Ų74.36%0.05540%0.404CS..SBendtrans-91.455.8-173.5-69-79.2000112.8F69 N137 L140 Y149 M161F69-Y153 AromaticContact CE2-CD1 3.72Å; F69-Y153 HydrophobicContact CE2-CD1 3.72Å; F69-Y153 AromaticContact CE2-CE1 3.47Å; F69-Y153 HydrophobicContact CE2-CE1 3.47Å; F69-Y153 VanDerWaalsContact CE2-CE1 3.47Å; F69-Y153 AromaticContact CZ-CD1 3.89Å; F69-Y153 HydrophobicContact CZ-CD1 3.89Å; F69-Y153 AromaticContact CZ-CE1 3.61Å; F69-Y153 HydrophobicContact CZ-CE1 3.61Å; N137-Y153 VanDerWaalsContact CA-OH 3.25Å; N137-Y153 WeakPolarHBondContact CA-OH 3.19Å; N137-Y153 HydrophobicContact CB-CE1 4.06Å; N137-Y153 PolarHBondContact N-OH 3.28Å; L140-Y153 HydrophobicContact CB-CE2 4.12Å; L140-Y153 HydrophobicContact CD1-CE2 3.73Å; Y149-Y153 AromaticContact CD2-CD2 3.44Å; Y149-Y153 HydrophobicContact CD2-CD2 3.44Å; Y149-Y153 VanDerWaalsContact CD2-CD2 3.44Å; Y149-Y153 AromaticContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CE2 3.84Å; Y149-Y153 HydrophobicContact CD2-CG 4.41Å; Y149-Y153 AromaticContact CE2-CD2 3.35Å; Y149-Y153 HydrophobicContact CE2-CD2 3.35Å; Y149-Y153 AromaticContact CE2-CE2 3.74Å; Y149-Y153 HydrophobicContact CE2-CE2 3.74Å; Y149-Y153 AromaticContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CE2-CG 3.99Å; Y149-Y153 HydrophobicContact CG-CD2 4.11Å; Y149-Y153 AromaticContact CZ-CD2 3.95Å; Y149-Y153 PolarHBondContact O-N 2.79Å; Y153-M161 HydrophobicContact CE1-CE 3.8Å; Y153-M161 HydrophobicContact CE1-SD 4.23Å
154Q93.4Very high93Very high70 Ų7078.1 Ų78.133%0.32742%0.423SS..  trans-79153.5167.1-63-176.9-10.200110.5Q150 L152 R156 H157 T158Q150-Q154 WeakPolarHBondContact O-CG 3.29Å; L152-Q154 VanDerWaalsContact C-N 3.3Å; L152-Q154 PolarHBondContact O-N 3.28Å; L152-Q154 VanDerWaalsContact O-N 3.11Å; Q154-R156 VanDerWaalsContact C-N 3.29Å; Q154-R156 HydrophobicContact CB-CG 4.25Å; Q154-R156 PolarHBondContact O-N 3.38Å; Q154-H157 PolarHBondContact O-N 3.17Å; Q154-H157 VanDerWaalsContact O-N 3.07Å; Q154-T158 WeakPolarHBondContact O-CB 3.45Å; Q154-T158 PolarHBondContact O-N 2.88Å; Q154-T158 PolarHBondContact O-OG1 3.18Å; Q154-T158 VanDerWaalsContact O-OG1 3.09Å
155R90.9Very high93.5Very high220 Ų22072 Ų7283%0.8340%0.4SS*.Hα-helixtrans-51.9-44.8-179.5-72.1-175.3178.1173.2-0.7113T158 A159R155-T158 PolarHBondContact O-N 3Å; R155-A159 WeakPolarHBondContact O-CB 3.33Å; R155-A159 PolarHBondContact O-N 3.3Å
156R93.4Very high94Very high178 Ų17873.4 Ų73.467%0.67239%0.394SS*.Hα-helixtrans-62.3-44.4177.658.8178178.1177.20.7113.1Q154 A159 G160Q154-R156 VanDerWaalsContact C-N 3.29Å; Q154-R156 HydrophobicContact CB-CG 4.25Å; Q154-R156 PolarHBondContact O-N 3.38Å; R156-A159 PolarHBondContact O-N 3.31Å; R156-G160 PolarHBondContact O-N 3.22Å
157H95Very high94.4Very high77 Ų7771.4 Ų71.436%0.35639%0.386SS..Hα-helixtrans-70.3-40179.2-59159.5000110.7L152 Q154 G160 M161L152-H157 WeakPolarHBondContact O-CB 3.37Å; L152-H157 PolarHBondContact O-ND1 3.41Å; L152-H157 VanDerWaalsContact O-ND1 3.16Å; Q154-H157 PolarHBondContact O-N 3.17Å; Q154-H157 VanDerWaalsContact O-N 3.07Å; H157-G160 CarbonylContact O-C 3.59Å; H157-G160 PolarHBondContact O-N 3.42Å; H157-M161 VanDerWaalsContact O-CG 3.25Å; H157-M161 WeakPolarHBondContact O-CG 3.47Å; H157-M161 PolarHBondContact O-N 3.43Å
158T94.9Very high94.6Very high6 Ų672.8 Ų72.84%0.03738%0.384CS..Hα-helixtrans-60.5-49.1174.8-59.80000110.6T65 A68 F69 Q154 R155 G160 M161 L162T65-T158 HydrophobicContact CG2-CG2 4.34Å; A68-T158 HydrophobicContact CB-CG2 4.23Å; F69-T158 HydrophobicContact CE1-CG2 4.13Å; F69-T158 HydrophobicContact CE2-CG2 4.3Å; F69-T158 HydrophobicContact CZ-CG2 3.83Å; Q154-T158 WeakPolarHBondContact O-CB 3.45Å; Q154-T158 PolarHBondContact O-N 2.88Å; Q154-T158 PolarHBondContact O-OG1 3.18Å; Q154-T158 VanDerWaalsContact O-OG1 3.09Å; R155-T158 PolarHBondContact O-N 3Å; T158-G160 VanDerWaalsContact C-N 3.28Å; T158-G160 PolarHBondContact O-N 3Å; T158-M161 WeakPolarHBondContact O-CB 3.07Å; T158-M161 PolarHBondContact O-N 3.35Å; T158-M161 VanDerWaalsContact O-N 3.08Å; T158-L162 HydrophobicContact CG2-CD1 3.75Å; T158-L162 WeakPolarHBondContact O-CD1 3.22Å; T158-L162 PolarHBondContact O-N 3.44Å
159A95.9Very high94.6Very high58 Ų5869.3 Ų69.348%0.47936%0.362SS..Hα-helixtrans-56.6-42.1174.500000112.1R155 R156 L162 A163R155-A159 WeakPolarHBondContact O-CB 3.33Å; R155-A159 PolarHBondContact O-N 3.3Å; R156-A159 PolarHBondContact O-N 3.31Å; A159-L162 PolarHBondContact O-N 3.42Å; A159-A163 PolarHBondContact O-N 2.93Å
160G97.4Very high94.8Very high40 Ų4071.7 Ų71.741%0.41238%0.376SS..Hα-helixtrans-61-42173.300000113.6R156 H157 T158 L162 A163 L164R156-G160 PolarHBondContact O-N 3.22Å; H157-G160 CarbonylContact O-C 3.59Å; H157-G160 PolarHBondContact O-N 3.42Å; T158-G160 VanDerWaalsContact C-N 3.28Å; T158-G160 PolarHBondContact O-N 3Å; G160-L162 VanDerWaalsContact C-N 3.35Å; G160-L162 PolarHBondContact O-N 2.95Å; G160-A163 PolarHBondContact O-N 3.27Å; G160-L164 WeakPolarHBondContact O-CB 3.33Å; G160-L164 PolarHBondContact O-N 3.08Å
161M97.2Very high94.7Very high46 Ų4666.5 Ų66.523%0.22736%0.359CS..Hα-helixtrans-64.2-39176.2-67.8164.870.200112F69 L133 Y153 H157 T158 S165F69-M161 HydrophobicContact CE1-CB 4.09Å; F69-M161 HydrophobicContact CE1-CE 3.99Å; F69-M161 HydrophobicContact CE1-SD 4.48Å; F69-M161 HydrophobicContact CZ-CE 3.69Å; F69-M161 HydrophobicContact CZ-SD 4.07Å; L133-M161 HydrophobicContact CD2-CE 3.55Å; Y153-M161 HydrophobicContact CE1-CE 3.8Å; Y153-M161 HydrophobicContact CE1-SD 4.23Å; H157-M161 VanDerWaalsContact O-CG 3.25Å; H157-M161 WeakPolarHBondContact O-CG 3.47Å; H157-M161 PolarHBondContact O-N 3.43Å; T158-M161 WeakPolarHBondContact O-CB 3.07Å; T158-M161 PolarHBondContact O-N 3.35Å; T158-M161 VanDerWaalsContact O-N 3.08Å; M161-S165 PolarHBondContact O-N 2.86Å
162L97.3Very high94.5Very high37 Ų3766.3 Ų66.319%0.19435%0.35CS..Hα-helixtrans-63.7-54174.5-85.869.8000110F69 N72 T158 A159 G160 L164 S165 W166F69-L162 HydrophobicContact CD1-CD1 3.65Å; F69-L162 HydrophobicContact CE1-CD1 3.56Å; N72-L162 HydrophobicContact CB-CD2 4.13Å; N72-L162 HydrophobicContact CB-CG 4.03Å; T158-L162 HydrophobicContact CG2-CD1 3.75Å; T158-L162 WeakPolarHBondContact O-CD1 3.22Å; T158-L162 PolarHBondContact O-N 3.44Å; A159-L162 PolarHBondContact O-N 3.42Å; G160-L162 VanDerWaalsContact C-N 3.35Å; G160-L162 PolarHBondContact O-N 2.95Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 3.34Å; L162-S165 WeakPolarHBondContact O-CB 3.44Å; L162-S165 PolarHBondContact O-N 3.13Å; L162-S165 PolarHBondContact O-OG 2.89Å; L162-W166 PolarHBondContact O-N 3.47Å
163A97.5Very high94.1Very high62 Ų6263.9 Ų63.951%0.51234%0.338SS..Hα-helixtrans-58.1-42.317900000112.3A159 G160 S165 W166 A167A159-A163 PolarHBondContact O-N 2.93Å; G160-A163 PolarHBondContact O-N 3.27Å; A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 3.33Å; A163-W166 PolarHBondContact O-N 3.24Å; A163-A167 WeakPolarHBondContact O-CB 3.28Å; A163-A167 PolarHBondContact O-N 3.02Å
164L97.2Very high93.7Very high98 Ų9869.4 Ų69.451%0.51337%0.368SS..Hα-helixtrans-62.4-36.4177.1-176.363.5000111.9G160 L162 W166 A167 L168G160-L164 WeakPolarHBondContact O-CB 3.33Å; G160-L164 PolarHBondContact O-N 3.08Å; L162-L164 VanDerWaalsContact C-N 3.3Å; L162-L164 PolarHBondContact O-N 3.34Å; L164-W166 VanDerWaalsContact C-N 3.34Å; L164-W166 PolarHBondContact O-N 3.33Å; L164-A167 PolarHBondContact O-N 3.28Å; L164-L168 HydrophobicContact CD1-CD1 4.16Å; L164-L168 HydrophobicContact CD1-CD2 4.4Å; L164-L168 HydrophobicContact CD1-CG 3.93Å; L164-L168 HydrophobicContact CD2-CD1 4.42Å; L164-L168 HydrophobicContact CG-CD1 3.86Å; L164-L168 HydrophobicContact CG-CG 4.1Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 VanDerWaalsContact O-CG 3.25Å; L164-L168 WeakPolarHBondContact O-CG 3.34Å; L164-L168 PolarHBondContact O-N 3.45Å
165S97.5Very high93.1Very high4 Ų472.8 Ų72.83%0.02839%0.388CS..Hα-helixtrans-62.4-41.1177.372.80000112.5N72 L129 M161 L162 A163 A169N72-S165 PolarHBondContact ND2-OG 3.19Å; N72-S165 VanDerWaalsContact ND2-OG 3.16Å; L129-S165 WeakPolarHBondContact CD1-O 3.44Å; M161-S165 PolarHBondContact O-N 2.86Å; L162-S165 WeakPolarHBondContact O-CB 3.44Å; L162-S165 PolarHBondContact O-N 3.13Å; L162-S165 PolarHBondContact O-OG 2.89Å; A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 3.33Å; S165-A169 WeakPolarHBondContact O-CB 3.36Å; S165-A169 PolarHBondContact O-N 3.47Å; S165-A169 VanDerWaalsContact O-N 3.12Å
166W97.6Very high92.1Very high84 Ų8464.8 Ų64.832%0.31836%0.361SS..Hα-helixtrans-69.7-43.5174.9-73.590.7000112N72 A75 L122 V126 L162 A163 L164 A169 L170N72-W166 PolarHBondContact OD1-NE1 3.06Å; A75-W166 HydrophobicContact CB-CZ2 4.38Å; L122-W166 HydrophobicContact CD1-CE3 4.38Å; L122-W166 HydrophobicContact CD2-CE3 4.34Å; L122-W166 HydrophobicContact CD2-CZ3 4.06Å; L122-W166 HydrophobicContact CG-CE3 4.37Å; L122-W166 HydrophobicContact CG-CZ3 4.22Å; V126-W166 HydrophobicContact CG1-CD2 4.01Å; V126-W166 HydrophobicContact CG1-CG 4.36Å; V126-W166 HydrophobicContact CG1-CH2 4.49Å; V126-W166 HydrophobicContact CG1-CZ2 3.93Å; V126-W166 HydrophobicContact CG2-CD2 3.84Å; V126-W166 HydrophobicContact CG2-CE3 3.79Å; V126-W166 HydrophobicContact CG2-CG 4.23Å; V126-W166 HydrophobicContact CG2-CZ3 4.21Å; L162-W166 PolarHBondContact O-N 3.47Å; A163-W166 PolarHBondContact O-N 3.24Å; L164-W166 VanDerWaalsContact C-N 3.34Å; L164-W166 PolarHBondContact O-N 3.33Å; W166-A169 PolarHBondContact O-N 3.29Å; W166-L170 VanDerWaalsContact O-CB 3.28Å; W166-L170 WeakPolarHBondContact O-CB 3.47Å; W166-L170 PolarHBondContact O-N 3.43Å
167A96.8Very high90.5Very high57 Ų5758.6 Ų58.647%0.47134%0.344SS..Hα-helixtrans-63.5-42.6179.200000112.3A163 L164 L170 G171A163-A167 WeakPolarHBondContact O-CB 3.28Å; A163-A167 PolarHBondContact O-N 3.02Å; L164-A167 PolarHBondContact O-N 3.28Å; A167-L170 PolarHBondContact O-N 3.43Å; A167-G171 PolarHBondContact O-N 3.39Å
168L94.3Very high88.8Confident98 Ų9860 Ų6051%0.51336%0.36SS..Hα-helixtrans-64.7-43.4175.7-72.7174.7000111.6L129 L164 G171 L172L129-L168 HydrophobicContact CD1-CB 4.19Å; L164-L168 HydrophobicContact CD1-CD1 4.16Å; L164-L168 HydrophobicContact CD1-CD2 4.4Å; L164-L168 HydrophobicContact CD1-CG 3.93Å; L164-L168 HydrophobicContact CD2-CD1 4.42Å; L164-L168 HydrophobicContact CG-CD1 3.86Å; L164-L168 HydrophobicContact CG-CG 4.1Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 VanDerWaalsContact O-CG 3.25Å; L164-L168 WeakPolarHBondContact O-CG 3.34Å; L164-L168 PolarHBondContact O-N 3.45Å; L168-G171 PolarHBondContact O-N 3.49Å; L168-L172 WeakPolarHBondContact O-CB 3.31Å; L168-L172 PolarHBondContact O-N 2.83Å
169A93.7Very high86.8Confident0 Ų068 Ų680%039%0.39CS..Hα-helixtrans-64.1-44.2177.200000112L122 T125 V126 S165 W166 L172 V173L122-A169 HydrophobicContact CD1-CB 3.79Å; T125-A169 HydrophobicContact CG2-CB 3.66Å; V126-A169 HydrophobicContact CB-CB 4.49Å; V126-A169 HydrophobicContact CG2-CB 3.35Å; S165-A169 WeakPolarHBondContact O-CB 3.36Å; S165-A169 PolarHBondContact O-N 3.47Å; S165-A169 VanDerWaalsContact O-N 3.12Å; W166-A169 PolarHBondContact O-N 3.29Å; A169-L172 PolarHBondContact O-N 2.93Å; A169-V173 WeakPolarHBondContact O-CG2 3.32Å; A169-V173 PolarHBondContact O-N 2.93Å
170L92.5Very high84.8Confident84 Ų8468.8 Ų68.844%0.4440%0.396SS..Hα-helixtrans-62.7-46.6175.8-177.963.7000111.1L122 W166 A167 L172 V173 L174L122-L170 HydrophobicContact CD1-CB 4.08Å; W166-L170 VanDerWaalsContact O-CB 3.28Å; W166-L170 WeakPolarHBondContact O-CB 3.47Å; W166-L170 PolarHBondContact O-N 3.43Å; A167-L170 PolarHBondContact O-N 3.43Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.37Å; L170-V173 PolarHBondContact O-N 3.14Å; L170-L174 HydrophobicContact CD1-CD1 4.03Å; L170-L174 HydrophobicContact CD1-CG 4.12Å; L170-L174 HydrophobicContact CD2-CD1 4.47Å; L170-L174 HydrophobicContact CG-CD1 3.82Å; L170-L174 HydrophobicContact CG-CG 4.3Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 VanDerWaalsContact O-CG 3.24Å; L170-L174 WeakPolarHBondContact O-CG 3.31Å; L170-L174 PolarHBondContact O-N 3.16Å
171G90.3Very high82.7Confident26 Ų2669.9 Ų69.927%0.26840%0.396SS..Hα-helixtrans-56.7-43.6175.400000112.1A167 L168 L174 L175A167-G171 PolarHBondContact O-N 3.39Å; L168-G171 PolarHBondContact O-N 3.49Å; G171-L174 PolarHBondContact O-N 2.93Å; G171-L175 VanDerWaalsContact O-CB 3.27Å; G171-L175 WeakPolarHBondContact O-CB 3.4Å; G171-L175 VanDerWaalsContact O-CD1 3.32Å; G171-L175 WeakPolarHBondContact O-CD1 3.21Å; G171-L175 WeakPolarHBondContact O-CG 3.19Å; G171-L175 PolarHBondContact O-N 3.03Å
172L86.7Confident80.8Confident53 Ų5377.9 Ų77.928%0.27742%0.424SS..Hα-helixtrans-62.4-45.5177.2-165.567.6000112.3T125 L168 A169 L170 L174 L175 L176 L196T125-L172 HydrophobicContact CG2-CD2 4.01Å; L168-L172 WeakPolarHBondContact O-CB 3.31Å; L168-L172 PolarHBondContact O-N 2.83Å; A169-L172 PolarHBondContact O-N 2.93Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.37Å; L172-L174 VanDerWaalsContact C-N 3.35Å; L172-L175 PolarHBondContact O-N 3Å; L172-L176 WeakPolarHBondContact O-CB 3.37Å; L172-L176 WeakPolarHBondContact O-CG 3.4Å; L172-L176 PolarHBondContact O-N 3.23Å; L172-L196 HydrophobicContact CD1-CD1 4.48Å; L172-L196 HydrophobicContact CD1-CD2 3.59Å; L172-L196 HydrophobicContact CD1-CG 4.34Å; L172-L196 HydrophobicContact CD2-CD2 4.36Å; L172-L196 HydrophobicContact CG-CD2 4.02Å
173V84.1Confident78.5Confident29 Ų2981 Ų8118%0.17645%0.446CS..Hα-helixtrans-65.3-38.1178.6170.20000111.7L122 A169 L170 L176L122-V173 HydrophobicContact CB-CG2 4.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.32Å; A169-V173 PolarHBondContact O-N 2.93Å; L170-V173 PolarHBondContact O-N 3.14Å; V173-L176 VanDerWaalsContact O-O 3.09Å
174L84.4Confident76.5Confident130 Ų13082.2 Ų82.268%0.68147%0.465SS*.Hα-helixtrans-75.3-30.2178.9-67.3175.5000113L170 G171 L172L170-L174 HydrophobicContact CD1-CD1 4.03Å; L170-L174 HydrophobicContact CD1-CG 4.12Å; L170-L174 HydrophobicContact CD2-CD1 4.47Å; L170-L174 HydrophobicContact CG-CD1 3.82Å; L170-L174 HydrophobicContact CG-CG 4.3Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 VanDerWaalsContact O-CG 3.24Å; L170-L174 WeakPolarHBondContact O-CG 3.31Å; L170-L174 PolarHBondContact O-N 3.16Å; G171-L174 PolarHBondContact O-N 2.93Å; L172-L174 VanDerWaalsContact C-N 3.35Å
175L79.6Confident74.9Confident142 Ų14279.9 Ų79.974%0.74346%0.459SS*.Hα-helixtrans-78-26.6174.8-74.7163.5000112.2G171 L172 P177G171-L175 VanDerWaalsContact O-CB 3.27Å; G171-L175 WeakPolarHBondContact O-CB 3.4Å; G171-L175 VanDerWaalsContact O-CD1 3.32Å; G171-L175 WeakPolarHBondContact O-CD1 3.21Å; G171-L175 WeakPolarHBondContact O-CG 3.19Å; G171-L175 PolarHBondContact O-N 3.03Å; L172-L175 PolarHBondContact O-N 3Å; L175-P177 WeakPolarHBondContact O-CD 3.35Å; L175-P177 WeakPolarHBondContact O-CG 3.16Å
176L70.3Confident73.5Confident52 Ų5285.7 Ų85.727%0.27249%0.494SS..SBendtrans-71.6115.4170.2-80.4175.4000108.3L172 V173 P193 L196L172-L176 WeakPolarHBondContact O-CB 3.37Å; L172-L176 WeakPolarHBondContact O-CG 3.4Å; L172-L176 PolarHBondContact O-N 3.23Å; V173-L176 VanDerWaalsContact O-O 3.09Å; L176-P193 HydrophobicContact CD2-CB 4.16Å; L176-P193 HydrophobicContact CD2-CG 4.15Å; L176-L196 HydrophobicContact CD1-CD2 4.02Å; L176-L196 HydrophobicContact CD2-CD2 3.55Å; L176-L196 HydrophobicContact CG-CD2 3.85Å
177P59.4Low72Confident47 Ų4786.2 Ų86.231%0.30551%0.509SS..  trans-82.5154.7-162.8-7.427.4000110.2L175 W179L175-P177 WeakPolarHBondContact O-CD 3.35Å; L175-P177 WeakPolarHBondContact O-CG 3.16Å; P177-W179 HydrophobicContact CB-CD2 3.51Å; P177-W179 HydrophobicContact CB-CE3 3.86Å; P177-W179 HydrophobicContact CB-CG 4.21Å; P177-W179 HydrophobicContact CB-CH2 3.53Å; P177-W179 HydrophobicContact CB-CZ2 3.21Å; P177-W179 HydrophobicContact CB-CZ3 3.84Å; P177-W179 HydrophobicContact CG-CD2 4.18Å; P177-W179 HydrophobicContact CG-CH2 3.82Å; P177-W179 HydrophobicContact CG-CZ2 3.11Å; P177-W179 VanDerWaalsContact CG-NE1 3.31Å; P177-W179 PolarHBondContact O-N 3.34Å
178P59.4Low70.8Confident106 Ų10686.1 Ų86.169%0.68850%0.503SS*.  trans-77.371.6-176.732.7-34.9000109.6L114L114-P178 HydrophobicContact CD1-CB 4.08Å
179W53.6Low70.1Confident175 Ų17592.5 Ų92.566%0.66352%0.521SS*.  trans-126.174.2173.524.565.1000110.4P177 P181P177-W179 HydrophobicContact CB-CD2 3.51Å; P177-W179 HydrophobicContact CB-CE3 3.86Å; P177-W179 HydrophobicContact CB-CG 4.21Å; P177-W179 HydrophobicContact CB-CH2 3.53Å; P177-W179 HydrophobicContact CB-CZ2 3.21Å; P177-W179 HydrophobicContact CB-CZ3 3.84Å; P177-W179 HydrophobicContact CG-CD2 4.18Å; P177-W179 HydrophobicContact CG-CH2 3.82Å; P177-W179 HydrophobicContact CG-CZ2 3.11Å; P177-W179 VanDerWaalsContact CG-NE1 3.31Å; P177-W179 PolarHBondContact O-N 3.34Å; W179-P181 WeakPolarHBondContact O-CD 3.29Å
180A53Low69.6Low74 Ų7494.6 Ų94.661%0.61253%0.533SS*.SBend-55.5117.6127.600000105.7R182A180-R182 PolarHBondContact O-N 3.47Å
181P53.3Low69.2Low63 Ų6393.7 Ų93.741%0.40953%0.526SS..PPolyproline II helixtrans-49.6135.4173.416.9-27.4000108.2W179 A185W179-P181 WeakPolarHBondContact O-CD 3.29Å; P181-A185 HydrophobicContact CB-CB 4.01Å
182R57.3Low68.9Low215 Ų215100 Ų10081%0.81154%0.544SS*.PPolyproline II helixtrans-48.8140.7172.1-68.4-179.4177.8169.7-1.8107.7A180 G184 A185A180-R182 PolarHBondContact O-N 3.47Å; R182-G184 PolarHBondContact O-N 3.28Å; R182-A185 HydrophobicContact CB-CB 4.37Å; R182-A185 WeakPolarHBondContact O-CB 3.42Å; R182-A185 PolarHBondContact O-N 3.42Å
183P50.6Low68.8Low103 Ų103100.4 Ų100.467%0.66955%0.549SS*.THydrogen-bonded Turntrans-53.6130.9175.9-24.634.6000110A103A103-P183 HydrophobicContact CB-CG 3.21Å
184G55.1Low68.9Low87 Ų87100 Ų10090%0.89755%0.549SS*.THydrogen-bonded Turntrans87.3-9.3-173.800000115.5R182R182-G184 PolarHBondContact O-N 3.28Å
185A63.9Low69.1Low48 Ų4895.7 Ų95.740%0.39753%0.526SS..SBendtrans-72.2137.8167.900000109.8P181 R182P181-A185 HydrophobicContact CB-CB 4.01Å; R182-A185 HydrophobicContact CB-CB 4.37Å; R182-A185 WeakPolarHBondContact O-CB 3.42Å; R182-A185 PolarHBondContact O-N 3.42Å
186T67.1Low69.5Low126 Ų12692 Ų9277%0.77351%0.507SS*.PPolyproline II helixtrans-57.8126.9176.151.40000109.4
187P66.4Low70.4Confident95 Ų9591.4 Ų91.462%0.61751%0.51SS*.PPolyproline II helixtrans-57.6136.6178.522.6-31.8000109.3R189P187-R189 PolarHBondContact O-N 2.95Å
188P71.6Confident71.9Confident55 Ų5589.2 Ų89.236%0.35750%0.495SS..PPolyproline II helixtrans-62.3141.5179.527.5-33.9000109.2V190 S310P188-V190 PolarHBondContact O-N 3.37Å; P188-V190 VanDerWaalsContact O-N 3.14Å; P188-S310 PolarHBondContact O-OG 3.49Å
189R78.9Confident73.5Confident233 Ų23386.7 Ų86.788%0.87948%0.484SS*.SBendtrans-59.5-26.6175.7-67.3-175.7177.9-164.8-0.8112P187 S310P187-R189 PolarHBondContact O-N 2.95Å; R189-S310 PolarHBondContact O-OG 3.27Å
190V84.8Confident75.3Confident43 Ų4380.1 Ų80.126%0.26147%0.467SS..SBendtrans-128.5125.7-177.7-178.70000110.6P188 Y192 L195 G308P188-V190 PolarHBondContact O-N 3.37Å; P188-V190 VanDerWaalsContact O-N 3.14Å; V190-Y192 HydrophobicContact CG1-CD1 4.35Å; V190-Y192 HydrophobicContact CG1-CE1 4.2Å; V190-Y192 PolarHBondContact O-N 3.34Å; V190-L195 HydrophobicContact CG1-CD1 3.45Å; V190-L195 VanDerWaalsContact CG1-CD1 3.45Å; V190-G308 CarbonylContact C-O 3.57Å; V190-G308 WeakPolarHBondContact CA-O 3.46Å
191H84.4Confident77.1Confident65 Ų6577 Ų7730%0.30144%0.44SS..  trans-95.587.1175.8-59.1102.1000110.6P193 A194 L195 S307 G308 S310H191-P193 VanDerWaalsContact C-CD 3.43Å; H191-A194 HydrophobicContact CB-CB 4.23Å; H191-A194 PolarHBondContact O-N 3.49Å; H191-A194 VanDerWaalsContact O-N 3.12Å; H191-L195 PolarHBondContact O-N 3.46Å; H191-S307 PolarHBondContact ND1-O 3.35Å; H191-G308 PolarHBondContact N-O 2.98Å; H191-S310 PolarHBondContact CE1-OG 2.93Å; H191-S310 VanDerWaalsContact CE1-OG 3.23Å; H191-S310 PolarHBondContact ND1-OG 3.4Å
192Y83.8Confident79Confident160 Ų16077.8 Ų77.863%0.62744%0.44SS*.Hα-helixtrans-52.7-40.5-179-63.4-79.6000115.4V190 A194 L195 L196V190-Y192 HydrophobicContact CG1-CD1 4.35Å; V190-Y192 HydrophobicContact CG1-CE1 4.2Å; V190-Y192 PolarHBondContact O-N 3.34Å; Y192-A194 VanDerWaalsContact C-N 3.31Å; Y192-A194 PolarHBondContact O-N 2.95Å; Y192-L195 PolarHBondContact O-N 3.5Å; Y192-L196 WeakPolarHBondContact O-CB 3.4Å; Y192-L196 PolarHBondContact O-N 2.89Å
193P83.2Confident80.8Confident61 Ų6170.6 Ų70.640%0.39643%0.426SS..Hα-helixtrans-61.6-38177.8-22.433000113L176 H191 L196 A197L176-P193 HydrophobicContact CD2-CB 4.16Å; L176-P193 HydrophobicContact CD2-CG 4.15Å; H191-P193 VanDerWaalsContact C-CD 3.43Å; P193-L196 PolarHBondContact O-N 3.22Å; P193-A197 WeakPolarHBondContact O-CB 3.47Å; P193-A197 PolarHBondContact O-N 3.44Å
194A86.6Confident82.8Confident20 Ų2066 Ų6617%0.16540%0.396CS..Hα-helixtrans-69.4-41.1177.700000111.3H191 Y192 L196 A197 A198 S304H191-A194 HydrophobicContact CB-CB 4.23Å; H191-A194 PolarHBondContact O-N 3.49Å; H191-A194 VanDerWaalsContact O-N 3.12Å; Y192-A194 VanDerWaalsContact C-N 3.31Å; Y192-A194 PolarHBondContact O-N 2.95Å; A194-L196 VanDerWaalsContact C-N 3.34Å; A194-L196 PolarHBondContact O-N 2.87Å; A194-A197 PolarHBondContact O-N 3.46Å; A194-A198 PolarHBondContact O-N 3.49Å; A194-S304 WeakPolarHBondContact CB-O 3.39Å; A194-S304 WeakPolarHBondContact O-CB 3.46Å
195L89.3Confident84.5Confident40 Ų4062.8 Ų62.821%0.20936%0.359CS..Hα-helixtrans-63.1-39.9173.5-68.7179.8000112.4V190 H191 Y192 A198 A199 L305 F309V190-L195 HydrophobicContact CG1-CD1 3.45Å; V190-L195 VanDerWaalsContact CG1-CD1 3.45Å; H191-L195 PolarHBondContact O-N 3.46Å; Y192-L195 PolarHBondContact O-N 3.5Å; L195-A198 PolarHBondContact O-N 2.86Å; L195-A199 WeakPolarHBondContact O-CB 3.4Å; L195-A199 PolarHBondContact O-N 3.43Å; L195-L305 HydrophobicContact CD2-CD2 4.23Å; L195-F309 HydrophobicContact CD2-CD2 4.2Å; L195-F309 HydrophobicContact CD2-CE2 3.78Å; L195-F309 HydrophobicContact CD2-CZ 4.02Å
196L88.3Confident85.9Confident63 Ų6363.4 Ų63.433%0.3336%0.364SS..Hα-helixtrans-66.9-40.7177.8-171.360.3000111.6L172 L176 Y192 P193 A194 A199 A200L172-L196 HydrophobicContact CD1-CD1 4.48Å; L172-L196 HydrophobicContact CD1-CD2 3.59Å; L172-L196 HydrophobicContact CD1-CG 4.34Å; L172-L196 HydrophobicContact CD2-CD2 4.36Å; L172-L196 HydrophobicContact CG-CD2 4.02Å; L176-L196 HydrophobicContact CD1-CD2 4.02Å; L176-L196 HydrophobicContact CD2-CD2 3.55Å; L176-L196 HydrophobicContact CG-CD2 3.85Å; Y192-L196 WeakPolarHBondContact O-CB 3.4Å; Y192-L196 PolarHBondContact O-N 2.89Å; P193-L196 PolarHBondContact O-N 3.22Å; A194-L196 VanDerWaalsContact C-N 3.34Å; A194-L196 PolarHBondContact O-N 2.87Å; L196-A199 PolarHBondContact O-N 3.31Å; L196-A200 WeakPolarHBondContact O-CB 3.38Å; L196-A200 PolarHBondContact O-N 2.91Å
197A88.4Confident87.1Confident41 Ų4160 Ų6034%0.33934%0.341SS..Hα-helixtrans-61.3-45.417300000111.6P193 A194 A199 A200 L201P193-A197 WeakPolarHBondContact O-CB 3.47Å; P193-A197 PolarHBondContact O-N 3.44Å; A194-A197 PolarHBondContact O-N 3.46Å; A197-A199 PolarHBondContact O-N 3.18Å; A197-A200 PolarHBondContact O-N 3.41Å; A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 VanDerWaalsContact O-CG 3.32Å; A197-L201 WeakPolarHBondContact O-CG 3.39Å; A197-L201 PolarHBondContact O-N 3.36Å
198A91.8Very high88.3Confident0 Ų055.6 Ų55.60%031%0.312CS..Hα-helixtrans-59.7-4717500000112A194 L195 A200 L201 L202 L305A194-A198 PolarHBondContact O-N 3.49Å; L195-A198 PolarHBondContact O-N 2.86Å; A198-A200 PolarHBondContact O-N 2.98Å; A198-L201 PolarHBondContact O-N 2.95Å; A198-L202 WeakPolarHBondContact O-CB 3.38Å; A198-L202 VanDerWaalsContact O-CG 3.32Å; A198-L202 WeakPolarHBondContact O-CG 3.21Å; A198-L202 PolarHBondContact O-N 3.24Å; A198-L305 HydrophobicContact CB-CD2 3.77Å; A198-L305 HydrophobicContact CB-CG 3.7Å
199A92.5Very high89.2Confident54 Ų5456.5 Ų56.545%0.44631%0.314SS..Hα-helixtrans-61.4-42.717800000111.9L195 L196 A197 L202 A203L195-A199 WeakPolarHBondContact O-CB 3.4Å; L195-A199 PolarHBondContact O-N 3.43Å; L196-A199 PolarHBondContact O-N 3.31Å; A197-A199 PolarHBondContact O-N 3.18Å; A199-L202 PolarHBondContact O-N 3.49Å; A199-A203 WeakPolarHBondContact O-CB 3.34Å; A199-A203 PolarHBondContact O-N 3.27Å
200A90.8Very high89.8Confident37 Ų3751 Ų5131%0.30630%0.298SS..Hα-helixtrans-62.3-45.8176.800000112L128 L196 A197 A198 A203 Q204L128-A200 HydrophobicContact CD1-CB 4.43Å; L196-A200 WeakPolarHBondContact O-CB 3.38Å; L196-A200 PolarHBondContact O-N 2.91Å; A197-A200 PolarHBondContact O-N 3.41Å; A198-A200 PolarHBondContact O-N 2.98Å; A200-A203 PolarHBondContact O-N 2.89Å; A200-Q204 VanDerWaalsContact O-CB 3.31Å; A200-Q204 WeakPolarHBondContact O-CB 3.34Å; A200-Q204 PolarHBondContact O-N 3.44Å
201L91.9Very high90.1Very high8 Ų849 Ų494%0.04229%0.286CS..Hα-helixtrans-65.2-38.1177.6-72.6169000112.4L128 A197 A198 T205 T297 L300 V301L128-L201 HydrophobicContact CD1-CD2 3.76Å; L128-L201 HydrophobicContact CD1-CG 4.23Å; L128-L201 HydrophobicContact CD2-CD2 3.82Å; L128-L201 HydrophobicContact CG-CD2 4.45Å; A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 VanDerWaalsContact O-CG 3.32Å; A197-L201 WeakPolarHBondContact O-CG 3.39Å; A197-L201 PolarHBondContact O-N 3.36Å; A198-L201 PolarHBondContact O-N 2.95Å; L201-T205 VanDerWaalsContact O-CB 3.25Å; L201-T205 WeakPolarHBondContact O-CB 3.33Å; L201-T205 PolarHBondContact O-N 3.46Å; L201-T205 PolarHBondContact O-OG1 3.41Å; L201-T297 HydrophobicContact CD2-CG2 4.23Å; L201-L300 HydrophobicContact CD1-CB 4.35Å; L201-L300 HydrophobicContact CD1-CD2 4.02Å; L201-L300 HydrophobicContact CD1-CG 4.11Å; L201-V301 HydrophobicContact CB-CG2 3.47Å; L201-V301 VanDerWaalsContact CB-CG2 3.47Å; L201-V301 HydrophobicContact CD1-CG2 3.92Å; L201-V301 HydrophobicContact CG-CG2 4.32Å
202L93.4Very high90.3Very high79 Ų7946.2 Ų46.241%0.41427%0.272SS..Hα-helixtrans-66.2-46.8174.5-75.8171.7000111.7A198 A199 Q204 T205 A206 V301A198-L202 WeakPolarHBondContact O-CB 3.38Å; A198-L202 VanDerWaalsContact O-CG 3.32Å; A198-L202 WeakPolarHBondContact O-CG 3.21Å; A198-L202 PolarHBondContact O-N 3.24Å; A199-L202 PolarHBondContact O-N 3.49Å; L202-Q204 VanDerWaalsContact C-N 3.32Å; L202-Q204 PolarHBondContact O-N 2.88Å; L202-T205 WeakPolarHBondContact O-CB 3.39Å; L202-T205 PolarHBondContact O-N 3.17Å; L202-A206 PolarHBondContact O-N 2.94Å; L202-V301 HydrophobicContact CD1-CG1 4.28Å; L202-V301 HydrophobicContact CD2-CG1 3.84Å; L202-V301 HydrophobicContact CG-CG1 3.82Å
203A93.3Very high90.5Very high64 Ų6442 Ų4253%0.52926%0.26SS..Hα-helixtrans-60.2-43.8177.400000111.3A199 A200 A206 L207A199-A203 WeakPolarHBondContact O-CB 3.34Å; A199-A203 PolarHBondContact O-N 3.27Å; A200-A203 PolarHBondContact O-N 2.89Å; A203-A206 PolarHBondContact O-N 3.41Å; A203-L207 PolarHBondContact O-N 3.32Å
204Q92.4Very high90.7Very high6 Ų639.8 Ų39.83%0.02825%0.249CC..Hα-helixtrans-61.9-46.1174171.8179.120.700112.3L128 A200 L202 A206 L207 L208 F293L128-Q204 VanDerWaalsContact CB-OE1 3.3Å; L128-Q204 PolarHBondContact O-NE2 3.42Å; A200-Q204 VanDerWaalsContact O-CB 3.31Å; A200-Q204 WeakPolarHBondContact O-CB 3.34Å; A200-Q204 PolarHBondContact O-N 3.44Å; L202-Q204 VanDerWaalsContact C-N 3.32Å; L202-Q204 PolarHBondContact O-N 2.88Å; Q204-A206 VanDerWaalsContact C-N 3.31Å; Q204-A206 PolarHBondContact O-N 3.38Å; Q204-L207 PolarHBondContact O-N 2.87Å; Q204-L208 HydrophobicContact CG-CD1 3.66Å; Q204-L208 HydrophobicContact CG-CG 4.32Å; Q204-L208 WeakPolarHBondContact O-CB 3.38Å; Q204-L208 WeakPolarHBondContact O-CG 3.49Å; Q204-L208 PolarHBondContact O-N 2.93Å; Q204-F293 VanDerWaalsContact CD-CE1 3.5Å; Q204-F293 HydrophobicContact CG-CE1 4.17Å
205T91.3Very high90.8Very high20 Ų2038.8 Ų38.812%0.12324%0.241CC..Hα-helixtrans-56.3-47.1177.2-69.80000110.8L201 L202 L207 L208 L209 L294L201-T205 VanDerWaalsContact O-CB 3.25Å; L201-T205 WeakPolarHBondContact O-CB 3.33Å; L201-T205 PolarHBondContact O-N 3.46Å; L201-T205 PolarHBondContact O-OG1 3.41Å; L202-T205 WeakPolarHBondContact O-CB 3.39Å; L202-T205 PolarHBondContact O-N 3.17Å; T205-L207 PolarHBondContact O-N 3.03Å; T205-L208 PolarHBondContact O-N 3.25Å; T205-L209 VanDerWaalsContact O-CB 3.31Å; T205-L209 WeakPolarHBondContact O-CB 3.24Å; T205-L209 PolarHBondContact O-N 2.87Å; T205-L294 HydrophobicContact CG2-CD2 3.31Å
206A93.1Very high90.5Very high61 Ų6138.2 Ų38.250%0.50424%0.239SC..Hα-helixtrans-61-43.3177.200000112L202 A203 Q204 L209 H210L202-A206 PolarHBondContact O-N 2.94Å; A203-A206 PolarHBondContact O-N 3.41Å; Q204-A206 VanDerWaalsContact C-N 3.31Å; Q204-A206 PolarHBondContact O-N 3.38Å; A206-L209 PolarHBondContact O-N 3.28Å; A206-H210 WeakPolarHBondContact O-CB 3.37Å; A206-H210 PolarHBondContact O-N 3.42Å
207L93.5Very high90.4Very high55 Ų5543.4 Ų43.429%0.28825%0.254SS..Hα-helixtrans-65.8-45.5178.5-178.163.8000112.5C132 L136 A203 Q204 T205 L209 H210 C211C132-L207 HydrophobicContact CB-CD2 3.65Å; L136-L207 HydrophobicContact CD1-CD2 4.26Å; L136-L207 HydrophobicContact CD2-CD1 4.2Å; L136-L207 HydrophobicContact CG-CD2 4.41Å; A203-L207 PolarHBondContact O-N 3.32Å; Q204-L207 PolarHBondContact O-N 2.87Å; T205-L207 PolarHBondContact O-N 3.03Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 2.88Å; L207-H210 PolarHBondContact O-N 2.92Å; L207-C211 WeakPolarHBondContact O-CB 3.24Å; L207-C211 PolarHBondContact O-N 3.03Å; L207-C211 PolarHBondContact O-SG 2.88Å
208L90.5Very high90.3Very high2 Ų246.5 Ų46.51%0.0126%0.257CS..Hα-helixtrans-58.2-48.7175.8-75.2161.5000110.1A135 Q204 T205 H210 C211 Y212 F293A135-L208 HydrophobicContact CB-CD2 3.59Å; Q204-L208 HydrophobicContact CG-CD1 3.66Å; Q204-L208 HydrophobicContact CG-CG 4.32Å; Q204-L208 WeakPolarHBondContact O-CB 3.38Å; Q204-L208 WeakPolarHBondContact O-CG 3.49Å; Q204-L208 PolarHBondContact O-N 2.93Å; T205-L208 PolarHBondContact O-N 3.25Å; L208-H210 VanDerWaalsContact C-N 3.35Å; L208-H210 PolarHBondContact O-N 2.94Å; L208-C211 PolarHBondContact O-N 3.37Å; L208-Y212 HydrophobicContact CB-CD2 4.16Å; L208-Y212 HydrophobicContact CB-CE2 4.2Å; L208-Y212 HydrophobicContact CD2-CD2 4.29Å; L208-Y212 HydrophobicContact CD2-CE2 3.52Å; L208-Y212 HydrophobicContact CG-CE2 4.48Å; L208-Y212 WeakPolarHBondContact O-CB 3.44Å; L208-Y212 WeakPolarHBondContact O-CD2 3.33Å; L208-Y212 PolarHBondContact O-N 3.47Å; L208-F293 HydrophobicContact CD1-CD1 3.29Å; L208-F293 HydrophobicContact CD1-CE1 3.65Å; L208-F293 HydrophobicContact CD1-CG 3.99Å
209L90.7Very high89.8Confident75 Ų7547.8 Ų47.839%0.39327%0.265SS..Hα-helixtrans-60.5-45.2179-170.165.7000111.1T205 A206 L207 C211 Y212 L213T205-L209 VanDerWaalsContact O-CB 3.31Å; T205-L209 WeakPolarHBondContact O-CB 3.24Å; T205-L209 PolarHBondContact O-N 2.87Å; A206-L209 PolarHBondContact O-N 3.28Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 2.88Å; L209-C211 PolarHBondContact O-N 3.47Å; L209-Y212 PolarHBondContact O-N 3.4Å; L209-L213 HydrophobicContact CD1-CD1 3.85Å; L209-L213 HydrophobicContact CD1-CD2 4.39Å; L209-L213 HydrophobicContact CD1-CG 3.9Å; L209-L213 HydrophobicContact CD2-CD1 4.35Å; L209-L213 HydrophobicContact CG-CD1 3.68Å; L209-L213 HydrophobicContact CG-CG 4.11Å; L209-L213 WeakPolarHBondContact O-CB 3.23Å; L209-L213 WeakPolarHBondContact O-CG 3.35Å; L209-L213 PolarHBondContact O-N 3.47Å
210H92.4Very high89.2Confident118 Ų11853.6 Ų53.655%0.54628%0.275SS..Hα-helixtrans-57.3-50.7175.3179.685.1000112A206 L207 L208 G214A206-H210 WeakPolarHBondContact O-CB 3.37Å; A206-H210 PolarHBondContact O-N 3.42Å; L207-H210 PolarHBondContact O-N 2.92Å; L208-H210 VanDerWaalsContact C-N 3.35Å; L208-H210 PolarHBondContact O-N 2.94Å; H210-G214 PolarHBondContact O-N 2.89Å
211C91Very high88.8Confident0 Ų054.8 Ų54.80%028%0.278CS..Hα-helixtrans-61.1-49.8-179.7-69.30000111.6A135 Y139 L207 L208 L209 G214 I215A135-C211 HydrophobicContact CB-CB 4.17Å; Y139-C211 VanDerWaalsContact CD2-O 3.32Å; Y139-C211 WeakPolarHBondContact CD2-O 3.37Å; Y139-C211 HydrophobicContact CG-CB 4.36Å; L207-C211 WeakPolarHBondContact O-CB 3.24Å; L207-C211 PolarHBondContact O-N 3.03Å; L207-C211 PolarHBondContact O-SG 2.88Å; L208-C211 PolarHBondContact O-N 3.37Å; L209-C211 PolarHBondContact O-N 3.47Å; C211-G214 PolarHBondContact O-N 3.02Å; C211-I215 WeakPolarHBondContact O-CG1 3.49Å; C211-I215 PolarHBondContact O-N 3.3Å
212Y87.4Confident88.1Confident6 Ų656.2 Ų56.22%0.02429%0.289CS..Hα-helixtrans-73.8-40.2-174.5-69.3-52.6000113.2A135 L208 L209 G214 I215 V216 V286 C290A135-Y212 HydrophobicContact CB-CE2 4.43Å; L208-Y212 HydrophobicContact CB-CD2 4.16Å; L208-Y212 HydrophobicContact CB-CE2 4.2Å; L208-Y212 HydrophobicContact CD2-CD2 4.29Å; L208-Y212 HydrophobicContact CD2-CE2 3.52Å; L208-Y212 HydrophobicContact CG-CE2 4.48Å; L208-Y212 WeakPolarHBondContact O-CB 3.44Å; L208-Y212 WeakPolarHBondContact O-CD2 3.33Å; L208-Y212 PolarHBondContact O-N 3.47Å; L209-Y212 PolarHBondContact O-N 3.4Å; Y212-G214 VanDerWaalsContact C-N 3.26Å; Y212-G214 PolarHBondContact O-N 3.41Å; Y212-I215 HydrophobicContact CD1-CD1 3.94Å; Y212-I215 HydrophobicContact CE1-CD1 4.42Å; Y212-I215 PolarHBondContact O-N 2.98Å; Y212-V216 WeakPolarHBondContact O-CG2 3.07Å; Y212-V216 PolarHBondContact O-N 3.05Å; Y212-V286 HydrophobicContact CD1-CB 4.49Å; Y212-V286 HydrophobicContact CD1-CG1 3.15Å; Y212-V286 HydrophobicContact CE1-CG1 3.47Å; Y212-V286 VanDerWaalsContact CE1-CG1 3.47Å; Y212-V286 HydrophobicContact CG-CG1 4.24Å; Y212-C290 HydrophobicContact CD2-CB 3.4Å; Y212-C290 WeakPolarHBondContact CD2-SG 3.44Å; Y212-C290 HydrophobicContact CE2-CB 3.81Å; Y212-C290 HydrophobicContact CG-CB 3.91Å
213L87.9Confident87.2Confident71 Ų7154.4 Ų54.437%0.37228%0.281SS..Hα-helixtrans-61.6-38.8171-68179.9000110.9L209 V216 R217L209-L213 HydrophobicContact CD1-CD1 3.85Å; L209-L213 HydrophobicContact CD1-CD2 4.39Å; L209-L213 HydrophobicContact CD1-CG 3.9Å; L209-L213 HydrophobicContact CD2-CD1 4.35Å; L209-L213 HydrophobicContact CG-CD1 3.68Å; L209-L213 HydrophobicContact CG-CG 4.11Å; L209-L213 WeakPolarHBondContact O-CB 3.23Å; L209-L213 WeakPolarHBondContact O-CG 3.35Å; L209-L213 PolarHBondContact O-N 3.47Å; L213-V216 PolarHBondContact O-N 3.47Å; L213-R217 WeakPolarHBondContact O-CB 3.49Å; L213-R217 WeakPolarHBondContact O-CG 3.42Å; L213-R217 PolarHBondContact O-N 2.9Å
214G88.9Confident86.4Confident15 Ų1558.6 Ų58.616%0.15529%0.288CS..Hα-helixtrans-59.4-45.6173.600000113.1H210 C211 Y212 R217 R218H210-G214 PolarHBondContact O-N 2.89Å; C211-G214 PolarHBondContact O-N 3.02Å; Y212-G214 VanDerWaalsContact C-N 3.26Å; Y212-G214 PolarHBondContact O-N 3.41Å; G214-R217 PolarHBondContact O-N 2.92Å; G214-R218 WeakPolarHBondContact O-CB 3.31Å; G214-R218 PolarHBondContact O-N 2.9Å
215I87.1Confident85.7Confident0 Ų066.2 Ų66.20%032%0.316CS..Hα-helixtrans-59.8-50.3174.4-69.5162.1000110.5R138 Y139 I142 T143 C211 Y212 R217 R218 V219 V286R138-I215 HydrophobicContact CB-CD1 4.22Å; Y139-I215 HydrophobicContact CD2-CG1 4.21Å; I142-I215 HydrophobicContact CB-CG1 4.5Å; I142-I215 HydrophobicContact CD1-CD1 4.2Å; I142-I215 HydrophobicContact CD1-CG1 4.21Å; I142-I215 HydrophobicContact CD1-CG2 3.84Å; I142-I215 HydrophobicContact CG2-CG2 4.19Å; T143-I215 HydrophobicContact CG2-CG1 4.45Å; C211-I215 WeakPolarHBondContact O-CG1 3.49Å; C211-I215 PolarHBondContact O-N 3.3Å; Y212-I215 HydrophobicContact CD1-CD1 3.94Å; Y212-I215 HydrophobicContact CE1-CD1 4.42Å; Y212-I215 PolarHBondContact O-N 2.98Å; I215-R217 VanDerWaalsContact C-N 3.35Å; I215-R217 PolarHBondContact O-N 3.43Å; I215-R218 PolarHBondContact O-N 3.01Å; I215-R218 VanDerWaalsContact O-N 3.17Å; I215-V219 HydrophobicContact CG2-CG2 4.2Å; I215-V219 WeakPolarHBondContact O-CG2 3.35Å; I215-V219 PolarHBondContact O-N 2.95Å; I215-V286 HydrophobicContact CD1-CG1 4.04Å; I215-V286 HydrophobicContact CG2-CG1 4.19Å
216V84.1Confident84.9Confident28 Ų2867.5 Ų67.517%0.1732%0.324CS..Hα-helixtrans-60.5-45-179171.10000111.1Y212 L213 R218 V219 R220Y212-V216 WeakPolarHBondContact O-CG2 3.07Å; Y212-V216 PolarHBondContact O-N 3.05Å; L213-V216 PolarHBondContact O-N 3.47Å; V216-R218 VanDerWaalsContact C-N 3.34Å; V216-R218 PolarHBondContact O-N 2.67Å; V216-V219 PolarHBondContact O-N 3.21Å; V216-R220 HydrophobicContact CG1-CG 4.37Å; V216-R220 WeakPolarHBondContact O-CB 3.11Å; V216-R220 VanDerWaalsContact O-CG 3.29Å; V216-R220 WeakPolarHBondContact O-CG 3.01Å; V216-R220 PolarHBondContact O-N 3.32Å
217R86.5Confident84.1Confident172 Ų17268.1 Ų68.165%0.64932%0.324SS*.Hα-helixtrans-57.8-47.3175.5-74.2172.3-174174.72.7110.8L213 G214 I215 R220 V221L213-R217 WeakPolarHBondContact O-CB 3.49Å; L213-R217 WeakPolarHBondContact O-CG 3.42Å; L213-R217 PolarHBondContact O-N 2.9Å; G214-R217 PolarHBondContact O-N 2.92Å; I215-R217 VanDerWaalsContact C-N 3.35Å; I215-R217 PolarHBondContact O-N 3.43Å; R217-R220 PolarHBondContact O-N 2.9Å; R217-V221 WeakPolarHBondContact O-CG2 3.39Å; R217-V221 PolarHBondContact O-N 3.4Å
218R85.2Confident83.2Confident105 Ų10569.4 Ų69.440%0.39633%0.334SS..Hα-helixtrans-62.9-46.8179-172.967.9176.2179.3-1112.2T143 G214 I215 V216 R220 V221 S222T143-R218 HydrophobicContact CG2-CB 3.86Å; T143-R218 HydrophobicContact CG2-CG 4.18Å; G214-R218 WeakPolarHBondContact O-CB 3.31Å; G214-R218 PolarHBondContact O-N 2.9Å; I215-R218 PolarHBondContact O-N 3.01Å; I215-R218 VanDerWaalsContact O-N 3.17Å; V216-R218 VanDerWaalsContact C-N 3.34Å; V216-R218 PolarHBondContact O-N 2.67Å; R218-R220 VanDerWaalsContact C-N 3.35Å; R218-R220 PolarHBondContact O-N 2.93Å; R218-V221 PolarHBondContact O-N 2.8Å; R218-S222 PolarHBondContact O-N 3.2Å; R218-S222 PolarHBondContact O-OG 2.9Å; R218-S222 VanDerWaalsContact O-OG 3.14Å
219V81Confident82.5Confident28 Ų2874.4 Ų74.417%0.1736%0.36CS..Hα-helixtrans-61-44.1178.9172.40000110.7I142 I215 V216 V221 S222 V223I142-V219 HydrophobicContact CG2-CG2 4.32Å; I215-V219 HydrophobicContact CG2-CG2 4.2Å; I215-V219 WeakPolarHBondContact O-CG2 3.35Å; I215-V219 PolarHBondContact O-N 2.95Å; V216-V219 PolarHBondContact O-N 3.21Å; V219-V221 PolarHBondContact O-N 3Å; V219-S222 PolarHBondContact O-N 3.28Å; V219-V223 WeakPolarHBondContact O-CG2 3.37Å; V219-V223 PolarHBondContact O-N 2.9Å
220R80.8Confident81.6Confident176 Ų17672.6 Ų72.666%0.66435%0.351SS*.Hα-helixtrans-59.4-45.4175.8-74.1178.1-177.8-1672111.8V216 R217 R218 V223 K224V216-R220 HydrophobicContact CG1-CG 4.37Å; V216-R220 WeakPolarHBondContact O-CB 3.11Å; V216-R220 VanDerWaalsContact O-CG 3.29Å; V216-R220 WeakPolarHBondContact O-CG 3.01Å; V216-R220 PolarHBondContact O-N 3.32Å; R217-R220 PolarHBondContact O-N 2.9Å; R218-R220 VanDerWaalsContact C-N 3.35Å; R218-R220 PolarHBondContact O-N 2.93Å; R220-V223 PolarHBondContact O-N 3.3Å; R220-K224 WeakPolarHBondContact O-CG 3.15Å; R220-K224 PolarHBondContact O-N 2.85Å
221V81.4Confident80.6Confident61 Ų6173.1 Ų73.137%0.3735%0.352SS..Hα-helixtrans-63.6-43.8176.81720000111.3R217 R218 V219 V223 K224 R225R217-V221 WeakPolarHBondContact O-CG2 3.39Å; R217-V221 PolarHBondContact O-N 3.4Å; R218-V221 PolarHBondContact O-N 2.8Å; V219-V221 PolarHBondContact O-N 3Å; V221-V223 VanDerWaalsContact C-N 3.32Å; V221-V223 PolarHBondContact O-N 3.3Å; V221-K224 PolarHBondContact O-N 3.04Å; V221-R225 HydrophobicContact CG1-CG 4.41Å; V221-R225 WeakPolarHBondContact O-CG 3.42Å; V221-R225 PolarHBondContact O-N 3.41Å
222S77.9Confident79.8Confident38 Ų3877.9 Ų77.927%0.26637%0.374SS..Hα-helixtrans-61.4-39.7177-650000112.3R218 V219 V226R218-S222 PolarHBondContact O-N 3.2Å; R218-S222 PolarHBondContact O-OG 2.9Å; R218-S222 VanDerWaalsContact O-OG 3.14Å; V219-S222 PolarHBondContact O-N 3.28Å; S222-V226 WeakPolarHBondContact O-CB 3.45Å; S222-V226 VanDerWaalsContact O-CG2 3.26Å; S222-V226 WeakPolarHBondContact O-CG2 3.44Å; S222-V226 PolarHBondContact O-N 3.17Å
223V74.1Confident78.9Confident42 Ų4282.2 Ų82.226%0.25540%0.397SS..Hα-helixtrans-64.6-44.8175.3171.30000110.9V219 R220 V221 V226 S227V219-V223 WeakPolarHBondContact O-CG2 3.37Å; V219-V223 PolarHBondContact O-N 2.9Å; R220-V223 PolarHBondContact O-N 3.3Å; V221-V223 VanDerWaalsContact C-N 3.32Å; V221-V223 PolarHBondContact O-N 3.3Å; V223-V226 PolarHBondContact O-N 2.88Å; V223-S227 WeakPolarHBondContact O-CB 3.43Å; V223-S227 PolarHBondContact O-N 3.2Å
224K77.3Confident77.7Confident152 Ų15283.5 Ų83.566%0.66140%0.404SS*.Hα-helixtrans-59.4-49176.3-73-176.4178.7-170.10111.9R220 V221 V226 S227 V228R220-K224 WeakPolarHBondContact O-CG 3.15Å; R220-K224 PolarHBondContact O-N 2.85Å; V221-K224 PolarHBondContact O-N 3.04Å; K224-V226 PolarHBondContact O-N 2.97Å; K224-S227 WeakPolarHBondContact O-CB 3.31Å; K224-S227 PolarHBondContact O-N 3.19Å; K224-S227 VanDerWaalsContact O-N 3.14Å; K224-V228 WeakPolarHBondContact O-CG2 3.48Å; K224-V228 PolarHBondContact O-N 2.74Å
225R77.7Confident76.2Confident166 Ų16689.9 Ų89.963%0.62643%0.429SS*.Hα-helixtrans-60.3-43.3178.8-71.4-177.6-176.8-167.6-1.3112.6V221 S227 V228 L229V221-R225 HydrophobicContact CG1-CG 4.41Å; V221-R225 WeakPolarHBondContact O-CG 3.42Å; V221-R225 PolarHBondContact O-N 3.41Å; R225-S227 VanDerWaalsContact C-N 3.31Å; R225-S227 PolarHBondContact O-N 3.25Å; R225-V228 PolarHBondContact O-N 2.87Å; R225-L229 WeakPolarHBondContact O-CB 3.44Å; R225-L229 PolarHBondContact O-N 2.61Å
226V74.8Confident74.7Confident47 Ų4796.8 Ų96.829%0.28546%0.462SS..Hα-helixtrans-66-36.1176.6170.90000111.3S222 V223 K224 N230S222-V226 WeakPolarHBondContact O-CB 3.45Å; S222-V226 VanDerWaalsContact O-CG2 3.26Å; S222-V226 WeakPolarHBondContact O-CG2 3.44Å; S222-V226 PolarHBondContact O-N 3.17Å; V223-V226 PolarHBondContact O-N 2.88Å; K224-V226 PolarHBondContact O-N 2.97Å; V226-N230 VanDerWaalsContact O-CB 3.22Å; V226-N230 WeakPolarHBondContact O-CB 3.49Å; V226-N230 PolarHBondContact O-N 3.33Å
227S75.4Confident73.4Confident73 Ų73101.3 Ų101.351%0.5148%0.484SS..Hα-helixtrans-64.9-44.5175.2-163.70000111.9V223 K224 R225 N230 F231V223-S227 WeakPolarHBondContact O-CB 3.43Å; V223-S227 PolarHBondContact O-N 3.2Å; K224-S227 WeakPolarHBondContact O-CB 3.31Å; K224-S227 PolarHBondContact O-N 3.19Å; K224-S227 VanDerWaalsContact O-N 3.14Å; R225-S227 VanDerWaalsContact C-N 3.31Å; R225-S227 PolarHBondContact O-N 3.25Å; S227-N230 PolarHBondContact O-N 2.85Å; S227-F231 WeakPolarHBondContact O-CB 3.39Å; S227-F231 PolarHBondContact O-N 3.43Å
228V75.5Confident71.7Confident82 Ų8298.6 Ų98.650%0.49749%0.489SS..Hα-helixtrans-65.5-45177.3173.70000111.1K224 R225 N230 F231 H232K224-V228 WeakPolarHBondContact O-CG2 3.48Å; K224-V228 PolarHBondContact O-N 2.74Å; R225-V228 PolarHBondContact O-N 2.87Å; V228-N230 VanDerWaalsContact C-N 3.31Å; V228-N230 PolarHBondContact O-N 2.81Å; V228-F231 WeakPolarHBondContact O-CB 3.18Å; V228-F231 PolarHBondContact O-N 3Å; V228-F231 VanDerWaalsContact O-N 3.16Å; V228-H232 PolarHBondContact O-CD2 2.66Å; V228-H232 PolarHBondContact O-N 2.67Å
229L74.7Confident70.2Confident107 Ų10796 Ų9656%0.5650%0.495SS*.Hα-helixtrans-61.6-40.9176.5-175.766.7000111.6R225 F231 H232 L233R225-L229 WeakPolarHBondContact O-CB 3.44Å; R225-L229 PolarHBondContact O-N 2.61Å; L229-F231 VanDerWaalsContact C-N 3.32Å; L229-H232 PolarHBondContact O-N 3.17Å; L229-L233 HydrophobicContact CG-CD1 4.26Å; L229-L233 WeakPolarHBondContact O-CB 3.36Å; L229-L233 WeakPolarHBondContact O-CG 3.18Å; L229-L233 PolarHBondContact O-N 3.2Å
230N72.8Confident68.4Low37 Ų37100.4 Ų100.420%0.19853%0.525CS..Hα-helixtrans-65.2-37.5175.9-164.374000111.7V226 S227 V228 L234V226-N230 VanDerWaalsContact O-CB 3.22Å; V226-N230 WeakPolarHBondContact O-CB 3.49Å; V226-N230 PolarHBondContact O-N 3.33Å; S227-N230 PolarHBondContact O-N 2.85Å; V228-N230 VanDerWaalsContact C-N 3.31Å; V228-N230 PolarHBondContact O-N 2.81Å; N230-L234 WeakPolarHBondContact O-CB 3.22Å; N230-L234 VanDerWaalsContact O-CG 3.28Å; N230-L234 WeakPolarHBondContact O-CG 3.33Å; N230-L234 PolarHBondContact O-N 3.08Å
231F71.9Confident66.6Low130 Ų13096 Ų9657%0.5753%0.527SS*.Hα-helixtrans-63.5-46.3173.3-179.1-100.9000111.4S227 V228 L229 L233 L234 H235S227-F231 WeakPolarHBondContact O-CB 3.39Å; S227-F231 PolarHBondContact O-N 3.43Å; V228-F231 WeakPolarHBondContact O-CB 3.18Å; V228-F231 PolarHBondContact O-N 3Å; V228-F231 VanDerWaalsContact O-N 3.16Å; L229-F231 VanDerWaalsContact C-N 3.32Å; F231-L233 PolarHBondContact O-N 3.05Å; F231-L234 PolarHBondContact O-N 3.39Å; F231-H235 WeakPolarHBondContact O-CB 3.41Å; F231-H235 PolarHBondContact O-N 3.4Å
232H73.2Confident64.8Low99 Ų9995.9 Ų95.946%0.45853%0.532SS..Hα-helixtrans-62-44.2176-80.4-142.9000112.1V228 L229 L234 H235 Q236V228-H232 PolarHBondContact O-CD2 2.66Å; V228-H232 PolarHBondContact O-N 2.67Å; L229-H232 PolarHBondContact O-N 3.17Å; H232-L234 PolarHBondContact O-N 3.08Å; H232-H235 PolarHBondContact O-N 3.47Å; H232-Q236 VanDerWaalsContact O-CB 3.23Å; H232-Q236 WeakPolarHBondContact O-CB 3.25Å; H232-Q236 VanDerWaalsContact O-CG 3.32Å; H232-Q236 WeakPolarHBondContact O-CG 3.43Å; H232-Q236 PolarHBondContact O-N 3.09Å
233L68.4Low63.1Low98 Ų9897.8 Ų97.851%0.51355%0.55SS..Hα-helixtrans-62.8-40.4177.4-78.3169.1000112.4L229 F231 H235 L237L229-L233 HydrophobicContact CG-CD1 4.26Å; L229-L233 WeakPolarHBondContact O-CB 3.36Å; L229-L233 WeakPolarHBondContact O-CG 3.18Å; L229-L233 PolarHBondContact O-N 3.2Å; F231-L233 PolarHBondContact O-N 3.05Å; L233-H235 VanDerWaalsContact C-N 3.32Å; L233-L237 WeakPolarHBondContact O-CG 3.43Å; L233-L237 PolarHBondContact O-N 3.32Å
234L63.3Low61.5Low97 Ų9799.8 Ų99.851%0.50857%0.571SS.*Hα-helixtrans-66.9-34.2175.8-73.2172.2000112.3N230 F231 H232 L268N230-L234 WeakPolarHBondContact O-CB 3.22Å; N230-L234 VanDerWaalsContact O-CG 3.28Å; N230-L234 WeakPolarHBondContact O-CG 3.33Å; N230-L234 PolarHBondContact O-N 3.08Å; F231-L234 PolarHBondContact O-N 3.39Å; H232-L234 PolarHBondContact O-N 3.08Å; L234-L268 HydrophobicContact CD2-CD1 4.04Å
235H58.2Low59.9Low149 Ų14996.4 Ų96.469%0.6957%0.572SS**Hα-helixtrans-88-17.5-178.3-148.3-76000113.7F231 H232 L233F231-H235 WeakPolarHBondContact O-CB 3.41Å; F231-H235 PolarHBondContact O-N 3.4Å; H232-H235 PolarHBondContact O-N 3.47Å; L233-H235 VanDerWaalsContact C-N 3.32Å
236Q55.2Low58.2Low146 Ų14691.7 Ų91.768%0.68257%0.568SS**Hα-helixtrans-94.3-6.9175.8-74.4-164.5-14.400113.8H232 P238H232-Q236 VanDerWaalsContact O-CB 3.23Å; H232-Q236 WeakPolarHBondContact O-CB 3.25Å; H232-Q236 VanDerWaalsContact O-CG 3.32Å; H232-Q236 WeakPolarHBondContact O-CG 3.43Å; H232-Q236 PolarHBondContact O-N 3.09Å; Q236-P238 WeakPolarHBondContact O-CD 3.49Å
237L55.3Low56.4Low123 Ų12398.6 Ų98.664%0.64460%0.595SS**  trans-72.2103.2168.5-80164000109.1L233 G239L233-L237 WeakPolarHBondContact O-CG 3.43Å; L233-L237 PolarHBondContact O-N 3.32Å; L237-G239 PolarHBondContact O-N 3.36Å
238P50.9Low54.8Low115 Ų115101 Ų10175%0.74761%0.609SS**  trans-83.374.4175.714.67.6000106.2Q236Q236-P238 WeakPolarHBondContact O-CD 3.49Å
239G54.1Low53.3Low50 Ų50100.7 Ų100.752%0.51562%0.622SS.*  trans-134.9-7.4-160.500000117.8L237L237-G239 PolarHBondContact O-N 3.36Å
240C44.7Very low51.3Low120 Ų120100.7 Ų100.781%0.81164%0.637SS**SBendtrans-131.6-22.1172.1-65.20000113.8
241A42.8Very low49.7Very low84 Ų84107.5 Ų107.569%0.69467%0.668SS**SBendtrans-87.6-34175.700000113A244A241-A244 PolarHBondContact O-N 3.12Å
242A42.1Very low47.9Very low59 Ų59110.3 Ų110.349%0.48868%0.683SS.*Hα-helixtrans-76.1-28.4-178.300000113.4A244 A245A242-A244 PolarHBondContact O-N 3.48Å; A242-A245 PolarHBondContact O-N 2.97Å
243A41.9Very low46.1Very low77 Ų77109.8 Ų109.864%0.63670%0.695SS**Hα-helixtrans-70.5-20174.900000113
244A41.4Very low45.1Very low85 Ų85111.6 Ų111.670%0.70271%0.713SS**Hα-helixtrans-87.4-19.7176.100000113.3A241 A242A241-A244 PolarHBondContact O-N 3.12Å; A242-A244 PolarHBondContact O-N 3.48Å
245A43.3Very low43.6Very low81 Ų81110.3 Ų110.367%0.66972%0.723SS**Hα-helixtrans-98.1-4.6-174.900000114.3A242A242-A245 PolarHBondContact O-N 2.97Å
246A41.5Very low43.1Very low67 Ų67109.9 Ų109.955%0.55473%0.734SS**SBendtrans-90.79.8-173.500000115.5
247F38.7Very low42.7Very low191 Ų191107 Ų10784%0.83874%0.743SS**  trans-131.482.4175.3-72.5-75.2000113.1
248P40.5Very low41.7Very low124 Ų124104.6 Ų104.681%0.80575%0.748SS**  trans-85.3103.5154.229.4-19.2000108.8
249G44.5Very low41Very low76 Ų76103.8 Ų103.878%0.78475%0.751SS**  trans74.899.815600000117.8
250A33.7Very low40.2Very low106 Ų106106.1 Ų106.188%0.87677%0.765SS**  trans-147.6105.4140.900000108.5
251Q38.6Very low39.8Very low181 Ų181108.7 Ų108.785%0.84677%0.765SS**  trans-76.6155.8168.5-67.9172.4-16.800109.7
252H33.6Very low39.6Very low189 Ų189110 Ų11088%0.87577%0.766SS**  trans79.1130.8176-76.362.1000116.2
253A35.9Very low39.5Very low87 Ų87112 Ų11272%0.71978%0.783SS**  cis-160.8172.15.800000108.4
254P46.7Very low39.2Very low136 Ų136117 Ų11788%0.88379%0.793SS**  trans-90.9144.7-16435.2-30.8000114.1
255G32.5Very low39.2Very low70 Ų70117.5 Ų117.572%0.72280%0.798SS**  trans-133136.4167.500000110.3
256P47.8Very low39Very low141 Ų141122.6 Ų122.692%0.91681%0.807SS**  trans-90.4141.2-168.435.1-31.4000111.6
257G45.6Very low39Very low85 Ų85125 Ų12588%0.87682%0.817SS**  trans111.192.6162.900000114.2
258G34.7Very low39.3Very low73 Ų73120 Ų12075%0.75380%0.799SS**  trans169.196.1168.200000110.1A260G258-A260 PolarHBondContact O-N 3.18Å
259A36.5Very low39.4Very low97 Ų97118 Ų11880%0.80279%0.786SS**  trans-57.8112174.400000109.7H261A259-H261 PolarHBondContact O-N 2.68Å; A259-H261 VanDerWaalsContact O-N 3.16Å
260A36.3Very low39.5Very low99 Ų99119.8 Ų119.882%0.81878%0.784SS**  trans-71.3105.2171.900000108.8G258G258-A260 PolarHBondContact O-N 3.18Å
261H38Very low40.1Very low175 Ų175118 Ų11881%0.8177%0.769SS**  trans-67.6130.8164-87.5-69.6000109A259 A263A259-H261 PolarHBondContact O-N 2.68Å; A259-H261 VanDerWaalsContact O-N 3.16Å; H261-A263 PolarHBondContact O-N 3.34Å
262P38.4Very low40.5Very low110 Ų110112.7 Ų112.771%0.71475%0.746SS**  trans-65.2126.3171.826.5-30.4000108.2Q264P262-Q264 PolarHBondContact O-N 3.1Å
263A40.2Very low40.9Very low103 Ų103109.7 Ų109.785%0.85173%0.732SS**  trans-56.7103.517300000108.9H261 A265H261-A263 PolarHBondContact O-N 3.34Å; A263-A265 PolarHBondContact O-N 3.49Å
264Q34.6Very low41.3Very low181 Ų181108.7 Ų108.785%0.84672%0.718SS**  trans-61.6124.2172.2-78.6-177.8-900108.3P262 Q266P262-Q264 PolarHBondContact O-N 3.1Å; Q264-Q266 PolarHBondContact O-N 2.88Å
265A41.3Very low41.5Very low96 Ų96110.1 Ų110.179%0.79371%0.706SS**  trans-55.2106.9167.200000108.4A263 P267A263-A265 PolarHBondContact O-N 3.49Å; A265-P267 VanDerWaalsContact O-CD 3.23Å; A265-P267 WeakPolarHBondContact O-CD 3.32Å; A265-P267 VanDerWaalsContact O-N 3.15Å
266Q39.3Very low42.2Very low187 Ų187110.8 Ų110.887%0.87469%0.687SS**  trans-64.5115-176.2-152.7159.3-24.900108.2Q264 L268Q264-Q266 PolarHBondContact O-N 2.88Å; Q266-L268 PolarHBondContact O-N 3.43Å
267P42.3Very low42Very low117 Ų117106.4 Ų106.476%0.7666%0.663SS**  trans-62.6137.8-179.5-16.629.4000108.9A265A265-P267 VanDerWaalsContact O-CD 3.23Å; A265-P267 WeakPolarHBondContact O-CD 3.32Å; A265-P267 VanDerWaalsContact O-N 3.15Å
268L44.9Very low42.3Very low87 Ų87109.1 Ų109.146%0.45565%0.652SS.*  trans-42.5137.7173.6-128.798.5000110.3L234 Q266 L272L234-L268 HydrophobicContact CD2-CD1 4.04Å; Q266-L268 PolarHBondContact O-N 3.43Å; L268-L272 HydrophobicContact CD2-CD1 4.05Å
269P42.2Very low43.2Very low82 Ų82111.4 Ų111.453%0.53264%0.638SS.*  trans-56.1131.3-174.117.4-29.7000111.3A271 L272P269-A271 PolarHBondContact O-N 3.12Å; P269-L272 PolarHBondContact O-N 3.47Å
270P47.4Very low43.8Very low113 Ų113114.4 Ų114.473%0.73463%0.629SS**THydrogen-bonded Turntrans-61-6.7-174.919.8-30.7000114.3L272 P274P270-L272 PolarHBondContact O-N 3.24Å; P270-P274 WeakPolarHBondContact O-CD 3.43Å
271A46Very low44.6Very low68 Ų68114.4 Ų114.456%0.56262%0.615SS**THydrogen-bonded Turntrans-71.2-17.2-179.500000115.5P269 P274P269-A271 PolarHBondContact O-N 3.12Å; A271-P274 WeakPolarHBondContact O-CD 3.32Å; A271-P274 WeakPolarHBondContact O-CG 3.28Å
272L45.6Very low45.6Very low70 Ų70108.5 Ų108.537%0.36659%0.593SS.*Hα-helixtrans-87.9-25.3-178.6-79166.3000114.3L268 P269 P270L268-L272 HydrophobicContact CD2-CD1 4.05Å; P269-L272 PolarHBondContact O-N 3.47Å; P270-L272 PolarHBondContact O-N 3.24Å
273H43.5Very low46.7Very low126 Ų126103.9 Ų103.958%0.58357%0.565SS**Hα-helixtrans-67.5-43.6174.3-83.6-83.3000115.1R275 R276 A277H273-R275 VanDerWaalsContact C-N 3.3Å; H273-R275 PolarHBondContact O-N 3.31Å; H273-R276 PolarHBondContact O-N 3.46Å; H273-R276 VanDerWaalsContact O-N 3.17Å; H273-A277 PolarHBondContact O-N 3.17Å
274P43.5Very low47.9Very low66 Ų66104.3 Ų104.343%0.42955%0.553SS.*Hα-helixtrans-63.5-35.4-177.320.2-31000112.3P270 A271 R276 Q278P270-P274 WeakPolarHBondContact O-CD 3.43Å; A271-P274 WeakPolarHBondContact O-CD 3.32Å; A271-P274 WeakPolarHBondContact O-CG 3.28Å; P274-R276 VanDerWaalsContact C-N 3.33Å; P274-R276 PolarHBondContact O-N 3.23Å; P274-Q278 WeakPolarHBondContact O-CB 3.18Å; P274-Q278 PolarHBondContact O-N 2.82Å
275R51Low49.3Very low166 Ų16696.9 Ų96.963%0.62652%0.521SS*.Hα-helixtrans-67-29.9178.3-70.1-178172.7177.1-0.8113.3H273 R279H273-R275 VanDerWaalsContact C-N 3.3Å; H273-R275 PolarHBondContact O-N 3.31Å; R275-R279 WeakPolarHBondContact O-CB 3.43Å; R275-R279 WeakPolarHBondContact O-CD 3.15Å; R275-R279 WeakPolarHBondContact O-CG 3.32Å; R275-R279 PolarHBondContact O-N 3.38Å
276R47.8Very low50.6Low84 Ų8493.1 Ų93.132%0.31749%0.488SS..Hα-helixtrans-76.2-45.1178.5-74179.3-178.4164.32.3111.8H273 P274 R280H273-R276 PolarHBondContact O-N 3.46Å; H273-R276 VanDerWaalsContact O-N 3.17Å; P274-R276 VanDerWaalsContact C-N 3.33Å; P274-R276 PolarHBondContact O-N 3.23Å; R276-R280 PolarHBondContact O-N 2.67Å
277A43.4Very low52.1Low50 Ų5088 Ų8841%0.41347%0.466SS..Hα-helixtrans-62.6-47.4175.400000110.7H273 R279 R280 L281H273-A277 PolarHBondContact O-N 3.17Å; A277-R279 VanDerWaalsContact C-N 3.34Å; A277-R279 PolarHBondContact O-N 2.92Å; A277-R280 PolarHBondContact O-N 3.06Å; A277-L281 HydrophobicContact CB-CD1 4.28Å; A277-L281 VanDerWaalsContact O-CB 3.31Å; A277-L281 WeakPolarHBondContact O-CB 3.36Å; A277-L281 WeakPolarHBondContact O-CD1 3.48Å; A277-L281 WeakPolarHBondContact O-CG 3.35Å; A277-L281 PolarHBondContact O-N 3.2Å
278Q51.5Low53.6Low141 Ų14187 Ų8766%0.65945%0.454SS*.Hα-helixtrans-62.6-35.4-178.3-168.1163.1-11.300113.4P274 S282P274-Q278 WeakPolarHBondContact O-CB 3.18Å; P274-Q278 PolarHBondContact O-N 2.82Å; Q278-S282 VanDerWaalsContact O-CB 3.29Å; Q278-S282 WeakPolarHBondContact O-CB 3.23Å; Q278-S282 PolarHBondContact O-N 3.12Å
279R53.2Low55.1Low122 Ų12284.1 Ų84.146%0.4644%0.439SS..Hα-helixtrans-72.2-37.5174.5-72.9172.8-176.7-174.51113.2R275 A277 G283R275-R279 WeakPolarHBondContact O-CB 3.43Å; R275-R279 WeakPolarHBondContact O-CD 3.15Å; R275-R279 WeakPolarHBondContact O-CG 3.32Å; R275-R279 PolarHBondContact O-N 3.38Å; A277-R279 VanDerWaalsContact C-N 3.34Å; A277-R279 PolarHBondContact O-N 2.92Å; R279-G283 PolarHBondContact O-N 3.18Å
280R49.9Very low56.8Low159 Ų15980.4 Ų80.460%0.642%0.415SS*.Hα-helixtrans-71.5-42176.1-75.8-178.5175.6-95.75.2112.2R276 A277 S282 G283 L284R276-R280 PolarHBondContact O-N 2.67Å; A277-R280 PolarHBondContact O-N 3.06Å; R280-S282 VanDerWaalsContact C-N 3.31Å; R280-S282 PolarHBondContact O-N 2.94Å; R280-G283 PolarHBondContact O-N 2.92Å; R280-L284 PolarHBondContact O-N 3.48Å; R280-L284 VanDerWaalsContact O-N 3.12Å
281L53.3Low58.5Low99 Ų9977.6 Ų77.652%0.51840%0.397SS..Hα-helixtrans-61.4-40174.3-79.5153.6000111.2A277 S285A277-L281 HydrophobicContact CB-CD1 4.28Å; A277-L281 VanDerWaalsContact O-CB 3.31Å; A277-L281 WeakPolarHBondContact O-CB 3.36Å; A277-L281 WeakPolarHBondContact O-CD1 3.48Å; A277-L281 WeakPolarHBondContact O-CG 3.35Å; A277-L281 PolarHBondContact O-N 3.2Å; L281-S285 WeakPolarHBondContact O-CB 3.5Å; L281-S285 PolarHBondContact O-N 3.33Å; L281-S285 VanDerWaalsContact O-N 3.09Å; L281-S285 PolarHBondContact O-OG 3.48Å
282S59.1Low60.2Low52 Ų5276.8 Ų76.836%0.36439%0.385SS..Hα-helixtrans-62.9-47.4174.6177.40000112.3Q278 R280 L284 S285 V286Q278-S282 VanDerWaalsContact O-CB 3.29Å; Q278-S282 WeakPolarHBondContact O-CB 3.23Å; Q278-S282 PolarHBondContact O-N 3.12Å; R280-S282 VanDerWaalsContact C-N 3.31Å; R280-S282 PolarHBondContact O-N 2.94Å; S282-L284 PolarHBondContact O-N 3.37Å; S282-S285 PolarHBondContact O-N 2.79Å; S282-V286 WeakPolarHBondContact O-CB 3.23Å; S282-V286 WeakPolarHBondContact O-CG2 3.5Å; S282-V286 PolarHBondContact O-N 2.85Å; S282-V286 VanDerWaalsContact O-N 3.08Å
283G60.3Low62Low12 Ų1273.7 Ų73.712%0.12437%0.368CS..Hα-helixtrans-62.8-38.7178.400000114.8R279 R280 L287R279-G283 PolarHBondContact O-N 3.18Å; R280-G283 PolarHBondContact O-N 2.92Å; G283-L287 PolarHBondContact O-N 3.25Å
284L65.6Low63.8Low113 Ų11369.4 Ų69.459%0.59235%0.35SS*.Hα-helixtrans-68.3-41.4175.5-88.6159.7000112.6R280 S282 V286 L287 L288R280-L284 PolarHBondContact O-N 3.48Å; R280-L284 VanDerWaalsContact O-N 3.12Å; S282-L284 PolarHBondContact O-N 3.37Å; L284-V286 VanDerWaalsContact C-N 3.26Å; L284-V286 PolarHBondContact O-N 3.29Å; L284-L287 PolarHBondContact O-N 3.14Å; L284-L288 WeakPolarHBondContact O-CB 3.41Å; L284-L288 PolarHBondContact O-N 2.94Å
285S65.2Low65.8Low25 Ų2572.5 Ų72.518%0.17536%0.362CS..Hα-helixtrans-59.1-42.4175.7-49.90000111.5L281 S282 L288 L289 R339L281-S285 WeakPolarHBondContact O-CB 3.5Å; L281-S285 PolarHBondContact O-N 3.33Å; L281-S285 VanDerWaalsContact O-N 3.09Å; L281-S285 PolarHBondContact O-OG 3.48Å; S282-S285 PolarHBondContact O-N 2.79Å; S285-L288 PolarHBondContact O-N 2.91Å; S285-L289 PolarHBondContact O-N 3.28Å; S285-L289 VanDerWaalsContact O-N 3.08Å; S285-R339 WeakPolarHBondContact OG-CD 3.24Å; S285-R339 PolarHBondContact OG-NH1 3.44Å
286V67.7Low67.4Low17 Ų1765 Ų6510%0.10334%0.335CS..Hα-helixtrans-69.6-38.8-177.9166.90000111.3Y212 I215 S282 L284 L289 C290Y212-V286 HydrophobicContact CD1-CB 4.49Å; Y212-V286 HydrophobicContact CD1-CG1 3.15Å; Y212-V286 HydrophobicContact CE1-CG1 3.47Å; Y212-V286 VanDerWaalsContact CE1-CG1 3.47Å; Y212-V286 HydrophobicContact CG-CG1 4.24Å; I215-V286 HydrophobicContact CD1-CG1 4.04Å; I215-V286 HydrophobicContact CG2-CG1 4.19Å; S282-V286 WeakPolarHBondContact O-CB 3.23Å; S282-V286 WeakPolarHBondContact O-CG2 3.5Å; S282-V286 PolarHBondContact O-N 2.85Å; S282-V286 VanDerWaalsContact O-N 3.08Å; L284-V286 VanDerWaalsContact C-N 3.26Å; L284-V286 PolarHBondContact O-N 3.29Å; V286-L289 WeakPolarHBondContact O-CB 3.36Å; V286-C290 PolarHBondContact O-N 3.04Å
287L70.8Confident69.2Low78 Ų7861.1 Ų61.141%0.40832%0.321SS..Hα-helixtrans-67.8-43.1174.1-175.966.7000111.8G283 L284 L289 C290 C291G283-L287 PolarHBondContact O-N 3.25Å; L284-L287 PolarHBondContact O-N 3.14Å; L287-L289 VanDerWaalsContact C-N 3.28Å; L287-L289 PolarHBondContact O-N 3.28Å; L287-C290 WeakPolarHBondContact O-CB 3.18Å; L287-C290 PolarHBondContact O-N 3.33Å; L287-C290 VanDerWaalsContact O-N 3.17Å; L287-C291 PolarHBondContact O-N 2.94Å; L287-C291 PolarHBondContact O-SG 3.17Å
288L74.4Confident71.5Confident97 Ų9761.4 Ų61.451%0.50831%0.314SS..Hα-helixtrans-57.4-44.1176.1-178.869.4000111.2L284 S285 C290 C291 V292L284-L288 WeakPolarHBondContact O-CB 3.41Å; L284-L288 PolarHBondContact O-N 2.94Å; S285-L288 PolarHBondContact O-N 2.91Å; L288-C290 VanDerWaalsContact C-N 3.32Å; L288-C290 PolarHBondContact O-N 3.43Å; L288-C291 PolarHBondContact O-N 2.99Å; L288-V292 WeakPolarHBondContact O-CG2 3.45Å; L288-V292 PolarHBondContact O-N 3.02Å
289L74.9Confident73.4Confident27 Ų2756.9 Ų56.914%0.14130%0.297CS..Hα-helixtrans-56.9-45.9176-142.173.1000112.2S285 V286 L287 F293 L335 Y336S285-L289 PolarHBondContact O-N 3.28Å; S285-L289 VanDerWaalsContact O-N 3.08Å; V286-L289 WeakPolarHBondContact O-CB 3.36Å; L287-L289 VanDerWaalsContact C-N 3.28Å; L287-L289 PolarHBondContact O-N 3.28Å; L289-F293 WeakPolarHBondContact O-CB 3.43Å; L289-F293 PolarHBondContact O-N 2.9Å; L289-F293 VanDerWaalsContact O-N 3.12Å; L289-L335 HydrophobicContact CD1-CB 3.58Å; L289-L335 HydrophobicContact CD1-CD2 4.3Å; L289-L335 HydrophobicContact CD1-CG 4.45Å; L289-L335 WeakPolarHBondContact CD1-O 3.44Å; L289-Y336 HydrophobicContact CD2-CD1 3.79Å; L289-Y336 HydrophobicContact CD2-CE1 3.39Å; L289-Y336 HydrophobicContact CG-CE1 4.23Å
290C79.3Confident75.2Confident4 Ų451.5 Ų51.53%0.02728%0.277CS..Hα-helixtrans-60.9-48.2175.6-1720000111Y212 V286 L287 L288 V292 F293 L294Y212-C290 HydrophobicContact CD2-CB 3.4Å; Y212-C290 WeakPolarHBondContact CD2-SG 3.44Å; Y212-C290 HydrophobicContact CE2-CB 3.81Å; Y212-C290 HydrophobicContact CG-CB 3.91Å; V286-C290 PolarHBondContact O-N 3.04Å; L287-C290 WeakPolarHBondContact O-CB 3.18Å; L287-C290 PolarHBondContact O-N 3.33Å; L287-C290 VanDerWaalsContact O-N 3.17Å; L288-C290 VanDerWaalsContact C-N 3.32Å; L288-C290 PolarHBondContact O-N 3.43Å; C290-V292 PolarHBondContact O-N 3.35Å; C290-F293 PolarHBondContact O-N 3.03Å; C290-L294 WeakPolarHBondContact O-CB 3.24Å; C290-L294 WeakPolarHBondContact O-CG 3.41Å; C290-L294 PolarHBondContact O-N 3.41Å
291C81.6Confident77.3Confident53 Ų5343.9 Ų43.936%0.35825%0.248SC..Hα-helixtrans-60.9-45.2-179.4-67.90000112.4L287 L288 F293 L294 L295L287-C291 PolarHBondContact O-N 2.94Å; L287-C291 PolarHBondContact O-SG 3.17Å; L288-C291 PolarHBondContact O-N 2.99Å; C291-F293 VanDerWaalsContact C-N 3.33Å; C291-F293 PolarHBondContact O-N 3.32Å; C291-L294 PolarHBondContact O-N 2.93Å; C291-L295 WeakPolarHBondContact O-CB 3.26Å; C291-L295 VanDerWaalsContact O-CG 3.24Å; C291-L295 WeakPolarHBondContact O-CG 3.41Å; C291-L295 PolarHBondContact O-N 2.92Å
292V83.4Confident79.3Confident51 Ų5147.3 Ų47.331%0.30926%0.255SS..Hα-helixtrans-59.6-47176.6173.80000110.3L288 C290 L294 L295 A296 L328 L335L288-V292 WeakPolarHBondContact O-CG2 3.45Å; L288-V292 PolarHBondContact O-N 3.02Å; C290-V292 PolarHBondContact O-N 3.35Å; V292-L294 PolarHBondContact O-N 3.34Å; V292-L295 PolarHBondContact O-N 3.43Å; V292-A296 WeakPolarHBondContact O-CB 3.41Å; V292-A296 PolarHBondContact O-N 3.3Å; V292-L328 HydrophobicContact CG1-CD1 4.34Å; V292-L335 HydrophobicContact CB-CD1 4.44Å; V292-L335 HydrophobicContact CB-CD2 4.17Å; V292-L335 HydrophobicContact CG1-CD1 3.77Å; V292-L335 HydrophobicContact CG1-CD2 3.94Å; V292-L335 HydrophobicContact CG2-CD2 4.11Å
293F82.2Confident80.9Confident5 Ų545.2 Ų45.22%0.02224%0.239CC..Hα-helixtrans-63.2-44.5-179.3-155.7-85.1000112.7L128 H131 Q204 L208 L289 C290 C291 T297 L328L128-F293 HydrophobicContact CD2-CZ 4.43Å; H131-F293 HydrophobicContact CB-CE2 4.15Å; H131-F293 HydrophobicContact CB-CZ 4.18Å; H131-F293 AromaticContact CD2-CE2 3.97Å; H131-F293 AromaticContact CE1-CE2 3.51Å; H131-F293 AromaticContact CG-CE2 3.49Å; H131-F293 VanDerWaalsContact CG-CE2 3.49Å; H131-F293 AromaticContact CG-CZ 3.86Å; H131-F293 AromaticContact ND1-CE2 3.2Å; H131-F293 WeakPolarHBondContact ND1-CE2 3.37Å; H131-F293 AromaticContact ND1-CZ 3.44Å; H131-F293 WeakPolarHBondContact ND1-CZ 3.26Å; H131-F293 AromaticContact NE2-CE2 3.94Å; Q204-F293 VanDerWaalsContact CD-CE1 3.5Å; Q204-F293 HydrophobicContact CG-CE1 4.17Å; L208-F293 HydrophobicContact CD1-CD1 3.29Å; L208-F293 HydrophobicContact CD1-CE1 3.65Å; L208-F293 HydrophobicContact CD1-CG 3.99Å; L289-F293 WeakPolarHBondContact O-CB 3.43Å; L289-F293 PolarHBondContact O-N 2.9Å; L289-F293 VanDerWaalsContact O-N 3.12Å; C290-F293 PolarHBondContact O-N 3.03Å; C291-F293 VanDerWaalsContact C-N 3.33Å; C291-F293 PolarHBondContact O-N 3.32Å; F293-T297 HydrophobicContact CD1-CG2 3.98Å; F293-T297 HydrophobicContact CE1-CG2 3.59Å; F293-T297 HydrophobicContact CZ-CG2 3.98Å; F293-T297 WeakPolarHBondContact O-CB 3.33Å; F293-T297 VanDerWaalsContact O-CG2 3.31Å; F293-T297 WeakPolarHBondContact O-CG2 3.24Å; F293-T297 PolarHBondContact O-N 2.82Å; F293-T297 VanDerWaalsContact O-N 3.1Å; F293-T297 PolarHBondContact O-OG1 3.29Å; F293-L328 HydrophobicContact CD2-CD1 4.15Å; F293-L328 HydrophobicContact CD2-CD2 3.91Å; F293-L328 HydrophobicContact CD2-CG 4.43Å; F293-L328 HydrophobicContact CE2-CD1 4.45Å; F293-L328 HydrophobicContact CE2-CD2 3.6Å; F293-L328 HydrophobicContact CE2-CG 4.25Å; F293-L328 HydrophobicContact CZ-CD2 3.99Å
294L82.8Confident82.4Confident37 Ų3745.1 Ų45.119%0.19424%0.237CC..Hα-helixtrans-61.5-55176.5-69.1174000110.7T205 C290 C291 V292 A296 T297 Q298T205-L294 HydrophobicContact CG2-CD2 3.31Å; C290-L294 WeakPolarHBondContact O-CB 3.24Å; C290-L294 WeakPolarHBondContact O-CG 3.41Å; C290-L294 PolarHBondContact O-N 3.41Å; C291-L294 PolarHBondContact O-N 2.93Å; V292-L294 PolarHBondContact O-N 3.34Å; L294-A296 VanDerWaalsContact C-N 3.26Å; L294-A296 PolarHBondContact O-N 2.97Å; L294-T297 PolarHBondContact O-N 3.41Å; L294-T297 PolarHBondContact O-OG1 3.46Å; L294-Q298 VanDerWaalsContact O-CG 3.25Å; L294-Q298 WeakPolarHBondContact O-CG 3.36Å; L294-Q298 PolarHBondContact O-N 2.92Å
295L84.1Confident83.7Confident130 Ų13041.9 Ų41.968%0.68122%0.22SC*.Hα-helixtrans-61.9-36.3-177-68.9171.5000112.1C291 V292 P299C291-L295 WeakPolarHBondContact O-CB 3.26Å; C291-L295 VanDerWaalsContact O-CG 3.24Å; C291-L295 WeakPolarHBondContact O-CG 3.41Å; C291-L295 PolarHBondContact O-N 2.92Å; V292-L295 PolarHBondContact O-N 3.43Å; L295-P299 VanDerWaalsContact O-CD 3.26Å; L295-P299 WeakPolarHBondContact O-CD 3.38Å
296A84.9Confident85Confident8 Ų841.7 Ų41.77%0.06622%0.22CC..Hα-helixtrans-72.8-30.6179.300000113.7V292 L294 L324 L328V292-A296 WeakPolarHBondContact O-CB 3.41Å; V292-A296 PolarHBondContact O-N 3.3Å; L294-A296 VanDerWaalsContact C-N 3.26Å; L294-A296 PolarHBondContact O-N 2.97Å; A296-L324 HydrophobicContact CB-CD1 4.31Å; A296-L324 HydrophobicContact CB-CG 4.07Å; A296-L324 WeakPolarHBondContact O-CD2 3.14Å; A296-L324 WeakPolarHBondContact O-CG 3.36Å; A296-L328 HydrophobicContact CB-CB 4.26Å; A296-L328 HydrophobicContact CB-CD1 3.98Å; A296-L328 HydrophobicContact CB-CD2 3.97Å; A296-L328 HydrophobicContact CB-CG 4.31Å
297T86.6Confident86Confident4 Ų442.4 Ų42.43%0.02523%0.226CC..Hα-helixtrans-96.6-24.6-174.8550000114L201 F293 L294 L300 V301 L328L201-T297 HydrophobicContact CD2-CG2 4.23Å; F293-T297 HydrophobicContact CD1-CG2 3.98Å; F293-T297 HydrophobicContact CE1-CG2 3.59Å; F293-T297 HydrophobicContact CZ-CG2 3.98Å; F293-T297 WeakPolarHBondContact O-CB 3.33Å; F293-T297 VanDerWaalsContact O-CG2 3.31Å; F293-T297 WeakPolarHBondContact O-CG2 3.24Å; F293-T297 PolarHBondContact O-N 2.82Å; F293-T297 VanDerWaalsContact O-N 3.1Å; F293-T297 PolarHBondContact O-OG1 3.29Å; L294-T297 PolarHBondContact O-N 3.41Å; L294-T297 PolarHBondContact O-OG1 3.46Å; T297-L300 PolarHBondContact O-N 2.9Å; T297-V301 PolarHBondContact O-N 2.99Å; T297-V301 VanDerWaalsContact O-N 3.12Å; T297-L328 HydrophobicContact CG2-CD2 3.67Å
298Q90.1Very high86.9Confident55 Ų5538.7 Ų38.726%0.25721%0.206SC..Hα-helixtrans-58.1-43.9-178.1-74.1-40.4-81.200114.2L294 L300 V301 W302L294-Q298 VanDerWaalsContact O-CG 3.25Å; L294-Q298 WeakPolarHBondContact O-CG 3.36Å; L294-Q298 PolarHBondContact O-N 2.92Å; Q298-L300 VanDerWaalsContact C-N 3.27Å; Q298-L300 PolarHBondContact O-N 3.45Å; Q298-V301 WeakPolarHBondContact O-CB 3.25Å; Q298-V301 PolarHBondContact O-N 3.24Å; Q298-V301 VanDerWaalsContact O-N 3.15Å; Q298-W302 PolarHBondContact O-N 2.8Å
299P92.4Very high87.7Confident47 Ų4739.8 Ų39.831%0.30521%0.207SC..Hα-helixtrans-58.3-41.2178.1-27.138.1000112.3L295 V301 W302 V303 S321 L324L295-P299 VanDerWaalsContact O-CD 3.26Å; L295-P299 WeakPolarHBondContact O-CD 3.38Å; P299-V301 PolarHBondContact O-N 3.4Å; P299-W302 PolarHBondContact O-N 2.81Å; P299-V303 WeakPolarHBondContact O-CG2 3.4Å; P299-V303 PolarHBondContact O-N 3.15Å; P299-S321 WeakPolarHBondContact CB-OG 3.42Å; P299-L324 HydrophobicContact CG-CD2 3.84Å
300L91Very high88.4Confident8 Ų841.1 Ų41.14%0.04222%0.219CC..Hα-helixtrans-66.9-34.3178.3-169.666.4000112.5L201 T297 Q298 S304 W322 C325L201-L300 HydrophobicContact CD1-CB 4.35Å; L201-L300 HydrophobicContact CD1-CD2 4.02Å; L201-L300 HydrophobicContact CD1-CG 4.11Å; T297-L300 PolarHBondContact O-N 2.9Å; Q298-L300 VanDerWaalsContact C-N 3.27Å; Q298-L300 PolarHBondContact O-N 3.45Å; L300-S304 WeakPolarHBondContact O-CB 3.21Å; L300-S304 PolarHBondContact O-N 3.17Å; L300-S304 PolarHBondContact O-OG 3.14Å; L300-W322 HydrophobicContact CD1-CD2 4.02Å; L300-W322 HydrophobicContact CD1-CE3 4.35Å; L300-W322 HydrophobicContact CD1-CG 4.43Å; L300-W322 HydrophobicContact CD1-CZ2 4.25Å; L300-C325 HydrophobicContact CD2-CB 3.86Å
301V94.1Very high88.8Confident0 Ų045.8 Ų45.80%024%0.243CC..Hα-helixtrans-58.6-52173172.60000110.6L201 L202 T297 Q298 P299 S304 L305L201-V301 HydrophobicContact CB-CG2 3.47Å; L201-V301 VanDerWaalsContact CB-CG2 3.47Å; L201-V301 HydrophobicContact CD1-CG2 3.92Å; L201-V301 HydrophobicContact CG-CG2 4.32Å; L202-V301 HydrophobicContact CD1-CG1 4.28Å; L202-V301 HydrophobicContact CD2-CG1 3.84Å; L202-V301 HydrophobicContact CG-CG1 3.82Å; T297-V301 PolarHBondContact O-N 2.99Å; T297-V301 VanDerWaalsContact O-N 3.12Å; Q298-V301 WeakPolarHBondContact O-CB 3.25Å; Q298-V301 PolarHBondContact O-N 3.24Å; Q298-V301 VanDerWaalsContact O-N 3.15Å; P299-V301 PolarHBondContact O-N 3.4Å; V301-S304 PolarHBondContact O-N 3.35Å; V301-L305 HydrophobicContact CG1-CD1 4.08Å; V301-L305 WeakPolarHBondContact O-CG 3.49Å; V301-L305 PolarHBondContact O-N 2.93Å
302W94Very high89.1Confident171 Ų17149.3 Ų49.365%0.64827%0.265SS*.Hα-helixtrans-67.6-41.7-176.5-67.5114.1000112.3Q298 P299 S304 L305 A306Q298-W302 PolarHBondContact O-N 2.8Å; P299-W302 PolarHBondContact O-N 2.81Å; W302-S304 VanDerWaalsContact C-N 3.32Å; W302-S304 PolarHBondContact O-N 3.31Å; W302-L305 HydrophobicContact CE3-CD1 3.94Å; W302-L305 HydrophobicContact CZ3-CD1 4.07Å; W302-L305 PolarHBondContact O-N 2.91Å; W302-A306 WeakPolarHBondContact O-CB 3.44Å; W302-A306 PolarHBondContact O-N 3.43Å
303V92.8Very high89.3Confident7 Ų748.4 Ų48.44%0.04226%0.26CS..Hα-helixtrans-60-44.9172.8169.60000110.6P299 L305 A306 S307 V313 V317 Q318 S321P299-V303 WeakPolarHBondContact O-CG2 3.4Å; P299-V303 PolarHBondContact O-N 3.15Å; V303-L305 PolarHBondContact O-N 2.87Å; V303-A306 PolarHBondContact O-N 3.44Å; V303-S307 WeakPolarHBondContact O-CB 3.24Å; V303-S307 PolarHBondContact O-N 2.89Å; V303-S307 PolarHBondContact O-OG 3.47Å; V303-V313 HydrophobicContact CG1-CG1 4.41Å; V303-V313 HydrophobicContact CG2-CG1 4.18Å; V303-V317 HydrophobicContact CG2-CG1 3.88Å; V303-Q318 HydrophobicContact CG1-CB 4.37Å; V303-Q318 HydrophobicContact CG1-CG 4.22Å; V303-S321 WeakPolarHBondContact CG2-OG 3.35Å
304S91.9Very high89.6Confident10 Ų1052.2 Ų52.27%0.0729%0.285CS..Hα-helixtrans-66.6-36.7-179.9-58.30000112.8A194 L300 V301 W302 G308A194-S304 WeakPolarHBondContact CB-O 3.39Å; A194-S304 WeakPolarHBondContact O-CB 3.46Å; L300-S304 WeakPolarHBondContact O-CB 3.21Å; L300-S304 PolarHBondContact O-N 3.17Å; L300-S304 PolarHBondContact O-OG 3.14Å; V301-S304 PolarHBondContact O-N 3.35Å; W302-S304 VanDerWaalsContact C-N 3.32Å; W302-S304 PolarHBondContact O-N 3.31Å; S304-G308 WeakPolarHBondContact O-CA 3.35Å; S304-G308 PolarHBondContact O-N 2.9Å
305L94.3Very high89.7Confident45 Ų4556.5 Ų56.524%0.23630%0.299CS..Hα-helixtrans-64.3-48.7172.1-76.6169.8000111.4L195 A198 V301 W302 V303 G308 F309L195-L305 HydrophobicContact CD2-CD2 4.23Å; A198-L305 HydrophobicContact CB-CD2 3.77Å; A198-L305 HydrophobicContact CB-CG 3.7Å; V301-L305 HydrophobicContact CG1-CD1 4.08Å; V301-L305 WeakPolarHBondContact O-CG 3.49Å; V301-L305 PolarHBondContact O-N 2.93Å; W302-L305 HydrophobicContact CE3-CD1 3.94Å; W302-L305 HydrophobicContact CZ3-CD1 4.07Å; W302-L305 PolarHBondContact O-N 2.91Å; V303-L305 PolarHBondContact O-N 2.87Å; L305-G308 WeakPolarHBondContact O-CA 3.44Å; L305-G308 PolarHBondContact O-N 3.03Å; L305-G308 VanDerWaalsContact O-N 3.13Å; L305-F309 WeakPolarHBondContact O-CD2 3.37Å; L305-F309 PolarHBondContact O-N 3.2Å; L305-F309 VanDerWaalsContact O-N 3.13Å
306A92.4Very high89.8Confident21 Ų2151.7 Ų51.717%0.17428%0.281CS..Hα-helixtrans-60.8-48.5179.300000111.4W302 V303 G308 F309 S310 L311 V313W302-A306 WeakPolarHBondContact O-CB 3.44Å; W302-A306 PolarHBondContact O-N 3.43Å; V303-A306 PolarHBondContact O-N 3.44Å; A306-G308 VanDerWaalsContact C-N 3.28Å; A306-G308 PolarHBondContact O-N 2.89Å; A306-F309 CarbonylContact O-C 3.59Å; A306-F309 PolarHBondContact O-N 2.94Å; A306-S310 PolarHBondContact O-N 3.02Å; A306-L311 HydrophobicContact CB-CB 4.14Å; A306-L311 HydrophobicContact CB-CD1 4.5Å; A306-L311 WeakPolarHBondContact O-CB 3.31Å; A306-L311 PolarHBondContact O-N 3.2Å; A306-V313 HydrophobicContact CB-CG2 3.49Å; A306-V313 VanDerWaalsContact CB-CG2 3.49Å
307S89.1Confident90Very high33 Ų3354.9 Ų54.923%0.23130%0.299CS..Hα-helixtrans-59.6-38.8172.9-61.20000111.8H191 V303 F309 S310H191-S307 PolarHBondContact ND1-O 3.35Å; V303-S307 WeakPolarHBondContact O-CB 3.24Å; V303-S307 PolarHBondContact O-N 2.89Å; V303-S307 PolarHBondContact O-OG 3.47Å; S307-F309 VanDerWaalsContact C-N 3.27Å; S307-F309 PolarHBondContact O-N 3.29Å; S307-S310 PolarHBondContact O-N 2.91Å
308G89Confident90.1Very high0 Ų058.6 Ų58.60%032%0.316CS..Hα-helixtrans-54.8-38.3175.200000114.1V190 H191 S304 L305 A306V190-G308 CarbonylContact C-O 3.57Å; V190-G308 WeakPolarHBondContact CA-O 3.46Å; H191-G308 PolarHBondContact N-O 2.98Å; S304-G308 WeakPolarHBondContact O-CA 3.35Å; S304-G308 PolarHBondContact O-N 2.9Å; L305-G308 WeakPolarHBondContact O-CA 3.44Å; L305-G308 PolarHBondContact O-N 3.03Å; L305-G308 VanDerWaalsContact O-N 3.13Å; A306-G308 VanDerWaalsContact C-N 3.28Å; A306-G308 PolarHBondContact O-N 2.89Å
309F91.5Very high90Very high119 Ų11956.8 Ų56.852%0.52231%0.31SS..THydrogen-bonded Turntrans-97.713.2177.1-65.6-69.9000113.8L195 L305 A306 S307 L311L195-F309 HydrophobicContact CD2-CD2 4.2Å; L195-F309 HydrophobicContact CD2-CE2 3.78Å; L195-F309 HydrophobicContact CD2-CZ 4.02Å; L305-F309 WeakPolarHBondContact O-CD2 3.37Å; L305-F309 PolarHBondContact O-N 3.2Å; L305-F309 VanDerWaalsContact O-N 3.13Å; A306-F309 CarbonylContact O-C 3.59Å; A306-F309 PolarHBondContact O-N 2.94Å; S307-F309 VanDerWaalsContact C-N 3.27Å; S307-F309 PolarHBondContact O-N 3.29Å; F309-L311 HydrophobicContact CB-CD1 4.43Å; F309-L311 HydrophobicContact CB-CG 4.13Å; F309-L311 PolarHBondContact O-N 3.31Å
310S88Confident89.9Confident56 Ų5657.2 Ų57.239%0.39232%0.318SS..THydrogen-bonded Turntrans57.728.9-178.2-50.10000113.6P188 R189 H191 A306 S307P188-S310 PolarHBondContact O-OG 3.49Å; R189-S310 PolarHBondContact O-OG 3.27Å; H191-S310 PolarHBondContact CE1-OG 2.93Å; H191-S310 VanDerWaalsContact CE1-OG 3.23Å; H191-S310 PolarHBondContact ND1-OG 3.4Å; A306-S310 PolarHBondContact O-N 3.02Å; S307-S310 PolarHBondContact O-N 2.91Å
311L89.4Confident89.9Confident101 Ų10157 Ų5753%0.52932%0.317SS..  trans-74.9141.7174.1-63.2176.4000109.7A306 F309 V313A306-L311 HydrophobicContact CB-CB 4.14Å; A306-L311 HydrophobicContact CB-CD1 4.5Å; A306-L311 WeakPolarHBondContact O-CB 3.31Å; A306-L311 PolarHBondContact O-N 3.2Å; F309-L311 HydrophobicContact CB-CD1 4.43Å; F309-L311 HydrophobicContact CB-CG 4.13Å; F309-L311 PolarHBondContact O-N 3.31Å; L311-V313 PolarHBondContact O-N 3.47Å
312P87.2Confident89.7Confident127 Ų12760 Ų6083%0.82533%0.328SS*.  trans-66.5122.4178.327.2-33.4000110.2
313V86.9Confident89.6Confident33 Ų3353 Ų5320%0.230%0.303CS..  trans-113.6128.1174.6-178.90000108.6V303 A306 L311 W315 V317 Q318V303-V313 HydrophobicContact CG1-CG1 4.41Å; V303-V313 HydrophobicContact CG2-CG1 4.18Å; A306-V313 HydrophobicContact CB-CG2 3.49Å; A306-V313 VanDerWaalsContact CB-CG2 3.49Å; L311-V313 PolarHBondContact O-N 3.47Å; V313-W315 PolarHBondContact O-N 2.84Å; V313-V317 HydrophobicContact CG1-CB 4.22Å; V313-V317 HydrophobicContact CG1-CG1 4.3Å; V313-Q318 HydrophobicContact CG1-CB 4.32Å
314P89.7Confident89.5Confident84 Ų8455.8 Ų55.855%0.54532%0.318SS..  trans-59.2135.7174.8-22.532.6000111.2G316 V317 Q318P314-G316 PolarHBondContact O-N 3.32Å; P314-G316 VanDerWaalsContact O-N 3.09Å; P314-V317 HydrophobicContact CB-CG2 4.14Å; P314-V317 HydrophobicContact CG-CG2 4.29Å; P314-V317 WeakPolarHBondContact O-CB 3.43Å; P314-V317 PolarHBondContact O-N 3.21Å; P314-Q318 PolarHBondContact O-N 3.46Å
315W84.9Confident89.4Confident128 Ų12856 Ų5649%0.48532%0.319SS..Hα-helixtrans-52.2-39.1-177.179.9-92.5000112.6R30 V34 V313 V317 Q318 A319R30-W315 HydrophobicContact CB-CH2 3.8Å; R30-W315 HydrophobicContact CB-CZ2 3.89Å; R30-W315 HydrophobicContact CB-CZ3 4.45Å; R30-W315 VanDerWaalsContact CD-CZ2 3.48Å; R30-W315 HydrophobicContact CG-CH2 4.07Å; R30-W315 HydrophobicContact CG-CZ2 3.71Å; V34-W315 HydrophobicContact CG2-CZ3 4.26Å; V313-W315 PolarHBondContact O-N 2.84Å; W315-V317 VanDerWaalsContact C-N 3.34Å; W315-V317 PolarHBondContact O-N 2.98Å; W315-Q318 PolarHBondContact O-N 3.15Å; W315-A319 HydrophobicContact CE3-CB 4.01Å; W315-A319 HydrophobicContact CZ3-CB 4Å; W315-A319 WeakPolarHBondContact O-CB 3.42Å; W315-A319 PolarHBondContact O-N 3.12Å
316G85.6Confident89.3Confident29 Ų2953.9 Ų53.930%0.29931%0.308SS..Hα-helixtrans-66.4-36.1-177.700000112.4P314 A320P314-G316 PolarHBondContact O-N 3.32Å; P314-G316 VanDerWaalsContact O-N 3.09Å; G316-A320 WeakPolarHBondContact O-CB 3.29Å; G316-A320 PolarHBondContact O-N 2.99Å
317V89.1Confident89.3Confident74 Ų7453.9 Ų53.945%0.44831%0.308SS..Hα-helixtrans-68.7-41.4175.7178.60000110.1V303 V313 P314 W315 S321V303-V317 HydrophobicContact CG2-CG1 3.88Å; V313-V317 HydrophobicContact CG1-CB 4.22Å; V313-V317 HydrophobicContact CG1-CG1 4.3Å; P314-V317 HydrophobicContact CB-CG2 4.14Å; P314-V317 HydrophobicContact CG-CG2 4.29Å; P314-V317 WeakPolarHBondContact O-CB 3.43Å; P314-V317 PolarHBondContact O-N 3.21Å; W315-V317 VanDerWaalsContact C-N 3.34Å; W315-V317 PolarHBondContact O-N 2.98Å; V317-S321 WeakPolarHBondContact O-CB 3.41Å; V317-S321 PolarHBondContact O-N 3.36Å; V317-S321 PolarHBondContact O-OG 3.38Å
318Q88.6Confident89.3Confident83 Ų8352.9 Ų52.939%0.38830%0.3SS..Hα-helixtrans-63.9-50.8175.6-177.8171.9-9.200111.1V303 V313 P314 W315 A320 S321 W322V303-Q318 HydrophobicContact CG1-CB 4.37Å; V303-Q318 HydrophobicContact CG1-CG 4.22Å; V313-Q318 HydrophobicContact CG1-CB 4.32Å; P314-Q318 PolarHBondContact O-N 3.46Å; W315-Q318 PolarHBondContact O-N 3.15Å; Q318-A320 PolarHBondContact O-N 3.23Å; Q318-S321 PolarHBondContact O-N 2.77Å; Q318-W322 PolarHBondContact O-N 3.13Å
319A87.2Confident89.3Confident17 Ų1753.1 Ų53.114%0.1430%0.302CS..Hα-helixtrans-59.5-46.2178.800000111.9V34 W315 S321 W322 L323V34-A319 HydrophobicContact CG2-CB 4.5Å; W315-A319 HydrophobicContact CE3-CB 4.01Å; W315-A319 HydrophobicContact CZ3-CB 4Å; W315-A319 WeakPolarHBondContact O-CB 3.42Å; W315-A319 PolarHBondContact O-N 3.12Å; A319-S321 VanDerWaalsContact C-N 3.34Å; A319-S321 PolarHBondContact O-N 3.32Å; A319-W322 PolarHBondContact O-N 3.21Å; A319-L323 WeakPolarHBondContact O-CB 3.26Å; A319-L323 VanDerWaalsContact O-CG 3.28Å; A319-L323 WeakPolarHBondContact O-CG 3.36Å; A319-L323 PolarHBondContact O-N 2.89Å
320A90.4Very high89.2Confident56 Ų5647.6 Ų47.646%0.46328%0.278SS..Hα-helixtrans-62-40.7177.400000112.3G316 Q318 L323 L324G316-A320 WeakPolarHBondContact O-CB 3.29Å; G316-A320 PolarHBondContact O-N 2.99Å; Q318-A320 PolarHBondContact O-N 3.23Å; A320-L323 PolarHBondContact O-N 3.2Å; A320-L324 VanDerWaalsContact O-CB 3.29Å; A320-L324 WeakPolarHBondContact O-CB 3.28Å; A320-L324 PolarHBondContact O-N 3.19Å
321S91.3Very high89Confident3 Ų349 Ų492%0.02128%0.281CS..Hα-helixtrans-65.1-41.3178.7-58.90000112P299 V303 V317 Q318 A319 C325P299-S321 WeakPolarHBondContact CB-OG 3.42Å; V303-S321 WeakPolarHBondContact CG2-OG 3.35Å; V317-S321 WeakPolarHBondContact O-CB 3.41Å; V317-S321 PolarHBondContact O-N 3.36Å; V317-S321 PolarHBondContact O-OG 3.38Å; Q318-S321 PolarHBondContact O-N 2.77Å; A319-S321 VanDerWaalsContact C-N 3.34Å; A319-S321 PolarHBondContact O-N 3.32Å; S321-C325 PolarHBondContact O-N 3.13Å; S321-C325 VanDerWaalsContact O-N 3.14Å
322W90.4Very high88.7Confident63 Ų6344.3 Ų44.324%0.23926%0.256CS..Hα-helixtrans-68.6-44.2174.8-79.9108.3000112.6Y38 W84 L120 L124 L300 Q318 A319 L324 C325 C326Y38-W322 WeakPolarHBondContact OH-CB 3.28Å; W84-W322 HydrophobicContact CH2-CE3 4.27Å; L120-W322 HydrophobicContact CD1-CZ3 4.24Å; L120-W322 HydrophobicContact CD2-CH2 3.96Å; L120-W322 HydrophobicContact CD2-CZ3 4.05Å; L124-W322 HydrophobicContact CD1-CH2 4.49Å; L124-W322 HydrophobicContact CD1-CZ3 4Å; L300-W322 HydrophobicContact CD1-CD2 4.02Å; L300-W322 HydrophobicContact CD1-CE3 4.35Å; L300-W322 HydrophobicContact CD1-CG 4.43Å; L300-W322 HydrophobicContact CD1-CZ2 4.25Å; Q318-W322 PolarHBondContact O-N 3.13Å; A319-W322 PolarHBondContact O-N 3.21Å; W322-L324 VanDerWaalsContact C-N 3.26Å; W322-L324 PolarHBondContact O-N 2.84Å; W322-C325 WeakPolarHBondContact O-CB 3.38Å; W322-C325 PolarHBondContact O-N 3.03Å; W322-C326 PolarHBondContact O-N 3.29Å; W322-C326 PolarHBondContact O-SG 3.44Å
323L91.4Very high88.2Confident24 Ų2438.4 Ų38.413%0.12622%0.218CC..Hα-helixtrans-60.2-37.4175.6-76.1170000111.9V34 L37 Y38 L41 A319 A320 C326 A327V34-L323 HydrophobicContact CG1-CD1 4.37Å; L37-L323 HydrophobicContact CB-CD2 3.86Å; L37-L323 HydrophobicContact CD1-CD1 3.91Å; Y38-L323 HydrophobicContact CD1-CD2 4.15Å; Y38-L323 HydrophobicContact CD2-CD2 4.13Å; Y38-L323 HydrophobicContact CE1-CD2 4.07Å; Y38-L323 HydrophobicContact CE2-CD2 4.07Å; Y38-L323 HydrophobicContact CG-CD2 4.17Å; L41-L323 HydrophobicContact CD1-CD2 4.19Å; A319-L323 WeakPolarHBondContact O-CB 3.26Å; A319-L323 VanDerWaalsContact O-CG 3.28Å; A319-L323 WeakPolarHBondContact O-CG 3.36Å; A319-L323 PolarHBondContact O-N 2.89Å; A320-L323 PolarHBondContact O-N 3.2Å; L323-C326 WeakPolarHBondContact O-CB 3.34Å; L323-C326 PolarHBondContact O-N 2.9Å; L323-A327 WeakPolarHBondContact O-CB 3.39Å; L323-A327 PolarHBondContact O-N 2.91Å
324L92Very high87.6Confident66 Ų6640.5 Ų40.535%0.34623%0.227SC..Hα-helixtrans-68-39.1176.4-171.760.1000112.1A296 P299 A320 W322 C326 A327 L328A296-L324 HydrophobicContact CB-CD1 4.31Å; A296-L324 HydrophobicContact CB-CG 4.07Å; A296-L324 WeakPolarHBondContact O-CD2 3.14Å; A296-L324 WeakPolarHBondContact O-CG 3.36Å; P299-L324 HydrophobicContact CG-CD2 3.84Å; A320-L324 VanDerWaalsContact O-CB 3.29Å; A320-L324 WeakPolarHBondContact O-CB 3.28Å; A320-L324 PolarHBondContact O-N 3.19Å; W322-L324 VanDerWaalsContact C-N 3.26Å; W322-L324 PolarHBondContact O-N 2.84Å; L324-C326 VanDerWaalsContact C-N 3.33Å; L324-A327 PolarHBondContact O-N 2.83Å; L324-L328 PolarHBondContact O-N 2.94Å
325C89.9Confident86.8Confident13 Ų1338.7 Ų38.79%0.08821%0.213CC..Hα-helixtrans-63.7-39.1171.8-175.90000112.1L300 S321 W322 L328 S329L300-C325 HydrophobicContact CD2-CB 3.86Å; S321-C325 PolarHBondContact O-N 3.13Å; S321-C325 VanDerWaalsContact O-N 3.14Å; W322-C325 WeakPolarHBondContact O-CB 3.38Å; W322-C325 PolarHBondContact O-N 3.03Å; C325-L328 WeakPolarHBondContact O-CB 3.29Å; C325-L328 PolarHBondContact O-N 3.38Å; C325-S329 PolarHBondContact O-N 2.98Å; C325-S329 PolarHBondContact O-OG 3.5Å; C325-S329 VanDerWaalsContact O-OG 3.05Å
326C91.6Very high86.1Confident2 Ų234 Ų341%0.01420%0.196CC..Hα-helixtrans-67.4-42.4175.6-66.80000111.8Y38 L41 M85 W322 L323 L324 L328 S329 A330Y38-C326 HydrophobicContact CE1-CB 4.37Å; Y38-C326 VanDerWaalsContact CE1-SG 3.56Å; L41-C326 HydrophobicContact CD1-CB 3.81Å; M85-C326 VanDerWaalsContact CE-CA 3.49Å; M85-C326 HydrophobicContact CE-CB 3.39Å; M85-C326 WeakPolarHBondContact CE-O 3.38Å; M85-C326 HydrophobicContact SD-CB 3.98Å; W322-C326 PolarHBondContact O-N 3.29Å; W322-C326 PolarHBondContact O-SG 3.44Å; L323-C326 WeakPolarHBondContact O-CB 3.34Å; L323-C326 PolarHBondContact O-N 2.9Å; L324-C326 VanDerWaalsContact C-N 3.33Å; C326-L328 VanDerWaalsContact C-N 3.28Å; C326-L328 PolarHBondContact O-N 2.84Å; C326-S329 PolarHBondContact O-N 3.48Å; C326-A330 WeakPolarHBondContact O-CB 3.32Å; C326-A330 PolarHBondContact O-N 3.46Å
327A91.4Very high85.6Confident21 Ų2133.4 Ų33.417%0.17419%0.186CC..Hα-helixtrans-60.4-39.7173.500000111.4L41 L323 L324 A330 L331L41-A327 HydrophobicContact CD1-CB 4.42Å; L41-A327 HydrophobicContact CD2-CB 4.09Å; L323-A327 WeakPolarHBondContact O-CB 3.39Å; L323-A327 PolarHBondContact O-N 2.91Å; L324-A327 PolarHBondContact O-N 2.83Å; A327-A330 PolarHBondContact O-N 2.97Å; A327-L331 HydrophobicContact CB-CD1 4.49Å; A327-L331 VanDerWaalsContact O-CB 3.24Å; A327-L331 WeakPolarHBondContact O-CB 3.18Å; A327-L331 WeakPolarHBondContact O-CG 3.2Å; A327-L331 PolarHBondContact O-N 3.42Å
328L89.1Confident84.9Confident12 Ų1233.6 Ų33.66%0.06318%0.179CC..Hα-helixtrans-59.7-50.2173.8-170.363.2000110.8V292 F293 A296 T297 L324 C325 C326 A330 L331 N332 L335V292-L328 HydrophobicContact CG1-CD1 4.34Å; F293-L328 HydrophobicContact CD2-CD1 4.15Å; F293-L328 HydrophobicContact CD2-CD2 3.91Å; F293-L328 HydrophobicContact CD2-CG 4.43Å; F293-L328 HydrophobicContact CE2-CD1 4.45Å; F293-L328 HydrophobicContact CE2-CD2 3.6Å; F293-L328 HydrophobicContact CE2-CG 4.25Å; F293-L328 HydrophobicContact CZ-CD2 3.99Å; A296-L328 HydrophobicContact CB-CB 4.26Å; A296-L328 HydrophobicContact CB-CD1 3.98Å; A296-L328 HydrophobicContact CB-CD2 3.97Å; A296-L328 HydrophobicContact CB-CG 4.31Å; T297-L328 HydrophobicContact CG2-CD2 3.67Å; L324-L328 PolarHBondContact O-N 2.94Å; C325-L328 WeakPolarHBondContact O-CB 3.29Å; C325-L328 PolarHBondContact O-N 3.38Å; C326-L328 VanDerWaalsContact C-N 3.28Å; C326-L328 PolarHBondContact O-N 2.84Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 3.38Å; L328-L331 PolarHBondContact O-N 2.96Å; L328-N332 WeakPolarHBondContact O-CB 3.48Å; L328-N332 PolarHBondContact O-N 3.3Å; L328-N332 PolarHBondContact O-ND2 3.35Å; L328-N332 PolarHBondContact O-OD1 3.38Å; L328-L335 HydrophobicContact CD1-CD1 4.1Å
329S90.9Very high84Confident4 Ų436 Ų363%0.02818%0.184CC..Hα-helixtrans-58.9-36.9177.3-52.20000112.8N49 D77 C325 C326N49-S329 PolarHBondContact ND2-O 3.38Å; D77-S329 WeakPolarHBondContact CB-O 3.46Å; C325-S329 PolarHBondContact O-N 2.98Å; C325-S329 PolarHBondContact O-OG 3.5Å; C325-S329 VanDerWaalsContact O-OG 3.05Å; C326-S329 PolarHBondContact O-N 3.48Å
330A88.8Confident83.5Confident4 Ų437.5 Ų37.53%0.03319%0.19CC..Hα-helixtrans-74.3-34.9177.400000113.4L41 C326 A327 L328L41-A330 HydrophobicContact CD2-CB 4.2Å; C326-A330 WeakPolarHBondContact O-CB 3.32Å; C326-A330 PolarHBondContact O-N 3.46Å; A327-A330 PolarHBondContact O-N 2.97Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 3.38Å
331L84.3Confident83Confident85 Ų8537.7 Ų37.745%0.44518%0.181SC..Hα-helixtrans-100.8-7.6-171.1-59.9173.1000114A327 L328 P333 L334 L335A327-L331 HydrophobicContact CB-CD1 4.49Å; A327-L331 VanDerWaalsContact O-CB 3.24Å; A327-L331 WeakPolarHBondContact O-CB 3.18Å; A327-L331 WeakPolarHBondContact O-CG 3.2Å; A327-L331 PolarHBondContact O-N 3.42Å; L328-L331 PolarHBondContact O-N 2.96Å; L331-P333 VanDerWaalsContact C-CD 3.47Å; L331-P333 VanDerWaalsContact C-N 3.32Å; L331-L334 HydrophobicContact CD2-CD1 3.82Å; L331-L334 WeakPolarHBondContact O-CB 3.45Å; L331-L334 PolarHBondContact O-N 3.3Å; L331-L335 PolarHBondContact O-N 2.85Å
332N81.9Confident82.6Confident3 Ų340.9 Ų40.92%0.01620%0.196CC..Hα-helixtrans-47.1-46.3174.5-77.1-24.1000113.4D77 H131 L328 L334 L335 Y336D77-N332 WeakPolarHBondContact OD2-CB 3.4Å; D77-N332 PolarHBondContact OD2-ND2 2.9Å; H131-N332 PolarHBondContact CE1-ND2 3.37Å; H131-N332 PolarHBondContact NE2-ND2 3.36Å; L328-N332 WeakPolarHBondContact O-CB 3.48Å; L328-N332 PolarHBondContact O-N 3.3Å; L328-N332 PolarHBondContact O-ND2 3.35Å; L328-N332 PolarHBondContact O-OD1 3.38Å; N332-L334 VanDerWaalsContact C-N 3.27Å; N332-L334 PolarHBondContact O-N 2.79Å; N332-L335 WeakPolarHBondContact O-CB 3.46Å; N332-L335 PolarHBondContact O-N 2.87Å; N332-Y336 HydrophobicContact CB-CE2 4.38Å; N332-Y336 WeakPolarHBondContact O-CD2 3.49Å; N332-Y336 PolarHBondContact O-N 2.97Å
333P77.1Confident82.2Confident2 Ų238 Ų381%0.01319%0.185CC..Hα-helixtrans-44.9-48.2171-37.441.1000114.6A48 N49 V52 L331 Y336 T337A48-P333 HydrophobicContact CB-CB 4.15Å; A48-P333 HydrophobicContact CB-CG 4.06Å; N49-P333 HydrophobicContact CB-CG 4.23Å; N49-P333 WeakPolarHBondContact OD1-CD 3.32Å; N49-P333 WeakPolarHBondContact OD1-CG 3.43Å; V52-P333 HydrophobicContact CG2-CB 3.63Å; V52-P333 HydrophobicContact CG2-CG 4.36Å; L331-P333 VanDerWaalsContact C-CD 3.47Å; L331-P333 VanDerWaalsContact C-N 3.32Å; P333-Y336 PolarHBondContact O-N 3.13Å; P333-T337 VanDerWaalsContact O-CB 3.3Å; P333-T337 WeakPolarHBondContact O-CB 3.26Å; P333-T337 VanDerWaalsContact O-CG2 3.26Å; P333-T337 WeakPolarHBondContact O-CG2 3.39Å; P333-T337 PolarHBondContact O-N 3.06Å; P333-T337 PolarHBondContact O-OG1 3.47Å
334L73.3Confident81.9Confident77 Ų7741.9 Ų41.940%0.40320%0.198SC..Hα-helixtrans-70.1-40.7-175.4-62.5174.1000110.9L331 N332 Y336 T337 W338L331-L334 HydrophobicContact CD2-CD1 3.82Å; L331-L334 WeakPolarHBondContact O-CB 3.45Å; L331-L334 PolarHBondContact O-N 3.3Å; N332-L334 VanDerWaalsContact C-N 3.27Å; N332-L334 PolarHBondContact O-N 2.79Å; L334-Y336 VanDerWaalsContact C-N 3.26Å; L334-Y336 PolarHBondContact O-N 3.48Å; L334-T337 PolarHBondContact O-N 3.43Å; L334-W338 WeakPolarHBondContact O-CB 3.4Å; L334-W338 PolarHBondContact O-N 2.94Å
335L72.9Confident81.6Confident46 Ų4644.4 Ų44.424%0.24120%0.203CC..Hα-helixtrans-54.4-43.5177.5-70.4178.6000111.6L289 V292 L328 L331 N332L289-L335 HydrophobicContact CD1-CB 3.58Å; L289-L335 HydrophobicContact CD1-CD2 4.3Å; L289-L335 HydrophobicContact CD1-CG 4.45Å; L289-L335 WeakPolarHBondContact CD1-O 3.44Å; V292-L335 HydrophobicContact CB-CD1 4.44Å; V292-L335 HydrophobicContact CB-CD2 4.17Å; V292-L335 HydrophobicContact CG1-CD1 3.77Å; V292-L335 HydrophobicContact CG1-CD2 3.94Å; V292-L335 HydrophobicContact CG2-CD2 4.11Å; L328-L335 HydrophobicContact CD1-CD1 4.1Å; L331-L335 PolarHBondContact O-N 2.85Å; N332-L335 WeakPolarHBondContact O-CB 3.46Å; N332-L335 PolarHBondContact O-N 2.87Å
336Y71.4Confident81.4Confident31 Ų3144.2 Ų44.212%0.12220%0.201CC..Hα-helixtrans-86.5-32.4-177.6-62.6-68.5000114.5I70 H131 V134 L289 N332 P333 L334I70-Y336 HydrophobicContact CD1-CG 4.36Å; I70-Y336 HydrophobicContact CG1-CG 4.3Å; I70-Y336 HydrophobicContact CG2-CD2 4.41Å; I70-Y336 HydrophobicContact CG2-CG 4.46Å; H131-Y336 AromaticContact CD2-CZ 3.87Å; H131-Y336 PolarHBondContact CD2-OH 3.16Å; V134-Y336 HydrophobicContact CB-CE1 4.49Å; V134-Y336 HydrophobicContact CG1-CD1 4.07Å; V134-Y336 HydrophobicContact CG1-CE1 3.59Å; L289-Y336 HydrophobicContact CD2-CD1 3.79Å; L289-Y336 HydrophobicContact CD2-CE1 3.39Å; L289-Y336 HydrophobicContact CG-CE1 4.23Å; N332-Y336 HydrophobicContact CB-CE2 4.38Å; N332-Y336 WeakPolarHBondContact O-CD2 3.49Å; N332-Y336 PolarHBondContact O-N 2.97Å; P333-Y336 PolarHBondContact O-N 3.13Å; L334-Y336 VanDerWaalsContact C-N 3.26Å; L334-Y336 PolarHBondContact O-N 3.48Å
337T74.7Confident81.1Confident16 Ų1645.4 Ų45.410%0.09821%0.208CC..Hα-helixtrans-98.7-26.5-168.464.20000113.9V52 P333 L334 R339 N340 F343V52-T337 HydrophobicContact CG1-CG2 4.23Å; V52-T337 HydrophobicContact CG2-CG2 3.82Å; P333-T337 VanDerWaalsContact O-CB 3.3Å; P333-T337 WeakPolarHBondContact O-CB 3.26Å; P333-T337 VanDerWaalsContact O-CG2 3.26Å; P333-T337 WeakPolarHBondContact O-CG2 3.39Å; P333-T337 PolarHBondContact O-N 3.06Å; P333-T337 PolarHBondContact O-OG1 3.47Å; L334-T337 PolarHBondContact O-N 3.43Å; T337-R339 VanDerWaalsContact C-N 3.27Å; T337-R339 PolarHBondContact O-N 2.77Å; T337-R339 VanDerWaalsContact O-N 3.14Å; T337-N340 PolarHBondContact O-N 2.94Å; T337-F343 HydrophobicContact CG2-CD1 3.57Å; T337-F343 HydrophobicContact CG2-CD2 4.12Å; T337-F343 HydrophobicContact CG2-CE1 3.59Å; T337-F343 HydrophobicContact CG2-CE2 4.12Å; T337-F343 HydrophobicContact CG2-CG 3.83Å; T337-F343 HydrophobicContact CG2-CZ 3.86Å
338W73.9Confident80.8Confident77 Ų7749.5 Ų49.529%0.29222%0.219SC..THydrogen-bonded Turntrans-55-39.9-173.6-178.2-89.1000113.7L334 R344 A358 A359 V362L334-W338 WeakPolarHBondContact O-CB 3.4Å; L334-W338 PolarHBondContact O-N 2.94Å; W338-R344 WeakPolarHBondContact O-CD 3.07Å; W338-A358 HydrophobicContact CH2-CB 4.07Å; W338-A358 WeakPolarHBondContact CH2-O 3.45Å; W338-A358 HydrophobicContact CZ3-CB 3.91Å; W338-A359 HydrophobicContact CH2-CB 4.47Å; W338-V362 HydrophobicContact CD2-CG2 4.15Å; W338-V362 HydrophobicContact CE3-CG2 4.01Å; W338-V362 HydrophobicContact CH2-CB 3.68Å; W338-V362 HydrophobicContact CH2-CG1 4.44Å; W338-V362 HydrophobicContact CH2-CG2 3.28Å; W338-V362 HydrophobicContact CZ2-CB 3.35Å; W338-V362 HydrophobicContact CZ2-CG1 3.69Å; W338-V362 HydrophobicContact CZ2-CG2 3.39Å; W338-V362 HydrophobicContact CZ3-CB 4.44Å; W338-V362 HydrophobicContact CZ3-CG2 3.57Å
339R70.6Confident80.6Confident135 Ų13552.5 Ų52.551%0.50924%0.241SC..THydrogen-bonded Turntrans-92-3.4-179-69.6-162.4172.9-163-1.2114.1S285 T337 E341S285-R339 WeakPolarHBondContact OG-CD 3.24Å; S285-R339 PolarHBondContact OG-NH1 3.44Å; T337-R339 VanDerWaalsContact C-N 3.27Å; T337-R339 PolarHBondContact O-N 2.77Å; T337-R339 VanDerWaalsContact O-N 3.14Å; R339-E341 PolarHBondContact O-N 3.35Å
340N76.2Confident80.4Confident48 Ų4855 Ų5526%0.25726%0.256SS..  trans-88.6111.4178.7-171.5-27.8000110.1T337 E342 F343 R344T337-N340 PolarHBondContact O-N 2.94Å; N340-E342 VanDerWaalsContact C-N 3.28Å; N340-E342 PolarHBondContact O-N 3.01Å; N340-E342 PolarHBondContact OD1-N 3.46Å; N340-F343 HydrophobicContact CB-CB 4.14Å; N340-F343 HydrophobicContact CB-CD2 3.75Å; N340-F343 HydrophobicContact CB-CG 4.41Å; N340-F343 WeakPolarHBondContact ND2-CD2 3.21Å; N340-F343 WeakPolarHBondContact O-CB 3.18Å; N340-F343 PolarHBondContact O-N 2.81Å; N340-F343 VanDerWaalsContact O-N 3.1Å; N340-R344 PolarHBondContact O-N 3.26Å
341E79.8Confident80Confident59 Ų5958 Ų5828%0.27627%0.272SS..Hα-helixtrans-57.2-39.9-178.4-173.260.8-152.500113R339 F343 R344 R345 R348R339-E341 PolarHBondContact O-N 3.35Å; E341-F343 VanDerWaalsContact C-N 3.32Å; E341-F343 PolarHBondContact O-N 3.25Å; E341-R344 PolarHBondContact O-N 3.21Å; E341-R344 IonicContact OE2-CZ 2.67Å; E341-R344 VanDerWaalsContact OE2-CZ 3.23Å; E341-R344 IonicContact OE2-NE 2.66Å; E341-R344 PolarHBondContact OE2-NE 2.7Å; E341-R344 IonicContact OE2-NH2 3.88Å; E341-R344 PolarHBondContact OE2-NH2 3.24Å; E341-R345 WeakPolarHBondContact O-CG 3.49Å; E341-R345 PolarHBondContact O-N 3.18Å; E341-R345 IonicContact OE1-CZ 3.48Å; E341-R345 IonicContact OE1-NE 3.88Å; E341-R345 PolarHBondContact OE1-NE 3.37Å; E341-R345 IonicContact OE1-NH2 3.18Å; E341-R348 IonicContact OE1-NH2 2.74Å; E341-R348 PolarHBondContact OE1-NH2 3.26Å
342E82.3Confident79.1Confident70 Ų7059.6 Ų59.633%0.32729%0.287SS..Hα-helixtrans-66.1-36.8179-61.8-59.615300111.3L62 N340 R345 S346L62-E342 HydrophobicContact CD2-CB 3.63Å; N340-E342 VanDerWaalsContact C-N 3.28Å; N340-E342 PolarHBondContact O-N 3.01Å; N340-E342 PolarHBondContact OD1-N 3.46Å; E342-R345 VanDerWaalsContact CD-NH1 3.29Å; E342-R345 IonicContact OE1-NH1 3.9Å; E342-R345 PolarHBondContact OE1-NH1 2.79Å; E342-R345 IonicContact OE2-NH1 3.04Å; E342-R345 PolarHBondContact OE2-NH1 2.9Å; E342-S346 WeakPolarHBondContact O-CB 3.47Å; E342-S346 PolarHBondContact O-N 3.47Å; E342-S346 PolarHBondContact O-OG 3.22Å
343F83.6Confident78Confident2 Ų261.8 Ų61.81%0.00931%0.31CS..Hα-helixtrans-65.2-46.9171.8-88.4-84.6000111V52 L55 V56 L62 T337 N340 E341 R345 S346 V347V52-F343 HydrophobicContact CG1-CE1 4.15Å; L55-F343 HydrophobicContact CB-CD1 4.48Å; L55-F343 HydrophobicContact CB-CE1 4.42Å; L55-F343 HydrophobicContact CD1-CD1 4.27Å; V56-F343 HydrophobicContact CG2-CE1 3.69Å; V56-F343 HydrophobicContact CG2-CZ 3.45Å; V56-F343 VanDerWaalsContact CG2-CZ 3.45Å; L62-F343 HydrophobicContact CD1-CD1 3.9Å; L62-F343 HydrophobicContact CD1-CD2 4.46Å; L62-F343 HydrophobicContact CD1-CE1 3.95Å; L62-F343 HydrophobicContact CD1-CG 4.18Å; L62-F343 HydrophobicContact CD1-CZ 4.29Å; L62-F343 HydrophobicContact CD2-CD2 3.8Å; L62-F343 HydrophobicContact CD2-CE2 3.94Å; L62-F343 HydrophobicContact CD2-CG 4.21Å; L62-F343 HydrophobicContact CD2-CZ 4.44Å; T337-F343 HydrophobicContact CG2-CD1 3.57Å; T337-F343 HydrophobicContact CG2-CD2 4.12Å; T337-F343 HydrophobicContact CG2-CE1 3.59Å; T337-F343 HydrophobicContact CG2-CE2 4.12Å; T337-F343 HydrophobicContact CG2-CG 3.83Å; T337-F343 HydrophobicContact CG2-CZ 3.86Å; N340-F343 HydrophobicContact CB-CB 4.14Å; N340-F343 HydrophobicContact CB-CD2 3.75Å; N340-F343 HydrophobicContact CB-CG 4.41Å; N340-F343 WeakPolarHBondContact ND2-CD2 3.21Å; N340-F343 WeakPolarHBondContact O-CB 3.18Å; N340-F343 PolarHBondContact O-N 2.81Å; N340-F343 VanDerWaalsContact O-N 3.1Å; E341-F343 VanDerWaalsContact C-N 3.32Å; E341-F343 PolarHBondContact O-N 3.25Å; F343-R345 VanDerWaalsContact C-N 3.3Å; F343-R345 PolarHBondContact O-N 3.17Å; F343-S346 PolarHBondContact O-N 3.28Å; F343-S346 VanDerWaalsContact O-N 3.12Å; F343-V347 WeakPolarHBondContact O-CG2 3.22Å; F343-V347 PolarHBondContact O-N 3.46Å
344R83.6Confident77.1Confident107 Ų10765.1 Ų65.140%0.40433%0.331SS..Hα-helixtrans-61.2-37178.6-66.3-162.5-62.7158.6-9.3113.1W338 N340 E341 R348W338-R344 WeakPolarHBondContact O-CD 3.07Å; N340-R344 PolarHBondContact O-N 3.26Å; E341-R344 PolarHBondContact O-N 3.21Å; E341-R344 IonicContact OE2-CZ 2.67Å; E341-R344 VanDerWaalsContact OE2-CZ 3.23Å; E341-R344 IonicContact OE2-NE 2.66Å; E341-R344 PolarHBondContact OE2-NE 2.7Å; E341-R344 IonicContact OE2-NH2 3.88Å; E341-R344 PolarHBondContact OE2-NH2 3.24Å; R344-R348 WeakPolarHBondContact O-CG 3.49Å; R344-R348 PolarHBondContact O-N 3.36Å; R344-R348 VanDerWaalsContact O-N 3.11Å; R344-R348 PolarHBondContact O-NE 3.36Å
345R85.8Confident76Confident119 Ų11962.4 Ų62.445%0.44932%0.321SS..Hα-helixtrans-66.9-43.6173.6-71.6-177-164.3129.8-3.7111.3E341 E342 F343 R348 S349E341-R345 WeakPolarHBondContact O-CG 3.49Å; E341-R345 PolarHBondContact O-N 3.18Å; E341-R345 IonicContact OE1-CZ 3.48Å; E341-R345 IonicContact OE1-NE 3.88Å; E341-R345 PolarHBondContact OE1-NE 3.37Å; E341-R345 IonicContact OE1-NH2 3.18Å; E342-R345 VanDerWaalsContact CD-NH1 3.29Å; E342-R345 IonicContact OE1-NH1 3.9Å; E342-R345 PolarHBondContact OE1-NH1 2.79Å; E342-R345 IonicContact OE2-NH1 3.04Å; E342-R345 PolarHBondContact OE2-NH1 2.9Å; F343-R345 VanDerWaalsContact C-N 3.3Å; F343-R345 PolarHBondContact O-N 3.17Å; R345-R348 PolarHBondContact O-N 3.06Å; R345-S349 PolarHBondContact O-N 2.75Å
346S86.3Confident75Confident8 Ų865.8 Ų65.86%0.05634%0.339CS..Hα-helixtrans-63.7-42.8178.3-550000111.6E342 F343 S349 V350E342-S346 WeakPolarHBondContact O-CB 3.47Å; E342-S346 PolarHBondContact O-N 3.47Å; E342-S346 PolarHBondContact O-OG 3.22Å; F343-S346 PolarHBondContact O-N 3.28Å; F343-S346 VanDerWaalsContact O-N 3.12Å; S346-S349 WeakPolarHBondContact CA-OG 3.47Å; S346-S349 PolarHBondContact O-N 3.09Å; S346-S349 PolarHBondContact O-OG 3.42Å; S346-V350 WeakPolarHBondContact O-CG2 3.43Å; S346-V350 PolarHBondContact O-N 3Å
347V85.3Confident73.9Confident27 Ų2767.3 Ų67.316%0.16436%0.359CS..Hα-helixtrans-57.9-50.5172.8172.30000110.7L55 F343 S349 V350 L351L55-V347 HydrophobicContact CD1-CG2 3.47Å; L55-V347 VanDerWaalsContact CD1-CG2 3.47Å; F343-V347 WeakPolarHBondContact O-CG2 3.22Å; F343-V347 PolarHBondContact O-N 3.46Å; V347-S349 PolarHBondContact O-N 3.45Å; V347-V350 PolarHBondContact O-N 2.79Å; V347-V350 VanDerWaalsContact O-N 3.08Å; V347-L351 PolarHBondContact O-N 2.83Å
348R85.1Confident72.5Confident107 Ų10768.3 Ų68.340%0.40437%0.368SS..Hα-helixtrans-60-32.2178.8-79.9-179-74.2172-5.5113.2E341 R344 R345E341-R348 IonicContact OE1-NH2 2.74Å; E341-R348 PolarHBondContact OE1-NH2 3.26Å; R344-R348 WeakPolarHBondContact O-CG 3.49Å; R344-R348 PolarHBondContact O-N 3.36Å; R344-R348 VanDerWaalsContact O-N 3.11Å; R344-R348 PolarHBondContact O-NE 3.36Å; R345-R348 PolarHBondContact O-N 3.06Å
349S85.9Confident71.2Confident75 Ų7566.5 Ų66.552%0.52437%0.37SS..Hα-helixtrans-74.6-24.9176.765.70000114.1F59 R345 S346 V347F59-S349 WeakPolarHBondContact CZ-OG 3.39Å; R345-S349 PolarHBondContact O-N 2.75Å; S346-S349 WeakPolarHBondContact CA-OG 3.47Å; S346-S349 PolarHBondContact O-N 3.09Å; S346-S349 PolarHBondContact O-OG 3.42Å; V347-S349 PolarHBondContact O-N 3.45Å
350V84.8Confident69.9Low56 Ų5662.8 Ų62.834%0.33937%0.368SS..Hα-helixtrans-93.2-36.8179.5176.20000111.4Y54 L55 F59 S346 V347Y54-V350 HydrophobicContact CE1-CG1 3.85Å; Y54-V350 HydrophobicContact CE1-CG2 3.95Å; L55-V350 HydrophobicContact CD2-CG2 3.87Å; F59-V350 HydrophobicContact CE2-CG2 3.82Å; F59-V350 HydrophobicContact CZ-CG2 3.97Å; S346-V350 WeakPolarHBondContact O-CG2 3.43Å; S346-V350 PolarHBondContact O-N 3Å; V347-V350 PolarHBondContact O-N 2.79Å; V347-V350 VanDerWaalsContact O-N 3.08Å
351L81.5Confident68.3Low69 Ų6963.2 Ų63.236%0.36138%0.378SS..SBendtrans-126.177.4-179.6-69.3165000109.3M51 V347 G353 V354M51-L351 HydrophobicContact SD-CD1 4.1Å; V347-L351 PolarHBondContact O-N 2.83Å; L351-G353 PolarHBondContact O-N 3.38Å; L351-V354 HydrophobicContact CB-CB 3.98Å; L351-V354 HydrophobicContact CB-CG2 3.92Å; L351-V354 HydrophobicContact CD1-CB 4.43Å; L351-V354 HydrophobicContact CD1-CG2 4.31Å; L351-V354 HydrophobicContact CD2-CG2 4.46Å; L351-V354 HydrophobicContact CG-CG2 4.47Å; L351-V354 PolarHBondContact O-N 3.43Å
352P65.2Low66.7Low118 Ų11863.2 Ų63.277%0.76638%0.382SS*.THydrogen-bonded Turntrans-60.2109.1173.924.8-32.9000109.2
353G59.5Low64.8Low49 Ų4963 Ų6351%0.50539%0.393SS..THydrogen-bonded Turntrans120.7-25.9179.100000116.4L351L351-G353 PolarHBondContact O-N 3.38Å
354V57.7Low62.8Low72 Ų7266.9 Ų66.944%0.43643%0.425SS..Hα-helixtrans-78.9-29.4-179.31760000112.2L351 D356 A357 A358L351-V354 HydrophobicContact CB-CB 3.98Å; L351-V354 HydrophobicContact CB-CG2 3.92Å; L351-V354 HydrophobicContact CD1-CB 4.43Å; L351-V354 HydrophobicContact CD1-CG2 4.31Å; L351-V354 HydrophobicContact CD2-CG2 4.46Å; L351-V354 HydrophobicContact CG-CG2 4.47Å; L351-V354 PolarHBondContact O-N 3.43Å; V354-D356 PolarHBondContact O-N 2.89Å; V354-A357 PolarHBondContact O-N 3Å; V354-A358 WeakPolarHBondContact O-CB 3.3Å; V354-A358 PolarHBondContact O-N 2.97Å
355G50.3Low60.6Low20 Ų2067.1 Ų67.121%0.20644%0.439CS..Hα-helixtrans-61-32.1179.700000113.8A359G355-A359 WeakPolarHBondContact O-CB 3.39Å; G355-A359 PolarHBondContact O-N 3.48Å
356D51.1Low58.3Low116 Ų11664.3 Ų64.362%0.6244%0.441SS*.Hα-helixtrans-82.2-37.4-179.8-60.1-34.6000111.3V354 A359 A360V354-D356 PolarHBondContact O-N 2.89Å; D356-A359 PolarHBondContact O-N 3.2Å; D356-A360 VanDerWaalsContact O-CB 3.28Å; D356-A360 WeakPolarHBondContact O-CB 3.2Å; D356-A360 PolarHBondContact O-N 3.1Å
357A48Very low55.8Low64 Ų6469.8 Ų69.853%0.52947%0.473SS..Hα-helixtrans-68.9-43.2176.100000112.8V354 A360 A361V354-A357 PolarHBondContact O-N 3Å; A357-A360 PolarHBondContact O-N 2.75Å; A357-A361 WeakPolarHBondContact O-CB 3.48Å; A357-A361 PolarHBondContact O-N 3.48Å
358A45.5Very low53.5Low36 Ų3674 Ų7430%0.29850%0.501SS..Hα-helixtrans-64.6-43.8175.100000110.3W338 V354 A360 A361 V362W338-A358 HydrophobicContact CH2-CB 4.07Å; W338-A358 WeakPolarHBondContact CH2-O 3.45Å; W338-A358 HydrophobicContact CZ3-CB 3.91Å; V354-A358 WeakPolarHBondContact O-CB 3.3Å; V354-A358 PolarHBondContact O-N 2.97Å; A358-A360 VanDerWaalsContact C-N 3.29Å; A358-A360 PolarHBondContact O-N 2.97Å; A358-A361 PolarHBondContact O-N 3.45Å; A358-V362 PolarHBondContact O-N 3.45Å
359A46.5Very low51.3Low39 Ų3973.2 Ų73.232%0.32252%0.518SS..Hα-helixtrans-61.8-38.4178.200000111.8W338 G355 D356 A363W338-A359 HydrophobicContact CH2-CB 4.47Å; G355-A359 WeakPolarHBondContact O-CB 3.39Å; G355-A359 PolarHBondContact O-N 3.48Å; D356-A359 PolarHBondContact O-N 3.2Å; A359-A363 VanDerWaalsContact O-CB 3.24Å; A359-A363 WeakPolarHBondContact O-CB 3.35Å; A359-A363 PolarHBondContact O-N 2.83Å
360A43.9Very low49.2Very low58 Ų5876 Ų7648%0.47953%0.531SS..Hα-helixtrans-65.8-41172.400000112.5D356 A357 A358 A363 A364D356-A360 VanDerWaalsContact O-CB 3.28Å; D356-A360 WeakPolarHBondContact O-CB 3.2Å; D356-A360 PolarHBondContact O-N 3.1Å; A357-A360 PolarHBondContact O-N 2.75Å; A358-A360 VanDerWaalsContact C-N 3.29Å; A358-A360 PolarHBondContact O-N 2.97Å; A360-A363 PolarHBondContact O-N 3.34Å; A360-A364 VanDerWaalsContact O-CB 3.31Å; A360-A364 WeakPolarHBondContact O-CB 3.38Å; A360-A364 PolarHBondContact O-N 3.36Å
361A42.9Very low46.9Very low57 Ų5778.2 Ų78.247%0.47155%0.549SS..Hα-helixtrans-65.1-42.6177.800000112.4A357 A358 A364 T365A357-A361 WeakPolarHBondContact O-CB 3.48Å; A357-A361 PolarHBondContact O-N 3.48Å; A358-A361 PolarHBondContact O-N 3.45Å; A361-A364 PolarHBondContact O-N 3.13Å; A361-T365 PolarHBondContact O-N 3.05Å; A361-T365 PolarHBondContact O-OG1 3.21Å
362V46.5Very low44.6Very low58 Ų5883.7 Ų83.735%0.35257%0.573SS.*Hα-helixtrans-69.6-36.4175.6173.90000111.6W338 A358 A364 T365 A366W338-V362 HydrophobicContact CD2-CG2 4.15Å; W338-V362 HydrophobicContact CE3-CG2 4.01Å; W338-V362 HydrophobicContact CH2-CB 3.68Å; W338-V362 HydrophobicContact CH2-CG1 4.44Å; W338-V362 HydrophobicContact CH2-CG2 3.28Å; W338-V362 HydrophobicContact CZ2-CB 3.35Å; W338-V362 HydrophobicContact CZ2-CG1 3.69Å; W338-V362 HydrophobicContact CZ2-CG2 3.39Å; W338-V362 HydrophobicContact CZ3-CB 4.44Å; W338-V362 HydrophobicContact CZ3-CG2 3.57Å; A358-V362 PolarHBondContact O-N 3.45Å; V362-A364 VanDerWaalsContact C-N 3.33Å; V362-T365 WeakPolarHBondContact CA-OG1 3.4Å; V362-T365 PolarHBondContact O-N 2.97Å; V362-T365 PolarHBondContact O-OG1 3.26Å; V362-A366 PolarHBondContact O-N 2.86Å; V362-A366 VanDerWaalsContact O-N 3.13Å
363A42.5Very low43.3Very low67 Ų6782.1 Ų82.155%0.55457%0.57SS**Hα-helixtrans-65.3-34.5172.300000112.5A359 A360 A366A359-A363 VanDerWaalsContact O-CB 3.24Å; A359-A363 WeakPolarHBondContact O-CB 3.35Å; A359-A363 PolarHBondContact O-N 2.83Å; A360-A363 PolarHBondContact O-N 3.34Å; A363-A366 PolarHBondContact O-N 3.42Å
364A40.5Very low42.3Very low83 Ų8388.9 Ų88.969%0.68659%0.588SS**Hα-helixtrans-71.6-29.7175.800000113A360 A361 V362A360-A364 VanDerWaalsContact O-CB 3.31Å; A360-A364 WeakPolarHBondContact O-CB 3.38Å; A360-A364 PolarHBondContact O-N 3.36Å; A361-A364 PolarHBondContact O-N 3.13Å; V362-A364 VanDerWaalsContact C-N 3.33Å
365T38.5Very low41.3Very low112 Ų11293.2 Ų93.269%0.68761%0.609SS**Hα-helixtrans-81.5-14.7172.956.30000114.1A361 V362 V367A361-T365 PolarHBondContact O-N 3.05Å; A361-T365 PolarHBondContact O-OG1 3.21Å; V362-T365 WeakPolarHBondContact CA-OG1 3.4Å; V362-T365 PolarHBondContact O-N 2.97Å; V362-T365 PolarHBondContact O-OG1 3.26Å; T365-V367 PolarHBondContact O-N 3.05Å
366A36.3Very low40.6Very low60 Ų6095.4 Ų95.450%0.49663%0.631SS.*SBendtrans-77.5106.5169.100000107.8V362 A363 P368V362-A366 PolarHBondContact O-N 2.86Å; V362-A366 VanDerWaalsContact O-N 3.13Å; A363-A366 PolarHBondContact O-N 3.42Å; A366-P368 VanDerWaalsContact O-N 3.13Å
367V34.2Very low40Very low122 Ų12295.9 Ų95.974%0.73964%0.638SS**  trans-41.3122.5172.3176.30000108.9T365 A369T365-V367 PolarHBondContact O-N 3.05Å; V367-A369 PolarHBondContact O-N 3.24Å
368P36.3Very low39.7Very low116 Ų116104.8 Ų104.875%0.75366%0.658SS**  trans-72.682.1177.128.6-31.1000108.1A366 V370A366-P368 VanDerWaalsContact O-N 3.13Å; P368-V370 PolarHBondContact O-N 3.23Å
369A40.9Very low39.7Very low90 Ų90107.5 Ų107.574%0.74468%0.68SS**  trans-7841.717400000111.2V367V367-A369 PolarHBondContact O-N 3.24Å
370V40.9Very low39.2Very low134 Ų134110.8 Ų110.881%0.81271%0.707SS**  trans-156.276.4167.8-168.80000109.5P368P368-V370 PolarHBondContact O-N 3.23Å
371S35.3Very low38.5Very low102 Ų102111.3 Ų111.371%0.71372%0.719SS**SBendtrans-158.636.7155.6-166.10000113.2
372Q34.4Very low38.5Very low184 Ų184116 Ų11686%0.8673%0.731SS**SBendtrans-125.2-0.6170.5-83.9-103.2-24.400112.9
373A38.3Very low38.5Very low86 Ų86122.3 Ų122.371%0.71176%0.756SS**SBendtrans-92.9-0.1179.900000114.7
374Q38.7Very low38.2Very low190 Ų190132.6 Ų132.689%0.88878%0.781SS**SBendtrans-110.73.9179.1-78.5-166.1-52.100115.1
375L36.8Very low38.1Very low164 Ų164135.1 Ų135.186%0.85979%0.786SS**SBendtrans-107.71.8175.2-90.7142000113.9
376G34Very low38.1Very low65 Ų65136.3 Ų136.367%0.6779%0.791SS**SBendtrans-107.20.1-175.900000116.9
377T38.7Very low38.2Very low126 Ų126140.6 Ų140.677%0.77381%0.807SS**SBendtrans-120.830.6-175.148.50000114.1
378R42.3Very low38.4Very low252 Ų252141.6 Ų141.695%0.95181%0.811SS**SBendtrans-12520173.6-116.3-174.8-170.7174.93.2116.1
379A45.2Very low38.6Very low92 Ų92143.3 Ų143.376%0.7682%0.815SS**SBendtrans-138.8138.3167.900000110.4
380A35.1Very low38.4Very low108 Ų108146.8 Ų146.889%0.89382%0.819SS**SBendtrans82.588.5173.400000117.2
381G31.1Very low38.2Very low70 Ų70147.7 Ų147.772%0.72282%0.82SS**  trans114122.5132.500000113.3
382Q42.6Very low38.5Very low154 Ų154151.2 Ų151.272%0.7283%0.828SS**  cis-152158.12.9-76.2146.1-43.100103W384Q382-W384 VanDerWaalsContact C-N 3.35Å; Q382-W384 VanDerWaalsContact CB-C 3.49Å; Q382-W384 WeakPolarHBondContact CB-O 3.42Å; Q382-W384 WeakPolarHBondContact CG-O 3.01Å; Q382-W384 PolarHBondContact O-N 3.38Å; Q382-W384 PolarHBondContact OE1-O 3.36Å
383H46.4Very low38.8Very low191 Ų191148.5 Ų148.588%0.88483%0.825SS**  trans-85.2104.5141.8-90.2-68.7000104.6
384W36.4Very low38.8Very low284 Ų284154.2 Ų154.2100%1.07684%0.836SS**  trans95.50-175.5-53.6102.7000117.2Q382Q382-W384 VanDerWaalsContact C-N 3.35Å; Q382-W384 VanDerWaalsContact CB-C 3.49Å; Q382-W384 WeakPolarHBondContact CB-O 3.42Å; Q382-W384 WeakPolarHBondContact CG-O 3.01Å; Q382-W384 PolarHBondContact O-N 3.38Å; Q382-W384 PolarHBondContact OE1-O 3.36Å

Retrieved 384 of 384 residues in 1577.6 ms (Link to these results)