A0A087XG55_POEFO Loading...

Mal, T cell differentiation protein

AlphaFold DB , UniProt , Accession A0A087XG55, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 152 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
1M33.6Very low42.5Very low251 Ų251109.2 Ų109.2100%1.23664%0.644SS**  0100.30-70.2179.5-177.700107
2A32.3Very low43.1Very low94 Ų94102.2 Ų102.278%0.77760%0.604SS**  trans-92.8127.6177.400000108.6N4A2-N4 PolarHBondContact O-N 3.47Å
3S34.8Very low44Very low99 Ų99100.4 Ų100.469%0.69260%0.6SS**  trans-78.1111.4-172.4-161.10000110.5T5S3-T5 PolarHBondContact O-N 3.46Å; S3-T5 VanDerWaalsContact O-N 3.08Å; S3-T5 PolarHBondContact OG-OG1 2.93Å
4N41.7Very low45Very low162 Ų16295.8 Ų95.887%0.86658%0.583SS**  trans-78.233.4177.8-79.4-4000113.8A2A2-N4 PolarHBondContact O-N 3.47Å
5T41.8Very low45.4Very low108 Ų10897.7 Ų97.766%0.66360%0.595SS**  trans-111.514-166.139.70000116.3S3S3-T5 PolarHBondContact O-N 3.46Å; S3-T5 VanDerWaalsContact O-N 3.08Å; S3-T5 PolarHBondContact OG-OG1 2.93Å
6V43.8Very low46Very low127 Ų12793 Ų9377%0.7757%0.572SS**SBendtrans-128.642.1-173.1-162.70000114.3
7T44.9Very low46.6Very low97 Ų9787.6 Ų87.660%0.59554%0.539SS*.  trans-146.631.1173.5-8.50000114.5G9T7-G9 VanDerWaalsContact C-N 3.29Å; T7-G9 PolarHBondContact O-N 3.24Å
8M49.6Very low47Very low76 Ų7686.6 Ų86.637%0.37454%0.535SS..THydrogen-bonded Turntrans-82.81.1177.6-71.1-68.5-74.800114.3I147M8-I147 HydrophobicContact CE-CB 4.35Å; M8-I147 HydrophobicContact CE-CG2 3.63Å
9G44.3Very low47.2Very low41 Ų4187.6 Ų87.642%0.42354%0.541SS..THydrogen-bonded Turntrans-108.34-173.700000116.4T7 N79T7-G9 VanDerWaalsContact C-N 3.29Å; T7-G9 PolarHBondContact O-N 3.24Å; G9-N79 PolarHBondContact O-ND2 3.43Å
10H48.7Very low47.7Very low130 Ų13085 Ų8560%0.60252%0.524SS*.SBendtrans-142132.3-176-136.2-91.9000111.2P12 N79H10-P12 VanDerWaalsContact O-CD 3.3Å; H10-P12 WeakPolarHBondContact O-CD 3.18Å; H10-N79 WeakPolarHBondContact CA-OD1 3.48Å
11L51.7Low48Very low16 Ų1685.7 Ų85.78%0.08452%0.524CS..  trans-66.1116.9169.8-69.5172.5000108.7F72 H77 N79 R148 F152L11-F72 HydrophobicContact CD1-CE1 4.16Å; L11-F72 HydrophobicContact CD2-CD1 4.27Å; L11-F72 HydrophobicContact CD2-CE1 3.66Å; L11-F72 HydrophobicContact CG-CE1 4.46Å; L11-H77 HydrophobicContact CD1-CB 3.66Å; L11-N79 PolarHBondContact N-OD1 3.25Å; L11-R148 VanDerWaalsContact CD2-NH1 3.34Å; L11-F152 HydrophobicContact CG-CZ 4.44Å
12P49.9Very low49.1Very low25 Ų2574 Ų7416%0.16247%0.467CS..  trans-69.1145.8173.230.8-34.1000109.4H10 T20 D23H10-P12 VanDerWaalsContact O-CD 3.3Å; H10-P12 WeakPolarHBondContact O-CD 3.18Å; P12-T20 HydrophobicContact CG-CG2 4.19Å; P12-D23 VanDerWaalsContact CD-OD2 3.26Å; P12-D23 WeakPolarHBondContact CD-OD2 3.36Å; P12-D23 WeakPolarHBondContact CG-OD2 3.1Å
13S54.6Low50.6Low79 Ų7969.5 Ų69.555%0.55243%0.43SS*.  trans-123.6154.2174.156.20000109.7
14G58.3Low52.5Low36 Ų3668.1 Ų68.137%0.37141%0.414SS..G310 helixtrans72.5-143.8-177.300000114.1G16 V17 A73G14-G16 PolarHBondContact O-N 3.17Å; G14-G16 VanDerWaalsContact O-N 3.11Å; G14-V17 WeakPolarHBondContact O-CB 3.31Å; G14-V17 WeakPolarHBondContact O-CG2 3.38Å; G14-V17 PolarHBondContact O-N 3.31Å; G14-V17 VanDerWaalsContact O-N 3.17Å; G14-A73 WeakPolarHBondContact CA-O 3.43Å; G14-A73 PolarHBondContact N-O 2.85Å
15V51.7Low54.3Low125 Ų12561.6 Ų61.676%0.75838%0.379SS*.G310 helixtrans-64.3-15.9-176.5-175.50000112.8V17 C18 T19V15-V17 PolarHBondContact O-N 3.35Å; V15-C18 PolarHBondContact O-N 3.36Å; V15-T19 PolarHBondContact O-OG1 3.43Å
16G54.4Low56.1Low22 Ų2256.5 Ų56.523%0.22735%0.347CS..G310 helixtrans-60.8-26.1173.200000113.9G14 C18 T19 T20G14-G16 PolarHBondContact O-N 3.17Å; G14-G16 VanDerWaalsContact O-N 3.11Å; G16-C18 PolarHBondContact O-N 3.11Å; G16-T19 WeakPolarHBondContact CA-OG1 3.19Å; G16-T19 PolarHBondContact O-N 3.11Å; G16-T19 PolarHBondContact O-OG1 3.19Å; G16-T20 WeakPolarHBondContact O-CB 3.39Å; G16-T20 PolarHBondContact O-N 3.45Å; G16-T20 PolarHBondContact O-OG1 2.97Å
17V56.1Low58.1Low2 Ų253.1 Ų53.11%0.01233%0.327CS..G310 helixtrans-61-33176.4174.70000111.4G14 V15 T19 D23 I24 L69 F72G14-V17 WeakPolarHBondContact O-CB 3.31Å; G14-V17 WeakPolarHBondContact O-CG2 3.38Å; G14-V17 PolarHBondContact O-N 3.31Å; G14-V17 VanDerWaalsContact O-N 3.17Å; V15-V17 PolarHBondContact O-N 3.35Å; V17-T19 VanDerWaalsContact C-N 3.28Å; V17-T19 PolarHBondContact O-N 2.89Å; V17-D23 HydrophobicContact CG1-CB 3.9Å; V17-D23 CarbonylContact O-C 3.16Å; V17-I24 PolarHBondContact O-N 3.2Å; V17-L69 HydrophobicContact CG1-CD1 3.81Å; V17-F72 HydrophobicContact CG1-CB 4.49Å; V17-F72 HydrophobicContact CG2-CB 4.23Å
18C54.3Low60Low68 Ų6850 Ų5046%0.45931%0.308SS..G310 helixtrans-80.8-3.9177.5-61.50000114V15 G16V15-C18 PolarHBondContact O-N 3.36Å; G16-C18 PolarHBondContact O-N 3.11Å
19T50.7Low61.9Low107 Ų10746.3 Ų46.366%0.65629%0.29SS*.THydrogen-bonded Turntrans-131.6-10.1-170.839.30000114.4V15 G16 V17V15-T19 PolarHBondContact O-OG1 3.43Å; G16-T19 WeakPolarHBondContact CA-OG1 3.19Å; G16-T19 PolarHBondContact O-N 3.11Å; G16-T19 PolarHBondContact O-OG1 3.19Å; V17-T19 VanDerWaalsContact C-N 3.28Å; V17-T19 PolarHBondContact O-N 2.89Å
20T56.9Low64.1Low34 Ų3445.4 Ų45.421%0.20928%0.275CS..SBendtrans-109132.6-177.7-36.40000109.8P12 G16 D23 I24P12-T20 HydrophobicContact CG-CG2 4.19Å; G16-T20 WeakPolarHBondContact O-CB 3.39Å; G16-T20 PolarHBondContact O-N 3.45Å; G16-T20 PolarHBondContact O-OG1 2.97Å; T20-D23 PolarHBondContact O-N 3Å; T20-I24 PolarHBondContact O-N 2.91Å
21I54.4Low66.2Low100 Ų10043.8 Ų43.851%0.51327%0.27SS..THydrogen-bonded Turntrans-77.9129.5173.3-61.3176.2000107.1I24 L144I21-I24 HydrophobicContact CG1-CG2 4.09Å; I21-L144 HydrophobicContact CG2-CD1 3.6Å; I21-L144 HydrophobicContact CG2-CD2 4.13Å; I21-L144 HydrophobicContact CG2-CG 4.41Å
22P55.4Low68Low5 Ų545.9 Ų45.93%0.03228%0.279CS..THydrogen-bonded Turncis-91.7-13.815.832.7-33000116.8I24 L25 L144P22-I24 PolarHBondContact O-N 2.94Å; P22-L25 WeakPolarHBondContact O-CB 3.48Å; P22-L25 WeakPolarHBondContact O-CG 3.45Å; P22-L25 PolarHBondContact O-N 3.47Å; P22-L144 HydrophobicContact CB-CB 3.7Å; P22-L144 HydrophobicContact CB-CD1 4.12Å
23D64.3Low69.8Low0 Ų044.7 Ų44.70%027%0.271CS..G310 helixtrans-68.8-14.6-164.2-50.4-42.1000114.2P12 V17 T20 L25 Y26 R148P12-D23 VanDerWaalsContact CD-OD2 3.26Å; P12-D23 WeakPolarHBondContact CD-OD2 3.36Å; P12-D23 WeakPolarHBondContact CG-OD2 3.1Å; V17-D23 HydrophobicContact CG1-CB 3.9Å; V17-D23 CarbonylContact O-C 3.16Å; T20-D23 PolarHBondContact O-N 3Å; D23-L25 PolarHBondContact O-N 3.23Å; D23-L25 VanDerWaalsContact O-N 3.15Å; D23-Y26 HydrophobicContact CB-CD2 3.93Å; D23-Y26 HydrophobicContact CB-CE2 4.07Å; D23-Y26 VanDerWaalsContact O-CD2 3.23Å; D23-Y26 WeakPolarHBondContact O-CD2 3.18Å; D23-Y26 PolarHBondContact O-N 3.11Å; D23-R148 IonicContact OD1-CZ 3.48Å; D23-R148 IonicContact OD1-NH1 3.99Å; D23-R148 PolarHBondContact OD1-NH1 3.38Å; D23-R148 IonicContact OD1-NH2 3.8Å; D23-R148 IonicContact OD2-NH1 3.71Å; D23-R148 PolarHBondContact OD2-NH1 3.11Å
24I74.8Confident71.5Confident71 Ų7141.2 Ų41.236%0.36425%0.248SC..G310 helixtrans-57.6-24.6168.1-166.6167.4000112.8V17 T20 I21 P22 Y26 P28V17-I24 PolarHBondContact O-N 3.2Å; T20-I24 PolarHBondContact O-N 2.91Å; I21-I24 HydrophobicContact CG1-CG2 4.09Å; P22-I24 PolarHBondContact O-N 2.94Å; I24-Y26 VanDerWaalsContact C-N 3.32Å; I24-Y26 PolarHBondContact O-N 3.01Å; I24-P28 WeakPolarHBondContact O-CD 3.22Å
25L78.7Confident73.1Confident25 Ų2542.5 Ų42.513%0.13125%0.246CC..G310 helixtrans-74-20.1-176.9-64.7177.4000113.5P22 D23 V27 P28 E29 L137 V140 H141 L144P22-L25 WeakPolarHBondContact O-CB 3.48Å; P22-L25 WeakPolarHBondContact O-CG 3.45Å; P22-L25 PolarHBondContact O-N 3.47Å; D23-L25 PolarHBondContact O-N 3.23Å; D23-L25 VanDerWaalsContact O-N 3.15Å; L25-V27 VanDerWaalsContact C-N 3.26Å; L25-V27 PolarHBondContact O-N 3.23Å; L25-P28 WeakPolarHBondContact O-CD 3.44Å; L25-P28 VanDerWaalsContact O-CG 3.3Å; L25-P28 WeakPolarHBondContact O-CG 3.34Å; L25-E29 WeakPolarHBondContact O-CB 3.27Å; L25-E29 VanDerWaalsContact O-CD 3.32Å; L25-E29 WeakPolarHBondContact O-CG 3.42Å; L25-E29 PolarHBondContact O-N 2.9Å; L25-L137 HydrophobicContact CD2-CD2 4.25Å; L25-V140 HydrophobicContact CD1-CB 4.44Å; L25-V140 HydrophobicContact CD1-CG1 3.94Å; L25-H141 HydrophobicContact CB-CB 4.36Å; L25-H141 HydrophobicContact CD1-CB 3.84Å; L25-L144 HydrophobicContact CD1-CD1 3.69Å
26Y80.8Confident75.1Confident0 Ų036.6 Ų36.60%021%0.21CC..Hα-helixtrans-58.4-37.3174.8-75.3-67.3000113D23 I24 L30 T65 W68 L69 F72 D87 H91 H141D23-Y26 HydrophobicContact CB-CD2 3.93Å; D23-Y26 HydrophobicContact CB-CE2 4.07Å; D23-Y26 VanDerWaalsContact O-CD2 3.23Å; D23-Y26 WeakPolarHBondContact O-CD2 3.18Å; D23-Y26 PolarHBondContact O-N 3.11Å; I24-Y26 VanDerWaalsContact C-N 3.32Å; I24-Y26 PolarHBondContact O-N 3.01Å; Y26-L30 WeakPolarHBondContact O-CB 3.32Å; Y26-L30 VanDerWaalsContact O-CG 3.3Å; Y26-L30 WeakPolarHBondContact O-CG 3.44Å; Y26-L30 PolarHBondContact O-N 3.47Å; Y26-T65 HydrophobicContact CD1-CG2 3.68Å; Y26-T65 HydrophobicContact CE1-CG2 4.41Å; Y26-W68 HydrophobicContact CD1-CB 4.44Å; Y26-W68 HydrophobicContact CE1-CB 3.6Å; Y26-W68 HydrophobicContact CE1-CG 4.41Å; Y26-L69 HydrophobicContact CG-CD1 4.38Å; Y26-F72 AromaticContact CE2-CD2 3.96Å; Y26-F72 HydrophobicContact CE2-CD2 3.96Å; Y26-F72 HydrophobicContact CE2-CE2 4.33Å; Y26-F72 AromaticContact CZ-CD2 3.94Å; Y26-F72 WeakPolarHBondContact OH-CD2 3.32Å; Y26-F72 WeakPolarHBondContact OH-CE2 3.2Å; Y26-D87 PolarHBondContact OH-OD1 2.93Å; Y26-H91 AromaticContact CE1-CE1 3.73Å; Y26-H91 AromaticContact CE1-NE2 3.58Å; Y26-H91 AromaticContact CZ-CE1 3.75Å; Y26-H91 AromaticContact CZ-NE2 3.96Å; Y26-H91 PolarHBondContact OH-CE1 3.34Å; Y26-H141 AromaticContact CD1-CE1 3.93Å; Y26-H141 AromaticContact CD2-CE1 3.82Å; Y26-H141 AromaticContact CE1-CE1 3.68Å; Y26-H141 AromaticContact CE2-CE1 3.51Å; Y26-H141 AromaticContact CE2-NE2 3.86Å; Y26-H141 AromaticContact CZ-CE1 3.45Å; Y26-H141 VanDerWaalsContact CZ-CE1 3.45Å; Y26-H141 AromaticContact CZ-NE2 3.89Å
27V84.7Confident77Confident56 Ų5639 Ų3934%0.33921%0.212SC..Hα-helixtrans-67.1-55.8-178.8177.40000112.4L25 E29 L30 I31L25-V27 VanDerWaalsContact C-N 3.26Å; L25-V27 PolarHBondContact O-N 3.23Å; V27-E29 VanDerWaalsContact C-N 3.3Å; V27-E29 PolarHBondContact O-N 3.39Å; V27-L30 PolarHBondContact O-N 2.91Å; V27-I31 HydrophobicContact CG1-CD1 3.87Å; V27-I31 WeakPolarHBondContact O-CG1 3.26Å; V27-I31 PolarHBondContact O-N 3.09Å
28P86.3Confident78.8Confident31 Ų3142.5 Ų42.520%0.20123%0.23CC..Hα-helixtrans-63.5-34.4175.825-32.7000112I24 L25 L30 I31 F32 L137I24-P28 WeakPolarHBondContact O-CD 3.22Å; L25-P28 WeakPolarHBondContact O-CD 3.44Å; L25-P28 VanDerWaalsContact O-CG 3.3Å; L25-P28 WeakPolarHBondContact O-CG 3.34Å; P28-L30 VanDerWaalsContact C-N 3.33Å; P28-L30 PolarHBondContact O-N 3.08Å; P28-I31 PolarHBondContact O-N 3.44Å; P28-F32 HydrophobicContact CB-CD2 4.05Å; P28-F32 HydrophobicContact CB-CE2 4.03Å; P28-F32 WeakPolarHBondContact O-CB 3.4Å; P28-F32 WeakPolarHBondContact O-CD2 3.1Å; P28-F32 PolarHBondContact O-N 3.24Å; P28-L137 HydrophobicContact CB-CD1 3.95Å; P28-L137 HydrophobicContact CB-CD2 4.35Å; P28-L137 HydrophobicContact CG-CD2 4.29Å
29E89.6Confident80.5Confident0 Ų040.6 Ų40.60%022%0.215CC..Hα-helixtrans-59.4-41.9173.5-74.7167.6-177.300112.5L25 V27 G33 T65 H91 L137 Y138 H141L25-E29 WeakPolarHBondContact O-CB 3.27Å; L25-E29 VanDerWaalsContact O-CD 3.32Å; L25-E29 WeakPolarHBondContact O-CG 3.42Å; L25-E29 PolarHBondContact O-N 2.9Å; V27-E29 VanDerWaalsContact C-N 3.3Å; V27-E29 PolarHBondContact O-N 3.39Å; E29-G33 WeakPolarHBondContact O-CA 3.18Å; E29-G33 PolarHBondContact O-N 2.93Å; E29-T65 HydrophobicContact CB-CG2 4.04Å; E29-H91 IonicContact OE2-NE2 2.71Å; E29-L137 HydrophobicContact CG-CB 3.78Å; E29-Y138 HydrophobicContact CB-CE1 4.03Å; E29-Y138 VanDerWaalsContact CD-CD1 3.44Å; E29-Y138 VanDerWaalsContact CD-CE1 3.47Å; E29-Y138 HydrophobicContact CG-CD1 3.96Å; E29-Y138 HydrophobicContact CG-CE1 3.84Å; E29-Y138 HydrophobicContact CG-CG 4.49Å; E29-Y138 VanDerWaalsContact OE2-CE1 3.31Å; E29-Y138 WeakPolarHBondContact OE2-CE1 3.5Å; E29-H141 WeakPolarHBondContact OE1-CB 3.48Å; E29-H141 IonicContact OE1-CG 2.54Å; E29-H141 IonicContact OE1-ND1 3.44Å; E29-H141 PolarHBondContact OE1-ND1 3.3Å; E29-H141 IonicContact OE2-CE1 3.32Å; E29-H141 IonicContact OE2-ND1 2.89Å; E29-H141 PolarHBondContact OE2-ND1 2.9Å
30L89.6Confident82.4Confident21 Ų2135.5 Ų35.511%0.1118%0.184CC..Hα-helixtrans-67.9-41.6174.7-75.9171.7000112.4Y26 V27 P28 G34 F62 T65 F66 L69Y26-L30 WeakPolarHBondContact O-CB 3.32Å; Y26-L30 VanDerWaalsContact O-CG 3.3Å; Y26-L30 WeakPolarHBondContact O-CG 3.44Å; Y26-L30 PolarHBondContact O-N 3.47Å; V27-L30 PolarHBondContact O-N 2.91Å; P28-L30 VanDerWaalsContact C-N 3.33Å; P28-L30 PolarHBondContact O-N 3.08Å; L30-G34 VanDerWaalsContact O-CA 3.3Å; L30-G34 WeakPolarHBondContact O-CA 3.4Å; L30-G34 PolarHBondContact O-N 3.33Å; L30-F62 HydrophobicContact CB-CE2 4.2Å; L30-F62 HydrophobicContact CD2-CD2 3.66Å; L30-F62 HydrophobicContact CD2-CE2 3.7Å; L30-F62 HydrophobicContact CD2-CG 4.13Å; L30-F62 HydrophobicContact CD2-CZ 4.2Å; L30-F62 VanDerWaalsContact CD2-O 3.32Å; L30-F62 WeakPolarHBondContact CD2-O 3.43Å; L30-F62 VanDerWaalsContact O-CE2 3.3Å; L30-F62 WeakPolarHBondContact O-CE2 3.48Å; L30-T65 HydrophobicContact CD2-CG2 4Å; L30-T65 HydrophobicContact CG-CG2 3.86Å; L30-F66 HydrophobicContact CD1-CD2 4.27Å; L30-F66 HydrophobicContact CD2-CB 3.94Å; L30-L69 HydrophobicContact CD1-CD2 3.68Å
31I92Very high84.1Confident97 Ų9735.6 Ų35.650%0.49719%0.188SC..Hα-helixtrans-65.7-55.2-179.7-65.9165.9000109.9V27 P28 G34 L35V27-I31 HydrophobicContact CG1-CD1 3.87Å; V27-I31 WeakPolarHBondContact O-CG1 3.26Å; V27-I31 PolarHBondContact O-N 3.09Å; P28-I31 PolarHBondContact O-N 3.44Å; I31-G34 PolarHBondContact O-N 2.85Å; I31-L35 HydrophobicContact CG2-CD1 4.29Å; I31-L35 VanDerWaalsContact O-CG 3.28Å; I31-L35 WeakPolarHBondContact O-CG 3.47Å; I31-L35 PolarHBondContact O-N 2.86Å
32F89.6Confident85.8Confident60 Ų6033.7 Ų33.726%0.26318%0.183SC..Hα-helixtrans-71-40.4-176.8-66.9-65.6000112P28 G34 L35 V36 F130 V133 T134 L137P28-F32 HydrophobicContact CB-CD2 4.05Å; P28-F32 HydrophobicContact CB-CE2 4.03Å; P28-F32 WeakPolarHBondContact O-CB 3.4Å; P28-F32 WeakPolarHBondContact O-CD2 3.1Å; P28-F32 PolarHBondContact O-N 3.24Å; F32-G34 VanDerWaalsContact C-N 3.28Å; F32-G34 PolarHBondContact O-N 3.35Å; F32-L35 HydrophobicContact CD1-CD1 4.23Å; F32-L35 PolarHBondContact O-N 3.3Å; F32-V36 WeakPolarHBondContact O-CG2 3.47Å; F32-V36 PolarHBondContact O-N 3.2Å; F32-V36 VanDerWaalsContact O-N 3.12Å; F32-F130 AromaticContact CD1-CD1 3.66Å; F32-F130 HydrophobicContact CD1-CD1 3.66Å; F32-F130 HydrophobicContact CD1-CE1 4.13Å; F32-F130 HydrophobicContact CD1-CG 4.49Å; F32-F130 HydrophobicContact CE1-CD1 4.04Å; F32-F130 HydrophobicContact CE1-CE1 4.1Å; F32-V133 HydrophobicContact CD1-CG1 4.27Å; F32-V133 HydrophobicContact CD2-CG1 3.99Å; F32-V133 HydrophobicContact CE1-CG1 4.45Å; F32-V133 HydrophobicContact CE2-CG1 4.19Å; F32-V133 HydrophobicContact CG-CG1 4.04Å; F32-V133 HydrophobicContact CZ-CG1 4.42Å; F32-T134 VanDerWaalsContact CB-OG1 3.28Å; F32-T134 WeakPolarHBondContact CB-OG1 3.48Å; F32-L137 HydrophobicContact CB-CD1 4.47Å; F32-L137 HydrophobicContact CD2-CD1 3.48Å; F32-L137 VanDerWaalsContact CD2-CD1 3.48Å; F32-L137 HydrophobicContact CE2-CD1 4.14Å; F32-L137 HydrophobicContact CG-CD1 4.35Å
33G89.1Confident87.3Confident0 Ų033.8 Ų33.80%018%0.183CC..Hα-helixtrans-62.4-38.3172.700000112.2E29 V36 S58 Y98 T134E29-G33 WeakPolarHBondContact O-CA 3.18Å; E29-G33 PolarHBondContact O-N 2.93Å; G33-V36 PolarHBondContact O-N 3.17Å; G33-S58 PolarHBondContact O-OG 3.08Å; G33-Y98 WeakPolarHBondContact CA-OH 3.43Å; G33-T134 PolarHBondContact N-OG1 3.03Å
34G89.8Confident88.4Confident6 Ų642.6 Ų42.66%0.06222%0.218CC..Hα-helixtrans-56.5-49.5171.800000113.1L30 I31 F32 V36 W37 I38L30-G34 VanDerWaalsContact O-CA 3.3Å; L30-G34 WeakPolarHBondContact O-CA 3.4Å; L30-G34 PolarHBondContact O-N 3.33Å; I31-G34 PolarHBondContact O-N 2.85Å; F32-G34 VanDerWaalsContact C-N 3.28Å; F32-G34 PolarHBondContact O-N 3.35Å; G34-V36 VanDerWaalsContact C-N 3.31Å; G34-V36 PolarHBondContact O-N 3.28Å; G34-W37 PolarHBondContact O-NE1 3.24Å; G34-I38 WeakPolarHBondContact O-CD1 3.48Å; G34-I38 VanDerWaalsContact O-CG1 3.24Å; G34-I38 WeakPolarHBondContact O-CG1 3.42Å; G34-I38 PolarHBondContact O-N 2.92Å
35L92.5Very high88.9Confident62 Ų6240.5 Ų40.533%0.32521%0.209SC..Hα-helixtrans-60.8-38.9178.7-70.3169.8000112I31 F32 I38 L39 F130I31-L35 HydrophobicContact CG2-CD1 4.29Å; I31-L35 VanDerWaalsContact O-CG 3.28Å; I31-L35 WeakPolarHBondContact O-CG 3.47Å; I31-L35 PolarHBondContact O-N 2.86Å; F32-L35 HydrophobicContact CD1-CD1 4.23Å; F32-L35 PolarHBondContact O-N 3.3Å; L35-I38 PolarHBondContact O-N 2.66Å; L35-L39 HydrophobicContact CB-CD1 4.49Å; L35-L39 WeakPolarHBondContact O-CB 3.26Å; L35-L39 WeakPolarHBondContact O-CD1 3.1Å; L35-L39 WeakPolarHBondContact O-CG 3.3Å; L35-L39 PolarHBondContact O-N 3.36Å; L35-F130 HydrophobicContact CB-CD2 4.2Å; L35-F130 HydrophobicContact CB-CG 4.49Å; L35-F130 HydrophobicContact CD1-CE1 4.38Å; L35-F130 HydrophobicContact CD1-CE2 4.37Å; L35-F130 HydrophobicContact CD1-CZ 4.3Å
36V93.8Very high89Confident1 Ų143 Ų431%0.00622%0.224CC..Hα-helixtrans-59.4-54.2-178.5172.90000111.6F32 G33 G34 I38 L39 V40 V54 Y98 F130F32-V36 WeakPolarHBondContact O-CG2 3.47Å; F32-V36 PolarHBondContact O-N 3.2Å; F32-V36 VanDerWaalsContact O-N 3.12Å; G33-V36 PolarHBondContact O-N 3.17Å; G34-V36 VanDerWaalsContact C-N 3.31Å; G34-V36 PolarHBondContact O-N 3.28Å; V36-I38 PolarHBondContact O-N 3.11Å; V36-L39 PolarHBondContact O-N 2.98Å; V36-V40 VanDerWaalsContact O-CG2 3.29Å; V36-V40 WeakPolarHBondContact O-CG2 3.4Å; V36-V40 PolarHBondContact O-N 3.03Å; V36-V54 HydrophobicContact CG1-CG1 4.31Å; V36-Y98 HydrophobicContact CG2-CE1 4.42Å; V36-F130 HydrophobicContact CG2-CB 3.75Å
37W92.7Very high89.2Confident73 Ų7345 Ų4528%0.27724%0.238SC..Hα-helixtrans-71.1-29.8-178.864.6-98.7000113G34 A41 S58 V59 F62G34-W37 PolarHBondContact O-NE1 3.24Å; W37-A41 WeakPolarHBondContact O-CB 3.3Å; W37-A41 PolarHBondContact O-N 2.99Å; W37-S58 WeakPolarHBondContact CB-OG 3.38Å; W37-S58 PolarHBondContact N-OG 2.91Å; W37-V59 HydrophobicContact CB-CG2 3.88Å; W37-V59 HydrophobicContact CD2-CG2 4.17Å; W37-V59 HydrophobicContact CG-CG2 3.85Å; W37-F62 AromaticContact NE1-CD2 3.92Å; W37-F62 AromaticContact NE1-CG 3.85Å
38I93.9Very high89.3Confident75 Ų7549.9 Ų49.939%0.38526%0.256SS..Hα-helixtrans-64.1-45.1173.7-68.4167.4000110.3G34 L35 V36 A41 C42G34-I38 WeakPolarHBondContact O-CD1 3.48Å; G34-I38 VanDerWaalsContact O-CG1 3.24Å; G34-I38 WeakPolarHBondContact O-CG1 3.42Å; G34-I38 PolarHBondContact O-N 2.92Å; L35-I38 PolarHBondContact O-N 2.66Å; V36-I38 PolarHBondContact O-N 3.11Å; I38-A41 PolarHBondContact O-N 3.4Å; I38-C42 WeakPolarHBondContact O-CB 3.29Å; I38-C42 PolarHBondContact O-N 3.43Å; I38-C42 PolarHBondContact O-SG 2.93Å
39L91.4Very high89.3Confident29 Ų2955 Ų5515%0.15228%0.282CS..Hα-helixtrans-66.4-41.6179.9-69.8164.6000111.7L35 V36 A41 C42 T43 L123 S126 A127 F130L35-L39 HydrophobicContact CB-CD1 4.49Å; L35-L39 WeakPolarHBondContact O-CB 3.26Å; L35-L39 WeakPolarHBondContact O-CD1 3.1Å; L35-L39 WeakPolarHBondContact O-CG 3.3Å; L35-L39 PolarHBondContact O-N 3.36Å; V36-L39 PolarHBondContact O-N 2.98Å; L39-A41 VanDerWaalsContact C-N 3.34Å; L39-C42 WeakPolarHBondContact O-CB 3.44Å; L39-C42 PolarHBondContact O-N 3.46Å; L39-T43 PolarHBondContact O-N 3.09Å; L39-L123 HydrophobicContact CD2-CD2 4.06Å; L39-L123 HydrophobicContact CD2-CG 4.1Å; L39-S126 WeakPolarHBondContact CD1-OG 3.29Å; L39-A127 HydrophobicContact CB-CB 3.81Å; L39-A127 HydrophobicContact CD1-CB 4.21Å; L39-F130 HydrophobicContact CD1-CD2 3.49Å; L39-F130 VanDerWaalsContact CD1-CD2 3.49Å; L39-F130 HydrophobicContact CD1-CE2 3.82Å
40V90.3Very high89.3Confident0 Ų056.6 Ų56.60%029%0.292CS..Hα-helixtrans-67.1-33.7174.4174.70000111.8V36 C42 T43 V45 Q51 V54 M55 L105 A127V36-V40 VanDerWaalsContact O-CG2 3.29Å; V36-V40 WeakPolarHBondContact O-CG2 3.4Å; V36-V40 PolarHBondContact O-N 3.03Å; V40-C42 VanDerWaalsContact C-N 3.33Å; V40-T43 PolarHBondContact O-N 3.48Å; V40-T43 PolarHBondContact O-OG1 3.31Å; V40-V45 PolarHBondContact O-N 3.37Å; V40-Q51 HydrophobicContact CG1-CB 4.24Å; V40-V54 HydrophobicContact CG2-CG1 3.98Å; V40-M55 HydrophobicContact CG1-CB 4.31Å; V40-L105 HydrophobicContact CG2-CD1 4.06Å; V40-L105 HydrophobicContact CG2-CD2 4.48Å; V40-A127 HydrophobicContact CG2-CB 4.26Å
41A91.9Very high89.2Confident36 Ų3655.6 Ų55.630%0.29829%0.287SS..Hα-helixtrans-68-35.7173.700000111.7W37 I38 L39 T43 Y44 M55W37-A41 WeakPolarHBondContact O-CB 3.3Å; W37-A41 PolarHBondContact O-N 2.99Å; I38-A41 PolarHBondContact O-N 3.4Å; L39-A41 VanDerWaalsContact C-N 3.34Å; A41-T43 PolarHBondContact O-N 3Å; A41-Y44 WeakPolarHBondContact O-CA 3.46Å; A41-Y44 PolarHBondContact O-N 2.98Å; A41-M55 HydrophobicContact CB-CE 4.26Å
42C90.8Very high89.1Confident59 Ų5952.4 Ų52.440%0.39928%0.279SS..Hα-helixtrans-69-17.7177.5-74.50000114.1I38 L39 V40 Y44 L123I38-C42 WeakPolarHBondContact O-CB 3.29Å; I38-C42 PolarHBondContact O-N 3.43Å; I38-C42 PolarHBondContact O-SG 2.93Å; L39-C42 WeakPolarHBondContact O-CB 3.44Å; L39-C42 PolarHBondContact O-N 3.46Å; V40-C42 VanDerWaalsContact C-N 3.33Å; C42-Y44 VanDerWaalsContact C-N 3.28Å; C42-L123 HydrophobicContact CB-CD2 3.19Å
43T87.2Confident89.4Confident7 Ų753.8 Ų53.84%0.04328%0.282CS..THydrogen-bonded Turntrans-90.28.6169.159.80000112.4L39 V40 A41 V45 V46 Q51 D120 L123L39-T43 PolarHBondContact O-N 3.09Å; V40-T43 PolarHBondContact O-N 3.48Å; V40-T43 PolarHBondContact O-OG1 3.31Å; A41-T43 PolarHBondContact O-N 3Å; T43-V45 PolarHBondContact O-N 3.34Å; T43-V45 VanDerWaalsContact O-N 3.17Å; T43-V46 PolarHBondContact O-N 3.29Å; T43-Q51 PolarHBondContact OG1-OE1 3.16Å; T43-D120 HydrophobicContact CG2-CB 4.2Å; T43-L123 HydrophobicContact CG2-CB 3.82Å; T43-L123 HydrophobicContact CG2-CD2 4.34Å
44Y86.2Confident89.6Confident186 Ų18653.8 Ų53.873%0.72928%0.282SS*.THydrogen-bonded Turntrans58.122.3-177.9-55.8-82.2000114.2A41 C42 V46A41-Y44 WeakPolarHBondContact O-CA 3.46Å; A41-Y44 PolarHBondContact O-N 2.98Å; C42-Y44 VanDerWaalsContact C-N 3.28Å; Y44-V46 VanDerWaalsContact C-N 3.29Å; Y44-V46 PolarHBondContact O-N 3.35Å
45V85.8Confident89.8Confident27 Ų2756.4 Ų56.416%0.16429%0.294CS..THydrogen-bonded Turntrans58.940.5178-159.80000111.8V40 T43 P47 H48 Q51 M55V40-V45 PolarHBondContact O-N 3.37Å; T43-V45 PolarHBondContact O-N 3.34Å; T43-V45 VanDerWaalsContact O-N 3.17Å; V45-P47 CarbonylContact O-C 3.15Å; V45-H48 VanDerWaalsContact O-CA 3.3Å; V45-H48 WeakPolarHBondContact O-CA 3.28Å; V45-H48 PolarHBondContact O-N 2.95Å; V45-H48 VanDerWaalsContact O-N 3.14Å; V45-Q51 VanDerWaalsContact CA-OE1 3.28Å; V45-Q51 HydrophobicContact CG1-CB 3.71Å; V45-M55 HydrophobicContact CG2-SD 3.58Å; V45-M55 VanDerWaalsContact CG2-SD 3.58Å
46V81.1Confident89.9Confident76 Ų7658.7 Ų58.746%0.46130%0.301SS..SBendtrans-104.2125178.9-179.10000109.8T43 Y44 Q51T43-V46 PolarHBondContact O-N 3.29Å; Y44-V46 VanDerWaalsContact C-N 3.29Å; Y44-V46 PolarHBondContact O-N 3.35Å; V46-Q51 PolarHBondContact O-OE1 3.48Å
47P84.8Confident89.9Confident43 Ų4358.7 Ų58.728%0.27930%0.301SS..SBendcis-75.9146.6-3.932.2-36.7000112.7V45 N49 Q51 V108V45-P47 CarbonylContact O-C 3.15Å; P47-N49 PolarHBondContact O-N 2.84Å; P47-Q51 WeakPolarHBondContact O-CB 3.31Å; P47-Q51 PolarHBondContact O-N 3.46Å; P47-V108 HydrophobicContact CG-CG1 4.39Å; P47-V108 HydrophobicContact CG-CG2 4.35Å
48H87Confident89.9Confident159 Ų15955.2 Ų55.274%0.73629%0.288SS*.Hα-helixtrans-50.1-38.5-178.3-59.196.4000113.4V45 G52V45-H48 VanDerWaalsContact O-CA 3.3Å; V45-H48 WeakPolarHBondContact O-CA 3.28Å; V45-H48 PolarHBondContact O-N 2.95Å; V45-H48 VanDerWaalsContact O-N 3.14Å; H48-G52 WeakPolarHBondContact O-CA 3.49Å; H48-G52 PolarHBondContact O-N 3.42Å
49N86.9Confident89.9Confident137 Ų13754.3 Ų54.373%0.73329%0.286SS*.Hα-helixtrans-117.8120.5170.9-173.625.6000108P47P47-N49 PolarHBondContact O-N 2.84Å
50P89.8Confident90.1Very high34 Ų3456.7 Ų56.722%0.22130%0.295CS..Hα-helixcis-99.86.411.739.7-38.2000116.6G52 W53 V54 A104 V108P50-G52 PolarHBondContact O-N 3.35Å; P50-W53 WeakPolarHBondContact O-CB 3.43Å; P50-W53 PolarHBondContact O-N 3.32Å; P50-V54 PolarHBondContact O-N 3.16Å; P50-A104 HydrophobicContact CB-CB 3.95Å; P50-A104 HydrophobicContact CG-CB 4.07Å; P50-V108 VanDerWaalsContact CD-CG2 3.43Å; P50-V108 HydrophobicContact CG-CG2 3.41Å; P50-V108 VanDerWaalsContact CG-CG2 3.41Å
51Q87.3Confident90.2Very high0 Ų056.7 Ų56.70%030%0.295CS..Hα-helixtrans-62.4-29.8-177.5-74.7-145-30.800113.5V40 T43 V45 V46 P47 W53 V54 M55 V108 D124V40-Q51 HydrophobicContact CG1-CB 4.24Å; T43-Q51 PolarHBondContact OG1-OE1 3.16Å; V45-Q51 VanDerWaalsContact CA-OE1 3.28Å; V45-Q51 HydrophobicContact CG1-CB 3.71Å; V46-Q51 PolarHBondContact O-OE1 3.48Å; P47-Q51 WeakPolarHBondContact O-CB 3.31Å; P47-Q51 PolarHBondContact O-N 3.46Å; Q51-W53 VanDerWaalsContact C-N 3.27Å; Q51-W53 PolarHBondContact O-N 2.71Å; Q51-V54 WeakPolarHBondContact O-CB 3.32Å; Q51-V54 PolarHBondContact O-N 2.59Å; Q51-V54 VanDerWaalsContact O-N 3.16Å; Q51-M55 PolarHBondContact O-N 3.04Å; Q51-V108 HydrophobicContact CG-CG1 4.23Å; Q51-D124 PolarHBondContact NE2-OD1 3Å
52G90.2Very high90.2Very high31 Ų3157.8 Ų57.832%0.3229%0.293SS..Hα-helixtrans-60.7-34.7173.100000113.2H48 P50 F56H48-G52 WeakPolarHBondContact O-CA 3.49Å; H48-G52 PolarHBondContact O-N 3.42Å; P50-G52 PolarHBondContact O-N 3.35Å; G52-F56 WeakPolarHBondContact O-CB 3.48Å; G52-F56 PolarHBondContact O-N 3.15Å
53W94.4Very high90.3Very high88 Ų8858.5 Ų58.533%0.33330%0.295SS..Hα-helixtrans-66.3-44.2173.4171.5-114.2000111.5P50 Q51 M55 F56 V57 S100P50-W53 WeakPolarHBondContact O-CB 3.43Å; P50-W53 PolarHBondContact O-N 3.32Å; Q51-W53 VanDerWaalsContact C-N 3.27Å; Q51-W53 PolarHBondContact O-N 2.71Å; W53-M55 VanDerWaalsContact C-N 3.32Å; W53-M55 PolarHBondContact O-N 3.5Å; W53-F56 AromaticContact CE3-CD1 3.91Å; W53-F56 HydrophobicContact CE3-CD1 3.91Å; W53-F56 HydrophobicContact CH2-CD1 4.5Å; W53-F56 AromaticContact CZ3-CD1 3.67Å; W53-F56 HydrophobicContact CZ3-CD1 3.67Å; W53-F56 AromaticContact CZ3-CE1 3.89Å; W53-F56 HydrophobicContact CZ3-CE1 3.89Å; W53-F56 PolarHBondContact O-N 3.28Å; W53-V57 HydrophobicContact CD2-CG2 3.85Å; W53-V57 VanDerWaalsContact CE2-CG2 3.48Å; W53-V57 HydrophobicContact CE3-CG2 4.14Å; W53-V57 HydrophobicContact CH2-CG2 3.8Å; W53-V57 HydrophobicContact CZ2-CG2 3.47Å; W53-V57 VanDerWaalsContact CZ2-CG2 3.47Å; W53-V57 HydrophobicContact CZ3-CG2 4.12Å; W53-V57 WeakPolarHBondContact O-CG2 3.3Å; W53-V57 PolarHBondContact O-N 3.46Å; W53-S100 PolarHBondContact NE1-OG 2.58Å
54V93.4Very high90.5Very high1 Ų160.9 Ų60.91%0.00631%0.307CS..Hα-helixtrans-60.3-45177.7-177.10000110.7V36 V40 P50 Q51 S58 A101 A104 L105V36-V54 HydrophobicContact CG1-CG1 4.31Å; V40-V54 HydrophobicContact CG2-CG1 3.98Å; P50-V54 PolarHBondContact O-N 3.16Å; Q51-V54 WeakPolarHBondContact O-CB 3.32Å; Q51-V54 PolarHBondContact O-N 2.59Å; Q51-V54 VanDerWaalsContact O-N 3.16Å; V54-S58 VanDerWaalsContact O-CB 3.25Å; V54-S58 WeakPolarHBondContact O-CB 3.13Å; V54-S58 PolarHBondContact O-N 3.45Å; V54-A101 HydrophobicContact CB-CB 4.43Å; V54-A101 HydrophobicContact CG1-CB 4.27Å; V54-A101 HydrophobicContact CG2-CB 4.35Å; V54-A101 WeakPolarHBondContact CG2-O 3.1Å; V54-A104 HydrophobicContact CG2-CB 4.21Å; V54-L105 HydrophobicContact CG1-CB 4.34Å; V54-L105 HydrophobicContact CG1-CD1 4.31Å; V54-L105 HydrophobicContact CG1-CD2 4.16Å; V54-L105 HydrophobicContact CG2-CB 4.03Å; V54-L105 HydrophobicContact CG2-CD1 4.46Å
55M93.9Very high90.7Very high61 Ų6152 Ų5230%0.327%0.272SS..Hα-helixtrans-63.7-46.2177.9-169.3176.4-171.300111.7V40 A41 V45 Q51 W53 S58 V59V40-M55 HydrophobicContact CG1-CB 4.31Å; A41-M55 HydrophobicContact CB-CE 4.26Å; V45-M55 HydrophobicContact CG2-SD 3.58Å; V45-M55 VanDerWaalsContact CG2-SD 3.58Å; Q51-M55 PolarHBondContact O-N 3.04Å; W53-M55 VanDerWaalsContact C-N 3.32Å; W53-M55 PolarHBondContact O-N 3.5Å; M55-S58 PolarHBondContact O-N 3.23Å; M55-V59 HydrophobicContact CG-CG2 4.46Å; M55-V59 WeakPolarHBondContact O-CB 3.18Å; M55-V59 WeakPolarHBondContact O-CG2 3.31Å; M55-V59 PolarHBondContact O-N 2.81Å
56F94.3Very high90.8Very high110 Ų11055.8 Ų55.848%0.48229%0.287SS..Hα-helixtrans-57.7-52.4176.8168.7-100.5000111.9G52 W53 S58 V59 F60G52-F56 WeakPolarHBondContact O-CB 3.48Å; G52-F56 PolarHBondContact O-N 3.15Å; W53-F56 AromaticContact CE3-CD1 3.91Å; W53-F56 HydrophobicContact CE3-CD1 3.91Å; W53-F56 HydrophobicContact CH2-CD1 4.5Å; W53-F56 AromaticContact CZ3-CD1 3.67Å; W53-F56 HydrophobicContact CZ3-CD1 3.67Å; W53-F56 AromaticContact CZ3-CE1 3.89Å; W53-F56 HydrophobicContact CZ3-CE1 3.89Å; W53-F56 PolarHBondContact O-N 3.28Å; F56-S58 VanDerWaalsContact C-N 3.33Å; F56-S58 PolarHBondContact O-N 3.06Å; F56-V59 PolarHBondContact O-N 2.97Å; F56-F60 WeakPolarHBondContact O-CB 3.47Å; F56-F60 PolarHBondContact O-N 2.99Å
57V94.6Very high91.2Very high0 Ų056 Ų560%028%0.284CS..Hα-helixtrans-57.9-48.4179.8164.50000110.8W53 F60 C61 F97 Y98 A101W53-V57 HydrophobicContact CD2-CG2 3.85Å; W53-V57 VanDerWaalsContact CE2-CG2 3.48Å; W53-V57 HydrophobicContact CE3-CG2 4.14Å; W53-V57 HydrophobicContact CH2-CG2 3.8Å; W53-V57 HydrophobicContact CZ2-CG2 3.47Å; W53-V57 VanDerWaalsContact CZ2-CG2 3.47Å; W53-V57 HydrophobicContact CZ3-CG2 4.12Å; W53-V57 WeakPolarHBondContact O-CG2 3.3Å; W53-V57 PolarHBondContact O-N 3.46Å; V57-F60 PolarHBondContact O-N 3.48Å; V57-C61 WeakPolarHBondContact O-CB 3.41Å; V57-C61 PolarHBondContact O-N 3.19Å; V57-C61 PolarHBondContact O-SG 3.06Å; V57-F97 HydrophobicContact CG1-CB 3.83Å; V57-F97 HydrophobicContact CG2-CB 4.26Å; V57-F97 HydrophobicContact CG2-CD2 4.28Å; V57-Y98 HydrophobicContact CG1-CD2 4.04Å; V57-Y98 HydrophobicContact CG1-CE2 4.35Å; V57-Y98 HydrophobicContact CG1-CG 4.38Å; V57-A101 HydrophobicContact CB-CB 4.01Å; V57-A101 HydrophobicContact CG1-CB 3.86Å; V57-A101 HydrophobicContact CG2-CB 4.33Å
58S93.4Very high91.2Very high1 Ų155.1 Ų55.11%0.00728%0.275CS..Hα-helixtrans-66-43.9-174.3-179.60000112.1G33 W37 V54 M55 F56 F62 Y98G33-S58 PolarHBondContact O-OG 3.08Å; W37-S58 WeakPolarHBondContact CB-OG 3.38Å; W37-S58 PolarHBondContact N-OG 2.91Å; V54-S58 VanDerWaalsContact O-CB 3.25Å; V54-S58 WeakPolarHBondContact O-CB 3.13Å; V54-S58 PolarHBondContact O-N 3.45Å; M55-S58 PolarHBondContact O-N 3.23Å; F56-S58 VanDerWaalsContact C-N 3.33Å; F56-S58 PolarHBondContact O-N 3.06Å; S58-F62 VanDerWaalsContact O-CB 3.25Å; S58-F62 WeakPolarHBondContact O-CB 3.43Å; S58-F62 PolarHBondContact O-N 3.39Å; S58-Y98 WeakPolarHBondContact CA-OH 3.23Å; S58-Y98 WeakPolarHBondContact CB-OH 3.28Å; S58-Y98 PolarHBondContact OG-OH 3.46Å
59V94.3Very high91.1Very high55 Ų5549.1 Ų49.133%0.33325%0.248SC..Hα-helixtrans-68.3-44176.4174.10000111.7W37 M55 F56 C61 F62 V63W37-V59 HydrophobicContact CB-CG2 3.88Å; W37-V59 HydrophobicContact CD2-CG2 4.17Å; W37-V59 HydrophobicContact CG-CG2 3.85Å; M55-V59 HydrophobicContact CG-CG2 4.46Å; M55-V59 WeakPolarHBondContact O-CB 3.18Å; M55-V59 WeakPolarHBondContact O-CG2 3.31Å; M55-V59 PolarHBondContact O-N 2.81Å; F56-V59 PolarHBondContact O-N 2.97Å; V59-C61 PolarHBondContact O-N 3.23Å; V59-F62 PolarHBondContact O-N 2.95Å; V59-V63 HydrophobicContact CG1-CG2 4.39Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.49Å
60F93.9Very high91Very high79 Ų7945.5 Ų45.535%0.34623%0.231SC..Hα-helixtrans-57.5-52.2178.5171.2-100.6000111.2F56 V57 F62 V63 M64 F97F56-F60 WeakPolarHBondContact O-CB 3.47Å; F56-F60 PolarHBondContact O-N 2.99Å; V57-F60 PolarHBondContact O-N 3.48Å; F60-F62 PolarHBondContact O-N 3.38Å; F60-V63 PolarHBondContact O-N 2.85Å; F60-M64 HydrophobicContact CD2-CG 4.28Å; F60-M64 HydrophobicContact CE1-CG 4.25Å; F60-M64 HydrophobicContact CE2-CG 3.9Å; F60-M64 HydrophobicContact CE2-SD 4.47Å; F60-M64 HydrophobicContact CZ-CG 3.88Å; F60-M64 WeakPolarHBondContact O-CB 3.38Å; F60-M64 VanDerWaalsContact O-CG 3.3Å; F60-M64 WeakPolarHBondContact O-CG 3.25Å; F60-M64 PolarHBondContact O-N 3.32Å; F60-F97 HydrophobicContact CD1-CD2 4.45Å; F60-F97 HydrophobicContact CE1-CE2 4.49Å
61C92.6Very high90.6Very high1 Ų145.6 Ų45.61%0.00723%0.231CC..Hα-helixtrans-64.6-38.3177-72.60000111.8V57 V59 V63 M64 T65 Y90 Y98 Y138V57-C61 WeakPolarHBondContact O-CB 3.41Å; V57-C61 PolarHBondContact O-N 3.19Å; V57-C61 PolarHBondContact O-SG 3.06Å; V59-C61 PolarHBondContact O-N 3.23Å; C61-V63 PolarHBondContact O-N 3.46Å; C61-M64 PolarHBondContact O-N 3.03Å; C61-T65 WeakPolarHBondContact O-CB 3.16Å; C61-T65 PolarHBondContact O-N 3.41Å; C61-T65 PolarHBondContact O-OG1 3.38Å; C61-Y90 PolarHBondContact O-OH 3.37Å; C61-Y98 HydrophobicContact CB-CD2 4.09Å; C61-Y98 HydrophobicContact CB-CE2 3.54Å; C61-Y138 HydrophobicContact CB-CE2 4.41Å
62F92.4Very high90Very high59 Ų5945.7 Ų45.726%0.25923%0.231SC..Hα-helixtrans-59-47.8175.9179.9-89.9000111.9L30 W37 S58 V59 F60 F66L30-F62 HydrophobicContact CB-CE2 4.2Å; L30-F62 HydrophobicContact CD2-CD2 3.66Å; L30-F62 HydrophobicContact CD2-CE2 3.7Å; L30-F62 HydrophobicContact CD2-CG 4.13Å; L30-F62 HydrophobicContact CD2-CZ 4.2Å; L30-F62 VanDerWaalsContact CD2-O 3.32Å; L30-F62 WeakPolarHBondContact CD2-O 3.43Å; L30-F62 VanDerWaalsContact O-CE2 3.3Å; L30-F62 WeakPolarHBondContact O-CE2 3.48Å; W37-F62 AromaticContact NE1-CD2 3.92Å; W37-F62 AromaticContact NE1-CG 3.85Å; S58-F62 VanDerWaalsContact O-CB 3.25Å; S58-F62 WeakPolarHBondContact O-CB 3.43Å; S58-F62 PolarHBondContact O-N 3.39Å; V59-F62 PolarHBondContact O-N 2.95Å; F60-F62 PolarHBondContact O-N 3.38Å; F62-F66 VanDerWaalsContact O-CB 3.31Å; F62-F66 WeakPolarHBondContact O-CB 3.31Å; F62-F66 PolarHBondContact O-N 2.95Å
63V93.4Very high89.3Confident73 Ų7346.1 Ų46.144%0.44223%0.232SC..Hα-helixtrans-64.5-45.2178.9172.90000111.1V59 F60 C61 F66 I67V59-V63 HydrophobicContact CG1-CG2 4.39Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.49Å; F60-V63 PolarHBondContact O-N 2.85Å; C61-V63 PolarHBondContact O-N 3.46Å; V63-F66 WeakPolarHBondContact O-CB 3.28Å; V63-F66 PolarHBondContact O-N 2.98Å; V63-I67 HydrophobicContact CG1-CD1 3.93Å; V63-I67 VanDerWaalsContact O-CG1 3.31Å; V63-I67 WeakPolarHBondContact O-CG1 3.24Å; V63-I67 PolarHBondContact O-N 3.06Å
64M90.7Very high88.4Confident58 Ų5846.5 Ų46.529%0.28625%0.247SC..Hα-helixtrans-66.5-43.5-179.4-70.4-59.8-61.400112.3F60 C61 F66 I67 W68 Y90F60-M64 HydrophobicContact CD2-CG 4.28Å; F60-M64 HydrophobicContact CE1-CG 4.25Å; F60-M64 HydrophobicContact CE2-CG 3.9Å; F60-M64 HydrophobicContact CE2-SD 4.47Å; F60-M64 HydrophobicContact CZ-CG 3.88Å; F60-M64 WeakPolarHBondContact O-CB 3.38Å; F60-M64 VanDerWaalsContact O-CG 3.3Å; F60-M64 WeakPolarHBondContact O-CG 3.25Å; F60-M64 PolarHBondContact O-N 3.32Å; C61-M64 PolarHBondContact O-N 3.03Å; M64-F66 VanDerWaalsContact C-N 3.28Å; M64-F66 PolarHBondContact O-N 2.73Å; M64-I67 PolarHBondContact O-N 3.36Å; M64-I67 HydrophobicContact SD-CD1 4.27Å; M64-W68 PolarHBondContact O-N 2.86Å; M64-Y90 HydrophobicContact CB-CD2 4.33Å; M64-Y90 HydrophobicContact CB-CE2 3.35Å; M64-Y90 VanDerWaalsContact CB-OH 3.29Å; M64-Y90 WeakPolarHBondContact CB-OH 3.49Å; M64-Y90 HydrophobicContact CG-CE2 4.09Å
65T89.9Confident87.2Confident0 Ų048 Ų480%026%0.263CS..Hα-helixtrans-62-36.9174.5-61.50000110.9Y26 E29 L30 C61 W68 L69 Y90 Y138Y26-T65 HydrophobicContact CD1-CG2 3.68Å; Y26-T65 HydrophobicContact CE1-CG2 4.41Å; E29-T65 HydrophobicContact CB-CG2 4.04Å; L30-T65 HydrophobicContact CD2-CG2 4Å; L30-T65 HydrophobicContact CG-CG2 3.86Å; C61-T65 WeakPolarHBondContact O-CB 3.16Å; C61-T65 PolarHBondContact O-N 3.41Å; C61-T65 PolarHBondContact O-OG1 3.38Å; T65-W68 PolarHBondContact O-N 2.96Å; T65-L69 WeakPolarHBondContact O-CB 3.5Å; T65-L69 PolarHBondContact O-N 3.04Å; T65-Y90 PolarHBondContact N-OH 3.43Å; T65-Y90 VanDerWaalsContact N-OH 3.16Å; T65-Y90 PolarHBondContact OG1-OH 2.94Å; T65-Y138 WeakPolarHBondContact OG1-CE1 3.47Å; T65-Y138 PolarHBondContact OG1-OH 3.36Å
66F88.8Confident85.8Confident106 Ų10649.3 Ų49.347%0.46528%0.278SS..Hα-helixtrans-66.9-43.4174.4-178.5-101.7000112.1L30 F62 V63 M64 L69 V70L30-F66 HydrophobicContact CD1-CD2 4.27Å; L30-F66 HydrophobicContact CD2-CB 3.94Å; F62-F66 VanDerWaalsContact O-CB 3.31Å; F62-F66 WeakPolarHBondContact O-CB 3.31Å; F62-F66 PolarHBondContact O-N 2.95Å; V63-F66 WeakPolarHBondContact O-CB 3.28Å; V63-F66 PolarHBondContact O-N 2.98Å; M64-F66 VanDerWaalsContact C-N 3.28Å; M64-F66 PolarHBondContact O-N 2.73Å; F66-L69 WeakPolarHBondContact O-CB 3.39Å; F66-L69 PolarHBondContact O-N 3.32Å; F66-V70 HydrophobicContact CD1-CG2 4.37Å; F66-V70 HydrophobicContact CE1-CG2 3.95Å; F66-V70 HydrophobicContact CE2-CG2 4.4Å; F66-V70 HydrophobicContact CZ-CG2 3.97Å; F66-V70 WeakPolarHBondContact O-CG2 3.4Å; F66-V70 PolarHBondContact O-N 3.36Å
67I89.1Confident84.3Confident80 Ų8044.3 Ų44.341%0.4126%0.256SS..Hα-helixtrans-58.9-50.1174.6-69.4164.7000109.5V63 M64 L69 V70 V71V63-I67 HydrophobicContact CG1-CD1 3.93Å; V63-I67 VanDerWaalsContact O-CG1 3.31Å; V63-I67 WeakPolarHBondContact O-CG1 3.24Å; V63-I67 PolarHBondContact O-N 3.06Å; M64-I67 PolarHBondContact O-N 3.36Å; M64-I67 HydrophobicContact SD-CD1 4.27Å; I67-L69 VanDerWaalsContact C-N 3.34Å; I67-L69 PolarHBondContact O-N 3.02Å; I67-V70 PolarHBondContact O-N 2.93Å; I67-V70 VanDerWaalsContact O-N 3.08Å; I67-V71 HydrophobicContact CG2-CG2 4.14Å; I67-V71 WeakPolarHBondContact O-CG2 3.12Å; I67-V71 PolarHBondContact O-N 3.24Å
68W85.4Confident82.7Confident24 Ų2447.9 Ų47.99%0.09129%0.292CS..Hα-helixtrans-55.8-47.5177.4-82.9118.3000112.4Y26 M64 T65 V70 V71 F72 H77 W83 A86 D87 Y90Y26-W68 HydrophobicContact CD1-CB 4.44Å; Y26-W68 HydrophobicContact CE1-CB 3.6Å; Y26-W68 HydrophobicContact CE1-CG 4.41Å; M64-W68 PolarHBondContact O-N 2.86Å; T65-W68 PolarHBondContact O-N 2.96Å; W68-V70 VanDerWaalsContact C-N 3.28Å; W68-V70 PolarHBondContact O-N 2.84Å; W68-V71 PolarHBondContact O-N 3.05Å; W68-F72 HydrophobicContact CB-CD2 4.36Å; W68-F72 HydrophobicContact CB-CE2 4.48Å; W68-F72 HydrophobicContact CD2-CE2 4.03Å; W68-F72 AromaticContact CE3-CD2 3.8Å; W68-F72 HydrophobicContact CE3-CD2 3.8Å; W68-F72 AromaticContact CE3-CE2 3.12Å; W68-F72 HydrophobicContact CE3-CE2 3.12Å; W68-F72 AromaticContact CE3-CZ 3.79Å; W68-F72 HydrophobicContact CE3-CZ 3.79Å; W68-F72 HydrophobicContact CZ3-CD2 4.47Å; W68-F72 AromaticContact CZ3-CE2 3.5Å; W68-F72 HydrophobicContact CZ3-CE2 3.5Å; W68-F72 VanDerWaalsContact CZ3-CE2 3.5Å; W68-F72 AromaticContact CZ3-CZ 3.65Å; W68-F72 HydrophobicContact CZ3-CZ 3.65Å; W68-F72 WeakPolarHBondContact O-CB 3.3Å; W68-F72 WeakPolarHBondContact O-CD2 3.3Å; W68-F72 PolarHBondContact O-N 2.71Å; W68-H77 AromaticContact CZ3-NE2 3.75Å; W68-W83 AromaticContact CH2-CE3 3.95Å; W68-W83 HydrophobicContact CH2-CE3 3.95Å; W68-W83 HydrophobicContact CH2-CZ3 4.27Å; W68-W83 AromaticContact CZ3-CE3 3.76Å; W68-W83 HydrophobicContact CZ3-CE3 3.76Å; W68-W83 HydrophobicContact CZ3-CZ3 4Å; W68-A86 HydrophobicContact CH2-CB 3.85Å; W68-A86 HydrophobicContact CZ2-CB 4.18Å; W68-D87 HydrophobicContact CH2-CB 4.28Å; W68-Y90 AromaticContact CD1-CD1 3.48Å; W68-Y90 VanDerWaalsContact CD1-CD1 3.48Å; W68-Y90 AromaticContact CD1-CE1 3.66Å; W68-Y90 AromaticContact CD1-CG 3.87Å; W68-Y90 HydrophobicContact CG-CD1 4.5Å; W68-Y90 AromaticContact NE1-CD1 3.39Å; W68-Y90 AromaticContact NE1-CD2 3.91Å; W68-Y90 AromaticContact NE1-CG 3.33Å; W68-Y90 VanDerWaalsContact NE1-CG 3.33Å
69L84.9Confident81.4Confident33 Ų3350 Ų5017%0.17330%0.304CS..Hα-helixtrans-53.8-45.9175.2-179.473.3000111.5V17 Y26 L30 T65 F66 I67 F72 A73V17-L69 HydrophobicContact CG1-CD1 3.81Å; Y26-L69 HydrophobicContact CG-CD1 4.38Å; L30-L69 HydrophobicContact CD1-CD2 3.68Å; T65-L69 WeakPolarHBondContact O-CB 3.5Å; T65-L69 PolarHBondContact O-N 3.04Å; F66-L69 WeakPolarHBondContact O-CB 3.39Å; F66-L69 PolarHBondContact O-N 3.32Å; I67-L69 VanDerWaalsContact C-N 3.34Å; I67-L69 PolarHBondContact O-N 3.02Å; L69-F72 PolarHBondContact O-N 3.26Å; L69-A73 WeakPolarHBondContact O-CB 3.3Å; L69-A73 PolarHBondContact O-N 3.49Å
70V83.5Confident80.6Confident62 Ų6250.2 Ų50.238%0.37631%0.308SS..Hα-helixtrans-66.5-46.8179.5173.10000111.5F66 I67 W68 F72 A73 C74F66-V70 HydrophobicContact CD1-CG2 4.37Å; F66-V70 HydrophobicContact CE1-CG2 3.95Å; F66-V70 HydrophobicContact CE2-CG2 4.4Å; F66-V70 HydrophobicContact CZ-CG2 3.97Å; F66-V70 WeakPolarHBondContact O-CG2 3.4Å; F66-V70 PolarHBondContact O-N 3.36Å; I67-V70 PolarHBondContact O-N 2.93Å; I67-V70 VanDerWaalsContact O-N 3.08Å; W68-V70 VanDerWaalsContact C-N 3.28Å; W68-V70 PolarHBondContact O-N 2.84Å; V70-F72 PolarHBondContact O-N 3.47Å; V70-A73 PolarHBondContact O-N 3.21Å; V70-C74 WeakPolarHBondContact O-CB 3.41Å; V70-C74 PolarHBondContact O-N 2.92Å; V70-C74 PolarHBondContact O-SG 2.86Å
71V82.2Confident79.9Confident36 Ų3648.9 Ų48.922%0.21831%0.308CS..Hα-helixtrans-62.2-37.7179.6-169.20000109.8I67 W68 C74 G75 H77 W83I67-V71 HydrophobicContact CG2-CG2 4.14Å; I67-V71 WeakPolarHBondContact O-CG2 3.12Å; I67-V71 PolarHBondContact O-N 3.24Å; W68-V71 PolarHBondContact O-N 3.05Å; V71-C74 PolarHBondContact O-N 3.25Å; V71-G75 PolarHBondContact O-N 2.79Å; V71-H77 VanDerWaalsContact CB-CE1 3.44Å; V71-H77 WeakPolarHBondContact CB-CE1 3.47Å; V71-H77 WeakPolarHBondContact CG1-CE1 3.33Å; V71-H77 WeakPolarHBondContact CG1-NE2 3.22Å; V71-H77 PolarHBondContact O-CE1 3.11Å; V71-H77 PolarHBondContact O-ND1 3.5Å; V71-H77 VanDerWaalsContact O-ND1 3.11Å; V71-W83 HydrophobicContact CG1-CH2 4.31Å; V71-W83 HydrophobicContact CG1-CZ3 4.41Å
72F75.2Confident79.5Confident1 Ų151 Ų510%0.00433%0.33CS..Hα-helixtrans-74.4-40.5-178.1-80.3-65.5000110.4L11 V17 Y26 W68 L69 V70 C74 G75 H77 D87L11-F72 HydrophobicContact CD1-CE1 4.16Å; L11-F72 HydrophobicContact CD2-CD1 4.27Å; L11-F72 HydrophobicContact CD2-CE1 3.66Å; L11-F72 HydrophobicContact CG-CE1 4.46Å; V17-F72 HydrophobicContact CG1-CB 4.49Å; V17-F72 HydrophobicContact CG2-CB 4.23Å; Y26-F72 AromaticContact CE2-CD2 3.96Å; Y26-F72 HydrophobicContact CE2-CD2 3.96Å; Y26-F72 HydrophobicContact CE2-CE2 4.33Å; Y26-F72 AromaticContact CZ-CD2 3.94Å; Y26-F72 WeakPolarHBondContact OH-CD2 3.32Å; Y26-F72 WeakPolarHBondContact OH-CE2 3.2Å; W68-F72 HydrophobicContact CB-CD2 4.36Å; W68-F72 HydrophobicContact CB-CE2 4.48Å; W68-F72 HydrophobicContact CD2-CE2 4.03Å; W68-F72 AromaticContact CE3-CD2 3.8Å; W68-F72 HydrophobicContact CE3-CD2 3.8Å; W68-F72 AromaticContact CE3-CE2 3.12Å; W68-F72 HydrophobicContact CE3-CE2 3.12Å; W68-F72 AromaticContact CE3-CZ 3.79Å; W68-F72 HydrophobicContact CE3-CZ 3.79Å; W68-F72 HydrophobicContact CZ3-CD2 4.47Å; W68-F72 AromaticContact CZ3-CE2 3.5Å; W68-F72 HydrophobicContact CZ3-CE2 3.5Å; W68-F72 VanDerWaalsContact CZ3-CE2 3.5Å; W68-F72 AromaticContact CZ3-CZ 3.65Å; W68-F72 HydrophobicContact CZ3-CZ 3.65Å; W68-F72 WeakPolarHBondContact O-CB 3.3Å; W68-F72 WeakPolarHBondContact O-CD2 3.3Å; W68-F72 PolarHBondContact O-N 2.71Å; L69-F72 PolarHBondContact O-N 3.26Å; V70-F72 PolarHBondContact O-N 3.47Å; F72-C74 VanDerWaalsContact C-N 3.33Å; F72-C74 PolarHBondContact O-N 3.38Å; F72-G75 PolarHBondContact O-N 3.19Å; F72-G75 VanDerWaalsContact O-N 3.11Å; F72-H77 WeakPolarHBondContact CA-CE1 3.12Å; F72-H77 WeakPolarHBondContact CA-ND1 3.34Å; F72-H77 AromaticContact CD1-CE1 3.1Å; F72-H77 WeakPolarHBondContact CD1-CE1 3.04Å; F72-H77 AromaticContact CD1-CG 3.88Å; F72-H77 AromaticContact CD1-ND1 3.18Å; F72-H77 WeakPolarHBondContact CD1-ND1 3.33Å; F72-H77 AromaticContact CD1-NE2 3.83Å; F72-H77 AromaticContact CD2-CE1 3.69Å; F72-H77 HydrophobicContact CE1-CB 4.47Å; F72-H77 AromaticContact CE1-CD2 3.86Å; F72-H77 AromaticContact CE1-CE1 3.4Å; F72-H77 VanDerWaalsContact CE1-CE1 3.4Å; F72-H77 WeakPolarHBondContact CE1-CE1 3.4Å; F72-H77 AromaticContact CE1-CG 3.8Å; F72-H77 AromaticContact CE1-ND1 3.58Å; F72-H77 AromaticContact CE1-NE2 3.65Å; F72-H77 AromaticContact CE2-CE1 3.99Å; F72-H77 AromaticContact CG-CE1 3.22Å; F72-H77 WeakPolarHBondContact CG-CE1 3.48Å; F72-H77 AromaticContact CG-ND1 3.72Å; F72-H77 AromaticContact CZ-CE1 3.84Å; F72-H77 AromaticContact CZ-NE2 3.76Å; F72-H77 PolarHBondContact N-CE1 2.81Å; F72-D87 HydrophobicContact CZ-CB 4.25Å
73A74Confident79.1Confident41 Ų4152.9 Ų52.934%0.33934%0.335SS..Hα-helixtrans-60.5-40.9172.700000112.2G14 L69 V70 G75G14-A73 WeakPolarHBondContact CA-O 3.43Å; G14-A73 PolarHBondContact N-O 2.85Å; L69-A73 WeakPolarHBondContact O-CB 3.3Å; L69-A73 PolarHBondContact O-N 3.49Å; V70-A73 PolarHBondContact O-N 3.21Å; A73-G75 PolarHBondContact O-N 3.29Å
74C76.3Confident78.6Confident96 Ų9649.4 Ų49.465%0.64931%0.314SS*.THydrogen-bonded Turntrans-73.7-10.6177.2-70.10000114V70 V71 F72 S76V70-C74 WeakPolarHBondContact O-CB 3.41Å; V70-C74 PolarHBondContact O-N 2.92Å; V70-C74 PolarHBondContact O-SG 2.86Å; V71-C74 PolarHBondContact O-N 3.25Å; F72-C74 VanDerWaalsContact C-N 3.33Å; F72-C74 PolarHBondContact O-N 3.38Å; C74-S76 PolarHBondContact O-N 2.98Å
75G67.8Low78.4Confident32 Ų3247.4 Ų47.433%0.3331%0.307SS..THydrogen-bonded Turntrans67.816.7176.600000115.1V71 F72 A73 H77V71-G75 PolarHBondContact O-N 2.79Å; F72-G75 PolarHBondContact O-N 3.19Å; F72-G75 VanDerWaalsContact O-N 3.11Å; A73-G75 PolarHBondContact O-N 3.29Å; G75-H77 PolarHBondContact O-N 3.42Å
76S64.9Low78.3Confident88 Ų8849.3 Ų49.362%0.61532%0.322SS*.THydrogen-bonded Turntrans-71.66.7-174.8-169.10000114.5C74C74-S76 PolarHBondContact O-N 2.98Å
77H63.6Low78.3Confident6 Ų644.2 Ų44.23%0.02830%0.3CS..THydrogen-bonded Turntrans-91.8-13.8-165.7-67.8113.6000115.4L11 W68 V71 F72 G75 N79 S80 W83L11-H77 HydrophobicContact CD1-CB 3.66Å; W68-H77 AromaticContact CZ3-NE2 3.75Å; V71-H77 VanDerWaalsContact CB-CE1 3.44Å; V71-H77 WeakPolarHBondContact CB-CE1 3.47Å; V71-H77 WeakPolarHBondContact CG1-CE1 3.33Å; V71-H77 WeakPolarHBondContact CG1-NE2 3.22Å; V71-H77 PolarHBondContact O-CE1 3.11Å; V71-H77 PolarHBondContact O-ND1 3.5Å; V71-H77 VanDerWaalsContact O-ND1 3.11Å; F72-H77 WeakPolarHBondContact CA-CE1 3.12Å; F72-H77 WeakPolarHBondContact CA-ND1 3.34Å; F72-H77 AromaticContact CD1-CE1 3.1Å; F72-H77 WeakPolarHBondContact CD1-CE1 3.04Å; F72-H77 AromaticContact CD1-CG 3.88Å; F72-H77 AromaticContact CD1-ND1 3.18Å; F72-H77 WeakPolarHBondContact CD1-ND1 3.33Å; F72-H77 AromaticContact CD1-NE2 3.83Å; F72-H77 AromaticContact CD2-CE1 3.69Å; F72-H77 HydrophobicContact CE1-CB 4.47Å; F72-H77 AromaticContact CE1-CD2 3.86Å; F72-H77 AromaticContact CE1-CE1 3.4Å; F72-H77 VanDerWaalsContact CE1-CE1 3.4Å; F72-H77 WeakPolarHBondContact CE1-CE1 3.4Å; F72-H77 AromaticContact CE1-CG 3.8Å; F72-H77 AromaticContact CE1-ND1 3.58Å; F72-H77 AromaticContact CE1-NE2 3.65Å; F72-H77 AromaticContact CE2-CE1 3.99Å; F72-H77 AromaticContact CG-CE1 3.22Å; F72-H77 WeakPolarHBondContact CG-CE1 3.48Å; F72-H77 AromaticContact CG-ND1 3.72Å; F72-H77 AromaticContact CZ-CE1 3.84Å; F72-H77 AromaticContact CZ-NE2 3.76Å; F72-H77 PolarHBondContact N-CE1 2.81Å; G75-H77 PolarHBondContact O-N 3.42Å; H77-N79 PolarHBondContact O-N 3.43Å; H77-S80 PolarHBondContact O-N 3.32Å; H77-W83 HydrophobicContact CB-CG 4.34Å; H77-W83 AromaticContact CD2-CD2 3.38Å; H77-W83 AromaticContact CD2-CE2 3.86Å; H77-W83 AromaticContact CD2-CE3 3.27Å; H77-W83 AromaticContact CD2-CG 3.78Å; H77-W83 AromaticContact CD2-CZ3 3.61Å; H77-W83 AromaticContact NE2-CE3 3.64Å; H77-W83 AromaticContact NE2-CZ3 3.67Å; H77-W83 PolarHBondContact O-NE1 2.98Å
78G61.1Low78.2Confident74 Ų7442.5 Ų42.576%0.76329%0.29SS*.THydrogen-bonded Turntrans5521.1172.600000116.5S80G78-S80 VanDerWaalsContact C-N 3.27Å; G78-S80 PolarHBondContact O-N 3Å
79N64.6Low78.6Confident46 Ų4645.7 Ų45.725%0.24631%0.308CS..THydrogen-bonded Turntrans50.837.6180-146.349.1000114.9G9 H10 L11 H77 F152G9-N79 PolarHBondContact O-ND2 3.43Å; H10-N79 WeakPolarHBondContact CA-OD1 3.48Å; L11-N79 PolarHBondContact N-OD1 3.25Å; H77-N79 PolarHBondContact O-N 3.43Å; N79-F152 HydrophobicContact CB-CE1 4.44Å; N79-F152 WeakPolarHBondContact ND2-CE1 3.19Å; N79-F152 VanDerWaalsContact O-CE1 3.26Å; N79-F152 WeakPolarHBondContact O-CE1 3.45Å; N79-F152 WeakPolarHBondContact OD1-CZ 3.5Å
80S78.9Confident78.9Confident60 Ų6045 Ų4542%0.4230%0.303SS..  trans-88.4139.4178.1172.30000112.3H77 G78 G82 W83 A84H77-S80 PolarHBondContact O-N 3.32Å; G78-S80 VanDerWaalsContact C-N 3.27Å; G78-S80 PolarHBondContact O-N 3Å; S80-G82 PolarHBondContact O-N 3.32Å; S80-G82 VanDerWaalsContact O-N 3.11Å; S80-G82 PolarHBondContact OG-N 2.89Å; S80-W83 PolarHBondContact O-N 3.47Å; S80-A84 PolarHBondContact O-N 2.85Å
81S79.3Confident79.4Confident51 Ų5142.1 Ų42.136%0.35729%0.285SS..Hα-helixtrans-53.4-29.5172.3-1760000112.5W83 A84 A85 W149S81-W83 PolarHBondContact O-N 3.28Å; S81-A84 PolarHBondContact O-N 3.07Å; S81-A85 WeakPolarHBondContact O-CB 3.34Å; S81-A85 PolarHBondContact O-N 3Å; S81-W149 PolarHBondContact OG-NE1 3.37Å
82G83.2Confident79.9Confident44 Ų4444.3 Ų44.345%0.45430%0.295SS..Hα-helixtrans-64.2-37.217600000113.9S80 A85 A86S80-G82 PolarHBondContact O-N 3.32Å; S80-G82 VanDerWaalsContact O-N 3.11Å; S80-G82 PolarHBondContact OG-N 2.89Å; G82-A85 PolarHBondContact O-N 3.04Å; G82-A86 WeakPolarHBondContact O-CB 3.32Å; G82-A86 PolarHBondContact O-N 3.42Å
83W84.3Confident80.8Confident100 Ų10047.9 Ų47.938%0.37931%0.314SS..Hα-helixtrans-73.7-35.3176.5-73109.7000111.8W68 V71 H77 S80 S81 A86 D87W68-W83 AromaticContact CH2-CE3 3.95Å; W68-W83 HydrophobicContact CH2-CE3 3.95Å; W68-W83 HydrophobicContact CH2-CZ3 4.27Å; W68-W83 AromaticContact CZ3-CE3 3.76Å; W68-W83 HydrophobicContact CZ3-CE3 3.76Å; W68-W83 HydrophobicContact CZ3-CZ3 4Å; V71-W83 HydrophobicContact CG1-CH2 4.31Å; V71-W83 HydrophobicContact CG1-CZ3 4.41Å; H77-W83 HydrophobicContact CB-CG 4.34Å; H77-W83 AromaticContact CD2-CD2 3.38Å; H77-W83 AromaticContact CD2-CE2 3.86Å; H77-W83 AromaticContact CD2-CE3 3.27Å; H77-W83 AromaticContact CD2-CG 3.78Å; H77-W83 AromaticContact CD2-CZ3 3.61Å; H77-W83 AromaticContact NE2-CE3 3.64Å; H77-W83 AromaticContact NE2-CZ3 3.67Å; H77-W83 PolarHBondContact O-NE1 2.98Å; S80-W83 PolarHBondContact O-N 3.47Å; S81-W83 PolarHBondContact O-N 3.28Å; W83-A86 PolarHBondContact O-N 2.86Å; W83-D87 VanDerWaalsContact O-CB 3.28Å; W83-D87 WeakPolarHBondContact O-CB 3.39Å; W83-D87 PolarHBondContact O-N 2.97Å
84A82.9Confident81.8Confident0 Ų046 Ų460%030%0.298CS..Hα-helixtrans-64.8-39.2172.400000112.1S80 S81 F88 W149 F152S80-A84 PolarHBondContact O-N 2.85Å; S81-A84 PolarHBondContact O-N 3.07Å; A84-F88 PolarHBondContact O-N 3.26Å; A84-F88 VanDerWaalsContact O-N 3.09Å; A84-W149 HydrophobicContact CB-CB 4.16Å; A84-W149 HydrophobicContact CB-CG 4.45Å; A84-F152 HydrophobicContact CB-CD2 3.89Å; A84-F152 HydrophobicContact CB-CE2 3.81Å
85A86.6Confident82.7Confident16 Ų1642.2 Ų42.213%0.13227%0.272CS..Hα-helixtrans-67.2-43.8174.900000112.3S81 G82 F88 I89 W149S81-A85 WeakPolarHBondContact O-CB 3.34Å; S81-A85 PolarHBondContact O-N 3Å; G82-A85 PolarHBondContact O-N 3.04Å; A85-F88 PolarHBondContact O-N 2.95Å; A85-I89 VanDerWaalsContact O-CG1 3.28Å; A85-I89 WeakPolarHBondContact O-CG1 3.48Å; A85-I89 PolarHBondContact O-N 3.01Å; A85-W149 HydrophobicContact CB-CD2 4.17Å; A85-W149 HydrophobicContact CB-CG 4.48Å; A85-W149 HydrophobicContact CB-CZ2 4.01Å
86A88.5Confident84Confident39 Ų3944.9 Ų44.932%0.32228%0.282SS..Hα-helixtrans-63-41.6178.400000112.2W68 G82 W83 I89 Y90W68-A86 HydrophobicContact CH2-CB 3.85Å; W68-A86 HydrophobicContact CZ2-CB 4.18Å; G82-A86 WeakPolarHBondContact O-CB 3.32Å; G82-A86 PolarHBondContact O-N 3.42Å; W83-A86 PolarHBondContact O-N 2.86Å; A86-I89 PolarHBondContact O-N 2.76Å; A86-Y90 WeakPolarHBondContact O-CB 3.25Å; A86-Y90 PolarHBondContact O-N 3.44Å
87D87.6Confident85.4Confident0 Ų043.7 Ų43.70%027%0.265CS..Hα-helixtrans-59.1-49.9172.7171.884.9000111.5Y26 W68 F72 W83 I89 Y90 H91 S145 R148Y26-D87 PolarHBondContact OH-OD1 2.93Å; W68-D87 HydrophobicContact CH2-CB 4.28Å; F72-D87 HydrophobicContact CZ-CB 4.25Å; W83-D87 VanDerWaalsContact O-CB 3.28Å; W83-D87 WeakPolarHBondContact O-CB 3.39Å; W83-D87 PolarHBondContact O-N 2.97Å; D87-I89 PolarHBondContact O-N 3.46Å; D87-Y90 PolarHBondContact O-N 2.91Å; D87-H91 PolarHBondContact O-N 3.2Å; D87-H91 PolarHBondContact O-ND1 3.31Å; D87-H91 IonicContact OD1-CE1 2.81Å; D87-H91 PolarHBondContact OD1-CE1 3.42Å; D87-H91 IonicContact OD1-ND1 3.46Å; D87-H91 PolarHBondContact OD1-ND1 3.44Å; D87-S145 WeakPolarHBondContact OD2-CB 3.48Å; D87-S145 PolarHBondContact OD2-OG 2.98Å; D87-R148 IonicContact OD1-NH2 3.79Å; D87-R148 PolarHBondContact OD1-NH2 3.41Å; D87-R148 IonicContact OD2-CZ 3.16Å; D87-R148 IonicContact OD2-NH2 3.35Å; D87-R148 PolarHBondContact OD2-NH2 3.13Å
88F88.4Confident86.8Confident44 Ų4443.4 Ų43.419%0.19326%0.264CS..Hα-helixtrans-57.3-47.7175.8165.5-107.7000112.9A84 A85 Y90 H91 L92 T142 A146 W149A84-F88 PolarHBondContact O-N 3.26Å; A84-F88 VanDerWaalsContact O-N 3.09Å; A85-F88 PolarHBondContact O-N 2.95Å; F88-Y90 VanDerWaalsContact C-N 3.33Å; F88-Y90 PolarHBondContact O-N 3.36Å; F88-H91 PolarHBondContact O-N 3.47Å; F88-L92 HydrophobicContact CZ-CD2 4.22Å; F88-L92 WeakPolarHBondContact O-CB 3.37Å; F88-L92 PolarHBondContact O-N 3.5Å; F88-T142 HydrophobicContact CD2-CG2 3.87Å; F88-T142 WeakPolarHBondContact CD2-O 3.36Å; F88-T142 HydrophobicContact CE2-CG2 3.58Å; F88-A146 HydrophobicContact CD2-CB 3.72Å; F88-A146 HydrophobicContact CE2-CB 3.68Å; F88-W149 HydrophobicContact CD1-CE3 4.02Å; F88-W149 HydrophobicContact CD1-CZ3 4.07Å; F88-W149 HydrophobicContact CE1-CZ3 4.26Å; F88-W149 HydrophobicContact CG-CE3 4.49Å
89I92Very high88.4Confident91 Ų9143.9 Ų43.947%0.46725%0.249SC..Hα-helixtrans-62.5-42.7-179.1-69166000110.7A85 A86 D87 L92 I93A85-I89 VanDerWaalsContact O-CG1 3.28Å; A85-I89 WeakPolarHBondContact O-CG1 3.48Å; A85-I89 PolarHBondContact O-N 3.01Å; A86-I89 PolarHBondContact O-N 2.76Å; D87-I89 PolarHBondContact O-N 3.46Å; I89-L92 PolarHBondContact O-N 3.41Å; I89-I93 HydrophobicContact CG2-CD1 3.82Å; I89-I93 VanDerWaalsContact O-CG1 3.32Å; I89-I93 WeakPolarHBondContact O-CG1 3.43Å; I89-I93 PolarHBondContact O-N 3.42Å
90Y92.9Very high89.9Confident19 Ų1944.3 Ų44.38%0.07526%0.255CS..Hα-helixtrans-59.8-50.9177.2169.2-105.7000111.5C61 M64 T65 W68 A86 D87 F88 L92 I93 A94C61-Y90 PolarHBondContact O-OH 3.37Å; M64-Y90 HydrophobicContact CB-CD2 4.33Å; M64-Y90 HydrophobicContact CB-CE2 3.35Å; M64-Y90 VanDerWaalsContact CB-OH 3.29Å; M64-Y90 WeakPolarHBondContact CB-OH 3.49Å; M64-Y90 HydrophobicContact CG-CE2 4.09Å; T65-Y90 PolarHBondContact N-OH 3.43Å; T65-Y90 VanDerWaalsContact N-OH 3.16Å; T65-Y90 PolarHBondContact OG1-OH 2.94Å; W68-Y90 AromaticContact CD1-CD1 3.48Å; W68-Y90 VanDerWaalsContact CD1-CD1 3.48Å; W68-Y90 AromaticContact CD1-CE1 3.66Å; W68-Y90 AromaticContact CD1-CG 3.87Å; W68-Y90 HydrophobicContact CG-CD1 4.5Å; W68-Y90 AromaticContact NE1-CD1 3.39Å; W68-Y90 AromaticContact NE1-CD2 3.91Å; W68-Y90 AromaticContact NE1-CG 3.33Å; W68-Y90 VanDerWaalsContact NE1-CG 3.33Å; A86-Y90 WeakPolarHBondContact O-CB 3.25Å; A86-Y90 PolarHBondContact O-N 3.44Å; D87-Y90 PolarHBondContact O-N 2.91Å; F88-Y90 VanDerWaalsContact C-N 3.33Å; F88-Y90 PolarHBondContact O-N 3.36Å; Y90-L92 VanDerWaalsContact C-N 3.3Å; Y90-L92 PolarHBondContact O-N 3.48Å; Y90-I93 PolarHBondContact O-N 2.84Å; Y90-A94 WeakPolarHBondContact O-CB 3.33Å; Y90-A94 PolarHBondContact O-N 3.23Å
91H92.8Very high90.6Very high0 Ų041.5 Ų41.50%024%0.236CC..Hα-helixtrans-63.1-38.3-179.1-69.386000111.5Y26 E29 D87 F88 I93 A94 V95 Y138 H141 T142Y26-H91 AromaticContact CE1-CE1 3.73Å; Y26-H91 AromaticContact CE1-NE2 3.58Å; Y26-H91 AromaticContact CZ-CE1 3.75Å; Y26-H91 AromaticContact CZ-NE2 3.96Å; Y26-H91 PolarHBondContact OH-CE1 3.34Å; E29-H91 IonicContact OE2-NE2 2.71Å; D87-H91 PolarHBondContact O-N 3.2Å; D87-H91 PolarHBondContact O-ND1 3.31Å; D87-H91 IonicContact OD1-CE1 2.81Å; D87-H91 PolarHBondContact OD1-CE1 3.42Å; D87-H91 IonicContact OD1-ND1 3.46Å; D87-H91 PolarHBondContact OD1-ND1 3.44Å; F88-H91 PolarHBondContact O-N 3.47Å; H91-I93 PolarHBondContact O-N 3.31Å; H91-A94 WeakPolarHBondContact O-CB 3.45Å; H91-A94 PolarHBondContact O-N 2.69Å; H91-V95 WeakPolarHBondContact O-CG2 3.22Å; H91-V95 PolarHBondContact O-N 3.46Å; H91-Y138 AromaticContact CD2-CD1 3.89Å; H91-H141 AromaticContact CD2-CD2 3.84Å; H91-H141 AromaticContact CD2-CE1 3.68Å; H91-H141 AromaticContact CD2-CG 3.31Å; H91-H141 AromaticContact CD2-ND1 3.21Å; H91-H141 PolarHBondContact CD2-ND1 3.34Å; H91-H141 AromaticContact CE1-CE1 3.49Å; H91-H141 PolarHBondContact CE1-CE1 3.22Å; H91-H141 VanDerWaalsContact CE1-CE1 3.49Å; H91-H141 AromaticContact CE1-ND1 3.84Å; H91-H141 AromaticContact CE1-NE2 3.64Å; H91-H141 AromaticContact CG-CG 3.93Å; H91-H141 AromaticContact NE2-CD2 3.86Å; H91-H141 AromaticContact NE2-CE1 3.04Å; H91-H141 PolarHBondContact NE2-CE1 2.97Å; H91-H141 AromaticContact NE2-CG 3.55Å; H91-H141 AromaticContact NE2-ND1 3.02Å; H91-H141 PolarHBondContact NE2-ND1 3.34Å; H91-H141 AromaticContact NE2-NE2 3.6Å; H91-T142 VanDerWaalsContact CB-OG1 3.28Å; H91-T142 WeakPolarHBondContact CB-OG1 3.46Å; H91-T142 PolarHBondContact O-OG1 3.29Å
92L93.5Very high91.3Very high82 Ų8239.1 Ų39.143%0.42922%0.219SC..Hα-helixtrans-60.6-45.5174.7-17866.2000112.2F88 I89 Y90 A94 V95 V96 T142F88-L92 HydrophobicContact CZ-CD2 4.22Å; F88-L92 WeakPolarHBondContact O-CB 3.37Å; F88-L92 PolarHBondContact O-N 3.5Å; I89-L92 PolarHBondContact O-N 3.41Å; Y90-L92 VanDerWaalsContact C-N 3.3Å; Y90-L92 PolarHBondContact O-N 3.48Å; L92-A94 VanDerWaalsContact C-N 3.34Å; L92-V95 PolarHBondContact O-N 3.08Å; L92-V96 PolarHBondContact O-N 2.85Å; L92-T142 HydrophobicContact CB-CG2 3.95Å; L92-T142 HydrophobicContact CD1-CG2 4.07Å; L92-T142 PolarHBondContact N-OG1 3.3Å
93I94.3Very high91.9Very high76 Ų7641 Ų4139%0.3922%0.222SC..Hα-helixtrans-64.2-42.7176.3-67.1167.5000110.2I89 Y90 H91 V95 V96 F97I89-I93 HydrophobicContact CG2-CD1 3.82Å; I89-I93 VanDerWaalsContact O-CG1 3.32Å; I89-I93 WeakPolarHBondContact O-CG1 3.43Å; I89-I93 PolarHBondContact O-N 3.42Å; Y90-I93 PolarHBondContact O-N 2.84Å; H91-I93 PolarHBondContact O-N 3.31Å; I93-V95 VanDerWaalsContact C-N 3.33Å; I93-V95 PolarHBondContact O-N 3.2Å; I93-V96 PolarHBondContact O-N 2.94Å; I93-F97 HydrophobicContact CG2-CD1 4.01Å; I93-F97 HydrophobicContact CG2-CE1 3.91Å; I93-F97 HydrophobicContact CG2-CG 4.38Å; I93-F97 HydrophobicContact CG2-CZ 4.17Å; I93-F97 WeakPolarHBondContact O-CB 3.17Å; I93-F97 WeakPolarHBondContact O-CD1 3.27Å; I93-F97 PolarHBondContact O-N 2.94Å
94A93.7Very high92.3Very high1 Ų137.1 Ų37.11%0.00821%0.211CC..Hα-helixtrans-59.4-42178.400000111.7Y90 H91 L92 V96 F97 Y98 Y138Y90-A94 WeakPolarHBondContact O-CB 3.33Å; Y90-A94 PolarHBondContact O-N 3.23Å; H91-A94 WeakPolarHBondContact O-CB 3.45Å; H91-A94 PolarHBondContact O-N 2.69Å; L92-A94 VanDerWaalsContact C-N 3.34Å; A94-V96 PolarHBondContact O-N 3.29Å; A94-F97 PolarHBondContact O-N 2.85Å; A94-Y98 WeakPolarHBondContact O-CB 3.36Å; A94-Y98 PolarHBondContact O-N 3.5Å; A94-Y138 HydrophobicContact CB-CD1 3.9Å; A94-Y138 HydrophobicContact CB-CD2 4.15Å; A94-Y138 HydrophobicContact CB-CE1 4.13Å; A94-Y138 HydrophobicContact CB-CE2 4.38Å; A94-Y138 HydrophobicContact CB-CG 3.93Å
95V95.2Very high92.7Very high17 Ų1737.1 Ų37.110%0.10321%0.211CC..Hα-helixtrans-57.2-50.1174173.10000111.5H91 L92 I93 F97 Y98 L99 T135 Y138 F139 T142H91-V95 WeakPolarHBondContact O-CG2 3.22Å; H91-V95 PolarHBondContact O-N 3.46Å; L92-V95 PolarHBondContact O-N 3.08Å; I93-V95 VanDerWaalsContact C-N 3.33Å; I93-V95 PolarHBondContact O-N 3.2Å; V95-F97 VanDerWaalsContact C-N 3.32Å; V95-F97 PolarHBondContact O-N 3.21Å; V95-Y98 PolarHBondContact O-N 2.97Å; V95-L99 WeakPolarHBondContact O-CB 3.39Å; V95-L99 PolarHBondContact O-N 3.05Å; V95-T135 HydrophobicContact CG1-CG2 4.4Å; V95-Y138 WeakPolarHBondContact CG2-O 3.44Å; V95-F139 HydrophobicContact CG1-CB 4.36Å; V95-F139 HydrophobicContact CG1-CD2 4.27Å; V95-F139 VanDerWaalsContact CG2-CA 3.43Å; V95-F139 HydrophobicContact CG2-CB 3.93Å; V95-F139 VanDerWaalsContact CG2-N 3.29Å; V95-T142 WeakPolarHBondContact CG2-OG1 3.25Å
96V95.8Very high93Very high88 Ų8837.3 Ų37.353%0.53321%0.213SC..Hα-helixtrans-63.1-42.7-1781750000110.6L92 I93 A94 S100L92-V96 PolarHBondContact O-N 2.85Å; I93-V96 PolarHBondContact O-N 2.94Å; A94-V96 PolarHBondContact O-N 3.29Å; V96-S100 WeakPolarHBondContact O-CB 3.47Å; V96-S100 PolarHBondContact O-N 2.98Å
97F93.8Very high93.1Very high63 Ų6340.9 Ų40.928%0.27622%0.221SC..Hα-helixtrans-65.9-48.9179.3-8431.7000111.2V57 F60 I93 A94 V95 L99 S100 A101V57-F97 HydrophobicContact CG1-CB 3.83Å; V57-F97 HydrophobicContact CG2-CB 4.26Å; V57-F97 HydrophobicContact CG2-CD2 4.28Å; F60-F97 HydrophobicContact CD1-CD2 4.45Å; F60-F97 HydrophobicContact CE1-CE2 4.49Å; I93-F97 HydrophobicContact CG2-CD1 4.01Å; I93-F97 HydrophobicContact CG2-CE1 3.91Å; I93-F97 HydrophobicContact CG2-CG 4.38Å; I93-F97 HydrophobicContact CG2-CZ 4.17Å; I93-F97 WeakPolarHBondContact O-CB 3.17Å; I93-F97 WeakPolarHBondContact O-CD1 3.27Å; I93-F97 PolarHBondContact O-N 2.94Å; A94-F97 PolarHBondContact O-N 2.85Å; V95-F97 VanDerWaalsContact C-N 3.32Å; V95-F97 PolarHBondContact O-N 3.21Å; F97-L99 VanDerWaalsContact C-N 3.34Å; F97-L99 PolarHBondContact O-N 3.26Å; F97-S100 WeakPolarHBondContact O-CB 3.44Å; F97-S100 PolarHBondContact O-N 3.25Å; F97-A101 PolarHBondContact O-N 3.35Å
98Y93.9Very high93.1Very high1 Ų140.9 Ų40.90%0.00422%0.221CC..Hα-helixtrans-67.2-32.7179.3-107.6-85.4000113G33 V36 V57 S58 C61 A94 V95 A101 S102 T134 T135 Y138G33-Y98 WeakPolarHBondContact CA-OH 3.43Å; V36-Y98 HydrophobicContact CG2-CE1 4.42Å; V57-Y98 HydrophobicContact CG1-CD2 4.04Å; V57-Y98 HydrophobicContact CG1-CE2 4.35Å; V57-Y98 HydrophobicContact CG1-CG 4.38Å; S58-Y98 WeakPolarHBondContact CA-OH 3.23Å; S58-Y98 WeakPolarHBondContact CB-OH 3.28Å; S58-Y98 PolarHBondContact OG-OH 3.46Å; C61-Y98 HydrophobicContact CB-CD2 4.09Å; C61-Y98 HydrophobicContact CB-CE2 3.54Å; A94-Y98 WeakPolarHBondContact O-CB 3.36Å; A94-Y98 PolarHBondContact O-N 3.5Å; V95-Y98 PolarHBondContact O-N 2.97Å; Y98-A101 PolarHBondContact O-N 2.92Å; Y98-S102 VanDerWaalsContact O-CB 3.28Å; Y98-S102 WeakPolarHBondContact O-CB 3.5Å; Y98-S102 PolarHBondContact O-N 3.4Å; Y98-S102 PolarHBondContact O-OG 3.22Å; Y98-T134 HydrophobicContact CD1-CG2 3.77Å; Y98-T134 HydrophobicContact CD2-CG2 4.24Å; Y98-T134 HydrophobicContact CE1-CG2 3.42Å; Y98-T134 VanDerWaalsContact CE1-CG2 3.42Å; Y98-T134 HydrophobicContact CE2-CG2 3.91Å; Y98-T134 HydrophobicContact CG-CG2 4.16Å; Y98-T135 PolarHBondContact O-OG1 3.49Å; Y98-Y138 AromaticContact CD2-CD2 3.77Å; Y98-Y138 HydrophobicContact CD2-CD2 3.77Å; Y98-Y138 AromaticContact CD2-CE2 3.44Å; Y98-Y138 HydrophobicContact CD2-CE2 3.44Å; Y98-Y138 VanDerWaalsContact CD2-CE2 3.44Å; Y98-Y138 HydrophobicContact CE2-CD2 4.26Å; Y98-Y138 AromaticContact CE2-CE2 3.49Å; Y98-Y138 HydrophobicContact CE2-CE2 3.49Å; Y98-Y138 VanDerWaalsContact CE2-CE2 3.49Å; Y98-Y138 HydrophobicContact CG-CD2 4.18Å; Y98-Y138 HydrophobicContact CG-CE2 4.2Å
99L94.8Very high93.1Very high83 Ų8339.3 Ų39.344%0.43522%0.215SC..Hα-helixtrans-64.4-45.2171.7-17764000110.7V95 F97 S102 V103 T135V95-L99 WeakPolarHBondContact O-CB 3.39Å; V95-L99 PolarHBondContact O-N 3.05Å; F97-L99 VanDerWaalsContact C-N 3.34Å; F97-L99 PolarHBondContact O-N 3.26Å; L99-S102 PolarHBondContact O-N 3.23Å; L99-V103 WeakPolarHBondContact O-CG2 3.44Å; L99-V103 PolarHBondContact O-N 3.33Å; L99-T135 HydrophobicContact CB-CG2 4Å; L99-T135 HydrophobicContact CD1-CG2 4.37Å
100S95.1Very high92.9Very high55 Ų5541.8 Ų41.839%0.38523%0.226SC..Hα-helixtrans-59.3-47.1175.2177.30000111.9W53 V96 F97 V103 A104W53-S100 PolarHBondContact NE1-OG 2.58Å; V96-S100 WeakPolarHBondContact O-CB 3.47Å; V96-S100 PolarHBondContact O-N 2.98Å; F97-S100 WeakPolarHBondContact O-CB 3.44Å; F97-S100 PolarHBondContact O-N 3.25Å; S100-V103 PolarHBondContact O-N 3.12Å; S100-A104 WeakPolarHBondContact O-CB 3.5Å; S100-A104 PolarHBondContact O-N 3.38Å; S100-A104 VanDerWaalsContact O-N 3.1Å
101A94.2Very high92.6Very high2 Ų245 Ų452%0.01725%0.245CC..Hα-helixtrans-62.2-42.4176.300000112.2V54 V57 F97 Y98 V103 A104 L105V54-A101 HydrophobicContact CB-CB 4.43Å; V54-A101 HydrophobicContact CG1-CB 4.27Å; V54-A101 HydrophobicContact CG2-CB 4.35Å; V54-A101 WeakPolarHBondContact CG2-O 3.1Å; V57-A101 HydrophobicContact CB-CB 4.01Å; V57-A101 HydrophobicContact CG1-CB 3.86Å; V57-A101 HydrophobicContact CG2-CB 4.33Å; F97-A101 PolarHBondContact O-N 3.35Å; Y98-A101 PolarHBondContact O-N 2.92Å; A101-V103 PolarHBondContact O-N 3.47Å; A101-A104 PolarHBondContact O-N 2.71Å; A101-L105 VanDerWaalsContact O-CB 3.32Å; A101-L105 WeakPolarHBondContact O-CB 3.4Å; A101-L105 PolarHBondContact O-N 3.46Å
102S94.5Very high92Very high0 Ų049 Ų490%026%0.262CS..Hα-helixtrans-63.9-42.1180-61.40000112.3Y98 L99 L105 A106 S131 T135Y98-S102 VanDerWaalsContact O-CB 3.28Å; Y98-S102 WeakPolarHBondContact O-CB 3.5Å; Y98-S102 PolarHBondContact O-N 3.4Å; Y98-S102 PolarHBondContact O-OG 3.22Å; L99-S102 PolarHBondContact O-N 3.23Å; S102-L105 PolarHBondContact O-N 2.88Å; S102-A106 VanDerWaalsContact O-CB 3.31Å; S102-A106 WeakPolarHBondContact O-CB 3.33Å; S102-A106 PolarHBondContact O-N 2.9Å; S102-S131 WeakPolarHBondContact CA-OG 3.47Å; S102-S131 WeakPolarHBondContact CB-OG 3.48Å; S102-S131 VanDerWaalsContact OG-C 3.25Å; S102-S131 VanDerWaalsContact OG-CB 3.27Å; S102-S131 WeakPolarHBondContact OG-CB 3.28Å; S102-S131 PolarHBondContact OG-O 3.03Å; S102-S131 PolarHBondContact OG-OG 3.47Å; S102-T135 PolarHBondContact OG-OG1 3.39Å
103V94.6Very high91.2Very high84 Ų8452 Ų5251%0.50927%0.272SS..Hα-helixtrans-64.8-43.7176.2174.10000110.9L99 S100 A101 A106 K107L99-V103 WeakPolarHBondContact O-CG2 3.44Å; L99-V103 PolarHBondContact O-N 3.33Å; S100-V103 PolarHBondContact O-N 3.12Å; A101-V103 PolarHBondContact O-N 3.47Å; V103-A106 PolarHBondContact O-N 3.26Å; V103-K107 PolarHBondContact O-N 2.96Å
104A92.6Very high90.1Very high18 Ų1853.7 Ų53.715%0.14929%0.29CS..Hα-helixtrans-62.2-44.117700000112.1P50 V54 S100 A101 K107 V108P50-A104 HydrophobicContact CB-CB 3.95Å; P50-A104 HydrophobicContact CG-CB 4.07Å; V54-A104 HydrophobicContact CG2-CB 4.21Å; S100-A104 WeakPolarHBondContact O-CB 3.5Å; S100-A104 PolarHBondContact O-N 3.38Å; S100-A104 VanDerWaalsContact O-N 3.1Å; A101-A104 PolarHBondContact O-N 2.71Å; A104-K107 WeakPolarHBondContact O-CB 3.45Å; A104-K107 PolarHBondContact O-N 3Å; A104-V108 WeakPolarHBondContact O-CG2 3.36Å; A104-V108 PolarHBondContact O-N 3.3Å; A104-V108 VanDerWaalsContact O-N 3.13Å
105L91.1Very high89Confident0 Ų057.7 Ų57.70%031%0.312CS..Hα-helixtrans-64.8-45.1178.1-169.762.7000111.3V40 V54 A101 S102 K107 V108 T109 A127 V128V40-L105 HydrophobicContact CG2-CD1 4.06Å; V40-L105 HydrophobicContact CG2-CD2 4.48Å; V54-L105 HydrophobicContact CG1-CB 4.34Å; V54-L105 HydrophobicContact CG1-CD1 4.31Å; V54-L105 HydrophobicContact CG1-CD2 4.16Å; V54-L105 HydrophobicContact CG2-CB 4.03Å; V54-L105 HydrophobicContact CG2-CD1 4.46Å; A101-L105 VanDerWaalsContact O-CB 3.32Å; A101-L105 WeakPolarHBondContact O-CB 3.4Å; A101-L105 PolarHBondContact O-N 3.46Å; S102-L105 PolarHBondContact O-N 2.88Å; L105-K107 VanDerWaalsContact C-N 3.31Å; L105-K107 PolarHBondContact O-N 3.21Å; L105-V108 PolarHBondContact O-N 2.97Å; L105-V108 VanDerWaalsContact O-N 3.16Å; L105-T109 PolarHBondContact O-N 2.91Å; L105-T109 PolarHBondContact O-OG1 3.25Å; L105-A127 VanDerWaalsContact CD2-C 3.44Å; L105-A127 HydrophobicContact CD2-CB 3.68Å; L105-V128 HydrophobicContact CB-CG2 4.17Å; L105-V128 HydrophobicContact CD2-CG2 3.94Å; L105-V128 HydrophobicContact CG-CG2 3.63Å
106A92.8Very high87.7Confident21 Ų2159.5 Ų59.517%0.17432%0.324CS..Hα-helixtrans-60.1-40.4177.200000112.3S102 V103 T109 M110 V128 Y132S102-A106 VanDerWaalsContact O-CB 3.31Å; S102-A106 WeakPolarHBondContact O-CB 3.33Å; S102-A106 PolarHBondContact O-N 2.9Å; V103-A106 PolarHBondContact O-N 3.26Å; A106-T109 PolarHBondContact O-N 3.14Å; A106-M110 WeakPolarHBondContact O-CG 3.16Å; A106-M110 PolarHBondContact O-N 3.35Å; A106-V128 HydrophobicContact CB-CG1 4.16Å; A106-V128 HydrophobicContact CB-CG2 4.39Å; A106-Y132 HydrophobicContact CB-CE2 4.45Å
107K91.4Very high86.6Confident113 Ų11363.7 Ų63.749%0.49134%0.335SS..Hα-helixtrans-58.4-51.8173.9-166.5-58.4-160.4-172.40110.4V103 A104 L105 T109 M110 D111V103-K107 PolarHBondContact O-N 2.96Å; A104-K107 WeakPolarHBondContact O-CB 3.45Å; A104-K107 PolarHBondContact O-N 3Å; L105-K107 VanDerWaalsContact C-N 3.31Å; L105-K107 PolarHBondContact O-N 3.21Å; K107-T109 VanDerWaalsContact C-N 3.32Å; K107-T109 PolarHBondContact O-N 3.45Å; K107-M110 WeakPolarHBondContact O-CB 3.36Å; K107-M110 PolarHBondContact O-N 2.9Å; K107-M110 VanDerWaalsContact O-N 3.09Å; K107-D111 WeakPolarHBondContact CD-OD2 3.36Å; K107-D111 WeakPolarHBondContact CE-OD2 3.28Å; K107-D111 IonicContact NZ-OD1 3.73Å; K107-D111 PolarHBondContact NZ-OD1 3.01Å; K107-D111 IonicContact NZ-OD2 2.74Å; K107-D111 PolarHBondContact NZ-OD2 3.2Å; K107-D111 PolarHBondContact O-N 3.35Å; K107-D111 VanDerWaalsContact O-N 3.13Å
108V88.1Confident86.1Confident1 Ų162.9 Ų62.91%0.00634%0.336CS..Hα-helixtrans-57.3-46.3179.7171.20000111P47 P50 Q51 A104 L105 M110 D111 F112P47-V108 HydrophobicContact CG-CG1 4.39Å; P47-V108 HydrophobicContact CG-CG2 4.35Å; P50-V108 VanDerWaalsContact CD-CG2 3.43Å; P50-V108 HydrophobicContact CG-CG2 3.41Å; P50-V108 VanDerWaalsContact CG-CG2 3.41Å; Q51-V108 HydrophobicContact CG-CG1 4.23Å; A104-V108 WeakPolarHBondContact O-CG2 3.36Å; A104-V108 PolarHBondContact O-N 3.3Å; A104-V108 VanDerWaalsContact O-N 3.13Å; L105-V108 PolarHBondContact O-N 2.97Å; L105-V108 VanDerWaalsContact O-N 3.16Å; V108-M110 VanDerWaalsContact C-N 3.28Å; V108-M110 PolarHBondContact O-N 3.48Å; V108-D111 WeakPolarHBondContact O-CB 3.36Å; V108-D111 PolarHBondContact O-N 3.38Å; V108-D111 VanDerWaalsContact O-N 3.11Å; V108-F112 HydrophobicContact CG1-CD2 3.75Å; V108-F112 HydrophobicContact CG1-CE2 3.6Å; V108-F112 VanDerWaalsContact O-CD2 3.26Å; V108-F112 WeakPolarHBondContact O-CD2 3.45Å; V108-F112 PolarHBondContact O-N 3.01Å
109T88.5Confident85.6Confident11 Ų1168.6 Ų68.67%0.06736%0.361CS..Hα-helixtrans-58.9-39.6177.2-48.70000112.1L105 A106 K107 D111 F112 K113 Y121 D124 I125 V128L105-T109 PolarHBondContact O-N 2.91Å; L105-T109 PolarHBondContact O-OG1 3.25Å; A106-T109 PolarHBondContact O-N 3.14Å; K107-T109 VanDerWaalsContact C-N 3.32Å; K107-T109 PolarHBondContact O-N 3.45Å; T109-D111 VanDerWaalsContact C-N 3.33Å; T109-D111 PolarHBondContact O-N 3.22Å; T109-F112 PolarHBondContact O-N 3.45Å; T109-K113 PolarHBondContact O-N 3.16Å; T109-Y121 HydrophobicContact CG2-CD2 4.22Å; T109-Y121 HydrophobicContact CG2-CE2 3.92Å; T109-Y121 WeakPolarHBondContact O-CE2 3.36Å; T109-D124 HydrophobicContact CG2-CB 4.15Å; T109-I125 HydrophobicContact CG2-CG1 3.63Å; T109-V128 VanDerWaalsContact OG1-CG2 3.3Å; T109-V128 WeakPolarHBondContact OG1-CG2 3.28Å
110M88Confident85.1Confident143 Ų14367.8 Ų67.870%0.70436%0.357SS*.Hα-helixtrans-65.4-34.5177.2-72.2178.867.400113A106 K107 V108 F112 K113A106-M110 WeakPolarHBondContact O-CG 3.16Å; A106-M110 PolarHBondContact O-N 3.35Å; K107-M110 WeakPolarHBondContact O-CB 3.36Å; K107-M110 PolarHBondContact O-N 2.9Å; K107-M110 VanDerWaalsContact O-N 3.09Å; V108-M110 VanDerWaalsContact C-N 3.28Å; V108-M110 PolarHBondContact O-N 3.48Å; M110-F112 VanDerWaalsContact C-N 3.33Å; M110-K113 WeakPolarHBondContact O-CB 3.35Å; M110-K113 PolarHBondContact O-N 2.86Å
111D85.3Confident84.7Confident87 Ų8767 Ų6747%0.46535%0.346SS..Hα-helixtrans-67.1-36.1176.9-61.3-35.4000112K107 V108 T109 K113K107-D111 WeakPolarHBondContact CD-OD2 3.36Å; K107-D111 WeakPolarHBondContact CE-OD2 3.28Å; K107-D111 IonicContact NZ-OD1 3.73Å; K107-D111 PolarHBondContact NZ-OD1 3.01Å; K107-D111 IonicContact NZ-OD2 2.74Å; K107-D111 PolarHBondContact NZ-OD2 3.2Å; K107-D111 PolarHBondContact O-N 3.35Å; K107-D111 VanDerWaalsContact O-N 3.13Å; V108-D111 WeakPolarHBondContact O-CB 3.36Å; V108-D111 PolarHBondContact O-N 3.38Å; V108-D111 VanDerWaalsContact O-N 3.11Å; T109-D111 VanDerWaalsContact C-N 3.33Å; T109-D111 PolarHBondContact O-N 3.22Å; D111-K113 PolarHBondContact O-N 3.45Å
112F79.9Confident84.5Confident83 Ų8372.9 Ų72.936%0.36437%0.371SS..G310 helixtrans-81.33.4179.2-73.6-67.3000114.2V108 T109 M110 S114 D115 Y121V108-F112 HydrophobicContact CG1-CD2 3.75Å; V108-F112 HydrophobicContact CG1-CE2 3.6Å; V108-F112 VanDerWaalsContact O-CD2 3.26Å; V108-F112 WeakPolarHBondContact O-CD2 3.45Å; V108-F112 PolarHBondContact O-N 3.01Å; T109-F112 PolarHBondContact O-N 3.45Å; M110-F112 VanDerWaalsContact C-N 3.33Å; F112-S114 PolarHBondContact O-N 3.45Å; F112-D115 PolarHBondContact O-N 3.17Å; F112-Y121 HydrophobicContact CB-CD2 4.22Å
113K77.5Confident84.3Confident144 Ų14474.3 Ų74.363%0.62638%0.378SS*.G310 helixtrans-59-21.9-179.5-176.5178.3177.2-175.80113.9T109 M110 D111 D115 P116 Y121T109-K113 PolarHBondContact O-N 3.16Å; M110-K113 WeakPolarHBondContact O-CB 3.35Å; M110-K113 PolarHBondContact O-N 2.86Å; D111-K113 PolarHBondContact O-N 3.45Å; K113-D115 PolarHBondContact O-N 2.99Å; K113-P116 WeakPolarHBondContact O-CD 3.3Å; K113-Y121 HydrophobicContact CB-CE2 4.29Å
114S72.2Confident84.1Confident112 Ų11270.5 Ų70.578%0.78336%0.355SS*.G310 helixtrans-61.3-22.8179.650.50000113.6F112F112-S114 PolarHBondContact O-N 3.45Å
115D69.9Low84.1Confident85 Ų8572.9 Ų72.946%0.45537%0.365SS..  trans-129.175.2176-160.9-10.8000112.6F112 K113 F117 T118F112-D115 PolarHBondContact O-N 3.17Å; K113-D115 PolarHBondContact O-N 2.99Å; D115-F117 PolarHBondContact O-N 3.48Å; D115-F117 VanDerWaalsContact O-N 3.16Å; D115-T118 HydrophobicContact CB-CG2 3.91Å; D115-T118 PolarHBondContact O-N 3.33Å; D115-T118 PolarHBondContact O-OG1 2.82Å; D115-T118 WeakPolarHBondContact OD2-CG2 3.34Å
116P67.4Low84.1Confident56 Ų5674.5 Ų74.536%0.36438%0.376SS..THydrogen-bonded Turntrans-72.9-8.7-16930.4-35.7000114.1K113 Y121K113-P116 WeakPolarHBondContact O-CD 3.3Å; P116-Y121 HydrophobicContact CB-CD1 4.15Å; P116-Y121 HydrophobicContact CB-CE1 3.88Å; P116-Y121 WeakPolarHBondContact O-CD1 3.47Å
117F73.1Confident84.2Confident175 Ų17573.5 Ų73.577%0.76837%0.368SS*.THydrogen-bonded Turntrans-92.4-7.3-179.6-63.2-72.5000113.1D115D115-F117 PolarHBondContact O-N 3.48Å; D115-F117 VanDerWaalsContact O-N 3.16Å
118T82.2Confident84.3Confident47 Ų4769.1 Ų69.129%0.28835%0.35SS..SBendtrans-65.1144.5176.8580000111.5D115 D120 Y121 K122D115-T118 HydrophobicContact CB-CG2 3.91Å; D115-T118 PolarHBondContact O-N 3.33Å; D115-T118 PolarHBondContact O-OG1 2.82Å; D115-T118 WeakPolarHBondContact OD2-CG2 3.34Å; T118-D120 PolarHBondContact O-N 3.4Å; T118-Y121 WeakPolarHBondContact OG1-CB 3.47Å; T118-Y121 PolarHBondContact OG1-N 2.72Å; T118-K122 PolarHBondContact O-N 3.28Å
119K84.6Confident84.6Confident120 Ų12073 Ų7352%0.52237%0.374SS..Hα-helixtrans-57.4-39.8173.8-177.5-174.862.757.80110.7K122 L123K119-K122 PolarHBondContact O-N 3.31Å; K119-L123 HydrophobicContact CD-CD1 4.39Å; K119-L123 HydrophobicContact CG-CD1 3.69Å; K119-L123 WeakPolarHBondContact O-CD1 3.39Å; K119-L123 PolarHBondContact O-N 2.84Å
120D84.9Confident84.9Confident66 Ų6675.2 Ų75.235%0.35338%0.383SS..Hα-helixtrans-72.1-37.9-171.9-55.9-26.4000111.7T43 T118 K122 L123 D124T43-D120 HydrophobicContact CG2-CB 4.2Å; T118-D120 PolarHBondContact O-N 3.4Å; D120-K122 VanDerWaalsContact C-N 3.31Å; D120-K122 PolarHBondContact O-N 2.84Å; D120-L123 PolarHBondContact O-N 2.97Å; D120-D124 PolarHBondContact O-N 3.49Å
121Y86.5Confident85.2Confident39 Ų3968.4 Ų68.415%0.15335%0.349CS..Hα-helixtrans-58.9-40.3171.4179.5-106.6000112.7T109 F112 K113 P116 T118 D124 I125T109-Y121 HydrophobicContact CG2-CD2 4.22Å; T109-Y121 HydrophobicContact CG2-CE2 3.92Å; T109-Y121 WeakPolarHBondContact O-CE2 3.36Å; F112-Y121 HydrophobicContact CB-CD2 4.22Å; K113-Y121 HydrophobicContact CB-CE2 4.29Å; P116-Y121 HydrophobicContact CB-CD1 4.15Å; P116-Y121 HydrophobicContact CB-CE1 3.88Å; P116-Y121 WeakPolarHBondContact O-CD1 3.47Å; T118-Y121 WeakPolarHBondContact OG1-CB 3.47Å; T118-Y121 PolarHBondContact OG1-N 2.72Å; Y121-D124 PolarHBondContact O-N 3.49Å; Y121-I125 HydrophobicContact CD1-CD1 3.79Å; Y121-I125 HydrophobicContact CE1-CD1 3.28Å; Y121-I125 HydrophobicContact CE1-CG1 4.3Å; Y121-I125 HydrophobicContact CE2-CD1 4.24Å; Y121-I125 HydrophobicContact CE2-CG1 4.5Å; Y121-I125 HydrophobicContact CG-CD1 4.47Å; Y121-I125 WeakPolarHBondContact O-CG1 3.37Å; Y121-I125 PolarHBondContact O-N 3.46Å
122K89.3Confident85.7Confident125 Ų12569 Ų6954%0.54335%0.346SS..Hα-helixtrans-67.7-39.2176.7-65.1177.4-176.51760112.1T118 K119 D120 S126T118-K122 PolarHBondContact O-N 3.28Å; K119-K122 PolarHBondContact O-N 3.31Å; D120-K122 VanDerWaalsContact C-N 3.31Å; D120-K122 PolarHBondContact O-N 2.84Å; K122-S126 PolarHBondContact O-N 3.43Å; K122-S126 VanDerWaalsContact O-N 3.14Å; K122-S126 PolarHBondContact O-OG 3.19Å
123L89.9Confident86.4Confident31 Ų3167.5 Ų67.516%0.16234%0.343CS..Hα-helixtrans-63.2-46.7173.8-93.891.3000111.1L39 C42 T43 K119 D120 I125 S126 A127L39-L123 HydrophobicContact CD2-CD2 4.06Å; L39-L123 HydrophobicContact CD2-CG 4.1Å; C42-L123 HydrophobicContact CB-CD2 3.19Å; T43-L123 HydrophobicContact CG2-CB 3.82Å; T43-L123 HydrophobicContact CG2-CD2 4.34Å; K119-L123 HydrophobicContact CD-CD1 4.39Å; K119-L123 HydrophobicContact CG-CD1 3.69Å; K119-L123 WeakPolarHBondContact O-CD1 3.39Å; K119-L123 PolarHBondContact O-N 2.84Å; D120-L123 PolarHBondContact O-N 2.97Å; L123-I125 PolarHBondContact O-N 2.84Å; L123-S126 PolarHBondContact O-N 3.41Å; L123-S126 VanDerWaalsContact O-N 3.13Å; L123-S126 PolarHBondContact O-OG 2.79Å; L123-A127 WeakPolarHBondContact O-CB 3.33Å; L123-A127 PolarHBondContact O-N 2.86Å
124D90.6Very high87.2Confident3 Ų360.7 Ų60.72%0.01631%0.313CS..Hα-helixtrans-60.8-43.4178.9-85.4-13.9000111.7Q51 T109 D120 Y121 S126 A127 V128Q51-D124 PolarHBondContact NE2-OD1 3Å; T109-D124 HydrophobicContact CG2-CB 4.15Å; D120-D124 PolarHBondContact O-N 3.49Å; Y121-D124 PolarHBondContact O-N 3.49Å; D124-S126 VanDerWaalsContact C-N 3.33Å; D124-S126 PolarHBondContact O-N 3.35Å; D124-A127 PolarHBondContact O-N 3.39Å; D124-V128 WeakPolarHBondContact O-CG2 3.45Å; D124-V128 PolarHBondContact O-N 3.42Å
125I91.9Very high88.2Confident69 Ų6956 Ų5635%0.35428%0.28SS..Hα-helixtrans-56.6-48173.3-72.6171.6000111T109 Y121 L123 A127 V128 V129T109-I125 HydrophobicContact CG2-CG1 3.63Å; Y121-I125 HydrophobicContact CD1-CD1 3.79Å; Y121-I125 HydrophobicContact CE1-CD1 3.28Å; Y121-I125 HydrophobicContact CE1-CG1 4.3Å; Y121-I125 HydrophobicContact CE2-CD1 4.24Å; Y121-I125 HydrophobicContact CE2-CG1 4.5Å; Y121-I125 HydrophobicContact CG-CD1 4.47Å; Y121-I125 WeakPolarHBondContact O-CG1 3.37Å; Y121-I125 PolarHBondContact O-N 3.46Å; L123-I125 PolarHBondContact O-N 2.84Å; I125-A127 VanDerWaalsContact C-N 3.3Å; I125-A127 PolarHBondContact O-N 2.86Å; I125-V128 PolarHBondContact O-N 3.41Å; I125-V129 WeakPolarHBondContact O-CG2 3.21Å; I125-V129 PolarHBondContact O-N 3.43Å
126S93.1Very high89.4Confident34 Ų3457.2 Ų57.224%0.23829%0.286CS..Hα-helixtrans-63.4-39.1-180670000111.8L39 K122 L123 D124 V128 V129 F130L39-S126 WeakPolarHBondContact CD1-OG 3.29Å; K122-S126 PolarHBondContact O-N 3.43Å; K122-S126 VanDerWaalsContact O-N 3.14Å; K122-S126 PolarHBondContact O-OG 3.19Å; L123-S126 PolarHBondContact O-N 3.41Å; L123-S126 VanDerWaalsContact O-N 3.13Å; L123-S126 PolarHBondContact O-OG 2.79Å; D124-S126 VanDerWaalsContact C-N 3.33Å; D124-S126 PolarHBondContact O-N 3.35Å; S126-V128 PolarHBondContact O-N 3.05Å; S126-V129 PolarHBondContact O-N 3.09Å; S126-F130 WeakPolarHBondContact O-CD2 3.3Å; S126-F130 WeakPolarHBondContact O-CG 3.27Å; S126-F130 PolarHBondContact O-N 2.91Å
127A93.5Very high90.5Very high0 Ų056 Ų560%028%0.276CS..Hα-helixtrans-64.2-40.3176.900000111.6L39 V40 L105 L123 D124 I125 F130 S131L39-A127 HydrophobicContact CB-CB 3.81Å; L39-A127 HydrophobicContact CD1-CB 4.21Å; V40-A127 HydrophobicContact CG2-CB 4.26Å; L105-A127 VanDerWaalsContact CD2-C 3.44Å; L105-A127 HydrophobicContact CD2-CB 3.68Å; L123-A127 WeakPolarHBondContact O-CB 3.33Å; L123-A127 PolarHBondContact O-N 2.86Å; D124-A127 PolarHBondContact O-N 3.39Å; I125-A127 VanDerWaalsContact C-N 3.3Å; I125-A127 PolarHBondContact O-N 2.86Å; A127-F130 PolarHBondContact O-N 3.46Å; A127-S131 VanDerWaalsContact O-CB 3.3Å; A127-S131 WeakPolarHBondContact O-CB 3.36Å; A127-S131 PolarHBondContact O-N 3.45Å; A127-S131 PolarHBondContact O-OG 3.27Å
128V94.1Very high91.4Very high20 Ų2047.6 Ų47.612%0.12124%0.239CC..Hα-helixtrans-60.1-47.8173.6172.80000111.1L105 A106 T109 D124 I125 S126 F130 S131 Y132L105-V128 HydrophobicContact CB-CG2 4.17Å; L105-V128 HydrophobicContact CD2-CG2 3.94Å; L105-V128 HydrophobicContact CG-CG2 3.63Å; A106-V128 HydrophobicContact CB-CG1 4.16Å; A106-V128 HydrophobicContact CB-CG2 4.39Å; T109-V128 VanDerWaalsContact OG1-CG2 3.3Å; T109-V128 WeakPolarHBondContact OG1-CG2 3.28Å; D124-V128 WeakPolarHBondContact O-CG2 3.45Å; D124-V128 PolarHBondContact O-N 3.42Å; I125-V128 PolarHBondContact O-N 3.41Å; S126-V128 PolarHBondContact O-N 3.05Å; V128-F130 PolarHBondContact O-N 3.28Å; V128-S131 PolarHBondContact O-N 2.95Å; V128-S131 PolarHBondContact O-OG 3.47Å; V128-Y132 HydrophobicContact CG1-CD2 3.72Å; V128-Y132 HydrophobicContact CG1-CE2 3.64Å; V128-Y132 VanDerWaalsContact O-CD2 3.25Å; V128-Y132 WeakPolarHBondContact O-CD2 3.45Å; V128-Y132 PolarHBondContact O-N 3.04Å; V128-Y132 VanDerWaalsContact O-N 3.09Å
129V95.1Very high91.9Very high82 Ų8250.4 Ų50.450%0.49725%0.248SC..Hα-helixtrans-60.5-47.8179.9174.10000110.3I125 S126 S131 Y132 V133I125-V129 WeakPolarHBondContact O-CG2 3.21Å; I125-V129 PolarHBondContact O-N 3.43Å; S126-V129 PolarHBondContact O-N 3.09Å; V129-S131 VanDerWaalsContact C-N 3.35Å; V129-S131 PolarHBondContact O-N 3.22Å; V129-Y132 PolarHBondContact O-N 2.86Å; V129-V133 WeakPolarHBondContact O-CG2 3.48Å; V129-V133 PolarHBondContact O-N 3.44Å
130F94.3Very high92.2Very high59 Ų5947.5 Ų47.526%0.25924%0.24SC..Hα-helixtrans-67.9-31.8178.9-64.2-48.9000113.2F32 L35 V36 L39 S126 A127 V128 V133 T134F32-F130 AromaticContact CD1-CD1 3.66Å; F32-F130 HydrophobicContact CD1-CD1 3.66Å; F32-F130 HydrophobicContact CD1-CE1 4.13Å; F32-F130 HydrophobicContact CD1-CG 4.49Å; F32-F130 HydrophobicContact CE1-CD1 4.04Å; F32-F130 HydrophobicContact CE1-CE1 4.1Å; L35-F130 HydrophobicContact CB-CD2 4.2Å; L35-F130 HydrophobicContact CB-CG 4.49Å; L35-F130 HydrophobicContact CD1-CE1 4.38Å; L35-F130 HydrophobicContact CD1-CE2 4.37Å; L35-F130 HydrophobicContact CD1-CZ 4.3Å; V36-F130 HydrophobicContact CG2-CB 3.75Å; L39-F130 HydrophobicContact CD1-CD2 3.49Å; L39-F130 VanDerWaalsContact CD1-CD2 3.49Å; L39-F130 HydrophobicContact CD1-CE2 3.82Å; S126-F130 WeakPolarHBondContact O-CD2 3.3Å; S126-F130 WeakPolarHBondContact O-CG 3.27Å; S126-F130 PolarHBondContact O-N 2.91Å; A127-F130 PolarHBondContact O-N 3.46Å; V128-F130 PolarHBondContact O-N 3.28Å; F130-V133 PolarHBondContact O-N 3.41Å; F130-T134 WeakPolarHBondContact O-CB 3.34Å; F130-T134 PolarHBondContact O-N 3.13Å; F130-T134 PolarHBondContact O-OG1 3.3Å
131S94.9Very high92.4Very high0 Ų044.3 Ų44.30%022%0.223CC..Hα-helixtrans-68.5-39177.878.40000111.7S102 A127 V128 V129 T134 T135S102-S131 WeakPolarHBondContact CA-OG 3.47Å; S102-S131 WeakPolarHBondContact CB-OG 3.48Å; S102-S131 VanDerWaalsContact OG-C 3.25Å; S102-S131 VanDerWaalsContact OG-CB 3.27Å; S102-S131 WeakPolarHBondContact OG-CB 3.28Å; S102-S131 PolarHBondContact OG-O 3.03Å; S102-S131 PolarHBondContact OG-OG 3.47Å; A127-S131 VanDerWaalsContact O-CB 3.3Å; A127-S131 WeakPolarHBondContact O-CB 3.36Å; A127-S131 PolarHBondContact O-N 3.45Å; A127-S131 PolarHBondContact O-OG 3.27Å; V128-S131 PolarHBondContact O-N 2.95Å; V128-S131 PolarHBondContact O-OG 3.47Å; V129-S131 VanDerWaalsContact C-N 3.35Å; V129-S131 PolarHBondContact O-N 3.22Å; S131-T134 PolarHBondContact O-N 3.31Å; S131-T135 PolarHBondContact O-N 2.97Å; S131-T135 PolarHBondContact O-OG1 3.37Å
132Y95.1Very high92.6Very high100 Ų10042.9 Ų42.939%0.39222%0.218SC..Hα-helixtrans-68.4-40.6173-81.7-67000112.6A106 V128 V129 T134 T135 L136A106-Y132 HydrophobicContact CB-CE2 4.45Å; V128-Y132 HydrophobicContact CG1-CD2 3.72Å; V128-Y132 HydrophobicContact CG1-CE2 3.64Å; V128-Y132 VanDerWaalsContact O-CD2 3.25Å; V128-Y132 WeakPolarHBondContact O-CD2 3.45Å; V128-Y132 PolarHBondContact O-N 3.04Å; V128-Y132 VanDerWaalsContact O-N 3.09Å; V129-Y132 PolarHBondContact O-N 2.86Å; Y132-T134 VanDerWaalsContact C-N 3.3Å; Y132-T134 PolarHBondContact O-N 3.1Å; Y132-T135 WeakPolarHBondContact O-CB 3.37Å; Y132-T135 PolarHBondContact O-N 2.87Å; Y132-L136 PolarHBondContact O-N 2.91Å
133V94.8Very high92.6Very high51 Ų5140.6 Ų40.631%0.30921%0.211SC..Hα-helixtrans-59.6-43.9172.8170.60000110.5F32 V129 F130 T135 L136 L137F32-V133 HydrophobicContact CD1-CG1 4.27Å; F32-V133 HydrophobicContact CD2-CG1 3.99Å; F32-V133 HydrophobicContact CE1-CG1 4.45Å; F32-V133 HydrophobicContact CE2-CG1 4.19Å; F32-V133 HydrophobicContact CG-CG1 4.04Å; F32-V133 HydrophobicContact CZ-CG1 4.42Å; V129-V133 WeakPolarHBondContact O-CG2 3.48Å; V129-V133 PolarHBondContact O-N 3.44Å; F130-V133 PolarHBondContact O-N 3.41Å; V133-T135 VanDerWaalsContact C-N 3.35Å; V133-T135 PolarHBondContact O-N 2.96Å; V133-L136 WeakPolarHBondContact O-CB 3.49Å; V133-L136 PolarHBondContact O-N 3.39Å; V133-L137 HydrophobicContact CG1-CD1 4.08Å; V133-L137 WeakPolarHBondContact O-CG 3.04Å; V133-L137 PolarHBondContact O-N 3.18Å
134T93.6Very high92.3Very high0 Ų041 Ų410%021%0.213CC..Hα-helixtrans-64.2-39.9178-54.50000111.8F32 G33 Y98 F130 S131 Y132 L136 L137 Y138F32-T134 VanDerWaalsContact CB-OG1 3.28Å; F32-T134 WeakPolarHBondContact CB-OG1 3.48Å; G33-T134 PolarHBondContact N-OG1 3.03Å; Y98-T134 HydrophobicContact CD1-CG2 3.77Å; Y98-T134 HydrophobicContact CD2-CG2 4.24Å; Y98-T134 HydrophobicContact CE1-CG2 3.42Å; Y98-T134 VanDerWaalsContact CE1-CG2 3.42Å; Y98-T134 HydrophobicContact CE2-CG2 3.91Å; Y98-T134 HydrophobicContact CG-CG2 4.16Å; F130-T134 WeakPolarHBondContact O-CB 3.34Å; F130-T134 PolarHBondContact O-N 3.13Å; F130-T134 PolarHBondContact O-OG1 3.3Å; S131-T134 PolarHBondContact O-N 3.31Å; Y132-T134 VanDerWaalsContact C-N 3.3Å; Y132-T134 PolarHBondContact O-N 3.1Å; T134-L136 VanDerWaalsContact C-N 3.33Å; T134-L136 PolarHBondContact O-N 3.49Å; T134-L137 PolarHBondContact O-N 3.48Å; T134-Y138 HydrophobicContact CG2-CD2 3.76Å; T134-Y138 HydrophobicContact CG2-CE2 3.42Å; T134-Y138 VanDerWaalsContact CG2-CE2 3.42Å; T134-Y138 VanDerWaalsContact O-CD2 3.27Å; T134-Y138 WeakPolarHBondContact O-CD2 3.42Å; T134-Y138 PolarHBondContact O-N 3.35Å
135T94.4Very high92Very high13 Ų1340.8 Ų40.88%0.0821%0.212CC..Hα-helixtrans-60.6-43.9174.5-53.40000111.1V95 Y98 L99 S102 S131 Y132 V133 Y138 F139V95-T135 HydrophobicContact CG1-CG2 4.4Å; Y98-T135 PolarHBondContact O-OG1 3.49Å; L99-T135 HydrophobicContact CB-CG2 4Å; L99-T135 HydrophobicContact CD1-CG2 4.37Å; S102-T135 PolarHBondContact OG-OG1 3.39Å; S131-T135 PolarHBondContact O-N 2.97Å; S131-T135 PolarHBondContact O-OG1 3.37Å; Y132-T135 WeakPolarHBondContact O-CB 3.37Å; Y132-T135 PolarHBondContact O-N 2.87Å; V133-T135 VanDerWaalsContact C-N 3.35Å; V133-T135 PolarHBondContact O-N 2.96Å; T135-Y138 PolarHBondContact O-N 2.95Å; T135-F139 WeakPolarHBondContact O-CB 3.17Å; T135-F139 PolarHBondContact O-N 3.44Å
136L93.3Very high91.6Very high111 Ų11139.1 Ų39.158%0.58121%0.209SC*.Hα-helixtrans-64-41.9178-174.670.1000111.5Y132 V133 T134 F139 V140Y132-L136 PolarHBondContact O-N 2.91Å; V133-L136 WeakPolarHBondContact O-CB 3.49Å; V133-L136 PolarHBondContact O-N 3.39Å; T134-L136 VanDerWaalsContact C-N 3.33Å; T134-L136 PolarHBondContact O-N 3.49Å; L136-F139 WeakPolarHBondContact O-CB 3.32Å; L136-F139 PolarHBondContact O-N 2.99Å; L136-V140 WeakPolarHBondContact O-CG2 3.3Å; L136-V140 PolarHBondContact O-N 3.13Å
137L91.8Very high91.1Very high30 Ų3041.6 Ų41.616%0.15722%0.218CC..Hα-helixtrans-60.4-51.6176.8-71.8167.4000111.2L25 P28 E29 F32 V133 T134 F139 V140 H141L25-L137 HydrophobicContact CD2-CD2 4.25Å; P28-L137 HydrophobicContact CB-CD1 3.95Å; P28-L137 HydrophobicContact CB-CD2 4.35Å; P28-L137 HydrophobicContact CG-CD2 4.29Å; E29-L137 HydrophobicContact CG-CB 3.78Å; F32-L137 HydrophobicContact CB-CD1 4.47Å; F32-L137 HydrophobicContact CD2-CD1 3.48Å; F32-L137 VanDerWaalsContact CD2-CD1 3.48Å; F32-L137 HydrophobicContact CE2-CD1 4.14Å; F32-L137 HydrophobicContact CG-CD1 4.35Å; V133-L137 HydrophobicContact CG1-CD1 4.08Å; V133-L137 WeakPolarHBondContact O-CG 3.04Å; V133-L137 PolarHBondContact O-N 3.18Å; T134-L137 PolarHBondContact O-N 3.48Å; L137-F139 PolarHBondContact O-N 3.39Å; L137-V140 PolarHBondContact O-N 2.66Å; L137-H141 WeakPolarHBondContact O-CB 3.31Å; L137-H141 PolarHBondContact O-N 3.06Å
138Y92.1Very high90.4Very high0 Ų042 Ų420%022%0.22CC..Hα-helixtrans-58.3-34.2175.3-76.1-52.3000112.3E29 C61 T65 H91 A94 V95 Y98 T134 T135 H141 T142E29-Y138 HydrophobicContact CB-CE1 4.03Å; E29-Y138 VanDerWaalsContact CD-CD1 3.44Å; E29-Y138 VanDerWaalsContact CD-CE1 3.47Å; E29-Y138 HydrophobicContact CG-CD1 3.96Å; E29-Y138 HydrophobicContact CG-CE1 3.84Å; E29-Y138 HydrophobicContact CG-CG 4.49Å; E29-Y138 VanDerWaalsContact OE2-CE1 3.31Å; E29-Y138 WeakPolarHBondContact OE2-CE1 3.5Å; C61-Y138 HydrophobicContact CB-CE2 4.41Å; T65-Y138 WeakPolarHBondContact OG1-CE1 3.47Å; T65-Y138 PolarHBondContact OG1-OH 3.36Å; H91-Y138 AromaticContact CD2-CD1 3.89Å; A94-Y138 HydrophobicContact CB-CD1 3.9Å; A94-Y138 HydrophobicContact CB-CD2 4.15Å; A94-Y138 HydrophobicContact CB-CE1 4.13Å; A94-Y138 HydrophobicContact CB-CE2 4.38Å; A94-Y138 HydrophobicContact CB-CG 3.93Å; V95-Y138 WeakPolarHBondContact CG2-O 3.44Å; Y98-Y138 AromaticContact CD2-CD2 3.77Å; Y98-Y138 HydrophobicContact CD2-CD2 3.77Å; Y98-Y138 AromaticContact CD2-CE2 3.44Å; Y98-Y138 HydrophobicContact CD2-CE2 3.44Å; Y98-Y138 VanDerWaalsContact CD2-CE2 3.44Å; Y98-Y138 HydrophobicContact CE2-CD2 4.26Å; Y98-Y138 AromaticContact CE2-CE2 3.49Å; Y98-Y138 HydrophobicContact CE2-CE2 3.49Å; Y98-Y138 VanDerWaalsContact CE2-CE2 3.49Å; Y98-Y138 HydrophobicContact CG-CD2 4.18Å; Y98-Y138 HydrophobicContact CG-CE2 4.2Å; T134-Y138 HydrophobicContact CG2-CD2 3.76Å; T134-Y138 HydrophobicContact CG2-CE2 3.42Å; T134-Y138 VanDerWaalsContact CG2-CE2 3.42Å; T134-Y138 VanDerWaalsContact O-CD2 3.27Å; T134-Y138 WeakPolarHBondContact O-CD2 3.42Å; T134-Y138 PolarHBondContact O-N 3.35Å; T135-Y138 PolarHBondContact O-N 2.95Å; Y138-H141 PolarHBondContact O-N 2.87Å; Y138-T142 WeakPolarHBondContact O-CB 3.32Å; Y138-T142 PolarHBondContact O-N 3.5Å; Y138-T142 PolarHBondContact O-OG1 3.48Å
139F92.9Very high89.7Confident105 Ų10546.1 Ų46.146%0.46123%0.233SC..Hα-helixtrans-69.9-45.7178.8179.5-106.9000112.2V95 T135 L136 L137 H141 T142 I143V95-F139 HydrophobicContact CG1-CB 4.36Å; V95-F139 HydrophobicContact CG1-CD2 4.27Å; V95-F139 VanDerWaalsContact CG2-CA 3.43Å; V95-F139 HydrophobicContact CG2-CB 3.93Å; V95-F139 VanDerWaalsContact CG2-N 3.29Å; T135-F139 WeakPolarHBondContact O-CB 3.17Å; T135-F139 PolarHBondContact O-N 3.44Å; L136-F139 WeakPolarHBondContact O-CB 3.32Å; L136-F139 PolarHBondContact O-N 2.99Å; L137-F139 PolarHBondContact O-N 3.39Å; F139-H141 VanDerWaalsContact C-N 3.29Å; F139-H141 PolarHBondContact O-N 2.89Å; F139-T142 WeakPolarHBondContact O-CB 3.38Å; F139-T142 PolarHBondContact O-N 3.06Å; F139-I143 HydrophobicContact CD1-CD1 4Å; F139-I143 HydrophobicContact CE1-CD1 3.5Å; F139-I143 VanDerWaalsContact CE1-CD1 3.5Å; F139-I143 HydrophobicContact CE2-CD1 4.39Å; F139-I143 HydrophobicContact CZ-CD1 3.73Å; F139-I143 HydrophobicContact CZ-CG1 4.43Å; F139-I143 WeakPolarHBondContact O-CG1 3.36Å; F139-I143 PolarHBondContact O-N 3.44Å; F139-I143 VanDerWaalsContact O-N 3.08Å
140V90.1Very high88.7Confident59 Ų5951 Ų5136%0.35825%0.248SC..Hα-helixtrans-61.2-42.9174.1174.40000110.1L25 L136 L137 T142 I143 L144L25-V140 HydrophobicContact CD1-CB 4.44Å; L25-V140 HydrophobicContact CD1-CG1 3.94Å; L136-V140 WeakPolarHBondContact O-CG2 3.3Å; L136-V140 PolarHBondContact O-N 3.13Å; L137-V140 PolarHBondContact O-N 2.66Å; V140-T142 PolarHBondContact O-N 3.27Å; V140-I143 PolarHBondContact O-N 3.14Å; V140-L144 HydrophobicContact CG1-CD1 3.94Å; V140-L144 HydrophobicContact CG1-CG 4.48Å; V140-L144 WeakPolarHBondContact O-CG 3.47Å; V140-L144 PolarHBondContact O-N 2.54Å
141H89.4Confident87.5Confident0 Ų051.5 Ų51.50%026%0.259CS..Hα-helixtrans-60.4-47.1176.3-159.3158.2000111.2L25 Y26 E29 H91 L137 Y138 F139 I143 L144 S145L25-H141 HydrophobicContact CB-CB 4.36Å; L25-H141 HydrophobicContact CD1-CB 3.84Å; Y26-H141 AromaticContact CD1-CE1 3.93Å; Y26-H141 AromaticContact CD2-CE1 3.82Å; Y26-H141 AromaticContact CE1-CE1 3.68Å; Y26-H141 AromaticContact CE2-CE1 3.51Å; Y26-H141 AromaticContact CE2-NE2 3.86Å; Y26-H141 AromaticContact CZ-CE1 3.45Å; Y26-H141 VanDerWaalsContact CZ-CE1 3.45Å; Y26-H141 AromaticContact CZ-NE2 3.89Å; E29-H141 WeakPolarHBondContact OE1-CB 3.48Å; E29-H141 IonicContact OE1-CG 2.54Å; E29-H141 IonicContact OE1-ND1 3.44Å; E29-H141 PolarHBondContact OE1-ND1 3.3Å; E29-H141 IonicContact OE2-CE1 3.32Å; E29-H141 IonicContact OE2-ND1 2.89Å; E29-H141 PolarHBondContact OE2-ND1 2.9Å; H91-H141 AromaticContact CD2-CD2 3.84Å; H91-H141 AromaticContact CD2-CE1 3.68Å; H91-H141 AromaticContact CD2-CG 3.31Å; H91-H141 AromaticContact CD2-ND1 3.21Å; H91-H141 PolarHBondContact CD2-ND1 3.34Å; H91-H141 AromaticContact CE1-CE1 3.49Å; H91-H141 PolarHBondContact CE1-CE1 3.22Å; H91-H141 VanDerWaalsContact CE1-CE1 3.49Å; H91-H141 AromaticContact CE1-ND1 3.84Å; H91-H141 AromaticContact CE1-NE2 3.64Å; H91-H141 AromaticContact CG-CG 3.93Å; H91-H141 AromaticContact NE2-CD2 3.86Å; H91-H141 AromaticContact NE2-CE1 3.04Å; H91-H141 PolarHBondContact NE2-CE1 2.97Å; H91-H141 AromaticContact NE2-CG 3.55Å; H91-H141 AromaticContact NE2-ND1 3.02Å; H91-H141 PolarHBondContact NE2-ND1 3.34Å; H91-H141 AromaticContact NE2-NE2 3.6Å; L137-H141 WeakPolarHBondContact O-CB 3.31Å; L137-H141 PolarHBondContact O-N 3.06Å; Y138-H141 PolarHBondContact O-N 2.87Å; F139-H141 VanDerWaalsContact C-N 3.29Å; F139-H141 PolarHBondContact O-N 2.89Å; H141-I143 VanDerWaalsContact C-N 3.3Å; H141-I143 PolarHBondContact O-N 3.3Å; H141-L144 PolarHBondContact O-N 3.28Å; H141-L144 VanDerWaalsContact O-N 3.11Å; H141-S145 PolarHBondContact CD2-OG 3.45Å; H141-S145 VanDerWaalsContact CD2-OG 3.25Å; H141-S145 WeakPolarHBondContact O-CB 3.42Å; H141-S145 PolarHBondContact O-N 3.16Å; H141-S145 PolarHBondContact O-OG 3.03Å; H141-S145 VanDerWaalsContact O-OG 3.05Å
142T90.6Very high85.7Confident8 Ų856.3 Ų56.35%0.04928%0.28CS..Hα-helixtrans-53.6-45175.7-57.20000112.1F88 H91 L92 V95 Y138 F139 V140 S145 A146F88-T142 HydrophobicContact CD2-CG2 3.87Å; F88-T142 WeakPolarHBondContact CD2-O 3.36Å; F88-T142 HydrophobicContact CE2-CG2 3.58Å; H91-T142 VanDerWaalsContact CB-OG1 3.28Å; H91-T142 WeakPolarHBondContact CB-OG1 3.46Å; H91-T142 PolarHBondContact O-OG1 3.29Å; L92-T142 HydrophobicContact CB-CG2 3.95Å; L92-T142 HydrophobicContact CD1-CG2 4.07Å; L92-T142 PolarHBondContact N-OG1 3.3Å; V95-T142 WeakPolarHBondContact CG2-OG1 3.25Å; Y138-T142 WeakPolarHBondContact O-CB 3.32Å; Y138-T142 PolarHBondContact O-N 3.5Å; Y138-T142 PolarHBondContact O-OG1 3.48Å; F139-T142 WeakPolarHBondContact O-CB 3.38Å; F139-T142 PolarHBondContact O-N 3.06Å; V140-T142 PolarHBondContact O-N 3.27Å; T142-S145 PolarHBondContact O-N 2.74Å; T142-A146 WeakPolarHBondContact O-CB 3.44Å; T142-A146 PolarHBondContact O-N 3.34Å
143I88.3Confident85.2Confident77 Ų7754.2 Ų54.240%0.39527%0.274SS..Hα-helixtrans-63.6-47.3178.6-67.4168.5000110.7F139 V140 H141 A146 I147F139-I143 HydrophobicContact CD1-CD1 4Å; F139-I143 HydrophobicContact CE1-CD1 3.5Å; F139-I143 VanDerWaalsContact CE1-CD1 3.5Å; F139-I143 HydrophobicContact CE2-CD1 4.39Å; F139-I143 HydrophobicContact CZ-CD1 3.73Å; F139-I143 HydrophobicContact CZ-CG1 4.43Å; F139-I143 WeakPolarHBondContact O-CG1 3.36Å; F139-I143 PolarHBondContact O-N 3.44Å; F139-I143 VanDerWaalsContact O-N 3.08Å; V140-I143 PolarHBondContact O-N 3.14Å; H141-I143 VanDerWaalsContact C-N 3.3Å; H141-I143 PolarHBondContact O-N 3.3Å; I143-A146 WeakPolarHBondContact O-CB 3.21Å; I143-A146 PolarHBondContact O-N 3.25Å; I143-I147 HydrophobicContact CG2-CD1 3.97Å; I143-I147 WeakPolarHBondContact O-CG1 3.26Å; I143-I147 PolarHBondContact O-N 3.31Å
144L84.4Confident84.7Confident39 Ų3954.3 Ų54.320%0.20427%0.272CS..Hα-helixtrans-67-37.9-179.1-64.2167.8000111.8I21 P22 L25 V140 H141 A146 I147 R148I21-L144 HydrophobicContact CG2-CD1 3.6Å; I21-L144 HydrophobicContact CG2-CD2 4.13Å; I21-L144 HydrophobicContact CG2-CG 4.41Å; P22-L144 HydrophobicContact CB-CB 3.7Å; P22-L144 HydrophobicContact CB-CD1 4.12Å; L25-L144 HydrophobicContact CD1-CD1 3.69Å; V140-L144 HydrophobicContact CG1-CD1 3.94Å; V140-L144 HydrophobicContact CG1-CG 4.48Å; V140-L144 WeakPolarHBondContact O-CG 3.47Å; V140-L144 PolarHBondContact O-N 2.54Å; H141-L144 PolarHBondContact O-N 3.28Å; H141-L144 VanDerWaalsContact O-N 3.11Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-I147 PolarHBondContact O-N 3.09Å; L144-R148 WeakPolarHBondContact O-CB 3.39Å; L144-R148 PolarHBondContact O-N 3.47Å
145S84.8Confident84.2Confident0 Ų057.3 Ų57.30%029%0.287CS..Hα-helixtrans-62.9-38.8172.3-63.10000112D87 H141 T142 R148 W149D87-S145 WeakPolarHBondContact OD2-CB 3.48Å; D87-S145 PolarHBondContact OD2-OG 2.98Å; H141-S145 PolarHBondContact CD2-OG 3.45Å; H141-S145 VanDerWaalsContact CD2-OG 3.25Å; H141-S145 WeakPolarHBondContact O-CB 3.42Å; H141-S145 PolarHBondContact O-N 3.16Å; H141-S145 PolarHBondContact O-OG 3.03Å; H141-S145 VanDerWaalsContact O-OG 3.05Å; T142-S145 PolarHBondContact O-N 2.74Å; S145-R148 PolarHBondContact O-N 3.42Å; S145-W149 WeakPolarHBondContact O-CB 3.33Å; S145-W149 PolarHBondContact O-N 2.89Å
146A84.1Confident83.7Confident34 Ų3459.9 Ų59.928%0.28130%0.3SS..Hα-helixtrans-64.7-42.417400000112.1F88 T142 I143 L144 W149 K150F88-A146 HydrophobicContact CD2-CB 3.72Å; F88-A146 HydrophobicContact CE2-CB 3.68Å; T142-A146 WeakPolarHBondContact O-CB 3.44Å; T142-A146 PolarHBondContact O-N 3.34Å; I143-A146 WeakPolarHBondContact O-CB 3.21Å; I143-A146 PolarHBondContact O-N 3.25Å; L144-A146 VanDerWaalsContact C-N 3.34Å; A146-W149 PolarHBondContact O-N 3.16Å; A146-K150 WeakPolarHBondContact O-CB 3.22Å; A146-K150 PolarHBondContact O-N 3.23Å
147I82.3Confident83.1Confident86 Ų8656.8 Ų56.844%0.44128%0.282SS..Hα-helixtrans-63.2-44.6175.4-65165.7000110.1M8 I143 L144 K150 S151M8-I147 HydrophobicContact CE-CB 4.35Å; M8-I147 HydrophobicContact CE-CG2 3.63Å; I143-I147 HydrophobicContact CG2-CD1 3.97Å; I143-I147 WeakPolarHBondContact O-CG1 3.26Å; I143-I147 PolarHBondContact O-N 3.31Å; L144-I147 PolarHBondContact O-N 3.09Å; I147-K150 PolarHBondContact O-N 3.24Å; I147-S151 PolarHBondContact O-N 3.03Å
148R78.4Confident82.5Confident9 Ų958.5 Ų58.53%0.03429%0.29CS..Hα-helixtrans-58.9-50176.3177.5169.469.9-179.31111L11 D23 D87 L144 S145 K150 S151 F152L11-R148 VanDerWaalsContact CD2-NH1 3.34Å; D23-R148 IonicContact OD1-CZ 3.48Å; D23-R148 IonicContact OD1-NH1 3.99Å; D23-R148 PolarHBondContact OD1-NH1 3.38Å; D23-R148 IonicContact OD1-NH2 3.8Å; D23-R148 IonicContact OD2-NH1 3.71Å; D23-R148 PolarHBondContact OD2-NH1 3.11Å; D87-R148 IonicContact OD1-NH2 3.79Å; D87-R148 PolarHBondContact OD1-NH2 3.41Å; D87-R148 IonicContact OD2-CZ 3.16Å; D87-R148 IonicContact OD2-NH2 3.35Å; D87-R148 PolarHBondContact OD2-NH2 3.13Å; L144-R148 WeakPolarHBondContact O-CB 3.39Å; L144-R148 PolarHBondContact O-N 3.47Å; S145-R148 PolarHBondContact O-N 3.42Å; R148-K150 VanDerWaalsContact C-N 3.3Å; R148-K150 PolarHBondContact O-N 3.06Å; R148-S151 WeakPolarHBondContact O-CB 3.44Å; R148-S151 PolarHBondContact O-N 3.39Å; R148-F152 HydrophobicContact CG-CD2 4.45Å; R148-F152 HydrophobicContact CG-CE2 3.93Å; R148-F152 VanDerWaalsContact O-CD2 3.31Å; R148-F152 WeakPolarHBondContact O-CD2 3.33Å; R148-F152 PolarHBondContact O-N 3.41Å
149W78.6Confident81.8Confident105 Ų10562.7 Ų62.740%0.39831%0.311SS..Hα-helixtrans-60.2-39.2179.7-179.834.8000112.6S81 A84 A85 F88 S145 A146 S151 F152S81-W149 PolarHBondContact OG-NE1 3.37Å; A84-W149 HydrophobicContact CB-CB 4.16Å; A84-W149 HydrophobicContact CB-CG 4.45Å; A85-W149 HydrophobicContact CB-CD2 4.17Å; A85-W149 HydrophobicContact CB-CG 4.48Å; A85-W149 HydrophobicContact CB-CZ2 4.01Å; F88-W149 HydrophobicContact CD1-CE3 4.02Å; F88-W149 HydrophobicContact CD1-CZ3 4.07Å; F88-W149 HydrophobicContact CE1-CZ3 4.26Å; F88-W149 HydrophobicContact CG-CE3 4.49Å; S145-W149 WeakPolarHBondContact O-CB 3.33Å; S145-W149 PolarHBondContact O-N 2.89Å; A146-W149 PolarHBondContact O-N 3.16Å; W149-S151 PolarHBondContact O-N 3.32Å; W149-F152 PolarHBondContact O-N 3.36Å
150K75.3Confident80.9Confident186 Ų18659.5 Ų59.581%0.80930%0.3SS*.Hα-helixtrans-68.6-21176.1-161.7-174.1-169.1-178.40113.8A146 I147 R148A146-K150 WeakPolarHBondContact O-CB 3.22Å; A146-K150 PolarHBondContact O-N 3.23Å; I147-K150 PolarHBondContact O-N 3.24Å; R148-K150 VanDerWaalsContact C-N 3.3Å; R148-K150 PolarHBondContact O-N 3.06Å
151S68.3Low80.2Confident69 Ų6959.5 Ų59.548%0.48330%0.295SS..THydrogen-bonded Turntrans-87.9-4.8-179.8-168.90000113.6I147 R148 W149I147-S151 PolarHBondContact O-N 3.03Å; R148-S151 WeakPolarHBondContact O-CB 3.44Å; R148-S151 PolarHBondContact O-N 3.39Å; W149-S151 PolarHBondContact O-N 3.32Å
152F57.4Low79.3Confident101 Ų10164.9 Ų64.944%0.44332%0.321SS..  trans-850168.5-83.1-82.8000111L11 N79 A84 R148 W149L11-F152 HydrophobicContact CG-CZ 4.44Å; N79-F152 HydrophobicContact CB-CE1 4.44Å; N79-F152 WeakPolarHBondContact ND2-CE1 3.19Å; N79-F152 VanDerWaalsContact O-CE1 3.26Å; N79-F152 WeakPolarHBondContact O-CE1 3.45Å; N79-F152 WeakPolarHBondContact OD1-CZ 3.5Å; A84-F152 HydrophobicContact CB-CD2 3.89Å; A84-F152 HydrophobicContact CB-CE2 3.81Å; R148-F152 HydrophobicContact CG-CD2 4.45Å; R148-F152 HydrophobicContact CG-CE2 3.93Å; R148-F152 VanDerWaalsContact O-CD2 3.31Å; R148-F152 WeakPolarHBondContact O-CD2 3.33Å; R148-F152 PolarHBondContact O-N 3.41Å; W149-F152 PolarHBondContact O-N 3.36Å

Retrieved 152 of 152 residues in 54.3 ms (Link to these results)