A0A5K4FAX5_SCHMA Loading...

J domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAX5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 220 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
1M40.7Very low46.7Very low238 Ų238143.8 Ų143.8100%1.17278%0.782SS**  0119.10-67.5134.8162.600107.1
2S45.1Very low46.9Very low101 Ų101145.6 Ų145.671%0.70679%0.788SS**  cis-143.5131-1.2-64.40000109.6
3D44.1Very low47.2Very low154 Ų154139.4 Ų139.482%0.82476%0.763SS**  trans-75131178.1-169.7-6.4000109.6G5D3-G5 PolarHBondContact OD1-N 3.47Å
4T52.8Low48Very low124 Ų124137.6 Ų137.676%0.76176%0.759SS**  trans-128.421.6176.7-27.60000111.8Q6T4-Q6 PolarHBondContact O-N 3.11Å; T4-Q6 VanDerWaalsContact O-N 3.12Å
5G41.7Very low48.8Very low53 Ų53132.9 Ų132.955%0.54674%0.739SS.*  trans-80.279.5179.100000113.9D3D3-G5 PolarHBondContact OD1-N 3.47Å
6Q49.7Very low49.7Very low149 Ų149125.2 Ų125.270%0.69670%0.699SS**  trans-171.591.6157.7-112.4163.993.700112.8T4T4-Q6 PolarHBondContact O-N 3.11Å; T4-Q6 VanDerWaalsContact O-N 3.12Å
7M50.2Low50.8Low149 Ų149124.4 Ų124.473%0.73469%0.689SS**  trans-148.523.7173.8-142.4177-70.900115.4
8S50.5Low52.5Low127 Ų127120.8 Ų120.889%0.88867%0.674SS**SBendtrans-126.4-5.6-177.7-167.20000114.9
9S43.7Very low54.5Low99 Ų99115.6 Ų115.669%0.69264%0.644SS**  trans-148.3106176.4-172.60000114.5
10R49.2Very low56.3Low190 Ų190110 Ų11072%0.71761%0.613SS**  -165.2118.6117.4-105.5154.7-78.1175.2-6.8110.3
11K46.4Very low57.9Low198 Ų198110.2 Ų110.286%0.86161%0.609SS**SBendtrans-63.9137.3165.7-72.1176.1175.4176.70108.7S13K11-S13 PolarHBondContact O-N 3.2Å
12L49.2Very low60.3Low165 Ų165100 Ų10086%0.86456%0.56SS**  trans5259155.8-58.1168.3000115.8
13S51.1Low62.5Low65 Ų6595.2 Ų95.246%0.45553%0.526SS..  trans-72.7125.5156.9-172.10000108.8K11 S15K11-S13 PolarHBondContact O-N 3.2Å; S13-S15 PolarHBondContact O-N 3.44Å
14T57.5Low64.7Low115 Ų11594.9 Ų94.971%0.70651%0.513SS*.  trans-69.7-17.5177.2-470000112.2
15S60.1Low66.6Low66 Ų6689.9 Ų89.946%0.46248%0.483SS..SBendtrans-58.2134.7171.9-58.90000111.3S13 E17S13-S15 PolarHBondContact O-N 3.44Å; S15-E17 VanDerWaalsContact CB-OE2 3.23Å; S15-E17 WeakPolarHBondContact CB-OE2 3.26Å; S15-E17 PolarHBondContact O-N 3.05Å
16G62.8Low68.8Low10 Ų1091.9 Ų91.910%0.10349%0.486CS..THydrogen-bonded Turntrans-7152.1175.100000113.9F20 Y79G16-F20 WeakPolarHBondContact O-CD2 3.36Å; G16-Y79 VanDerWaalsContact CA-CZ 3.48Å; G16-Y79 WeakPolarHBondContact CA-OH 3.32Å; G16-Y79 WeakPolarHBondContact O-CE1 3.33Å
17E69.1Low70.5Confident111 Ų11191.5 Ų91.552%0.51948%0.482SS..THydrogen-bonded Turntrans-96.3-30.8-178-66.9171.3129.700112S15 L19 F20 H21 Y79S15-E17 VanDerWaalsContact CB-OE2 3.23Å; S15-E17 WeakPolarHBondContact CB-OE2 3.26Å; S15-E17 PolarHBondContact O-N 3.05Å; E17-L19 PolarHBondContact O-N 3.22Å; E17-F20 PolarHBondContact O-N 3.31Å; E17-H21 VanDerWaalsContact O-CB 3.26Å; E17-H21 WeakPolarHBondContact O-CB 3.32Å; E17-H21 PolarHBondContact O-N 3.14Å; E17-Y79 PolarHBondContact N-OH 2.95Å
18S81.4Confident72.2Confident60 Ų6086.7 Ų86.742%0.4247%0.471SS..Hα-helixtrans-56.4-47.7-170.253.50000114.2H21 V22 Y79S18-H21 PolarHBondContact O-N 3.1Å; S18-V22 VanDerWaalsContact O-CG2 3.25Å; S18-V22 WeakPolarHBondContact O-CG2 3.39Å; S18-V22 PolarHBondContact O-N 3.35Å; S18-Y79 PolarHBondContact N-OH 3.15Å; S18-Y79 VanDerWaalsContact N-OH 3.1Å; S18-Y79 PolarHBondContact OG-OH 3.07Å
19L90Very high74Confident22 Ų2280.9 Ų80.912%0.11543%0.431CS..Hα-helixtrans-69.2-39.7-178.2-86.966000112.7E17 L23 A66 I69 L70 Y79E17-L19 PolarHBondContact O-N 3.22Å; L19-L23 PolarHBondContact O-N 2.88Å; L19-A66 HydrophobicContact CB-CB 4.06Å; L19-A66 HydrophobicContact CD2-CB 4.47Å; L19-A66 HydrophobicContact CG-CB 3.84Å; L19-I69 HydrophobicContact CD2-CB 3.6Å; L19-I69 HydrophobicContact CD2-CD1 3.84Å; L19-I69 HydrophobicContact CD2-CG1 4.35Å; L19-I69 HydrophobicContact CD2-CG2 3.41Å; L19-I69 VanDerWaalsContact CD2-CG2 3.41Å; L19-L70 HydrophobicContact CB-CD1 4.08Å; L19-L70 HydrophobicContact CB-CD2 4.5Å; L19-L70 HydrophobicContact CB-CG 4.29Å; L19-L70 HydrophobicContact CD2-CD2 4.33Å; L19-L70 HydrophobicContact CD2-CG 4.23Å; L19-Y79 HydrophobicContact CB-CE1 3.88Å; L19-Y79 HydrophobicContact CD1-CD2 4.47Å; L19-Y79 HydrophobicContact CD1-CE1 4.42Å; L19-Y79 HydrophobicContact CD1-CE2 3.74Å; L19-Y79 HydrophobicContact CD2-CD1 4.43Å; L19-Y79 HydrophobicContact CD2-CE1 4.37Å; L19-Y79 HydrophobicContact CD2-CE2 4.46Å; L19-Y79 HydrophobicContact CD2-CG 4.5Å; L19-Y79 HydrophobicContact CG-CE1 4.44Å; L19-Y79 PolarHBondContact N-OH 3.03Å
20F91.3Very high76.3Confident4 Ų479.7 Ų79.72%0.01842%0.42CS..Hα-helixtrans-68.5-37.8176.6-66.2-86.8000110.9G16 E17 L23 R24 V25 P26 K27 L70 Y79 E80G16-F20 WeakPolarHBondContact O-CD2 3.36Å; E17-F20 PolarHBondContact O-N 3.31Å; F20-L23 CarbonylContact O-C 3.54Å; F20-L23 PolarHBondContact O-N 2.86Å; F20-R24 PolarHBondContact O-N 2.88Å; F20-V25 CarbonylContact C-O 3.6Å; F20-V25 HydrophobicContact CB-CG2 4.11Å; F20-V25 HydrophobicContact CD1-CG2 3.95Å; F20-V25 WeakPolarHBondContact O-CG2 3.26Å; F20-V25 PolarHBondContact O-N 3.15Å; F20-P26 WeakPolarHBondContact CD1-O 3.26Å; F20-K27 HydrophobicContact CE2-CG 4.38Å; F20-L70 HydrophobicContact CD1-CD1 3.85Å; F20-L70 HydrophobicContact CD2-CD1 4.36Å; F20-L70 HydrophobicContact CE1-CD1 3.83Å; F20-L70 HydrophobicContact CE1-CD2 4.27Å; F20-L70 HydrophobicContact CE2-CD1 4.35Å; F20-L70 HydrophobicContact CE2-CD2 3.91Å; F20-L70 HydrophobicContact CG-CD1 4.12Å; F20-L70 HydrophobicContact CZ-CD1 4.09Å; F20-L70 HydrophobicContact CZ-CD2 3.73Å; F20-Y79 HydrophobicContact CD2-CE1 4.05Å; F20-Y79 HydrophobicContact CE2-CD1 4.15Å; F20-Y79 AromaticContact CE2-CE1 3.92Å; F20-Y79 HydrophobicContact CE2-CE1 3.92Å; F20-E80 HydrophobicContact CE2-CG 4.36Å; F20-E80 HydrophobicContact CZ-CG 4.28Å
21H89.6Confident78.3Confident114 Ų11473.4 Ų73.453%0.52840%0.399SS..Hα-helixtrans-63.9-45.7175-176.7-90.2000112.5E17 S18 L23 R24E17-H21 VanDerWaalsContact O-CB 3.26Å; E17-H21 WeakPolarHBondContact O-CB 3.32Å; E17-H21 PolarHBondContact O-N 3.14Å; S18-H21 PolarHBondContact O-N 3.1Å; H21-L23 VanDerWaalsContact C-N 3.31Å; H21-L23 PolarHBondContact O-N 3.12Å; H21-R24 WeakPolarHBondContact O-CA 3.33Å; H21-R24 PolarHBondContact O-N 3.02Å
22V91Very high80.5Confident24 Ų2469.8 Ų69.815%0.14539%0.385CS..Hα-helixtrans-56.4-44.7174.7165.70000111.4S18 R24 E62 I63 A66S18-V22 VanDerWaalsContact O-CG2 3.25Å; S18-V22 WeakPolarHBondContact O-CG2 3.39Å; S18-V22 PolarHBondContact O-N 3.35Å; V22-R24 PolarHBondContact O-N 2.72Å; V22-E62 HydrophobicContact CG1-CB 4.26Å; V22-E62 HydrophobicContact CG1-CG 4.03Å; V22-E62 HydrophobicContact CG2-CG 3.84Å; V22-I63 HydrophobicContact CG1-CB 4.48Å; V22-I63 HydrophobicContact CG1-CG1 3.98Å; V22-A66 HydrophobicContact CB-CB 4.3Å; V22-A66 HydrophobicContact CG1-CB 3.97Å
23L91.7Very high82.7Confident0 Ų064.7 Ų64.70%036%0.359CS..THydrogen-bonded Turntrans-78.1-1.6176-81.5159.9000114L19 F20 H21 V25 S37 L41 I63 A66 L70L19-L23 PolarHBondContact O-N 2.88Å; F20-L23 CarbonylContact O-C 3.54Å; F20-L23 PolarHBondContact O-N 2.86Å; H21-L23 VanDerWaalsContact C-N 3.31Å; H21-L23 PolarHBondContact O-N 3.12Å; L23-V25 VanDerWaalsContact C-N 3.3Å; L23-V25 HydrophobicContact CB-CG2 3.74Å; L23-V25 PolarHBondContact O-N 3.33Å; L23-S37 VanDerWaalsContact O-CB 3.32Å; L23-S37 WeakPolarHBondContact O-CB 3.26Å; L23-S37 PolarHBondContact O-OG 2.84Å; L23-L41 HydrophobicContact CD2-CD1 4.47Å; L23-L41 WeakPolarHBondContact O-CD1 3.44Å; L23-I63 HydrophobicContact CD2-CG2 4.28Å; L23-A66 HydrophobicContact CD1-CB 3.85Å; L23-A66 HydrophobicContact CG-CB 4.13Å; L23-L70 HydrophobicContact CD1-CD1 3.95Å
24R90.5Very high84.7Confident147 Ų14761.6 Ų61.656%0.55534%0.338SS*.THydrogen-bonded Turntrans50.447.4-176.6-54.7-174.4-173.6174.41.7112.8F20 H21 V22F20-R24 PolarHBondContact O-N 2.88Å; H21-R24 WeakPolarHBondContact O-CA 3.33Å; H21-R24 PolarHBondContact O-N 3.02Å; V22-R24 PolarHBondContact O-N 2.72Å
25V91.4Very high86.4Confident19 Ų1961.3 Ų61.312%0.11532%0.323CS..  trans-125152.7179.2-72.40000110.3F20 L23 A29 L34F20-V25 CarbonylContact C-O 3.6Å; F20-V25 HydrophobicContact CB-CG2 4.11Å; F20-V25 HydrophobicContact CD1-CG2 3.95Å; F20-V25 WeakPolarHBondContact O-CG2 3.26Å; F20-V25 PolarHBondContact O-N 3.15Å; L23-V25 VanDerWaalsContact C-N 3.3Å; L23-V25 HydrophobicContact CB-CG2 3.74Å; L23-V25 PolarHBondContact O-N 3.33Å; V25-A29 HydrophobicContact CB-CB 4.15Å; V25-L34 HydrophobicContact CB-CD2 4.48Å; V25-L34 HydrophobicContact CG1-CD2 4.49Å; V25-L34 HydrophobicContact CG2-CD2 3.84Å
26P88.9Confident88.1Confident95 Ų9562.5 Ų62.562%0.61732%0.32SS*.  trans-69.1150.3172.629-33.8000111.3F20 G28 A29F20-P26 WeakPolarHBondContact CD1-O 3.26Å; P26-G28 PolarHBondContact O-N 3.39Å; P26-A29 HydrophobicContact CG-CB 4.19Å; P26-A29 WeakPolarHBondContact O-CB 3.38Å; P26-A29 PolarHBondContact O-N 3.48Å; P26-A29 VanDerWaalsContact O-N 3.15Å
27K85.5Confident89.6Confident141 Ų14162.1 Ų62.161%0.61332%0.316SS*.THydrogen-bonded Turntrans-56.3130.2168-177.6-178.4178.9-177.20108.9F20F20-K27 HydrophobicContact CE2-CG 4.38Å
28G84.8Confident90.9Very high49 Ų4959.2 Ų59.251%0.50530%0.301SS..THydrogen-bonded Turntrans90.7-1-178.100000115.6P26 R76P26-G28 PolarHBondContact O-N 3.39Å; G28-R76 PolarHBondContact O-NH2 3.31Å
29A88.8Confident91.5Very high4 Ų463 Ų633%0.03331%0.306CS..  trans-50.1144.3177.300000113.5V25 P26 D33 L34 R76V25-A29 HydrophobicContact CB-CB 4.15Å; P26-A29 HydrophobicContact CG-CB 4.19Å; P26-A29 WeakPolarHBondContact O-CB 3.38Å; P26-A29 PolarHBondContact O-N 3.48Å; P26-A29 VanDerWaalsContact O-N 3.15Å; A29-D33 HydrophobicContact CB-CB 4.42Å; A29-L34 HydrophobicContact CB-CD2 4.33Å; A29-R76 PolarHBondContact O-NH1 2.94Å; A29-R76 PolarHBondContact O-NH2 3.47Å
30P91.4Very high91.8Very high74 Ų7468.4 Ų68.448%0.48133%0.325SS..  trans-67.8156.4175.430.7-35.8000110.9E32 D33 L34P30-E32 PolarHBondContact O-N 2.94Å; P30-E32 VanDerWaalsContact O-N 3.15Å; P30-D33 WeakPolarHBondContact CD-OD2 3.37Å; P30-D33 HydrophobicContact CG-CB 4.18Å; P30-D33 WeakPolarHBondContact CG-OD2 3.42Å; P30-D33 PolarHBondContact O-N 3.16Å; P30-L34 PolarHBondContact O-N 3.35Å
31E92Very high91.9Very high59 Ų5968.3 Ų68.328%0.27632%0.324SS..Hα-helixtrans-60.6-29.8-175.4-150.9-137.7137.500112.8D33 L34 R35E31-D33 VanDerWaalsContact C-N 3.28Å; E31-D33 PolarHBondContact O-N 3.21Å; E31-L34 HydrophobicContact CG-CD1 4.29Å; E31-L34 WeakPolarHBondContact O-CB 3.38Å; E31-L34 PolarHBondContact O-N 2.87Å; E31-R35 VanDerWaalsContact CD-NE 3.31Å; E31-R35 VanDerWaalsContact O-CG 3.29Å; E31-R35 WeakPolarHBondContact O-CG 3.33Å; E31-R35 PolarHBondContact O-N 3.22Å; E31-R35 IonicContact OE1-CZ 3.42Å; E31-R35 IonicContact OE1-NE 2.89Å; E31-R35 PolarHBondContact OE1-NE 3.09Å; E31-R35 IonicContact OE1-NH2 3.56Å; E31-R35 PolarHBondContact OE1-NH2 2.93Å; E31-R35 IonicContact OE2-CZ 2.72Å; E31-R35 IonicContact OE2-NE 2.74Å; E31-R35 IonicContact OE2-NH2 2.68Å; E31-R35 PolarHBondContact OE2-NH2 3.05Å
32E93.3Very high92.1Very high121 Ų12163.6 Ų63.657%0.56531%0.306SS*.Hα-helixtrans-55.9-40.4171.5-69-168.1-166.300113.7P30 R35 K36P30-E32 PolarHBondContact O-N 2.94Å; P30-E32 VanDerWaalsContact O-N 3.15Å; E32-R35 WeakPolarHBondContact O-CB 3.44Å; E32-R35 PolarHBondContact O-N 3.36Å; E32-K36 WeakPolarHBondContact O-CB 3.25Å; E32-K36 WeakPolarHBondContact O-CG 3.45Å; E32-K36 PolarHBondContact O-N 3.46Å; E32-K36 WeakPolarHBondContact OE2-CE 3.45Å; E32-K36 IonicContact OE2-NZ 2.73Å; E32-K36 PolarHBondContact OE2-NZ 3.12Å
33D93.6Very high92.1Very high59 Ų5968.3 Ų68.332%0.31633%0.329SS..Hα-helixtrans-79.5-29.5-175.5-67.3-13.9000111A29 P30 E31 K36 S37A29-D33 HydrophobicContact CB-CB 4.42Å; P30-D33 WeakPolarHBondContact CD-OD2 3.37Å; P30-D33 HydrophobicContact CG-CB 4.18Å; P30-D33 WeakPolarHBondContact CG-OD2 3.42Å; P30-D33 PolarHBondContact O-N 3.16Å; E31-D33 VanDerWaalsContact C-N 3.28Å; E31-D33 PolarHBondContact O-N 3.21Å; D33-K36 PolarHBondContact O-N 3.44Å; D33-K36 WeakPolarHBondContact OD1-CD 3.35Å; D33-K36 WeakPolarHBondContact OD1-CE 3.5Å; D33-K36 IonicContact OD1-NZ 4Å; D33-K36 PolarHBondContact OD1-NZ 3.44Å; D33-S37 WeakPolarHBondContact O-CB 3.47Å; D33-S37 PolarHBondContact O-N 2.97Å
34L93.6Very high92.1Very high0 Ų072.7 Ų72.70%035%0.35CS..Hα-helixtrans-58.7-50.9164-50.9-178.7000110.1V25 A29 P30 E31 K36 S37 Y38 L70V25-L34 HydrophobicContact CB-CD2 4.48Å; V25-L34 HydrophobicContact CG1-CD2 4.49Å; V25-L34 HydrophobicContact CG2-CD2 3.84Å; A29-L34 HydrophobicContact CB-CD2 4.33Å; P30-L34 PolarHBondContact O-N 3.35Å; E31-L34 HydrophobicContact CG-CD1 4.29Å; E31-L34 WeakPolarHBondContact O-CB 3.38Å; E31-L34 PolarHBondContact O-N 2.87Å; L34-K36 PolarHBondContact O-N 2.89Å; L34-S37 PolarHBondContact O-N 3.47Å; L34-Y38 WeakPolarHBondContact O-CB 3.23Å; L34-Y38 PolarHBondContact O-N 3.26Å; L34-L70 HydrophobicContact CD1-CB 3.58Å; L34-L70 WeakPolarHBondContact CD1-O 3.15Å; L34-L70 HydrophobicContact CD2-CD1 4.13Å
35R94Very high92.2Very high108 Ų10867.8 Ų67.841%0.40833%0.332SS..Hα-helixtrans-60.4-42.5177-67.7169.7-177.2-169.84.9112.2E31 E32 R39 Y67E31-R35 VanDerWaalsContact CD-NE 3.31Å; E31-R35 VanDerWaalsContact O-CG 3.29Å; E31-R35 WeakPolarHBondContact O-CG 3.33Å; E31-R35 PolarHBondContact O-N 3.22Å; E31-R35 IonicContact OE1-CZ 3.42Å; E31-R35 IonicContact OE1-NE 2.89Å; E31-R35 PolarHBondContact OE1-NE 3.09Å; E31-R35 IonicContact OE1-NH2 3.56Å; E31-R35 PolarHBondContact OE1-NH2 2.93Å; E31-R35 IonicContact OE2-CZ 2.72Å; E31-R35 IonicContact OE2-NE 2.74Å; E31-R35 IonicContact OE2-NH2 2.68Å; E31-R35 PolarHBondContact OE2-NH2 3.05Å; E32-R35 WeakPolarHBondContact O-CB 3.44Å; E32-R35 PolarHBondContact O-N 3.36Å; R35-R39 WeakPolarHBondContact O-CG 3.26Å; R35-R39 PolarHBondContact O-N 3.35Å; R35-R39 VanDerWaalsContact O-N 3.17Å; R35-Y67 HydrophobicContact CG-CE2 4.09Å
36K95Very high92.1Very high91 Ų9170.6 Ų70.640%0.39634%0.344SS..Hα-helixtrans-64.4-48.6177.4-70.6160.7-155.9157.60111E32 D33 L34 R40E32-K36 WeakPolarHBondContact O-CB 3.25Å; E32-K36 WeakPolarHBondContact O-CG 3.45Å; E32-K36 PolarHBondContact O-N 3.46Å; E32-K36 WeakPolarHBondContact OE2-CE 3.45Å; E32-K36 IonicContact OE2-NZ 2.73Å; E32-K36 PolarHBondContact OE2-NZ 3.12Å; D33-K36 PolarHBondContact O-N 3.44Å; D33-K36 WeakPolarHBondContact OD1-CD 3.35Å; D33-K36 WeakPolarHBondContact OD1-CE 3.5Å; D33-K36 IonicContact OD1-NZ 4Å; D33-K36 PolarHBondContact OD1-NZ 3.44Å; L34-K36 PolarHBondContact O-N 2.89Å; K36-R40 PolarHBondContact O-N 2.8Å
37S95Very high92.2Very high3 Ų369 Ų692%0.02133%0.334CS..Hα-helixtrans-71.6-38.3-178.6-156.60000112.5L23 D33 L34 R39 R40 L41L23-S37 VanDerWaalsContact O-CB 3.32Å; L23-S37 WeakPolarHBondContact O-CB 3.26Å; L23-S37 PolarHBondContact O-OG 2.84Å; D33-S37 WeakPolarHBondContact O-CB 3.47Å; D33-S37 PolarHBondContact O-N 2.97Å; L34-S37 PolarHBondContact O-N 3.47Å; S37-R39 PolarHBondContact O-N 3.18Å; S37-R40 WeakPolarHBondContact O-CB 3.33Å; S37-R40 PolarHBondContact O-N 3.2Å; S37-R40 PolarHBondContact OG-NH2 3.4Å; S37-L41 WeakPolarHBondContact O-CB 3.36Å; S37-L41 WeakPolarHBondContact O-CG 3.38Å; S37-L41 PolarHBondContact O-N 3.39Å
38Y95.6Very high92.4Very high50 Ų5068.2 Ų68.220%0.19634%0.336CS..Hα-helixtrans-55.8-51.3172.6174.3-107.1000111.5L34 R40 L41 A42 I63 Y67L34-Y38 WeakPolarHBondContact O-CB 3.23Å; L34-Y38 PolarHBondContact O-N 3.26Å; Y38-R40 VanDerWaalsContact C-N 3.33Å; Y38-R40 PolarHBondContact O-N 3.48Å; Y38-L41 PolarHBondContact O-N 2.95Å; Y38-A42 HydrophobicContact CE2-CB 4.43Å; Y38-A42 WeakPolarHBondContact O-CB 3.36Å; Y38-A42 PolarHBondContact O-N 3.36Å; Y38-I63 HydrophobicContact CD2-CG2 3.67Å; Y38-I63 HydrophobicContact CE2-CG2 3.98Å; Y38-Y67 AromaticContact CD1-CD1 3.95Å; Y38-Y67 HydrophobicContact CD1-CD1 3.95Å; Y38-Y67 HydrophobicContact CD1-CD2 4.14Å; Y38-Y67 AromaticContact CD1-CE1 3.95Å; Y38-Y67 HydrophobicContact CD1-CE1 3.95Å; Y38-Y67 HydrophobicContact CD1-CE2 4.13Å; Y38-Y67 HydrophobicContact CD1-CG 4.05Å; Y38-Y67 AromaticContact CD2-CD1 3.95Å; Y38-Y67 HydrophobicContact CD2-CD1 3.95Å; Y38-Y67 HydrophobicContact CD2-CD2 4.05Å; Y38-Y67 AromaticContact CD2-CG 3.56Å; Y38-Y67 HydrophobicContact CD2-CG 3.56Å; Y38-Y67 HydrophobicContact CE1-CD1 4.01Å; Y38-Y67 HydrophobicContact CE1-CE1 4.06Å; Y38-Y67 HydrophobicContact CE1-CG 4.49Å; Y38-Y67 HydrophobicContact CE2-CD1 4.02Å; Y38-Y67 HydrophobicContact CE2-CG 4.05Å; Y38-Y67 AromaticContact CG-CD1 3.93Å; Y38-Y67 HydrophobicContact CG-CD1 3.93Å; Y38-Y67 AromaticContact CG-CD2 3.62Å; Y38-Y67 HydrophobicContact CG-CD2 3.62Å; Y38-Y67 HydrophobicContact CG-CE1 4.32Å; Y38-Y67 HydrophobicContact CG-CE2 4.04Å; Y38-Y67 AromaticContact CG-CG 3.56Å; Y38-Y67 HydrophobicContact CG-CG 3.56Å
39R94.9Very high92.7Very high139 Ų13972.1 Ų72.153%0.52534%0.339SS..Hα-helixtrans-56.8-44.9176.3-72.9-172.8-59.7-98.35.5112.3R35 S37 L43R35-R39 WeakPolarHBondContact O-CG 3.26Å; R35-R39 PolarHBondContact O-N 3.35Å; R35-R39 VanDerWaalsContact O-N 3.17Å; S37-R39 PolarHBondContact O-N 3.18Å; R39-L43 WeakPolarHBondContact O-CG 3.37Å; R39-L43 PolarHBondContact O-N 2.89Å
40R94.9Very high92.7Very high135 Ų13574.1 Ų74.151%0.50935%0.35SS..Hα-helixtrans-61.3-44.4178.6174.8178.462179.4-1.9112.5K36 S37 Y38 Q44K36-R40 PolarHBondContact O-N 2.8Å; S37-R40 WeakPolarHBondContact O-CB 3.33Å; S37-R40 PolarHBondContact O-N 3.2Å; S37-R40 PolarHBondContact OG-NH2 3.4Å; Y38-R40 VanDerWaalsContact C-N 3.33Å; Y38-R40 PolarHBondContact O-N 3.48Å; R40-Q44 WeakPolarHBondContact O-CG 3.32Å; R40-Q44 PolarHBondContact O-N 3.4Å
41L93.9Very high92.5Very high2 Ų275.5 Ų75.51%0.0136%0.358CS..Hα-helixtrans-77.8-38.8-178-68.1168.4000112L23 S37 Y38 L43 Q44 F45 I63L23-L41 HydrophobicContact CD2-CD1 4.47Å; L23-L41 WeakPolarHBondContact O-CD1 3.44Å; S37-L41 WeakPolarHBondContact O-CB 3.36Å; S37-L41 WeakPolarHBondContact O-CG 3.38Å; S37-L41 PolarHBondContact O-N 3.39Å; Y38-L41 PolarHBondContact O-N 2.95Å; L41-L43 VanDerWaalsContact C-N 3.27Å; L41-L43 PolarHBondContact O-N 3.35Å; L41-Q44 PolarHBondContact O-N 2.95Å; L41-F45 HydrophobicContact CD2-CD2 4.47Å; L41-F45 HydrophobicContact CD2-CE2 4.06Å; L41-F45 WeakPolarHBondContact O-CD2 3.17Å; L41-F45 PolarHBondContact O-N 2.95Å; L41-I63 HydrophobicContact CB-CD1 3.83Å; L41-I63 HydrophobicContact CB-CG1 4.37Å; L41-I63 HydrophobicContact CB-CG2 4.19Å
42A93.7Very high92.3Very high16 Ų1680 Ų8013%0.13239%0.385CS..Hα-helixtrans-59.3-3717500000112.2Y38 H46 F60Y38-A42 HydrophobicContact CE2-CB 4.43Å; Y38-A42 WeakPolarHBondContact O-CB 3.36Å; Y38-A42 PolarHBondContact O-N 3.36Å; A42-H46 WeakPolarHBondContact O-CB 3.42Å; A42-H46 PolarHBondContact O-N 3.02Å; A42-H46 VanDerWaalsContact O-N 3.16Å; A42-F60 HydrophobicContact CB-CE2 3.96Å
43L92.1Very high92Very high122 Ų12278 Ų7864%0.63938%0.377SS*.Hα-helixtrans-73-24.4174.3-71.6171.9000113.9R39 L41R39-L43 WeakPolarHBondContact O-CG 3.37Å; R39-L43 PolarHBondContact O-N 2.89Å; L41-L43 VanDerWaalsContact C-N 3.27Å; L41-L43 PolarHBondContact O-N 3.35Å
44Q91.2Very high91.8Very high93 Ų9379.7 Ų79.744%0.43539%0.392SS..Hα-helixtrans-82-45.2177-72.3171.419.600111.7R40 L41 N50R40-Q44 WeakPolarHBondContact O-CG 3.32Å; R40-Q44 PolarHBondContact O-N 3.4Å; L41-Q44 PolarHBondContact O-N 2.95Å; Q44-N50 PolarHBondContact O-ND2 3.39Å
45F91.9Very high91.6Very high43 Ų4382.6 Ų82.619%0.18941%0.412CS..SBendtrans-98.514.8-174.6-64.2-75.7000113.9L41 A56 T59 F60 I63L41-F45 HydrophobicContact CD2-CD2 4.47Å; L41-F45 HydrophobicContact CD2-CE2 4.06Å; L41-F45 WeakPolarHBondContact O-CD2 3.17Å; L41-F45 PolarHBondContact O-N 2.95Å; F45-A56 HydrophobicContact CD1-CB 4.19Å; F45-T59 HydrophobicContact CD1-CG2 3.87Å; F45-T59 HydrophobicContact CD2-CG2 4.04Å; F45-T59 HydrophobicContact CE1-CG2 3.9Å; F45-T59 HydrophobicContact CE2-CG2 4.08Å; F45-T59 HydrophobicContact CG-CG2 3.94Å; F45-T59 HydrophobicContact CZ-CG2 4.01Å; F45-F60 HydrophobicContact CB-CB 4.24Å; F45-I63 HydrophobicContact CB-CD1 4.24Å; F45-I63 HydrophobicContact CD2-CD1 3.59Å; F45-I63 HydrophobicContact CE2-CD1 4.3Å; F45-I63 HydrophobicContact CG-CD1 4.14Å
46H90.8Very high91.4Very high78 Ų7877.5 Ų77.536%0.36139%0.393SS..  trans-61.6133.1178.1-154.8-108.3000110.6A42 D48 K49 N50A42-H46 WeakPolarHBondContact O-CB 3.42Å; A42-H46 PolarHBondContact O-N 3.02Å; A42-H46 VanDerWaalsContact O-N 3.16Å; H46-D48 VanDerWaalsContact C-N 3.31Å; H46-D48 VanDerWaalsContact ND1-CB 3.26Å; H46-D48 WeakPolarHBondContact ND1-CB 3.35Å; H46-D48 PolarHBondContact O-N 2.73Å; H46-K49 HydrophobicContact CB-CG 4.47Å; H46-K49 PolarHBondContact O-N 3.49Å; H46-N50 PolarHBondContact O-N 3.45Å; H46-N50 PolarHBondContact O-ND2 2.83Å
47P89.7Confident91.2Very high61 Ų6174.7 Ų74.740%0.39639%0.387SS..G310 helixtrans-61.9-36.7-176.622.6-33.2000112.8K49 N50P47-K49 PolarHBondContact O-N 3.25Å; P47-K49 VanDerWaalsContact O-N 3.15Å; P47-N50 CarbonylContact O-C 3.27Å; P47-N50 VanDerWaalsContact O-C 3.27Å; P47-N50 PolarHBondContact O-N 3.46Å
48D91.2Very high90.9Very high125 Ų12580.5 Ų80.567%0.66841%0.414SS*.G310 helixtrans-53.2-31.6172.7-177.773.4000113.8H46H46-D48 VanDerWaalsContact C-N 3.31Å; H46-D48 VanDerWaalsContact ND1-CB 3.26Å; H46-D48 WeakPolarHBondContact ND1-CB 3.35Å; H46-D48 PolarHBondContact O-N 2.73Å
49K90.4Very high90.7Very high132 Ų13280.1 Ų80.157%0.57442%0.417SS*.G310 helixtrans-95-8.5-179.2-65.8-169.8177.4-54.60113.7H46 P47H46-K49 HydrophobicContact CB-CG 4.47Å; H46-K49 PolarHBondContact O-N 3.49Å; P47-K49 PolarHBondContact O-N 3.25Å; P47-K49 VanDerWaalsContact O-N 3.15Å
50N89.2Confident90.6Very high46 Ų4675.6 Ų75.625%0.24640%0.401CS..  trans-138.948.6-174.9-58.6-94.5000111Q44 H46 P47 D52 N53 A56Q44-N50 PolarHBondContact O-ND2 3.39Å; H46-N50 PolarHBondContact O-N 3.45Å; H46-N50 PolarHBondContact O-ND2 2.83Å; P47-N50 CarbonylContact O-C 3.27Å; P47-N50 VanDerWaalsContact O-C 3.27Å; P47-N50 PolarHBondContact O-N 3.46Å; N50-D52 PolarHBondContact O-N 3.5Å; N50-N53 HydrophobicContact CB-CB 4.38Å; N50-N53 PolarHBondContact O-N 3.44Å; N50-N53 VanDerWaalsContact O-N 3.11Å; N50-A56 HydrophobicContact CB-CB 3.58Å
51P86.2Confident90.4Very high102 Ų10275.9 Ų75.966%0.66241%0.406SS*.THydrogen-bonded Turntrans-60.2-32.6-172.625.3-34.2000112.6N53P51-N53 VanDerWaalsContact C-N 3.33Å; P51-N53 PolarHBondContact O-N 2.93Å
52D87.4Confident90.3Very high155 Ų15580.9 Ų80.983%0.82943%0.429SS*.THydrogen-bonded Turntrans-81.3-6.2-178.1-44.8-76.9000114.1N50N50-D52 PolarHBondContact O-N 3.5Å
53N88.6Confident90.3Very high77 Ų7780.2 Ų80.241%0.41242%0.423SS..  trans-119.396.3-172.2-172.7-8.7000112.6N50 P51 S55 A56N50-N53 HydrophobicContact CB-CB 4.38Å; N50-N53 PolarHBondContact O-N 3.44Å; N50-N53 VanDerWaalsContact O-N 3.11Å; P51-N53 VanDerWaalsContact C-N 3.33Å; P51-N53 PolarHBondContact O-N 2.93Å; N53-S55 PolarHBondContact O-N 3.04Å; N53-S55 VanDerWaalsContact OD1-CB 3.32Å; N53-S55 WeakPolarHBondContact OD1-CB 3.32Å; N53-S55 PolarHBondContact OD1-N 3.49Å; N53-A56 HydrophobicContact CB-CB 4.26Å; N53-A56 WeakPolarHBondContact O-CB 3.35Å; N53-A56 PolarHBondContact O-N 3.17Å; N53-A56 VanDerWaalsContact O-N 3.07Å; N53-A56 PolarHBondContact OD1-N 3.36Å
54P88.5Confident90.3Very high95 Ų9577.2 Ų77.262%0.61741%0.408SS*.Hα-helixtrans-62.6-28.3179.224.7-33.5000113.1A56 A57 E58P54-A56 VanDerWaalsContact C-N 3.25Å; P54-A56 PolarHBondContact O-N 3.26Å; P54-A57 PolarHBondContact O-N 3.06Å; P54-A57 VanDerWaalsContact O-N 3.14Å; P54-E58 PolarHBondContact O-N 3.32Å; P54-E58 VanDerWaalsContact O-N 3.1Å
55S89.5Confident90.4Very high61 Ų6179.7 Ų79.743%0.42741%0.413SS..Hα-helixtrans-67-27.1177.4-172.80000112.2N53 E58 T59N53-S55 PolarHBondContact O-N 3.04Å; N53-S55 VanDerWaalsContact OD1-CB 3.32Å; N53-S55 WeakPolarHBondContact OD1-CB 3.32Å; N53-S55 PolarHBondContact OD1-N 3.49Å; S55-E58 PolarHBondContact O-N 3.13Å; S55-T59 WeakPolarHBondContact O-CB 3.29Å; S55-T59 PolarHBondContact O-N 3.41Å; S55-T59 PolarHBondContact O-OG1 2.83Å
56A89.9Confident90.4Very high1 Ų177.7 Ų77.71%0.00841%0.405CS..Hα-helixtrans-64.7-42.7171.600000111.5F45 N50 N53 P54 E58 T59 F60F45-A56 HydrophobicContact CD1-CB 4.19Å; N50-A56 HydrophobicContact CB-CB 3.58Å; N53-A56 HydrophobicContact CB-CB 4.26Å; N53-A56 WeakPolarHBondContact O-CB 3.35Å; N53-A56 PolarHBondContact O-N 3.17Å; N53-A56 VanDerWaalsContact O-N 3.07Å; N53-A56 PolarHBondContact OD1-N 3.36Å; P54-A56 VanDerWaalsContact C-N 3.25Å; P54-A56 PolarHBondContact O-N 3.26Å; A56-E58 VanDerWaalsContact C-N 3.34Å; A56-E58 PolarHBondContact O-N 2.82Å; A56-T59 PolarHBondContact O-N 3.2Å; A56-F60 VanDerWaalsContact O-CB 3.32Å; A56-F60 WeakPolarHBondContact O-CB 3.41Å; A56-F60 PolarHBondContact O-N 2.77Å
57A89.9Confident90.6Very high32 Ų3276.3 Ų76.326%0.26440%0.397SS..Hα-helixtrans-67.2-32.6176.300000112.8P54 K61P54-A57 PolarHBondContact O-N 3.06Å; P54-A57 VanDerWaalsContact O-N 3.14Å; A57-K61 VanDerWaalsContact O-CG 3.26Å; A57-K61 WeakPolarHBondContact O-CG 3.42Å; A57-K61 PolarHBondContact O-N 3.34Å
58E90.2Very high90.7Very high126 Ų12681.1 Ų81.159%0.58941%0.407SS*.Hα-helixtrans-68.8-47.5171.7-68.2-179.8161.700111.8P54 S55 A56 F60 K61 E62P54-E58 PolarHBondContact O-N 3.32Å; P54-E58 VanDerWaalsContact O-N 3.1Å; S55-E58 PolarHBondContact O-N 3.13Å; A56-E58 VanDerWaalsContact C-N 3.34Å; A56-E58 PolarHBondContact O-N 2.82Å; E58-F60 VanDerWaalsContact C-N 3.29Å; E58-F60 PolarHBondContact O-N 3.1Å; E58-K61 WeakPolarHBondContact O-CB 3.41Å; E58-K61 PolarHBondContact O-N 3.45Å; E58-K61 VanDerWaalsContact O-N 3.12Å; E58-E62 PolarHBondContact O-N 3.23Å; E58-E62 VanDerWaalsContact O-N 3.09Å
59T90.5Very high90.7Very high42 Ų4275.8 Ų75.826%0.25838%0.378SS..Hα-helixtrans-59.5-41.2177.3-54.60000110.7F45 S55 A56 E62 I63F45-T59 HydrophobicContact CD1-CG2 3.87Å; F45-T59 HydrophobicContact CD2-CG2 4.04Å; F45-T59 HydrophobicContact CE1-CG2 3.9Å; F45-T59 HydrophobicContact CE2-CG2 4.08Å; F45-T59 HydrophobicContact CG-CG2 3.94Å; F45-T59 HydrophobicContact CZ-CG2 4.01Å; S55-T59 WeakPolarHBondContact O-CB 3.29Å; S55-T59 PolarHBondContact O-N 3.41Å; S55-T59 PolarHBondContact O-OG1 2.83Å; A56-T59 PolarHBondContact O-N 3.2Å; T59-E62 PolarHBondContact O-N 3.4Å; T59-I63 HydrophobicContact CG2-CD1 3.82Å; T59-I63 HydrophobicContact CG2-CG1 4.46Å; T59-I63 WeakPolarHBondContact O-CD1 3.37Å; T59-I63 VanDerWaalsContact O-CG1 3.26Å; T59-I63 WeakPolarHBondContact O-CG1 3.47Å; T59-I63 PolarHBondContact O-N 2.88Å
60F92.3Very high90.7Very high43 Ų4369.6 Ų69.619%0.18935%0.351CS..Hα-helixtrans-63-39.9175.5-174.4-94.2000113.2A42 F45 A56 E58 E62 I63 N64A42-F60 HydrophobicContact CB-CE2 3.96Å; F45-F60 HydrophobicContact CB-CB 4.24Å; A56-F60 VanDerWaalsContact O-CB 3.32Å; A56-F60 WeakPolarHBondContact O-CB 3.41Å; A56-F60 PolarHBondContact O-N 2.77Å; E58-F60 VanDerWaalsContact C-N 3.29Å; E58-F60 PolarHBondContact O-N 3.1Å; F60-E62 VanDerWaalsContact C-N 3.32Å; F60-E62 PolarHBondContact O-N 2.86Å; F60-I63 PolarHBondContact O-N 3.38Å; F60-N64 WeakPolarHBondContact O-CB 3.44Å; F60-N64 PolarHBondContact O-N 3.33Å
61K91.6Very high90.9Very high141 Ų14169.3 Ų69.361%0.61335%0.352SS*.Hα-helixtrans-61.2-41.8173.2-69.5163.7-165.8171.50111A57 E58 R65A57-K61 VanDerWaalsContact O-CG 3.26Å; A57-K61 WeakPolarHBondContact O-CG 3.42Å; A57-K61 PolarHBondContact O-N 3.34Å; E58-K61 WeakPolarHBondContact O-CB 3.41Å; E58-K61 PolarHBondContact O-N 3.45Å; E58-K61 VanDerWaalsContact O-N 3.12Å; K61-R65 WeakPolarHBondContact O-CB 3.39Å; K61-R65 PolarHBondContact O-N 3.29Å
62E91.5Very high91.2Very high108 Ų10867.2 Ų67.251%0.50534%0.335SS..Hα-helixtrans-69.1-43.5178.8-156.7-179.6-164.500112.1V22 E58 T59 F60 N64 R65 A66V22-E62 HydrophobicContact CG1-CB 4.26Å; V22-E62 HydrophobicContact CG1-CG 4.03Å; V22-E62 HydrophobicContact CG2-CG 3.84Å; E58-E62 PolarHBondContact O-N 3.23Å; E58-E62 VanDerWaalsContact O-N 3.09Å; T59-E62 PolarHBondContact O-N 3.4Å; F60-E62 VanDerWaalsContact C-N 3.32Å; F60-E62 PolarHBondContact O-N 2.86Å; E62-N64 PolarHBondContact O-N 3.31Å; E62-R65 PolarHBondContact O-N 2.98Å; E62-A66 WeakPolarHBondContact O-CB 3.49Å; E62-A66 PolarHBondContact O-N 2.6Å
63I93.3Very high91.4Very high2 Ų264.6 Ų64.61%0.0133%0.326CS..Hα-helixtrans-56.6-47.4173.7-69.6157.1000111.3V22 L23 Y38 L41 F45 T59 F60 A66 Y67V22-I63 HydrophobicContact CG1-CB 4.48Å; V22-I63 HydrophobicContact CG1-CG1 3.98Å; L23-I63 HydrophobicContact CD2-CG2 4.28Å; Y38-I63 HydrophobicContact CD2-CG2 3.67Å; Y38-I63 HydrophobicContact CE2-CG2 3.98Å; L41-I63 HydrophobicContact CB-CD1 3.83Å; L41-I63 HydrophobicContact CB-CG1 4.37Å; L41-I63 HydrophobicContact CB-CG2 4.19Å; F45-I63 HydrophobicContact CB-CD1 4.24Å; F45-I63 HydrophobicContact CD2-CD1 3.59Å; F45-I63 HydrophobicContact CE2-CD1 4.3Å; F45-I63 HydrophobicContact CG-CD1 4.14Å; T59-I63 HydrophobicContact CG2-CD1 3.82Å; T59-I63 HydrophobicContact CG2-CG1 4.46Å; T59-I63 WeakPolarHBondContact O-CD1 3.37Å; T59-I63 VanDerWaalsContact O-CG1 3.26Å; T59-I63 WeakPolarHBondContact O-CG1 3.47Å; T59-I63 PolarHBondContact O-N 2.88Å; F60-I63 PolarHBondContact O-N 3.38Å; I63-A66 PolarHBondContact O-N 2.98Å; I63-Y67 WeakPolarHBondContact O-CB 3.44Å; I63-Y67 PolarHBondContact O-N 3.33Å
64N93.4Very high91.5Very high58 Ų5864.4 Ų64.431%0.3133%0.328SS..Hα-helixtrans-64.6-43.6178-176.617.9000111.6F60 E62 A66 Y67 R68F60-N64 WeakPolarHBondContact O-CB 3.44Å; F60-N64 PolarHBondContact O-N 3.33Å; E62-N64 PolarHBondContact O-N 3.31Å; N64-A66 PolarHBondContact O-N 3.17Å; N64-Y67 PolarHBondContact O-N 3.33Å; N64-R68 WeakPolarHBondContact O-CG 3.42Å; N64-R68 PolarHBondContact O-N 3.36Å
65R91.7Very high91.6Very high145 Ų14562.3 Ų62.355%0.54731%0.309SS..Hα-helixtrans-58.1-50.3174.8-173179.5-170.6-154.45.1111K61 E62 Y67 R68 I69 E91K61-R65 WeakPolarHBondContact O-CB 3.39Å; K61-R65 PolarHBondContact O-N 3.29Å; E62-R65 PolarHBondContact O-N 2.98Å; R65-Y67 PolarHBondContact O-N 3.16Å; R65-R68 PolarHBondContact O-N 3.43Å; R65-I69 HydrophobicContact CG-CD1 3.73Å; R65-I69 VanDerWaalsContact O-CD1 3.26Å; R65-I69 WeakPolarHBondContact O-CD1 3.45Å; R65-I69 WeakPolarHBondContact O-CG1 3.29Å; R65-I69 PolarHBondContact O-N 3.4Å; R65-E91 IonicContact NH2-OE2 3.59Å
66A92.7Very high91.6Very high2 Ų261.3 Ų61.32%0.01730%0.296CS..Hα-helixtrans-61.3-42.5-18000000112.4L19 V22 L23 E62 I63 N64 I69 L70L19-A66 HydrophobicContact CB-CB 4.06Å; L19-A66 HydrophobicContact CD2-CB 4.47Å; L19-A66 HydrophobicContact CG-CB 3.84Å; V22-A66 HydrophobicContact CB-CB 4.3Å; V22-A66 HydrophobicContact CG1-CB 3.97Å; L23-A66 HydrophobicContact CD1-CB 3.85Å; L23-A66 HydrophobicContact CG-CB 4.13Å; E62-A66 WeakPolarHBondContact O-CB 3.49Å; E62-A66 PolarHBondContact O-N 2.6Å; I63-A66 PolarHBondContact O-N 2.98Å; N64-A66 PolarHBondContact O-N 3.17Å; A66-I69 PolarHBondContact O-N 3.25Å; A66-L70 WeakPolarHBondContact O-CG 3.48Å; A66-L70 PolarHBondContact O-N 2.93Å; A66-L70 VanDerWaalsContact O-N 3.13Å
67Y94.2Very high91.6Very high49 Ų4963.3 Ų63.319%0.19231%0.31CS..Hα-helixtrans-62.1-51.3177.6178.1-109.3000112R35 Y38 I63 N64 R65 I69 L70 T71R35-Y67 HydrophobicContact CG-CE2 4.09Å; Y38-Y67 AromaticContact CD1-CD1 3.95Å; Y38-Y67 HydrophobicContact CD1-CD1 3.95Å; Y38-Y67 HydrophobicContact CD1-CD2 4.14Å; Y38-Y67 AromaticContact CD1-CE1 3.95Å; Y38-Y67 HydrophobicContact CD1-CE1 3.95Å; Y38-Y67 HydrophobicContact CD1-CE2 4.13Å; Y38-Y67 HydrophobicContact CD1-CG 4.05Å; Y38-Y67 AromaticContact CD2-CD1 3.95Å; Y38-Y67 HydrophobicContact CD2-CD1 3.95Å; Y38-Y67 HydrophobicContact CD2-CD2 4.05Å; Y38-Y67 AromaticContact CD2-CG 3.56Å; Y38-Y67 HydrophobicContact CD2-CG 3.56Å; Y38-Y67 HydrophobicContact CE1-CD1 4.01Å; Y38-Y67 HydrophobicContact CE1-CE1 4.06Å; Y38-Y67 HydrophobicContact CE1-CG 4.49Å; Y38-Y67 HydrophobicContact CE2-CD1 4.02Å; Y38-Y67 HydrophobicContact CE2-CG 4.05Å; Y38-Y67 AromaticContact CG-CD1 3.93Å; Y38-Y67 HydrophobicContact CG-CD1 3.93Å; Y38-Y67 AromaticContact CG-CD2 3.62Å; Y38-Y67 HydrophobicContact CG-CD2 3.62Å; Y38-Y67 HydrophobicContact CG-CE1 4.32Å; Y38-Y67 HydrophobicContact CG-CE2 4.04Å; Y38-Y67 AromaticContact CG-CG 3.56Å; Y38-Y67 HydrophobicContact CG-CG 3.56Å; I63-Y67 WeakPolarHBondContact O-CB 3.44Å; I63-Y67 PolarHBondContact O-N 3.33Å; N64-Y67 PolarHBondContact O-N 3.33Å; R65-Y67 PolarHBondContact O-N 3.16Å; Y67-I69 VanDerWaalsContact C-N 3.27Å; Y67-I69 PolarHBondContact O-N 3.46Å; Y67-L70 PolarHBondContact O-N 3.11Å; Y67-T71 WeakPolarHBondContact CE2-OG1 3.18Å; Y67-T71 WeakPolarHBondContact O-CB 3.47Å; Y67-T71 PolarHBondContact O-N 2.94Å; Y67-T71 PolarHBondContact O-OG1 3.13Å
68R92.6Very high91.6Very high162 Ų16262.2 Ų62.261%0.61130%0.299SS*.Hα-helixtrans-53.6-43.3178.3-71.4177.568.5-161.3-0.3112.5N64 R65 D72N64-R68 WeakPolarHBondContact O-CG 3.42Å; N64-R68 PolarHBondContact O-N 3.36Å; R65-R68 PolarHBondContact O-N 3.43Å; R68-D72 PolarHBondContact O-N 3.09Å
69I91.4Very high91.5Very high13 Ų1356.3 Ų56.37%0.06727%0.272CS..Hα-helixtrans-73.5-31.7-176.5-65158.5000112.7L19 R65 A66 Y67 K75 R76 L87L19-I69 HydrophobicContact CD2-CB 3.6Å; L19-I69 HydrophobicContact CD2-CD1 3.84Å; L19-I69 HydrophobicContact CD2-CG1 4.35Å; L19-I69 HydrophobicContact CD2-CG2 3.41Å; L19-I69 VanDerWaalsContact CD2-CG2 3.41Å; R65-I69 HydrophobicContact CG-CD1 3.73Å; R65-I69 VanDerWaalsContact O-CD1 3.26Å; R65-I69 WeakPolarHBondContact O-CD1 3.45Å; R65-I69 WeakPolarHBondContact O-CG1 3.29Å; R65-I69 PolarHBondContact O-N 3.4Å; A66-I69 PolarHBondContact O-N 3.25Å; Y67-I69 VanDerWaalsContact C-N 3.27Å; Y67-I69 PolarHBondContact O-N 3.46Å; I69-K75 HydrophobicContact CG2-CB 4.23Å; I69-R76 PolarHBondContact O-N 3.23Å; I69-L87 HydrophobicContact CD1-CD1 4.08Å; I69-L87 HydrophobicContact CD1-CD2 3.51Å; I69-L87 HydrophobicContact CD1-CG 4.44Å; I69-L87 HydrophobicContact CG1-CD1 3.99Å; I69-L87 HydrophobicContact CG1-CD2 4.34Å; I69-L87 HydrophobicContact CG2-CD1 3.93Å
70L91.3Very high91.3Very high1 Ų157.9 Ų57.91%0.00528%0.276CS..Hα-helixtrans-90.9-17.4-179.9-62.8-177000114L19 F20 L23 L34 A66 Y67 R76 Y79L19-L70 HydrophobicContact CB-CD1 4.08Å; L19-L70 HydrophobicContact CB-CD2 4.5Å; L19-L70 HydrophobicContact CB-CG 4.29Å; L19-L70 HydrophobicContact CD2-CD2 4.33Å; L19-L70 HydrophobicContact CD2-CG 4.23Å; F20-L70 HydrophobicContact CD1-CD1 3.85Å; F20-L70 HydrophobicContact CD2-CD1 4.36Å; F20-L70 HydrophobicContact CE1-CD1 3.83Å; F20-L70 HydrophobicContact CE1-CD2 4.27Å; F20-L70 HydrophobicContact CE2-CD1 4.35Å; F20-L70 HydrophobicContact CE2-CD2 3.91Å; F20-L70 HydrophobicContact CG-CD1 4.12Å; F20-L70 HydrophobicContact CZ-CD1 4.09Å; F20-L70 HydrophobicContact CZ-CD2 3.73Å; L23-L70 HydrophobicContact CD1-CD1 3.95Å; L34-L70 HydrophobicContact CD1-CB 3.58Å; L34-L70 WeakPolarHBondContact CD1-O 3.15Å; L34-L70 HydrophobicContact CD2-CD1 4.13Å; A66-L70 WeakPolarHBondContact O-CG 3.48Å; A66-L70 PolarHBondContact O-N 2.93Å; A66-L70 VanDerWaalsContact O-N 3.13Å; Y67-L70 PolarHBondContact O-N 3.11Å; L70-R76 HydrophobicContact CD2-CG 4.13Å; L70-Y79 HydrophobicContact CD2-CD1 4.14Å
71T92Very high91Very high41 Ų4163 Ų6325%0.25230%0.298SS..Hα-helixtrans-72.8-42.1168.4-76.50000111.5Y67 P73Y67-T71 WeakPolarHBondContact CE2-OG1 3.18Å; Y67-T71 WeakPolarHBondContact O-CB 3.47Å; Y67-T71 PolarHBondContact O-N 2.94Å; Y67-T71 PolarHBondContact O-OG1 3.13Å; T71-P73 VanDerWaalsContact O-CD 3.32Å; T71-P73 WeakPolarHBondContact O-CD 3.4Å
72D92.1Very high90.7Very high57 Ų5759.2 Ų59.231%0.30528%0.28SS..SBendtrans-70.7112.4177.3-69.9-31.4000110.2R68 V74 K75 R76R68-D72 PolarHBondContact O-N 3.09Å; D72-V74 VanDerWaalsContact C-N 3.28Å; D72-V74 PolarHBondContact O-N 3.39Å; D72-K75 HydrophobicContact CB-CB 4.02Å; D72-K75 HydrophobicContact CB-CD 3.81Å; D72-K75 HydrophobicContact CB-CG 3.9Å; D72-K75 PolarHBondContact O-N 3.47Å; D72-K75 WeakPolarHBondContact OD2-CD 3.44Å; D72-K75 WeakPolarHBondContact OD2-CE 3.41Å; D72-K75 IonicContact OD2-NZ 2.78Å; D72-K75 PolarHBondContact OD2-NZ 2.87Å; D72-R76 WeakPolarHBondContact O-CB 3.47Å; D72-R76 PolarHBondContact O-N 3.18Å
73P91.5Very high90.5Very high101 Ų10154.2 Ų54.266%0.65626%0.258SS*.Hα-helixtrans-65.8-31.4-169.425.1-34.2000113T71 S77T71-P73 VanDerWaalsContact O-CD 3.32Å; T71-P73 WeakPolarHBondContact O-CD 3.4Å; P73-S77 WeakPolarHBondContact O-CB 3.47Å; P73-S77 PolarHBondContact O-N 3.33Å
74V90.9Very high90.2Very high73 Ų7357.2 Ų57.244%0.44228%0.28SS..Hα-helixtrans-68.3-54.4177-178.30000110.2D72 R76 S77 I78 E95D72-V74 VanDerWaalsContact C-N 3.28Å; D72-V74 PolarHBondContact O-N 3.39Å; V74-R76 VanDerWaalsContact C-N 3.32Å; V74-R76 PolarHBondContact O-N 3.41Å; V74-S77 WeakPolarHBondContact O-CB 3.23Å; V74-S77 PolarHBondContact O-N 3.32Å; V74-S77 PolarHBondContact O-OG 3.33Å; V74-I78 HydrophobicContact CG1-CD1 3.94Å; V74-I78 WeakPolarHBondContact O-CG1 3.47Å; V74-I78 PolarHBondContact O-N 3.35Å; V74-E95 VanDerWaalsContact CB-OE2 3.3Å; V74-E95 WeakPolarHBondContact CB-OE2 3.42Å; V74-E95 HydrophobicContact CG1-CB 3.83Å; V74-E95 HydrophobicContact CG1-CG 4.48Å; V74-E95 WeakPolarHBondContact CG1-OE2 3.42Å
75K90.9Very high89.9Confident50 Ų5057.9 Ų57.922%0.21729%0.286CS..Hα-helixtrans-58.2-40.5175.4-56.8-179.2-168.1153.80112.7I69 D72 I78 Y79 E95I69-K75 HydrophobicContact CG2-CB 4.23Å; D72-K75 HydrophobicContact CB-CB 4.02Å; D72-K75 HydrophobicContact CB-CD 3.81Å; D72-K75 HydrophobicContact CB-CG 3.9Å; D72-K75 PolarHBondContact O-N 3.47Å; D72-K75 WeakPolarHBondContact OD2-CD 3.44Å; D72-K75 WeakPolarHBondContact OD2-CE 3.41Å; D72-K75 IonicContact OD2-NZ 2.78Å; D72-K75 PolarHBondContact OD2-NZ 2.87Å; K75-I78 PolarHBondContact O-N 3.34Å; K75-Y79 WeakPolarHBondContact O-CB 3.34Å; K75-Y79 PolarHBondContact O-N 3.4Å; K75-E95 WeakPolarHBondContact CE-OE1 3.23Å; K75-E95 HydrophobicContact CG-CG 4.27Å; K75-E95 VanDerWaalsContact CG-OE2 3.24Å; K75-E95 WeakPolarHBondContact CG-OE2 3.5Å; K75-E95 IonicContact NZ-OE1 3.21Å
76R90.9Very high89.7Confident40 Ų4051 Ų5115%0.15126%0.259CS..Hα-helixtrans-56.8-49.4172179.8174.7172.5162.3-1.1111.1G28 A29 I69 L70 D72 V74 I78 Y79 E80G28-R76 PolarHBondContact O-NH2 3.31Å; A29-R76 PolarHBondContact O-NH1 2.94Å; A29-R76 PolarHBondContact O-NH2 3.47Å; I69-R76 PolarHBondContact O-N 3.23Å; L70-R76 HydrophobicContact CD2-CG 4.13Å; D72-R76 WeakPolarHBondContact O-CB 3.47Å; D72-R76 PolarHBondContact O-N 3.18Å; V74-R76 VanDerWaalsContact C-N 3.32Å; V74-R76 PolarHBondContact O-N 3.41Å; R76-I78 VanDerWaalsContact C-N 3.31Å; R76-I78 PolarHBondContact O-N 2.81Å; R76-Y79 PolarHBondContact O-N 2.73Å; R76-E80 HydrophobicContact CG-CG 4.39Å; R76-E80 IonicContact CZ-OE1 3.4Å; R76-E80 IonicContact NE-OE1 2.78Å; R76-E80 PolarHBondContact NE-OE1 3.33Å; R76-E80 IonicContact NH2-OE1 3.15Å; R76-E80 PolarHBondContact NH2-OE1 3.39Å; R76-E80 VanDerWaalsContact NH2-OE1 3.15Å; R76-E80 WeakPolarHBondContact O-CB 3.36Å; R76-E80 WeakPolarHBondContact O-CG 3.49Å; R76-E80 PolarHBondContact O-N 3.28Å
77S89Confident89.5Confident43 Ų4351.6 Ų51.630%0.30126%0.262SS..Hα-helixtrans-64.3-34.2178.683.30000113.1P73 V74 K81P73-S77 WeakPolarHBondContact O-CB 3.47Å; P73-S77 PolarHBondContact O-N 3.33Å; V74-S77 WeakPolarHBondContact O-CB 3.23Å; V74-S77 PolarHBondContact O-N 3.32Å; V74-S77 PolarHBondContact O-OG 3.33Å; S77-K81 WeakPolarHBondContact O-CB 3.44Å; S77-K81 WeakPolarHBondContact O-CD 3.32Å; S77-K81 VanDerWaalsContact O-CG 3.24Å; S77-K81 WeakPolarHBondContact O-CG 3.44Å; S77-K81 PolarHBondContact O-N 3.5Å
78I89Confident89.2Confident10 Ų1051.6 Ų51.65%0.05127%0.269CS..Hα-helixtrans-66.7-46.7175.1-71.5163.2000110.2V74 K75 R76 K81 Y82 G86 A90 E95 V98V74-I78 HydrophobicContact CG1-CD1 3.94Å; V74-I78 WeakPolarHBondContact O-CG1 3.47Å; V74-I78 PolarHBondContact O-N 3.35Å; K75-I78 PolarHBondContact O-N 3.34Å; R76-I78 VanDerWaalsContact C-N 3.31Å; R76-I78 PolarHBondContact O-N 2.81Å; I78-K81 PolarHBondContact O-N 3.46Å; I78-Y82 HydrophobicContact CG2-CD2 4.27Å; I78-Y82 WeakPolarHBondContact O-CB 3.42Å; I78-Y82 WeakPolarHBondContact O-CD2 2.77Å; I78-Y82 PolarHBondContact O-N 2.91Å; I78-G86 WeakPolarHBondContact CG2-O 3.45Å; I78-A90 HydrophobicContact CD1-CB 4.32Å; I78-E95 HydrophobicContact CD1-CB 3.95Å; I78-E95 HydrophobicContact CD1-CG 4.28Å; I78-V98 HydrophobicContact CD1-CB 4.43Å; I78-V98 HydrophobicContact CD1-CG2 4.1Å; I78-V98 HydrophobicContact CG2-CG1 3.99Å
79Y88.5Confident88.9Confident2 Ų244.3 Ų44.31%0.00824%0.242CC..Hα-helixtrans-67.5-39.2178.3178.8-103.5000112.6G16 E17 S18 L19 F20 L70 K75 R76 K81 G83G16-Y79 VanDerWaalsContact CA-CZ 3.48Å; G16-Y79 WeakPolarHBondContact CA-OH 3.32Å; G16-Y79 WeakPolarHBondContact O-CE1 3.33Å; E17-Y79 PolarHBondContact N-OH 2.95Å; S18-Y79 PolarHBondContact N-OH 3.15Å; S18-Y79 VanDerWaalsContact N-OH 3.1Å; S18-Y79 PolarHBondContact OG-OH 3.07Å; L19-Y79 HydrophobicContact CB-CE1 3.88Å; L19-Y79 HydrophobicContact CD1-CD2 4.47Å; L19-Y79 HydrophobicContact CD1-CE1 4.42Å; L19-Y79 HydrophobicContact CD1-CE2 3.74Å; L19-Y79 HydrophobicContact CD2-CD1 4.43Å; L19-Y79 HydrophobicContact CD2-CE1 4.37Å; L19-Y79 HydrophobicContact CD2-CE2 4.46Å; L19-Y79 HydrophobicContact CD2-CG 4.5Å; L19-Y79 HydrophobicContact CG-CE1 4.44Å; L19-Y79 PolarHBondContact N-OH 3.03Å; F20-Y79 HydrophobicContact CD2-CE1 4.05Å; F20-Y79 HydrophobicContact CE2-CD1 4.15Å; F20-Y79 AromaticContact CE2-CE1 3.92Å; F20-Y79 HydrophobicContact CE2-CE1 3.92Å; L70-Y79 HydrophobicContact CD2-CD1 4.14Å; K75-Y79 WeakPolarHBondContact O-CB 3.34Å; K75-Y79 PolarHBondContact O-N 3.4Å; R76-Y79 PolarHBondContact O-N 2.73Å; Y79-K81 VanDerWaalsContact C-N 3.29Å; Y79-K81 PolarHBondContact O-N 2.78Å; Y79-G83 VanDerWaalsContact CD2-C 3.48Å; Y79-G83 WeakPolarHBondContact CD2-O 3.37Å; Y79-G83 VanDerWaalsContact O-CA 3.23Å; Y79-G83 WeakPolarHBondContact O-CA 3.34Å; Y79-G83 PolarHBondContact O-N 3.13Å
80E87.5Confident88.8Confident74 Ų7444.2 Ų44.235%0.34624%0.244SC..Hα-helixtrans-66.7-27.7176.3-75.3179.4-178.500112.9F20 R76F20-E80 HydrophobicContact CE2-CG 4.36Å; F20-E80 HydrophobicContact CZ-CG 4.28Å; R76-E80 HydrophobicContact CG-CG 4.39Å; R76-E80 IonicContact CZ-OE1 3.4Å; R76-E80 IonicContact NE-OE1 2.78Å; R76-E80 PolarHBondContact NE-OE1 3.33Å; R76-E80 IonicContact NH2-OE1 3.15Å; R76-E80 PolarHBondContact NH2-OE1 3.39Å; R76-E80 VanDerWaalsContact NH2-OE1 3.15Å; R76-E80 WeakPolarHBondContact O-CB 3.36Å; R76-E80 WeakPolarHBondContact O-CG 3.49Å; R76-E80 PolarHBondContact O-N 3.28Å
81K85.8Confident88.6Confident152 Ų15250.9 Ų50.966%0.66128%0.275SS*.Hα-helixtrans-89-42.1177-72.9171.7-177.6173.30114.5S77 I78 Y79S77-K81 WeakPolarHBondContact O-CB 3.44Å; S77-K81 WeakPolarHBondContact O-CD 3.32Å; S77-K81 VanDerWaalsContact O-CG 3.24Å; S77-K81 WeakPolarHBondContact O-CG 3.44Å; S77-K81 PolarHBondContact O-N 3.5Å; I78-K81 PolarHBondContact O-N 3.46Å; Y79-K81 VanDerWaalsContact C-N 3.29Å; Y79-K81 PolarHBondContact O-N 2.78Å
82Y85.5Confident88.4Confident60 Ų6055.8 Ų55.824%0.23530%0.295CS..Hα-helixtrans-1264.4-165.3-53.2-71.4000113.9I78 G86 V98 N99 F102I78-Y82 HydrophobicContact CG2-CD2 4.27Å; I78-Y82 WeakPolarHBondContact O-CB 3.42Å; I78-Y82 WeakPolarHBondContact O-CD2 2.77Å; I78-Y82 PolarHBondContact O-N 2.91Å; Y82-G86 PolarHBondContact O-N 2.68Å; Y82-V98 HydrophobicContact CD2-CG1 4.19Å; Y82-V98 HydrophobicContact CE2-CG1 4.26Å; Y82-N99 PolarHBondContact OH-OD1 3.15Å; Y82-F102 HydrophobicContact CD1-CB 4.5Å; Y82-F102 HydrophobicContact CD1-CD1 4.02Å; Y82-F102 AromaticContact CD1-CD2 3.39Å; Y82-F102 HydrophobicContact CD1-CD2 3.39Å; Y82-F102 HydrophobicContact CD1-CE1 4.03Å; Y82-F102 AromaticContact CD1-CE2 3.4Å; Y82-F102 HydrophobicContact CD1-CE2 3.4Å; Y82-F102 VanDerWaalsContact CD1-CE2 3.4Å; Y82-F102 AromaticContact CD1-CG 3.72Å; Y82-F102 HydrophobicContact CD1-CG 3.72Å; Y82-F102 AromaticContact CD1-CZ 3.74Å; Y82-F102 HydrophobicContact CD1-CZ 3.74Å; Y82-F102 AromaticContact CD2-CD2 3.91Å; Y82-F102 HydrophobicContact CD2-CD2 3.91Å; Y82-F102 AromaticContact CD2-CE2 3.75Å; Y82-F102 HydrophobicContact CD2-CE2 3.75Å; Y82-F102 HydrophobicContact CE1-CB 3.78Å; Y82-F102 HydrophobicContact CE1-CD1 4.13Å; Y82-F102 AromaticContact CE1-CD2 3.33Å; Y82-F102 HydrophobicContact CE1-CD2 3.33Å; Y82-F102 AromaticContact CE1-CE2 3.88Å; Y82-F102 HydrophobicContact CE1-CE2 3.88Å; Y82-F102 AromaticContact CE1-CG 3.48Å; Y82-F102 HydrophobicContact CE1-CG 3.48Å; Y82-F102 VanDerWaalsContact CE1-CG 3.48Å; Y82-F102 HydrophobicContact CE1-CZ 4.48Å; Y82-F102 AromaticContact CE2-CD2 3.85Å; Y82-F102 HydrophobicContact CE2-CD2 3.85Å; Y82-F102 HydrophobicContact CE2-CE2 4.18Å; Y82-F102 AromaticContact CG-CD2 3.68Å; Y82-F102 HydrophobicContact CG-CD2 3.68Å; Y82-F102 AromaticContact CG-CE2 3.32Å; Y82-F102 HydrophobicContact CG-CE2 3.32Å; Y82-F102 HydrophobicContact CG-CG 4.44Å; Y82-F102 AromaticContact CG-CZ 3.83Å; Y82-F102 HydrophobicContact CG-CZ 3.83Å; Y82-F102 AromaticContact CZ-CD2 3.56Å
83G86.9Confident88Confident4 Ų458.2 Ų58.24%0.04130%0.303CS..Hα-helixtrans60.9-150.8-179.800000113.7Y79 V85 G86Y79-G83 VanDerWaalsContact CD2-C 3.48Å; Y79-G83 WeakPolarHBondContact CD2-O 3.37Å; Y79-G83 VanDerWaalsContact O-CA 3.23Å; Y79-G83 WeakPolarHBondContact O-CA 3.34Å; Y79-G83 PolarHBondContact O-N 3.13Å; G83-V85 PolarHBondContact O-N 2.86Å; G83-G86 PolarHBondContact O-N 3.32Å
84S86.5Confident87.7Confident65 Ų6554.6 Ų54.646%0.45528%0.284SS..Hα-helixtrans-62.5-27.9178.150.10000113.6L87 S88S84-L87 PolarHBondContact O-N 2.82Å; S84-S88 PolarHBondContact O-N 2.88Å; S84-S88 VanDerWaalsContact O-N 3.09Å; S84-S88 PolarHBondContact O-OG 2.74Å
85V86.2Confident87.4Confident72 Ų7254 Ų5444%0.43628%0.276SS..Hα-helixtrans-66.4-48.4-179.8-176.90000110.5G83 L87 S88 I89 F102G83-V85 PolarHBondContact O-N 2.86Å; V85-L87 VanDerWaalsContact C-N 3.27Å; V85-L87 PolarHBondContact O-N 3.24Å; V85-S88 PolarHBondContact O-N 2.89Å; V85-S88 VanDerWaalsContact O-N 3.13Å; V85-S88 PolarHBondContact O-OG 2.72Å; V85-I89 HydrophobicContact CG1-CD1 3.97Å; V85-I89 WeakPolarHBondContact O-CD1 3.3Å; V85-I89 WeakPolarHBondContact O-CG1 3.32Å; V85-I89 PolarHBondContact O-N 3.48Å; V85-I89 VanDerWaalsContact O-N 3.11Å; V85-F102 HydrophobicContact CG1-CZ 4.15Å
86G87.9Confident87Confident0 Ų058 Ų580%030%0.296CS..Hα-helixtrans-60.5-35.9176.600000113.5I78 Y82 G83 I89 A90I78-G86 WeakPolarHBondContact CG2-O 3.45Å; Y82-G86 PolarHBondContact O-N 2.68Å; G83-G86 PolarHBondContact O-N 3.32Å; G86-I89 PolarHBondContact O-N 2.73Å; G86-A90 PolarHBondContact O-N 3.08Å
87L88.5Confident86.7Confident15 Ų1559.4 Ų59.48%0.07931%0.306CS..Hα-helixtrans-63.3-45173.5179.172.4000112I69 S84 V85 I89 A90 E91I69-L87 HydrophobicContact CD1-CD1 4.08Å; I69-L87 HydrophobicContact CD1-CD2 3.51Å; I69-L87 HydrophobicContact CD1-CG 4.44Å; I69-L87 HydrophobicContact CG1-CD1 3.99Å; I69-L87 HydrophobicContact CG1-CD2 4.34Å; I69-L87 HydrophobicContact CG2-CD1 3.93Å; S84-L87 PolarHBondContact O-N 2.82Å; V85-L87 VanDerWaalsContact C-N 3.27Å; V85-L87 PolarHBondContact O-N 3.24Å; L87-I89 PolarHBondContact O-N 2.85Å; L87-A90 WeakPolarHBondContact O-CB 3.5Å; L87-A90 PolarHBondContact O-N 3.41Å; L87-E91 WeakPolarHBondContact O-CB 3.24Å; L87-E91 PolarHBondContact O-N 3.04Å
88S87.7Confident86.5Confident48 Ų4857.4 Ų57.434%0.33629%0.292SS..Hα-helixtrans-64.6-28.3177.356.80000113.5S84 V85 Q92S84-S88 PolarHBondContact O-N 2.88Å; S84-S88 VanDerWaalsContact O-N 3.09Å; S84-S88 PolarHBondContact O-OG 2.74Å; V85-S88 PolarHBondContact O-N 2.89Å; V85-S88 VanDerWaalsContact O-N 3.13Å; V85-S88 PolarHBondContact O-OG 2.72Å; S88-Q92 VanDerWaalsContact O-CG 3.29Å; S88-Q92 WeakPolarHBondContact O-CG 3.36Å; S88-Q92 PolarHBondContact O-N 3.49Å
89I87.9Confident86.3Confident9 Ų961.5 Ų61.55%0.04631%0.314CS..Hα-helixtrans-74.7-40.9173.5-61.8156.1000110V85 G86 L87 E91 Q92 F93 V98 Y101 F102V85-I89 HydrophobicContact CG1-CD1 3.97Å; V85-I89 WeakPolarHBondContact O-CD1 3.3Å; V85-I89 WeakPolarHBondContact O-CG1 3.32Å; V85-I89 PolarHBondContact O-N 3.48Å; V85-I89 VanDerWaalsContact O-N 3.11Å; G86-I89 PolarHBondContact O-N 2.73Å; L87-I89 PolarHBondContact O-N 2.85Å; I89-E91 VanDerWaalsContact C-N 3.3Å; I89-E91 PolarHBondContact O-N 3.25Å; I89-Q92 PolarHBondContact O-N 3.37Å; I89-Q92 VanDerWaalsContact O-N 3.16Å; I89-F93 HydrophobicContact CG2-CD2 3.91Å; I89-F93 PolarHBondContact O-N 3.26Å; I89-V98 HydrophobicContact CB-CG1 4.35Å; I89-V98 HydrophobicContact CB-CG2 4.37Å; I89-V98 HydrophobicContact CG2-CB 4.34Å; I89-V98 HydrophobicContact CG2-CG1 4.25Å; I89-V98 HydrophobicContact CG2-CG2 4.06Å; I89-Y101 HydrophobicContact CD1-CD1 3.54Å; I89-Y101 HydrophobicContact CD1-CE1 3.58Å; I89-Y101 HydrophobicContact CD1-CG 4.42Å; I89-Y101 HydrophobicContact CG1-CD1 4.18Å; I89-Y101 HydrophobicContact CG1-CE1 4.17Å; I89-Y101 HydrophobicContact CG2-CD1 4.1Å; I89-Y101 HydrophobicContact CG2-CD2 4.4Å; I89-Y101 HydrophobicContact CG2-CG 3.9Å; I89-F102 HydrophobicContact CD1-CD2 4.45Å; I89-F102 HydrophobicContact CD1-CE1 4.14Å; I89-F102 HydrophobicContact CD1-CE2 3.61Å; I89-F102 HydrophobicContact CD1-CZ 3.43Å; I89-F102 VanDerWaalsContact CD1-CZ 3.43Å
90A88.5Confident86.1Confident12 Ų1265.4 Ų65.410%0.09934%0.338CS..Hα-helixtrans-58.8-42.3175.200000112.2I78 G86 L87 Q92 G94 E95 V98I78-A90 HydrophobicContact CD1-CB 4.32Å; G86-A90 PolarHBondContact O-N 3.08Å; L87-A90 WeakPolarHBondContact O-CB 3.5Å; L87-A90 PolarHBondContact O-N 3.41Å; A90-Q92 PolarHBondContact O-N 2.85Å; A90-G94 CarbonylContact O-C 3.56Å; A90-G94 WeakPolarHBondContact O-CA 3.29Å; A90-G94 PolarHBondContact O-N 3.4Å; A90-G94 VanDerWaalsContact O-N 3.13Å; A90-E95 HydrophobicContact CB-CG 4.1Å; A90-V98 VanDerWaalsContact CA-CG2 3.45Å; A90-V98 HydrophobicContact CB-CG2 3.67Å
91E87.4Confident85.9Confident140 Ų14066.4 Ų66.465%0.65434%0.34SS*.Hα-helixtrans-69.6-18.2179.6-168.5164-159.100113.1R65 L87 I89R65-E91 IonicContact NH2-OE2 3.59Å; L87-E91 WeakPolarHBondContact O-CB 3.24Å; L87-E91 PolarHBondContact O-N 3.04Å; I89-E91 VanDerWaalsContact C-N 3.3Å; I89-E91 PolarHBondContact O-N 3.25Å
92Q87.1Confident85.8Confident145 Ų14561.7 Ų61.768%0.67832%0.319SS*.Hα-helixtrans-104.8-37.6-180-71.3174.821.200114.3S88 I89 A90S88-Q92 VanDerWaalsContact O-CG 3.29Å; S88-Q92 WeakPolarHBondContact O-CG 3.36Å; S88-Q92 PolarHBondContact O-N 3.49Å; I89-Q92 PolarHBondContact O-N 3.37Å; I89-Q92 VanDerWaalsContact O-N 3.16Å; A90-Q92 PolarHBondContact O-N 2.85Å
93F83.4Confident85.7Confident108 Ų10862.9 Ų62.947%0.47433%0.333SS..Hα-helixtrans-117.4-2.7-169.2-65.8-84.1000114.3I89 N97I89-F93 HydrophobicContact CG2-CD2 3.91Å; I89-F93 PolarHBondContact O-N 3.26Å; F93-N97 HydrophobicContact CB-CB 4.15Å; F93-N97 WeakPolarHBondContact O-CB 3.32Å; F93-N97 PolarHBondContact O-ND2 2.94Å
94G86.3Confident85.4Confident24 Ų2467.1 Ų67.125%0.24735%0.354CS..  trans88.9152.3-168.100000112.1A90 E96 N97 V98A90-G94 CarbonylContact O-C 3.56Å; A90-G94 WeakPolarHBondContact O-CA 3.29Å; A90-G94 PolarHBondContact O-N 3.4Å; A90-G94 VanDerWaalsContact O-N 3.13Å; G94-E96 VanDerWaalsContact C-N 3.35Å; G94-E96 PolarHBondContact O-N 2.76Å; G94-N97 PolarHBondContact O-N 3.04Å; G94-V98 WeakPolarHBondContact O-CG2 3.19Å
95E84.1Confident85.2Confident61 Ų6167.7 Ų67.729%0.28536%0.355SS..THydrogen-bonded Turntrans-69.7-33.8-172.9-68.4172.9-130.800112.3V74 K75 I78 A90 V98V74-E95 VanDerWaalsContact CB-OE2 3.3Å; V74-E95 WeakPolarHBondContact CB-OE2 3.42Å; V74-E95 HydrophobicContact CG1-CB 3.83Å; V74-E95 HydrophobicContact CG1-CG 4.48Å; V74-E95 WeakPolarHBondContact CG1-OE2 3.42Å; K75-E95 WeakPolarHBondContact CE-OE1 3.23Å; K75-E95 HydrophobicContact CG-CG 4.27Å; K75-E95 VanDerWaalsContact CG-OE2 3.24Å; K75-E95 WeakPolarHBondContact CG-OE2 3.5Å; K75-E95 IonicContact NZ-OE1 3.21Å; I78-E95 HydrophobicContact CD1-CB 3.95Å; I78-E95 HydrophobicContact CD1-CG 4.28Å; A90-E95 HydrophobicContact CB-CG 4.1Å; E95-V98 WeakPolarHBondContact O-CG2 3.4Å
96E82.3Confident85Confident134 Ų13468.1 Ų68.163%0.62636%0.355SS*.THydrogen-bonded Turntrans-66.3-35.6176.770.5-75.2-173.700112.7G94 V98G94-E96 VanDerWaalsContact C-N 3.35Å; G94-E96 PolarHBondContact O-N 2.76Å; E96-V98 VanDerWaalsContact C-N 3.35Å; E96-V98 PolarHBondContact O-N 2.86Å
97N84.9Confident84.7Confident69 Ų6976.7 Ų76.737%0.36939%0.392SS..Hα-helixtrans-82.2-11.5-175.4-66.9-53.3000113.4F93 G94 N99 T100 Y101F93-N97 HydrophobicContact CB-CB 4.15Å; F93-N97 WeakPolarHBondContact O-CB 3.32Å; F93-N97 PolarHBondContact O-ND2 2.94Å; G94-N97 PolarHBondContact O-N 3.04Å; N97-N99 PolarHBondContact O-N 3.37Å; N97-T100 WeakPolarHBondContact O-CB 3.42Å; N97-T100 PolarHBondContact O-N 3.02Å; N97-Y101 WeakPolarHBondContact O-CB 3.18Å; N97-Y101 PolarHBondContact O-N 3.44Å
98V85.5Confident84.3Confident1 Ų186.2 Ų86.21%0.00643%0.427CS..Hα-helixtrans-60.6-44.3179-175.30000111.8I78 Y82 I89 A90 G94 E95 E96 Y101 F102I78-V98 HydrophobicContact CD1-CB 4.43Å; I78-V98 HydrophobicContact CD1-CG2 4.1Å; I78-V98 HydrophobicContact CG2-CG1 3.99Å; Y82-V98 HydrophobicContact CD2-CG1 4.19Å; Y82-V98 HydrophobicContact CE2-CG1 4.26Å; I89-V98 HydrophobicContact CB-CG1 4.35Å; I89-V98 HydrophobicContact CB-CG2 4.37Å; I89-V98 HydrophobicContact CG2-CB 4.34Å; I89-V98 HydrophobicContact CG2-CG1 4.25Å; I89-V98 HydrophobicContact CG2-CG2 4.06Å; A90-V98 VanDerWaalsContact CA-CG2 3.45Å; A90-V98 HydrophobicContact CB-CG2 3.67Å; G94-V98 WeakPolarHBondContact O-CG2 3.19Å; E95-V98 WeakPolarHBondContact O-CG2 3.4Å; E96-V98 VanDerWaalsContact C-N 3.35Å; E96-V98 PolarHBondContact O-N 2.86Å; V98-Y101 PolarHBondContact O-N 3.02Å; V98-F102 HydrophobicContact CG1-CD2 3.73Å; V98-F102 HydrophobicContact CG1-CE2 3.58Å; V98-F102 VanDerWaalsContact O-CD2 3.23Å; V98-F102 WeakPolarHBondContact O-CD2 3.4Å; V98-F102 PolarHBondContact O-N 3.31Å
99N83.2Confident84Confident97 Ų9785.1 Ų85.152%0.51942%0.419SS..Hα-helixtrans-63.3-46.1178.3-171.430.4000110.6Y82 N97 Y101 F102 V103Y82-N99 PolarHBondContact OH-OD1 3.15Å; N97-N99 PolarHBondContact O-N 3.37Å; N99-Y101 VanDerWaalsContact C-N 3.34Å; N99-Y101 PolarHBondContact O-N 2.88Å; N99-F102 PolarHBondContact O-N 3.18Å; N99-V103 WeakPolarHBondContact O-CG2 3.45Å; N99-V103 PolarHBondContact O-N 3.03Å
100T84.3Confident83.8Confident84 Ų8491.4 Ų91.452%0.51545%0.446SS..Hα-helixtrans-56.7-45.1174.6-49.40000111.6N97 F102 V103 L104N97-T100 WeakPolarHBondContact O-CB 3.42Å; N97-T100 PolarHBondContact O-N 3.02Å; T100-F102 PolarHBondContact O-N 3.15Å; T100-V103 PolarHBondContact O-N 2.83Å; T100-L104 VanDerWaalsContact O-CB 3.26Å; T100-L104 WeakPolarHBondContact O-CB 3.41Å; T100-L104 PolarHBondContact O-N 2.8Å
101Y84.5Confident83.7Confident95 Ų9593.4 Ų93.437%0.37346%0.463SS..Hα-helixtrans-61.2-44.3177.6-178.7-84.4000112.3I89 N97 V98 N99 L104 T105I89-Y101 HydrophobicContact CD1-CD1 3.54Å; I89-Y101 HydrophobicContact CD1-CE1 3.58Å; I89-Y101 HydrophobicContact CD1-CG 4.42Å; I89-Y101 HydrophobicContact CG1-CD1 4.18Å; I89-Y101 HydrophobicContact CG1-CE1 4.17Å; I89-Y101 HydrophobicContact CG2-CD1 4.1Å; I89-Y101 HydrophobicContact CG2-CD2 4.4Å; I89-Y101 HydrophobicContact CG2-CG 3.9Å; N97-Y101 WeakPolarHBondContact O-CB 3.18Å; N97-Y101 PolarHBondContact O-N 3.44Å; V98-Y101 PolarHBondContact O-N 3.02Å; N99-Y101 VanDerWaalsContact C-N 3.34Å; N99-Y101 PolarHBondContact O-N 2.88Å; Y101-L104 PolarHBondContact O-N 3.08Å; Y101-T105 WeakPolarHBondContact CE1-OG1 3.24Å; Y101-T105 WeakPolarHBondContact O-CB 3.17Å; Y101-T105 PolarHBondContact O-N 3.41Å; Y101-T105 PolarHBondContact O-OG1 2.84Å
102F84.1Confident83.7Confident53 Ų5391 Ų9123%0.23245%0.454CS..Hα-helixtrans-70.7-34177.9-79.2-67.7000113.1Y82 V85 I89 V98 N99 T100 N106Y82-F102 HydrophobicContact CD1-CB 4.5Å; Y82-F102 HydrophobicContact CD1-CD1 4.02Å; Y82-F102 AromaticContact CD1-CD2 3.39Å; Y82-F102 HydrophobicContact CD1-CD2 3.39Å; Y82-F102 HydrophobicContact CD1-CE1 4.03Å; Y82-F102 AromaticContact CD1-CE2 3.4Å; Y82-F102 HydrophobicContact CD1-CE2 3.4Å; Y82-F102 VanDerWaalsContact CD1-CE2 3.4Å; Y82-F102 AromaticContact CD1-CG 3.72Å; Y82-F102 HydrophobicContact CD1-CG 3.72Å; Y82-F102 AromaticContact CD1-CZ 3.74Å; Y82-F102 HydrophobicContact CD1-CZ 3.74Å; Y82-F102 AromaticContact CD2-CD2 3.91Å; Y82-F102 HydrophobicContact CD2-CD2 3.91Å; Y82-F102 AromaticContact CD2-CE2 3.75Å; Y82-F102 HydrophobicContact CD2-CE2 3.75Å; Y82-F102 HydrophobicContact CE1-CB 3.78Å; Y82-F102 HydrophobicContact CE1-CD1 4.13Å; Y82-F102 AromaticContact CE1-CD2 3.33Å; Y82-F102 HydrophobicContact CE1-CD2 3.33Å; Y82-F102 AromaticContact CE1-CE2 3.88Å; Y82-F102 HydrophobicContact CE1-CE2 3.88Å; Y82-F102 AromaticContact CE1-CG 3.48Å; Y82-F102 HydrophobicContact CE1-CG 3.48Å; Y82-F102 VanDerWaalsContact CE1-CG 3.48Å; Y82-F102 HydrophobicContact CE1-CZ 4.48Å; Y82-F102 AromaticContact CE2-CD2 3.85Å; Y82-F102 HydrophobicContact CE2-CD2 3.85Å; Y82-F102 HydrophobicContact CE2-CE2 4.18Å; Y82-F102 AromaticContact CG-CD2 3.68Å; Y82-F102 HydrophobicContact CG-CD2 3.68Å; Y82-F102 AromaticContact CG-CE2 3.32Å; Y82-F102 HydrophobicContact CG-CE2 3.32Å; Y82-F102 HydrophobicContact CG-CG 4.44Å; Y82-F102 AromaticContact CG-CZ 3.83Å; Y82-F102 HydrophobicContact CG-CZ 3.83Å; Y82-F102 AromaticContact CZ-CD2 3.56Å; V85-F102 HydrophobicContact CG1-CZ 4.15Å; I89-F102 HydrophobicContact CD1-CD2 4.45Å; I89-F102 HydrophobicContact CD1-CE1 4.14Å; I89-F102 HydrophobicContact CD1-CE2 3.61Å; I89-F102 HydrophobicContact CD1-CZ 3.43Å; I89-F102 VanDerWaalsContact CD1-CZ 3.43Å; V98-F102 HydrophobicContact CG1-CD2 3.73Å; V98-F102 HydrophobicContact CG1-CE2 3.58Å; V98-F102 VanDerWaalsContact O-CD2 3.23Å; V98-F102 WeakPolarHBondContact O-CD2 3.4Å; V98-F102 PolarHBondContact O-N 3.31Å; N99-F102 PolarHBondContact O-N 3.18Å; T100-F102 PolarHBondContact O-N 3.15Å; F102-N106 PolarHBondContact O-N 2.78Å; F102-N106 VanDerWaalsContact O-N 3.08Å
103V82.7Confident83.7Confident85 Ų8589.5 Ų89.552%0.51545%0.445SS..Hα-helixtrans-64.7-45.2171.3170.20000110.8N99 T100 N106 C109N99-V103 WeakPolarHBondContact O-CG2 3.45Å; N99-V103 PolarHBondContact O-N 3.03Å; T100-V103 PolarHBondContact O-N 2.83Å; V103-N106 WeakPolarHBondContact O-CB 3.45Å; V103-N106 PolarHBondContact O-N 3.44Å; V103-C109 WeakPolarHBondContact O-CB 3.49Å
104L81.5Confident83.9Confident93 Ų9388.8 Ų88.849%0.48745%0.445SS..Hα-helixtrans-65.9-38.1178.2-164.877.8000112.5T100 Y101 N106 F113T100-L104 VanDerWaalsContact O-CB 3.26Å; T100-L104 WeakPolarHBondContact O-CB 3.41Å; T100-L104 PolarHBondContact O-N 2.8Å; Y101-L104 PolarHBondContact O-N 3.08Å; L104-N106 VanDerWaalsContact C-N 3.28Å; L104-N106 PolarHBondContact O-N 3.46Å; L104-F113 HydrophobicContact CD1-CE2 3.62Å; L104-F113 HydrophobicContact CD1-CZ 3.84Å; L104-F113 HydrophobicContact CG-CE2 4.45Å
105T82.2Confident84Confident77 Ų7793.9 Ų93.947%0.47246%0.461SS..Hα-helixtrans-75.4-15.9177.7-57.50000112.6Y101 K107Y101-T105 WeakPolarHBondContact CE1-OG1 3.24Å; Y101-T105 WeakPolarHBondContact O-CB 3.17Å; Y101-T105 PolarHBondContact O-N 3.41Å; Y101-T105 PolarHBondContact O-OG1 2.84Å; T105-K107 PolarHBondContact O-N 3.48Å
106N80.3Confident84.2Confident81 Ų8194.9 Ų94.943%0.43347%0.468SS..SBendtrans-57.5137.5178.1-170.6-10.6000110.7F102 V103 L104 W108 C109 K110F102-N106 PolarHBondContact O-N 2.78Å; F102-N106 VanDerWaalsContact O-N 3.08Å; V103-N106 WeakPolarHBondContact O-CB 3.45Å; V103-N106 PolarHBondContact O-N 3.44Å; L104-N106 VanDerWaalsContact C-N 3.28Å; L104-N106 PolarHBondContact O-N 3.46Å; N106-W108 PolarHBondContact O-N 3.41Å; N106-W108 VanDerWaalsContact O-N 3.08Å; N106-W108 PolarHBondContact OD1-N 3.43Å; N106-C109 PolarHBondContact O-N 3.31Å; N106-K110 PolarHBondContact O-N 3.28Å
107K81.5Confident84.4Confident179 Ų17996 Ų9678%0.77847%0.471SS*.Hα-helixtrans-52.7-33.5177.3-67.2179.9179.41780112.1T105 A111T105-K107 PolarHBondContact O-N 3.48Å; K107-A111 WeakPolarHBondContact O-CB 3.27Å; K107-A111 PolarHBondContact O-N 2.87Å
108W81.3Confident84.5Confident216 Ų21698 Ų9882%0.81848%0.481SS*.Hα-helixtrans-63.8-42.4173.1-86.378.5000113.6N106 A111 L112N106-W108 PolarHBondContact O-N 3.41Å; N106-W108 VanDerWaalsContact O-N 3.08Å; N106-W108 PolarHBondContact OD1-N 3.43Å; W108-A111 PolarHBondContact O-N 3.37Å; W108-L112 VanDerWaalsContact O-CB 3.3Å; W108-L112 WeakPolarHBondContact O-CB 3.37Å; W108-L112 PolarHBondContact O-N 2.86Å
109C81.9Confident84.5Confident25 Ų25100.6 Ų100.617%0.16949%0.494CS..Hα-helixtrans-71.1-41177.7-165.90000110.9V103 N106 A111 L112 F113V103-C109 WeakPolarHBondContact O-CB 3.49Å; N106-C109 PolarHBondContact O-N 3.31Å; C109-A111 VanDerWaalsContact C-N 3.34Å; C109-A111 PolarHBondContact O-N 2.84Å; C109-L112 WeakPolarHBondContact O-CB 3.45Å; C109-L112 PolarHBondContact O-N 3.41Å; C109-F113 WeakPolarHBondContact O-CD2 3.19Å; C109-F113 PolarHBondContact O-N 3.32Å; C109-F113 WeakPolarHBondContact SG-CE2 3.26Å
110K82.8Confident84.7Confident140 Ų140100.2 Ų100.261%0.60950%0.495SS*.Hα-helixtrans-60.7-41.2171.8-166.6179-177.169.50112.4N106 F113 I114N106-K110 PolarHBondContact O-N 3.28Å; K110-F113 PolarHBondContact O-N 3.42Å; K110-I114 HydrophobicContact CG-CD1 4.28Å; K110-I114 WeakPolarHBondContact O-CD1 3.16Å; K110-I114 VanDerWaalsContact O-CG1 3.29Å; K110-I114 WeakPolarHBondContact O-CG1 3.47Å; K110-I114 PolarHBondContact O-N 3.19Å
111A86.5Confident84.7Confident55 Ų5597.9 Ų97.946%0.45549%0.488SS..Hα-helixtrans-66.7-38.3174.600000111.9K107 W108 C109 I114 F115K107-A111 WeakPolarHBondContact O-CB 3.27Å; K107-A111 PolarHBondContact O-N 2.87Å; W108-A111 PolarHBondContact O-N 3.37Å; C109-A111 VanDerWaalsContact C-N 3.34Å; C109-A111 PolarHBondContact O-N 2.84Å; A111-I114 PolarHBondContact O-N 3.43Å; A111-F115 WeakPolarHBondContact O-CB 3.48Å; A111-F115 PolarHBondContact O-N 3.27Å
112L87.7Confident84.6Confident90 Ų9097.3 Ų97.347%0.47150%0.497SS..Hα-helixtrans-63.1-42.7173.1179.6152.1000111.5W108 C109 F115 L116W108-L112 VanDerWaalsContact O-CB 3.3Å; W108-L112 WeakPolarHBondContact O-CB 3.37Å; W108-L112 PolarHBondContact O-N 2.86Å; C109-L112 WeakPolarHBondContact O-CB 3.45Å; C109-L112 PolarHBondContact O-N 3.41Å; L112-F115 PolarHBondContact O-N 3.01Å; L112-L116 HydrophobicContact CD2-CD1 3.56Å; L112-L116 HydrophobicContact CD2-CG 4.11Å; L112-L116 HydrophobicContact CG-CD1 4.33Å; L112-L116 HydrophobicContact CG-CG 4.42Å; L112-L116 VanDerWaalsContact O-CB 3.31Å; L112-L116 WeakPolarHBondContact O-CB 3.21Å; L112-L116 WeakPolarHBondContact O-CG 3.3Å; L112-L116 PolarHBondContact O-N 3.34Å
113F87Confident84.4Confident113 Ų113101.4 Ų101.450%0.49652%0.515SS..Hα-helixtrans-63.6-41.1173.3-75.2-61.9000112.5L104 C109 K110 F117L104-F113 HydrophobicContact CD1-CE2 3.62Å; L104-F113 HydrophobicContact CD1-CZ 3.84Å; L104-F113 HydrophobicContact CG-CE2 4.45Å; C109-F113 WeakPolarHBondContact O-CD2 3.19Å; C109-F113 PolarHBondContact O-N 3.32Å; C109-F113 WeakPolarHBondContact SG-CE2 3.26Å; K110-F113 PolarHBondContact O-N 3.42Å; F113-F117 WeakPolarHBondContact O-CB 3.42Å; F113-F117 PolarHBondContact O-N 2.87Å
114I87.8Confident84.2Confident92 Ų92104.9 Ų104.947%0.47252%0.524SS..Hα-helixtrans-64.2-44175.1-68.7163.3000110.5K110 A111 F117 L118K110-I114 HydrophobicContact CG-CD1 4.28Å; K110-I114 WeakPolarHBondContact O-CD1 3.16Å; K110-I114 VanDerWaalsContact O-CG1 3.29Å; K110-I114 WeakPolarHBondContact O-CG1 3.47Å; K110-I114 PolarHBondContact O-N 3.19Å; A111-I114 PolarHBondContact O-N 3.43Å; I114-F117 PolarHBondContact O-N 2.85Å; I114-L118 HydrophobicContact CG2-CD1 3.94Å; I114-L118 HydrophobicContact CG2-CG 4.44Å; I114-L118 WeakPolarHBondContact O-CB 3.19Å; I114-L118 VanDerWaalsContact O-CG 3.27Å; I114-L118 WeakPolarHBondContact O-CG 3.35Å; I114-L118 PolarHBondContact O-N 3.3Å
115F88.4Confident83.9Confident132 Ų132103.6 Ų103.658%0.57952%0.522SS*.Hα-helixtrans-66.8-43.7179.3-175.7-115.2000111.8A111 L112 L118 I119A111-F115 WeakPolarHBondContact O-CB 3.48Å; A111-F115 PolarHBondContact O-N 3.27Å; L112-F115 PolarHBondContact O-N 3.01Å; F115-L118 PolarHBondContact O-N 2.78Å; F115-I119 HydrophobicContact CD1-CD1 3.82Å; F115-I119 HydrophobicContact CD2-CD1 4.31Å; F115-I119 HydrophobicContact CE1-CD1 3.38Å; F115-I119 HydrophobicContact CE2-CD1 3.92Å; F115-I119 HydrophobicContact CE2-CG1 4.46Å; F115-I119 HydrophobicContact CG-CD1 4.28Å; F115-I119 HydrophobicContact CZ-CD1 3.44Å; F115-I119 VanDerWaalsContact CZ-CD1 3.44Å; F115-I119 HydrophobicContact CZ-CG1 4.43Å; F115-I119 VanDerWaalsContact O-CB 3.25Å; F115-I119 WeakPolarHBondContact O-CB 3.45Å; F115-I119 WeakPolarHBondContact O-CG1 3.48Å; F115-I119 PolarHBondContact O-N 2.83Å
116L87.1Confident83.1Confident82 Ų82103 Ų10343%0.42952%0.52SS..Hα-helixtrans-65.3-38.4173.3-72.6-174.9000112L112 I119 T120L112-L116 HydrophobicContact CD2-CD1 3.56Å; L112-L116 HydrophobicContact CD2-CG 4.11Å; L112-L116 HydrophobicContact CG-CD1 4.33Å; L112-L116 HydrophobicContact CG-CG 4.42Å; L112-L116 VanDerWaalsContact O-CB 3.31Å; L112-L116 WeakPolarHBondContact O-CB 3.21Å; L112-L116 WeakPolarHBondContact O-CG 3.3Å; L112-L116 PolarHBondContact O-N 3.34Å; L116-I119 PolarHBondContact O-N 3.43Å; L116-T120 WeakPolarHBondContact O-CG2 3.48Å; L116-T120 PolarHBondContact O-N 3.41Å; L116-T120 PolarHBondContact O-OG1 2.89Å
117F86.9Confident82.5Confident158 Ų158102.6 Ų102.669%0.69352%0.523SS*.Hα-helixtrans-67.8-39.5175.6-177.8-96.4000112.1F113 I114 G121F113-F117 WeakPolarHBondContact O-CB 3.42Å; F113-F117 PolarHBondContact O-N 2.87Å; I114-F117 PolarHBondContact O-N 2.85Å; F117-G121 WeakPolarHBondContact O-CA 3.14Å; F117-G121 PolarHBondContact O-N 2.93Å
118L87.1Confident81.5Confident110 Ų11096.6 Ų96.658%0.57650%0.503SS*.Hα-helixtrans-67.5-36.3171.7-72.2172.5000111.6I114 F115 C122I114-L118 HydrophobicContact CG2-CD1 3.94Å; I114-L118 HydrophobicContact CG2-CG 4.44Å; I114-L118 WeakPolarHBondContact O-CB 3.19Å; I114-L118 VanDerWaalsContact O-CG 3.27Å; I114-L118 WeakPolarHBondContact O-CG 3.35Å; I114-L118 PolarHBondContact O-N 3.3Å; F115-L118 PolarHBondContact O-N 2.78Å; L118-C122 WeakPolarHBondContact O-CA 2.98Å; L118-C122 WeakPolarHBondContact O-CB 3.33Å; L118-C122 PolarHBondContact O-N 2.86Å
119I86.5Confident80.6Confident56 Ų5693.2 Ų93.229%0.28749%0.494SS..Hα-helixtrans-70.8-51.4176.8-82-178.7000111.3F115 L116 G121 C122 F123F115-I119 HydrophobicContact CD1-CD1 3.82Å; F115-I119 HydrophobicContact CD2-CD1 4.31Å; F115-I119 HydrophobicContact CE1-CD1 3.38Å; F115-I119 HydrophobicContact CE2-CD1 3.92Å; F115-I119 HydrophobicContact CE2-CG1 4.46Å; F115-I119 HydrophobicContact CG-CD1 4.28Å; F115-I119 HydrophobicContact CZ-CD1 3.44Å; F115-I119 VanDerWaalsContact CZ-CD1 3.44Å; F115-I119 HydrophobicContact CZ-CG1 4.43Å; F115-I119 VanDerWaalsContact O-CB 3.25Å; F115-I119 WeakPolarHBondContact O-CB 3.45Å; F115-I119 WeakPolarHBondContact O-CG1 3.48Å; F115-I119 PolarHBondContact O-N 2.83Å; L116-I119 PolarHBondContact O-N 3.43Å; I119-G121 VanDerWaalsContact C-N 3.34Å; I119-C122 PolarHBondContact O-N 2.95Å; I119-F123 HydrophobicContact CG2-CD2 3.73Å; I119-F123 HydrophobicContact CG2-CE2 3.95Å; I119-F123 WeakPolarHBondContact O-CB 3.06Å; I119-F123 WeakPolarHBondContact O-CD2 3.01Å; I119-F123 PolarHBondContact O-N 2.75Å
120T86.5Confident79.5Confident88 Ų8895.3 Ų95.354%0.5451%0.508SS..Hα-helixtrans-67.3-37.8178.456.10000111.1L116 F124L116-T120 WeakPolarHBondContact O-CG2 3.48Å; L116-T120 PolarHBondContact O-N 3.41Å; L116-T120 PolarHBondContact O-OG1 2.89Å; T120-F124 WeakPolarHBondContact O-CB 3.32Å; T120-F124 PolarHBondContact O-N 3.46Å
121G84.8Confident78.4Confident36 Ų3691.7 Ų91.737%0.37150%0.5SS..Hα-helixtrans-60.7-43.7170.300000112.7F117 I119 C125F117-G121 WeakPolarHBondContact O-CA 3.14Å; F117-G121 PolarHBondContact O-N 2.93Å; I119-G121 VanDerWaalsContact C-N 3.34Å; G121-C125 WeakPolarHBondContact O-CB 3.31Å; G121-C125 PolarHBondContact O-N 3.24Å
122C81.5Confident77.1Confident83 Ų8397.5 Ų97.556%0.56152%0.515SS*.Hα-helixtrans-70.3-44.2177.8-173.60000112.3L118 I119 C125 C126L118-C122 WeakPolarHBondContact O-CA 2.98Å; L118-C122 WeakPolarHBondContact O-CB 3.33Å; L118-C122 PolarHBondContact O-N 2.86Å; I119-C122 PolarHBondContact O-N 2.95Å; C122-C125 PolarHBondContact O-N 2.82Å; C122-C126 WeakPolarHBondContact O-CA 3.46Å; C122-C126 WeakPolarHBondContact O-CB 3.25Å; C122-C126 PolarHBondContact O-N 2.78Å
123F79.8Confident75.6Confident138 Ų13899.7 Ų99.761%0.60553%0.527SS*.Hα-helixtrans-64-43.5174.9-87.5-73.6000111.6I119 C127I119-F123 HydrophobicContact CG2-CD2 3.73Å; I119-F123 HydrophobicContact CG2-CE2 3.95Å; I119-F123 WeakPolarHBondContact O-CB 3.06Å; I119-F123 WeakPolarHBondContact O-CD2 3.01Å; I119-F123 PolarHBondContact O-N 2.75Å; F123-C127 WeakPolarHBondContact O-CB 3.33Å; F123-C127 PolarHBondContact O-N 2.79Å; F123-C127 PolarHBondContact O-SG 2.77Å
124F78.3Confident74Confident158 Ų158101.4 Ų101.469%0.69354%0.535SS*.Hα-helixtrans-64.3-46.2176.6-165.6-98.5000111.3T120 C128T120-F124 WeakPolarHBondContact O-CB 3.32Å; T120-F124 PolarHBondContact O-N 3.46Å; F124-C128 WeakPolarHBondContact O-CB 3.44Å; F124-C128 PolarHBondContact O-N 2.78Å; F124-C128 PolarHBondContact O-SG 3.4Å
125C75.8Confident72.4Confident66 Ų66100.5 Ų100.545%0.44654%0.536SS..Hα-helixtrans-62.9-46.4176.5-173.60000112.5G121 C122 C128 F129G121-C125 WeakPolarHBondContact O-CB 3.31Å; G121-C125 PolarHBondContact O-N 3.24Å; C122-C125 PolarHBondContact O-N 2.82Å; C125-C128 PolarHBondContact O-N 3.36Å; C125-F129 PolarHBondContact O-N 3.48Å
126C66.2Low70.5Confident64 Ų64100 Ų10043%0.43255%0.547SS..Hα-helixtrans-69-41.9-179.1-170.70000111.6C122 C128 F129 C130C122-C126 WeakPolarHBondContact O-CA 3.46Å; C122-C126 WeakPolarHBondContact O-CB 3.25Å; C122-C126 PolarHBondContact O-N 2.78Å; C126-C128 VanDerWaalsContact C-N 3.34Å; C126-C128 PolarHBondContact O-N 3.34Å; C126-F129 PolarHBondContact O-N 3.08Å; C126-C130 WeakPolarHBondContact O-CB 3.1Å; C126-C130 PolarHBondContact O-N 2.95Å; C126-C130 PolarHBondContact O-SG 3.43Å; C126-C130 VanDerWaalsContact O-SG 3.35Å
127C66.5Low68.9Low73 Ų7398.9 Ų98.949%0.49356%0.556SS.*Hα-helixtrans-60.3-43.2170.7-72.60000111.2F123 C131F123-C127 WeakPolarHBondContact O-CB 3.33Å; F123-C127 PolarHBondContact O-N 2.79Å; F123-C127 PolarHBondContact O-SG 2.77Å; C127-C131 WeakPolarHBondContact O-CB 3.4Å; C127-C131 PolarHBondContact O-N 2.84Å; C127-C131 PolarHBondContact O-SG 3.33Å
128C62Low67.4Low54 Ų5498.1 Ų98.137%0.36556%0.558SS.*Hα-helixtrans-61.2-54.3174.1-73.30000112.3F124 C125 C126 C130 F132F124-C128 WeakPolarHBondContact O-CB 3.44Å; F124-C128 PolarHBondContact O-N 2.78Å; F124-C128 PolarHBondContact O-SG 3.4Å; C125-C128 PolarHBondContact O-N 3.36Å; C126-C128 VanDerWaalsContact C-N 3.34Å; C126-C128 PolarHBondContact O-N 3.34Å; C128-C130 PolarHBondContact O-N 3.25Å; C128-F132 WeakPolarHBondContact O-CB 3.18Å; C128-F132 WeakPolarHBondContact O-CD2 3.16Å; C128-F132 PolarHBondContact O-N 3.3Å; C128-F132 VanDerWaalsContact O-N 3.08Å
129F61.8Low66Low144 Ų144102.9 Ų102.963%0.63257%0.57SS**Hα-helixtrans-64.9-39.9-176.7-94-92.1000113.3C125 C126 N133C125-F129 PolarHBondContact O-N 3.48Å; C126-F129 PolarHBondContact O-N 3.08Å; F129-N133 PolarHBondContact O-N 3.47Å; F129-N133 PolarHBondContact O-ND2 3.15Å
130C58Low64.6Low70 Ų70108.8 Ų108.847%0.47359%0.594SS.*Hα-helixtrans-75-40.9179-67.10000112.4C126 C128 F132 N133 F134C126-C130 WeakPolarHBondContact O-CB 3.1Å; C126-C130 PolarHBondContact O-N 2.95Å; C126-C130 PolarHBondContact O-SG 3.43Å; C126-C130 VanDerWaalsContact O-SG 3.35Å; C128-C130 PolarHBondContact O-N 3.25Å; C130-F132 PolarHBondContact O-N 3.47Å; C130-N133 PolarHBondContact O-N 3.29Å; C130-F134 WeakPolarHBondContact O-CB 3.43Å; C130-F134 PolarHBondContact O-N 2.86Å
131C60.7Low63.6Low63 Ų63110.2 Ų110.243%0.42660%0.604SS.*Hα-helixtrans-64.9-39.9177-69.40000112C127 N133 C135C127-C131 WeakPolarHBondContact O-CB 3.4Å; C127-C131 PolarHBondContact O-N 2.84Å; C127-C131 PolarHBondContact O-SG 3.33Å; C131-N133 VanDerWaalsContact C-N 3.27Å; C131-N133 PolarHBondContact O-N 2.95Å; C131-C135 HydrophobicContact CB-CB 4.44Å; C131-C135 WeakPolarHBondContact O-CB 3.4Å; C131-C135 PolarHBondContact O-N 3.35Å
132F57.8Low62.3Low178 Ų178117.7 Ų117.778%0.78163%0.627SS**Hα-helixtrans-67.4-20.8176.4-93.5-82.6000114.4C128 C130C128-F132 WeakPolarHBondContact O-CB 3.18Å; C128-F132 WeakPolarHBondContact O-CD2 3.16Å; C128-F132 PolarHBondContact O-N 3.3Å; C128-F132 VanDerWaalsContact O-N 3.08Å; C130-F132 PolarHBondContact O-N 3.47Å
133N58.1Low61.5Low135 Ų135119 Ų11972%0.72263%0.634SS**Hα-helixtrans-103.8-25.4179-75.9-86.3000114.5F129 C130 C131F129-N133 PolarHBondContact O-N 3.47Å; F129-N133 PolarHBondContact O-ND2 3.15Å; C130-N133 PolarHBondContact O-N 3.29Å; C131-N133 VanDerWaalsContact C-N 3.27Å; C131-N133 PolarHBondContact O-N 2.95Å
134F53.2Low60.6Low149 Ų149117.5 Ų117.565%0.65464%0.638SS**Hα-helixtrans-121.6-28.6-169.2-147.3-106.4000115C130 C136 G137C130-F134 WeakPolarHBondContact O-CB 3.43Å; C130-F134 PolarHBondContact O-N 2.86Å; F134-C136 PolarHBondContact O-N 2.84Å; F134-G137 PolarHBondContact O-N 2.83Å
135C53.2Low59.6Low73 Ų73114 Ų11449%0.49363%0.631SS.*Hα-helixtrans-74.5-21-173.8-720000114.6C131 G137C131-C135 HydrophobicContact CB-CB 4.44Å; C131-C135 WeakPolarHBondContact O-CB 3.4Å; C131-C135 PolarHBondContact O-N 3.35Å; C135-G137 VanDerWaalsContact C-N 3.28Å; C135-G137 PolarHBondContact O-N 3.24Å
136C49.4Very low58.6Low121 Ų121117.6 Ų117.682%0.81865%0.646SS**Hα-helixtrans-79.7-4.2175-63.90000114.1F134F134-C136 PolarHBondContact O-N 2.84Å
137G53.6Low58Low59 Ų59123.2 Ų123.261%0.60867%0.666SS**Hα-helixtrans-88.5-41.1-176.700000115.2F134 C135F134-G137 PolarHBondContact O-N 2.83Å; C135-G137 VanDerWaalsContact C-N 3.28Å; C135-G137 PolarHBondContact O-N 3.24Å
138L55.4Low57.4Low142 Ų142125.2 Ų125.274%0.74367%0.672SS**Hα-helixtrans-89.9-14.9-173-97.666000114.6K140L138-K140 PolarHBondContact O-N 3.39Å
139Y57Low57Low211 Ų211128.6 Ų128.683%0.82769%0.685SS**  trans-83.860.8177.1-97.2-89.5000112.7
140K57.7Low56.7Low180 Ų180126.3 Ų126.378%0.78368%0.676SS**  trans-132.6103.9156.8-75.6-166176.9-173.80109.1L138 K142L138-K140 PolarHBondContact O-N 3.39Å; K140-K142 PolarHBondContact O-N 3.22Å
141P64.6Low56.4Low118 Ų118127.1 Ų127.177%0.76669%0.688SS**PPolyproline II helixtrans-59.9126161.427.6-32.2000107.2P143P141-P143 WeakPolarHBondContact O-CD 3.44Å
142K58.2Low56.1Low193 Ų193133.7 Ų133.784%0.83971%0.709SS**PPolyproline II helixtrans-68.9124.1163.1-75.6-174.5174.5-176.20106.5K140K140-K142 PolarHBondContact O-N 3.22Å
143P64.3Low56Low109 Ų109131.2 Ų131.271%0.70870%0.702SS**PPolyproline II helixtrans-56.9151.8158.728.5-33.3000108.2P141P141-P143 WeakPolarHBondContact O-CD 3.44Å
144P60.9Low55.8Low108 Ų108129.7 Ų129.770%0.70169%0.69SS**PPolyproline II helixtrans-59.4138.5-173.125.5-34.6000110.3D146P144-D146 PolarHBondContact O-N 2.88Å
145P57.5Low55.5Low83 Ų83129.3 Ų129.354%0.53969%0.694SS.*PPolyproline II helixtrans-63.5128.7155.731.9-32.2000108
146D55.5Low55.5Low142 Ų142131.8 Ų131.876%0.75970%0.703SS**THydrogen-bonded Turntrans-34.6143.5138.832.4-37.8000112.3P144P144-D146 PolarHBondContact O-N 2.88Å
147E52.7Low55.8Low182 Ų182133 Ų13385%0.8570%0.697SS**THydrogen-bonded Turntrans88.616.6171.6-49.3-172.4161.300121.5
148D53.7Low55.9Low116 Ų116136.6 Ų136.662%0.6270%0.701SS**SBendtrans-13612.6161.771.8-84.6000119.1
149I54.5Low55.9Low124 Ų124137.4 Ų137.464%0.63671%0.707SS**SBendtrans-70.1-33.7166.6-60.7178.1000111.4M153I149-M153 HydrophobicContact CG2-CE 3.81Å
150E54.2Low55.7Low96 Ų96134.1 Ų134.145%0.44970%0.703SS.*G310 helixtrans-82.9-15.6-171.7-83.8154.4118.100114.8K152 M153 Q154E150-K152 PolarHBondContact O-N 3.3Å; E150-M153 PolarHBondContact O-N 3.45Å; E150-Q154 HydrophobicContact CB-CB 3.8Å; E150-Q154 HydrophobicContact CG-CB 4.17Å; E150-Q154 WeakPolarHBondContact O-CB 3.35Å; E150-Q154 PolarHBondContact O-N 2.99Å; E150-Q154 PolarHBondContact OE1-NE2 3.24Å
151A52.4Low55.5Low88 Ų88133.6 Ų133.673%0.72771%0.709SS**G310 helixtrans-63.3-2.4177.200000114.6
152K53.6Low55.1Low201 Ų201134.3 Ų134.387%0.87471%0.706SS**G310 helixtrans-134.117.5168.2-119.7172.4-174.3173.40114.1E150E150-K152 PolarHBondContact O-N 3.3Å
153M56Low54.9Low126 Ų126131.2 Ų131.262%0.62170%0.703SS**THydrogen-bonded Turntrans-135.6-10-177.8-126.4173.3-65.300113.9I149 E150I149-M153 HydrophobicContact CG2-CE 3.81Å; E150-M153 PolarHBondContact O-N 3.45Å
154Q53.9Low54.5Low103 Ų103131.1 Ų131.148%0.48170%0.7SS.*SBendtrans-128.725.6-170.6-162.916958.600113.6E150E150-Q154 HydrophobicContact CB-CB 3.8Å; E150-Q154 HydrophobicContact CG-CB 4.17Å; E150-Q154 WeakPolarHBondContact O-CB 3.35Å; E150-Q154 PolarHBondContact O-N 2.99Å; E150-Q154 PolarHBondContact OE1-NE2 3.24Å
155L47.6Very low53.9Low141 Ų141131.2 Ų131.274%0.73870%0.701SS**  trans-12958.8163.1-74.3177.5000109.3
156N52.7Low53.6Low125 Ų125135.8 Ų135.867%0.66872%0.717SS**SBendtrans-1138.4160.7-68-59.6000111.1
157E56.4Low53.5Low147 Ų147137.2 Ų137.269%0.68772%0.719SS**SBendtrans-92-21.8-169.2-107.695.5135.400114.6
158D55.1Low53.4Low133 Ų133137.6 Ų137.671%0.71172%0.721SS**SBendtrans-104.8-1.8-170.6-67.9-58.9000115.1
159D55.1Low53.4Low160 Ų160136.7 Ų136.786%0.85673%0.73SS**SBendtrans-120.315.4-173.7-90.1-57.1000113.8
160L54.2Low53.6Low141 Ų141135.2 Ų135.274%0.73874%0.736SS**  trans-111.145.8-174.7-154.672.8000114.6D162L160-D162 PolarHBondContact O-N 3.41Å
161D53.1Low54.3Low170 Ų170136.1 Ų136.191%0.90975%0.75SS**  trans-73.455.2175.4-82.6-28.4000114
162D54.8Low54.6Low133 Ų133137.9 Ų137.971%0.71175%0.754SS**  trans-146.587.4160.9-168.44.2000112.2L160L160-D162 PolarHBondContact O-N 3.41Å
163V55Low54.9Low127 Ų127137.9 Ų137.977%0.7775%0.75SS**  trans-96.398.7-180-179.80000110.7
164T55.5Low55.4Low108 Ų108138.8 Ų138.866%0.66376%0.757SS**  trans-110.6100.5166.9-57.10000111M166T164-M166 PolarHBondContact O-N 2.75Å
165P47.9Very low55.4Low110 Ų110137.6 Ų137.671%0.71476%0.759SS**  trans-8697.7-174.732.6-33.3000112.6
166M52Low55.6Low178 Ų178136.1 Ų136.188%0.87776%0.76SS**  trans-93.6102.7170.2-87.4-1736300112.6T164T164-M166 PolarHBondContact O-N 2.75Å
167Q52.3Low55.6Low172 Ų172135.7 Ų135.780%0.80476%0.764SS**  trans-73141.2158.2-58.9169.9-73.900109.5
168Q51.3Low55.2Low191 Ų191134.4 Ų134.489%0.89377%0.772SS**  177.9141.5118.3-95.8159.8-9.700113.9
169A53.5Low54.9Low96 Ų96132.7 Ų132.779%0.79377%0.77SS**  trans34.4115.2157.500000120.1
170A58.7Low54.6Low94 Ų94130.6 Ų130.678%0.77777%0.768SS**PPolyproline II helixtrans-65.7139162.400000111.4
171P69.9Low54Low114 Ų114128 Ų12874%0.7478%0.776SS**PPolyproline II helixtrans-70.1152.8173.929.9-34.8000111.6
172P58.6Low53.5Low126 Ų126128.5 Ų128.582%0.81877%0.77SS**PPolyproline II helixtrans-69.3145-179.229.3-35.2000112.1
173Y60.2Low53Low201 Ų201129.5 Ų129.579%0.78878%0.775SS**PPolyproline II helixtrans-69.6152.4177106.3-56.4000112P175Y173-P175 HydrophobicContact CD2-CG 4.37Å; Y173-P175 HydrophobicContact CE2-CB 4.27Å; Y173-P175 HydrophobicContact CE2-CG 3.59Å
174N66.2Low52.7Low144 Ų144127.4 Ų127.477%0.7777%0.766SS**  trans-149.9114.6168.9-175.715000110.6
175P53.8Low52.5Low78 Ų78129.9 Ų129.951%0.50678%0.776SS.*  trans-98.4127.4177.435.8-29.8000111.9Y173Y173-P175 HydrophobicContact CD2-CG 4.37Å; Y173-P175 HydrophobicContact CE2-CB 4.27Å; Y173-P175 HydrophobicContact CE2-CG 3.59Å
176S51.3Low52.4Low111 Ų111132.9 Ų132.978%0.77678%0.778SS**  trans-153.4142.3161.1-79.50000111
177P52.4Low52.6Low115 Ų115131 Ų13175%0.74778%0.776SS**  trans-111.6172.8-162.141.4-34.6000115.1
178S48.3Very low52.6Low121 Ų121128 Ų12885%0.84677%0.769SS**  trans73.1158.6164.285.10000115.8
179S49.9Very low52.5Low96 Ų96122.3 Ų122.367%0.67176%0.762SS**  cis-151166.9959.60000113.2
180S46.7Very low52.6Low117 Ų117123 Ų12382%0.81876%0.758SS**  trans49.6123.8149.761.20000121.4
181G41.9Very low52.4Low87 Ų87124.8 Ų124.890%0.89776%0.76SS**  trans175.855.4169.600000115.2
182F42.5Very low51.6Low179 Ų179124.2 Ų124.279%0.78576%0.758SS**  trans-103.1131.1171.8175-80.7000109.4
183D44.2Very low51.4Low155 Ų155125.9 Ų125.983%0.82976%0.759SS**  trans-168.1163.4146.8-106.9-31000112.4
184S48.6Very low50.6Low83 Ų83119.7 Ų119.758%0.5876%0.756SS**  trans-134.9138.3-161.462.30000115.6
185N52.4Low49.5Very low160 Ų160117.1 Ų117.186%0.85676%0.764SS**  trans-145.6121.1162.7-66.7-80.2000107.1
186F45.7Very low49.1Very low173 Ų173116.8 Ų116.876%0.75977%0.774SS**  cis72.899.447.7-168-95.1000115.3T188F186-T188 HydrophobicContact CE1-CG2 4.21Å; F186-T188 HydrophobicContact CZ-CG2 3.73Å
187V55.4Low49.3Very low138 Ų138119.1 Ų119.184%0.83678%0.783SS**  trans-143.3134.3158.4178.70000108.9
188T53.1Low49.4Very low108 Ų108117.1 Ų117.166%0.66378%0.784SS**  trans-72.2146.3176.7500000112F186F186-T188 HydrophobicContact CE1-CG2 4.21Å; F186-T188 HydrophobicContact CZ-CG2 3.73Å
189G49.3Very low49.5Very low72 Ų72117.5 Ų117.574%0.74279%0.787SS**  106.1172.95700000109.9
190P55.3Low49.8Very low111 Ų111116 Ų11672%0.72179%0.786SS**  cis-136.5176.6-941.6-24.4000116
191T54.5Low50.6Low132 Ų132120 Ų12081%0.8179%0.789SS**  trans61.8149.115743.50000119.6
192S53.5Low51.9Low101 Ų101121.7 Ų121.771%0.70678%0.784SS**  cis-175.9161.7-3.846.20000107.6
193I53.3Low52.8Low161 Ų161123.7 Ų123.783%0.82679%0.788SS**  cis-156.7145.90.1-118.2164.9000106.6
194G44.7Very low54.2Low71 Ų71122.2 Ų122.273%0.73279%0.787SS**  69.6123.798.100000114.2
195G43.1Very low55.5Low90 Ų90124.1 Ų124.193%0.92880%0.796SS**  cis94.3139.944.500000109.8
196G45.3Very low56.2Low71 Ų71122.3 Ų122.373%0.73279%0.793SS**  cis149.5130.6-2.300000111.5
197V55.5Low57.5Low160 Ų160120.6 Ų120.697%0.9780%0.796SS**  trans70.4140.2167-158.80000118.5
198G53.3Low58.3Low74 Ų74120.3 Ų120.376%0.76380%0.795SS**  trans102.776.6140.800000119.5
199S50.4Low58.9Low129 Ų129121.3 Ų121.390%0.90280%0.801SS**  trans-87.3115.7166.747.60000112.4
200G57.4Low59.8Low64 Ų64122 Ų12266%0.6680%0.799SS**  trans-153.2111.417500000112.8
201F63.5Low60Low201 Ų201125.8 Ų125.888%0.88281%0.807SS**  trans-121.2110.4177-82.2-81.4000110.7
202P68.4Low60.6Low122 Ų122128.6 Ų128.679%0.79281%0.811SS**PPolyproline II helixtrans-77.9161.6166.5-13.730.8000112.6
203Y62.9Low61.3Low221 Ų221132 Ų13287%0.86782%0.816SS**PPolyproline II helixtrans-77155-167.7-60.7-89.6000115.1
204P73.4Confident61.6Low125 Ų125130.4 Ų130.481%0.81282%0.816SS**PPolyproline II helixtrans-67.4152.8167.830.4-35.7000112.2
205T76Confident62.4Low123 Ų123135.3 Ų135.376%0.75582%0.823SS**PPolyproline II helixtrans-83154.2-176.744.60000113.5
206P66.7Low63.7Low122 Ų122136.6 Ų136.679%0.79282%0.818SS**PPolyproline II helixtrans-73.213717430.5-34.4000111.5
207V71.6Confident64.3Low136 Ų136136.3 Ų136.382%0.82482%0.815SS**PPolyproline II helixtrans-93.4123.3172.8179.80000109.6V209V207-V209 PolarHBondContact O-N 2.87Å
208T72.4Confident64.5Low133 Ų133139.5 Ų139.582%0.81681%0.81SS**PPolyproline II helixtrans-64.4124.6-179.3-53.90000112A210T208-A210 PolarHBondContact O-N 2.85Å
209V66.4Low65Low129 Ų129142.1 Ų142.178%0.78281%0.811SS**PPolyproline II helixtrans-76.6116171.1178.80000109.5V207 Q211V207-V209 PolarHBondContact O-N 2.87Å; V209-Q211 PolarHBondContact O-N 2.86Å
210A67.5Low65.4Low85 Ų85150.3 Ų150.370%0.70282%0.824SS**PPolyproline II helixtrans-74121.2170.600000110.3T208T208-A210 PolarHBondContact O-N 2.85Å
211Q59.4Low65.8Low191 Ų191154.6 Ų154.689%0.89383%0.832SS**PPolyproline II helixtrans-71.9134.2168-68-176.4-5500109.8V209V209-Q211 PolarHBondContact O-N 2.86Å
212Q67.5Low65.9Low191 Ų191152.2 Ų152.289%0.89383%0.829SS**  trans-127.1148.8168.7-114.6165.5-18.300111
213Q69.5Low65.8Low173 Ų173153.8 Ų153.881%0.80883%0.831SS**PPolyproline II helixtrans-92.7158.8-147.8-66.7-151.8-22.100114I215Q213-I215 PolarHBondContact O-N 3.28Å
214P59.2Low65.9Low127 Ų127149.9 Ų149.983%0.82583%0.829SS**PPolyproline II helixtrans-59.9126.8-178.223.3-35.1000112.3S216P214-S216 PolarHBondContact O-N 2.91Å
215I62Low65.5Low175 Ų175151.4 Ų151.490%0.89783%0.83SS**PPolyproline II helixtrans-71.4117.8179.3-63.8171.9000109.5Q213Q213-I215 PolarHBondContact O-N 3.28Å
216S68.6Low64.8Low116 Ų116153.3 Ų153.381%0.81184%0.835SS**  trans-113.6106.8176.1-171.10000111.7P214P214-S216 PolarHBondContact O-N 2.91Å
217G59.2Low64.6Low65 Ų65155.6 Ų155.667%0.6784%0.839SS**  trans66.2118.6141.200000121.4
218R59.4Low64.1Low228 Ų228157.1 Ų157.186%0.8684%0.84SS**  trans5297.1131.5-178.8177.2-87.3154.9-9.1116.4
219V64.2Low63.4Low129 Ų129159.1 Ų159.178%0.78284%0.842SS**  55.9102.176.6-175.10000113.4
220Y58.2Low63.1Low300 Ų300161.8 Ų161.8100%1.17685%0.847SS**  trans-108.30136.6-80.6-85.6000107.6

Retrieved 220 of 220 residues in 258.8 ms (Link to these results)