A0A087WU66_HUMAN Loading...

Zn regulated GTPase metalloprotein activator 1F

AlphaFold DB , UniProt , Accession A0A087WU66, Species HUMAN (Homo sapiens, Human), Gene ZNG1F, Length 73 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
1C42.4Very low68Low186 Ų18695.5 Ų95.5100%1.25755%0.548SS*.  0102.60-580000108.2
2S52Low69.2Low66 Ų6696.5 Ų96.546%0.46255%0.545SS..  trans-97.8146.8-171.8103.20000110.5K4 D5S2-K4 PolarHBondContact O-N 3.5Å; S2-K4 VanDerWaalsContact OG-CB 3.27Å; S2-K4 WeakPolarHBondContact OG-CB 3.25Å; S2-K4 VanDerWaalsContact OG-CG 3.26Å; S2-K4 WeakPolarHBondContact OG-CG 3.26Å; S2-K4 PolarHBondContact OG-N 3.08Å; S2-D5 WeakPolarHBondContact O-CB 3.38Å; S2-D5 PolarHBondContact O-N 3.23Å
3V57.7Low70.6Confident126 Ų12695.8 Ų95.876%0.76454%0.539SS*.Hα-helixtrans-50.1-25.2177.6179.80000112.9D5 N6 G7V3-D5 PolarHBondContact O-N 3.38Å; V3-N6 PolarHBondContact O-N 2.68Å; V3-G7 PolarHBondContact O-N 3.24Å
4K60.4Low71.8Confident131 Ų13193.8 Ų93.857%0.5753%0.526SS*.Hα-helixtrans-54.2-37.6175.1-54.9-173.3171.3-171.30113.1S2 L8 M40S2-K4 PolarHBondContact O-N 3.5Å; S2-K4 VanDerWaalsContact OG-CB 3.27Å; S2-K4 WeakPolarHBondContact OG-CB 3.25Å; S2-K4 VanDerWaalsContact OG-CG 3.26Å; S2-K4 WeakPolarHBondContact OG-CG 3.26Å; S2-K4 PolarHBondContact OG-N 3.08Å; K4-L8 PolarHBondContact O-N 3.39Å; K4-M40 HydrophobicContact CB-CE 4.14Å; K4-M40 HydrophobicContact CB-SD 3.99Å; K4-M40 HydrophobicContact CD-CE 3.62Å; K4-M40 HydrophobicContact CD-SD 4.36Å; K4-M40 HydrophobicContact CG-CE 3.55Å; K4-M40 HydrophobicContact CG-SD 4.09Å
5D64.2Low72.7Confident98 Ų9890.3 Ų90.352%0.52450%0.504SS..Hα-helixtrans-74.9-30.8-174.6-143.97.6000111.8S2 V3 R9S2-D5 WeakPolarHBondContact O-CB 3.38Å; S2-D5 PolarHBondContact O-N 3.23Å; V3-D5 PolarHBondContact O-N 3.38Å; D5-R9 VanDerWaalsContact O-CG 3.24Å; D5-R9 WeakPolarHBondContact O-CG 3.32Å; D5-R9 PolarHBondContact O-N 3.25Å
6N72.3Confident73.6Confident110 Ų11094.7 Ų94.759%0.58852%0.519SS*.Hα-helixtrans-74.1-36.7179-69.8-11.8000112.1V3 A10V3-N6 PolarHBondContact O-N 2.68Å; N6-A10 WeakPolarHBondContact O-CB 3.43Å; N6-A10 PolarHBondContact O-N 3.19Å; N6-A10 VanDerWaalsContact O-N 3.09Å
7G75.9Confident74.5Confident37 Ų3796.8 Ų96.838%0.38152%0.522SS..Hα-helixtrans-66-43.5177.100000112V3 A10 I11V3-G7 PolarHBondContact O-N 3.24Å; G7-A10 PolarHBondContact O-N 3.1Å; G7-I11 PolarHBondContact O-N 3.11Å
8L76.2Confident75Confident72 Ų7298.2 Ų98.238%0.37752%0.523SS..Hα-helixtrans-61.1-48.7177.4-141.990.4000111.3K4 A10 I11 E12K4-L8 PolarHBondContact O-N 3.39Å; L8-A10 VanDerWaalsContact C-N 3.3Å; L8-A10 PolarHBondContact O-N 2.86Å; L8-I11 PolarHBondContact O-N 2.84Å; L8-I11 VanDerWaalsContact O-N 3.09Å; L8-E12 WeakPolarHBondContact O-CG 3.44Å; L8-E12 PolarHBondContact O-N 2.94Å
9R80.6Confident75.6Confident152 Ų15296.8 Ų96.857%0.57454%0.535SS*.Hα-helixtrans-62.4-35178.9-70178.280.2-165.66.3113.2D5 I11 N13D5-R9 VanDerWaalsContact O-CG 3.24Å; D5-R9 WeakPolarHBondContact O-CG 3.32Å; D5-R9 PolarHBondContact O-N 3.25Å; R9-I11 VanDerWaalsContact C-N 3.3Å; R9-N13 PolarHBondContact O-N 2.94Å; R9-N13 VanDerWaalsContact O-N 3.09Å; R9-N13 PolarHBondContact O-ND2 2.81Å
10A84.4Confident76.4Confident53 Ų53101.2 Ų101.244%0.43855%0.548SS..Hα-helixtrans-62.6-41.4175.300000111.2N6 G7 L8 N13 L14N6-A10 WeakPolarHBondContact O-CB 3.43Å; N6-A10 PolarHBondContact O-N 3.19Å; N6-A10 VanDerWaalsContact O-N 3.09Å; G7-A10 PolarHBondContact O-N 3.1Å; L8-A10 VanDerWaalsContact C-N 3.3Å; L8-A10 PolarHBondContact O-N 2.86Å; A10-N13 PolarHBondContact O-N 3.29Å; A10-L14 WeakPolarHBondContact O-CG 3.44Å; A10-L14 PolarHBondContact O-N 2.97Å; A10-L14 VanDerWaalsContact O-N 3.09Å
11I81.9Confident77Confident19 Ų1999 Ų9910%0.09753%0.534CS..Hα-helixtrans-72.3-41.8179.5-69.3166.9000111.2G7 L8 R9 N13 L14 M15 I24 F41 I51G7-I11 PolarHBondContact O-N 3.11Å; L8-I11 PolarHBondContact O-N 2.84Å; L8-I11 VanDerWaalsContact O-N 3.09Å; R9-I11 VanDerWaalsContact C-N 3.3Å; I11-N13 PolarHBondContact O-N 3.22Å; I11-L14 CarbonylContact O-C 3.59Å; I11-L14 WeakPolarHBondContact O-CA 3.36Å; I11-L14 WeakPolarHBondContact O-CB 3.49Å; I11-L14 PolarHBondContact O-N 2.96Å; I11-M15 HydrophobicContact CG2-CG 4.41Å; I11-M15 WeakPolarHBondContact O-CG 3.45Å; I11-M15 PolarHBondContact O-N 3.09Å; I11-I24 HydrophobicContact CG2-CD1 4.37Å; I11-F41 HydrophobicContact CD1-CD1 4.33Å; I11-F41 HydrophobicContact CD1-CE1 3.16Å; I11-F41 HydrophobicContact CD1-CE2 4.32Å; I11-F41 HydrophobicContact CD1-CZ 3.15Å; I11-I51 HydrophobicContact CG2-CD1 3.41Å; I11-I51 VanDerWaalsContact CG2-CD1 3.41Å
12E82.8Confident79.1Confident108 Ų10897.7 Ų97.751%0.50551%0.514SS..Hα-helixtrans-54.6-42.7172.3-71174.5164.200111.8L8 L14 M15 Q16L8-E12 WeakPolarHBondContact O-CG 3.44Å; L8-E12 PolarHBondContact O-N 2.94Å; E12-L14 VanDerWaalsContact C-N 3.33Å; E12-L14 PolarHBondContact O-N 3.44Å; E12-M15 PolarHBondContact O-N 3.23Å; E12-Q16 PolarHBondContact O-N 2.92Å
13N87Confident80.8Confident88 Ų88100.4 Ų100.447%0.47152%0.523SS..Hα-helixtrans-66.8-32.1175.6-70.3-32000113.1R9 A10 I11R9-N13 PolarHBondContact O-N 2.94Å; R9-N13 VanDerWaalsContact O-N 3.09Å; R9-N13 PolarHBondContact O-ND2 2.81Å; A10-N13 PolarHBondContact O-N 3.29Å; I11-N13 PolarHBondContact O-N 3.22Å
14L87.4Confident82.2Confident67 Ų6797.6 Ų97.635%0.35150%0.503SS..Hα-helixtrans-69.4-40.2172.9-72.3171.2000110.7A10 I11 E12 Q16 K17 F21 I24A10-L14 WeakPolarHBondContact O-CG 3.44Å; A10-L14 PolarHBondContact O-N 2.97Å; A10-L14 VanDerWaalsContact O-N 3.09Å; I11-L14 CarbonylContact O-C 3.59Å; I11-L14 WeakPolarHBondContact O-CA 3.36Å; I11-L14 WeakPolarHBondContact O-CB 3.49Å; I11-L14 PolarHBondContact O-N 2.96Å; E12-L14 VanDerWaalsContact C-N 3.33Å; E12-L14 PolarHBondContact O-N 3.44Å; L14-Q16 PolarHBondContact O-N 3.09Å; L14-K17 CarbonylContact O-C 3.58Å; L14-K17 WeakPolarHBondContact O-CA 3.39Å; L14-K17 WeakPolarHBondContact O-CB 3.43Å; L14-K17 PolarHBondContact O-N 3.28Å; L14-F21 HydrophobicContact CB-CE1 4.38Å; L14-F21 HydrophobicContact CB-CZ 3.94Å; L14-F21 VanDerWaalsContact O-CE1 3.32Å; L14-F21 WeakPolarHBondContact O-CE1 3.07Å; L14-F21 VanDerWaalsContact O-CZ 3.26Å; L14-F21 WeakPolarHBondContact O-CZ 3.49Å; L14-I24 HydrophobicContact CB-CD1 4.22Å; L14-I24 HydrophobicContact CD1-CD1 4.2Å; L14-I24 HydrophobicContact CD1-CG2 4.25Å
15M85.6Confident83.6Confident41 Ų4199 Ų9920%0.20252%0.516CS..Hα-helixtrans-64.7-27.1178.5-67.2-50.4-68.500113.5I11 E12 K17 K18 I24 D50 I51I11-M15 HydrophobicContact CG2-CG 4.41Å; I11-M15 WeakPolarHBondContact O-CG 3.45Å; I11-M15 PolarHBondContact O-N 3.09Å; E12-M15 PolarHBondContact O-N 3.23Å; M15-K17 PolarHBondContact O-N 3.46Å; M15-K17 VanDerWaalsContact O-N 3.11Å; M15-K18 HydrophobicContact CE-CB 4.49Å; M15-K18 HydrophobicContact CE-CD 3.89Å; M15-K18 HydrophobicContact CE-CG 4.29Å; M15-K18 VanDerWaalsContact O-CB 3.25Å; M15-K18 WeakPolarHBondContact O-CB 3.35Å; M15-K18 PolarHBondContact O-N 3.42Å; M15-K18 VanDerWaalsContact O-N 3.08Å; M15-I24 HydrophobicContact SD-CD1 4.3Å; M15-D50 HydrophobicContact CE-CB 3.68Å; M15-I51 HydrophobicContact CE-CD1 4.11Å; M15-I51 HydrophobicContact CE-CG1 3.58Å; M15-I51 HydrophobicContact CG-CD1 3.31Å; M15-I51 HydrophobicContact CG-CG1 3.9Å; M15-I51 HydrophobicContact SD-CD1 3.49Å; M15-I51 WeakPolarHBondContact SD-CD1 3.34Å; M15-I51 HydrophobicContact SD-CG1 3.44Å; M15-I51 WeakPolarHBondContact SD-CG1 3.41Å
16Q87.4Confident84.6Confident161 Ų16198.6 Ų98.675%0.75251%0.514SS*.THydrogen-bonded Turntrans-61.4-17.1168.7-67.3-179.2-2.700113.4E12 L14E12-Q16 PolarHBondContact O-N 2.92Å; L14-Q16 PolarHBondContact O-N 3.09Å
17K88.3Confident85.2Confident130 Ų130101.9 Ų101.957%0.56553%0.525SS*.THydrogen-bonded Turntrans-110.717.9178-57.4177.4-174.9172.90112.4L14 M15 G19 K20 F21L14-K17 CarbonylContact O-C 3.58Å; L14-K17 WeakPolarHBondContact O-CA 3.39Å; L14-K17 WeakPolarHBondContact O-CB 3.43Å; L14-K17 PolarHBondContact O-N 3.28Å; M15-K17 PolarHBondContact O-N 3.46Å; M15-K17 VanDerWaalsContact O-N 3.11Å; K17-G19 PolarHBondContact O-N 3.09Å; K17-K20 PolarHBondContact O-N 3.37Å; K17-F21 HydrophobicContact CB-CE1 4.24Å
18K83.8Confident85.3Confident122 Ų122102.5 Ų102.553%0.5352%0.522SS..THydrogen-bonded Turntrans-48.9138175-171.7-177.4-172.2-175.20110.4M15 D50M15-K18 HydrophobicContact CE-CB 4.49Å; M15-K18 HydrophobicContact CE-CD 3.89Å; M15-K18 HydrophobicContact CE-CG 4.29Å; M15-K18 VanDerWaalsContact O-CB 3.25Å; M15-K18 WeakPolarHBondContact O-CB 3.35Å; M15-K18 PolarHBondContact O-N 3.42Å; M15-K18 VanDerWaalsContact O-N 3.08Å; K18-D50 VanDerWaalsContact NZ-CG 3.34Å; K18-D50 IonicContact NZ-OD1 2.68Å; K18-D50 PolarHBondContact NZ-OD1 3.06Å
19G85.9Confident85.3Confident73 Ų73103.8 Ų103.875%0.75353%0.533SS*.THydrogen-bonded Turntrans93.3-3.8-175.500000115K17K17-G19 PolarHBondContact O-N 3.09Å
20K91.8Very high84.7Confident183 Ų183101 Ų10180%0.79655%0.551SS**SBendtrans-97.9-12.7166.7-66.7-168.7175.1-172.60113.8K17K17-K20 PolarHBondContact O-N 3.37Å
21F89.2Confident84.1Confident57 Ų57106.8 Ų106.825%0.2557%0.574CS.*  trans-148.6153.8177.259.9-91.1000107.7L14 K17 I24L14-F21 HydrophobicContact CB-CE1 4.38Å; L14-F21 HydrophobicContact CB-CZ 3.94Å; L14-F21 VanDerWaalsContact O-CE1 3.32Å; L14-F21 WeakPolarHBondContact O-CE1 3.07Å; L14-F21 VanDerWaalsContact O-CZ 3.26Å; L14-F21 WeakPolarHBondContact O-CZ 3.49Å; K17-F21 HydrophobicContact CB-CE1 4.24Å; F21-I24 HydrophobicContact CD2-CG1 4.02Å; F21-I24 HydrophobicContact CE2-CD1 3.78Å; F21-I24 HydrophobicContact CE2-CG1 3.49Å; F21-I24 VanDerWaalsContact CE2-CG1 3.49Å; F21-I24 HydrophobicContact CZ-CD1 4.24Å; F21-I24 HydrophobicContact CZ-CG1 4.3Å
22D86.3Confident83.8Confident157 Ų157107.8 Ų107.884%0.8459%0.585SS**SBendtrans-98.9-36.4-178.9-54.2-68.4000111.1
23D88.4Confident83.7Confident124 Ų124107.6 Ų107.666%0.66359%0.587SS**  trans-129.4151.7-174.6-62.4-54.4000112.8
24I86.9Confident83.3Confident67 Ų67105.9 Ų105.934%0.34458%0.581SS.*  trans-114.6114.9172.6-60.6173.8000108.3I11 L14 M15 F21I11-I24 HydrophobicContact CG2-CD1 4.37Å; L14-I24 HydrophobicContact CB-CD1 4.22Å; L14-I24 HydrophobicContact CD1-CD1 4.2Å; L14-I24 HydrophobicContact CD1-CG2 4.25Å; M15-I24 HydrophobicContact SD-CD1 4.3Å; F21-I24 HydrophobicContact CD2-CG1 4.02Å; F21-I24 HydrophobicContact CE2-CD1 3.78Å; F21-I24 HydrophobicContact CE2-CG1 3.49Å; F21-I24 VanDerWaalsContact CE2-CG1 3.49Å; F21-I24 HydrophobicContact CZ-CD1 4.24Å; F21-I24 HydrophobicContact CZ-CG1 4.3Å
25L89.1Confident83.1Confident160 Ų160104.5 Ų104.584%0.83858%0.583SS**  trans-91.5116.1171.4-177.164.8000110
26L85.4Confident82.7Confident90 Ų90104.2 Ų104.247%0.47159%0.588SS.*  trans-102.1110.4175.1-176.965000110.6V37 F41L26-V37 HydrophobicContact CD2-CG1 3.46Å; L26-V37 VanDerWaalsContact CD2-CG1 3.46Å; L26-F41 HydrophobicContact CD2-CE2 3.59Å; L26-F41 HydrophobicContact CD2-CZ 3.92Å
27E85.3Confident82.3Confident178 Ų17898.2 Ų98.283%0.83256%0.562SS**PPolyproline II helixtrans-84.2118.1171-172.2-175.2178.700109.9
28T78.4Confident81.9Confident50 Ų5092.8 Ų92.831%0.30754%0.541SS..PPolyproline II helixtrans-87.6137.8168.655.60000109.2A32 V37T28-A32 HydrophobicContact CG2-CB 4.46Å; T28-V37 HydrophobicContact CG2-CG1 4.46Å; T28-V37 HydrophobicContact CG2-CG2 3.92Å
29T74.8Confident81.7Confident99 Ų9990.7 Ų90.761%0.60754%0.542SS*.PPolyproline II helixtrans-57.8152.3170.4630000109.7L31 A32T29-L31 PolarHBondContact O-N 3.11Å; T29-A32 PolarHBondContact O-N 3.25Å
30G68.2Low81.1Confident93 Ų9390 Ų9096%0.95952%0.52SS*.THydrogen-bonded Turntrans-60.1-1.8-177.200000116.2
31L72.2Confident80.1Confident176 Ų17683.4 Ų83.492%0.92149%0.491SS*.THydrogen-bonded Turntrans-108.3-14.4175.4-72.4162000113.3T29T29-L31 PolarHBondContact O-N 3.11Å
32A76.5Confident79.1Confident40 Ų4089.9 Ų89.933%0.33151%0.514SS..SBendtrans-80.1136.1179.600000110T28 T29 P34T28-A32 HydrophobicContact CG2-CB 4.46Å; T29-A32 PolarHBondContact O-N 3.25Å; A32-P34 WeakPolarHBondContact O-CD 3.5Å
33D80.1Confident77.9Confident103 Ų10385.8 Ų85.855%0.55150%0.495SS*.  trans-78.3115178.3175.718.2000110.3G35 A36 V37D33-G35 PolarHBondContact O-N 2.91Å; D33-G35 PolarHBondContact OD1-N 3.15Å; D33-A36 HydrophobicContact CB-CB 4.31Å; D33-A36 PolarHBondContact O-N 3.42Å; D33-A36 PolarHBondContact OD2-N 3.33Å; D33-V37 PolarHBondContact O-N 2.96Å
34P78.6Confident76.4Confident52 Ų5284.7 Ų84.734%0.33849%0.489SS..Hα-helixtrans-64.8-23.717727.5-34.6000112.3A32 V37 A38 I56A32-P34 WeakPolarHBondContact O-CD 3.5Å; P34-V37 PolarHBondContact O-N 3.34Å; P34-A38 WeakPolarHBondContact O-CB 3.44Å; P34-A38 PolarHBondContact O-N 3.38Å; P34-I56 HydrophobicContact CB-CG2 4.13Å
35G82.1Confident74.8Confident39 Ų3985.7 Ų85.740%0.40251%0.507SS..Hα-helixtrans-65.6-45.6176.700000112.3D33 V37 A38 S39D33-G35 PolarHBondContact O-N 2.91Å; D33-G35 PolarHBondContact OD1-N 3.15Å; G35-V37 VanDerWaalsContact C-N 3.27Å; G35-V37 PolarHBondContact O-N 3.33Å; G35-A38 PolarHBondContact O-N 2.86Å; G35-S39 WeakPolarHBondContact O-CB 3.49Å; G35-S39 PolarHBondContact O-N 3.23Å; G35-S39 PolarHBondContact O-OG 2.89Å
36A79Confident73Confident35 Ų3586.7 Ų86.729%0.28951%0.507SS..Hα-helixtrans-58.9-40.9174.100000111.6D33 S39 M40D33-A36 HydrophobicContact CB-CB 4.31Å; D33-A36 PolarHBondContact O-N 3.42Å; D33-A36 PolarHBondContact OD2-N 3.33Å; A36-S39 PolarHBondContact O-OG 3.29Å; A36-M40 HydrophobicContact CB-CE 4.38Å; A36-M40 WeakPolarHBondContact O-CE 3.33Å; A36-M40 WeakPolarHBondContact O-CG 3.48Å; A36-M40 PolarHBondContact O-N 3.41Å
37V78.4Confident71.2Confident34 Ų3489.1 Ų89.121%0.20652%0.52CS..Hα-helixtrans-67.5-48178.8175.60000111.3L26 T28 D33 P34 G35 S39 M40 F41L26-V37 HydrophobicContact CD2-CG1 3.46Å; L26-V37 VanDerWaalsContact CD2-CG1 3.46Å; T28-V37 HydrophobicContact CG2-CG1 4.46Å; T28-V37 HydrophobicContact CG2-CG2 3.92Å; D33-V37 PolarHBondContact O-N 2.96Å; P34-V37 PolarHBondContact O-N 3.34Å; G35-V37 VanDerWaalsContact C-N 3.27Å; G35-V37 PolarHBondContact O-N 3.33Å; V37-S39 VanDerWaalsContact C-N 3.29Å; V37-S39 PolarHBondContact O-N 3.09Å; V37-M40 WeakPolarHBondContact O-CB 3.17Å; V37-M40 PolarHBondContact O-N 2.74Å; V37-M40 VanDerWaalsContact O-N 3.11Å; V37-F41 HydrophobicContact CG1-CD2 3.91Å; V37-F41 HydrophobicContact CG1-CE2 3.38Å; V37-F41 HydrophobicContact CG1-CZ 4.42Å; V37-F41 WeakPolarHBondContact O-CD2 3.49Å; V37-F41 PolarHBondContact O-N 3.36Å
38A80Confident69.7Low16 Ų1683.6 Ų83.613%0.13251%0.511CS..Hα-helixtrans-57.6-4217600000112.1P34 G35 M40 F41 W42 L53 I56P34-A38 WeakPolarHBondContact O-CB 3.44Å; P34-A38 PolarHBondContact O-N 3.38Å; G35-A38 PolarHBondContact O-N 2.86Å; A38-M40 VanDerWaalsContact C-N 3.3Å; A38-M40 PolarHBondContact O-N 3.42Å; A38-F41 CarbonylContact O-C 3.5Å; A38-F41 PolarHBondContact O-N 3.33Å; A38-F41 VanDerWaalsContact O-N 3.15Å; A38-W42 PolarHBondContact O-N 3.43Å; A38-L53 HydrophobicContact CB-CD2 3.78Å; A38-I56 HydrophobicContact CB-CD1 3.84Å
39S78.3Confident69Low78 Ų7883.6 Ų83.655%0.54551%0.513SS..Hα-helixtrans-66-27.9177.971.90000114.1G35 A36 V37 F41G35-S39 WeakPolarHBondContact O-CB 3.49Å; G35-S39 PolarHBondContact O-N 3.23Å; G35-S39 PolarHBondContact O-OG 2.89Å; A36-S39 PolarHBondContact O-OG 3.29Å; V37-S39 VanDerWaalsContact C-N 3.29Å; V37-S39 PolarHBondContact O-N 3.09Å; S39-F41 VanDerWaalsContact C-N 3.32Å
40M74.4Confident68.9Low59 Ų5984.5 Ų84.529%0.29151%0.514SS..Hα-helixtrans-71.9-30.4174.5-70.8177.1-142.700112K4 A36 V37 A38K4-M40 HydrophobicContact CB-CE 4.14Å; K4-M40 HydrophobicContact CB-SD 3.99Å; K4-M40 HydrophobicContact CD-CE 3.62Å; K4-M40 HydrophobicContact CD-SD 4.36Å; K4-M40 HydrophobicContact CG-CE 3.55Å; K4-M40 HydrophobicContact CG-SD 4.09Å; A36-M40 HydrophobicContact CB-CE 4.38Å; A36-M40 WeakPolarHBondContact O-CE 3.33Å; A36-M40 WeakPolarHBondContact O-CG 3.48Å; A36-M40 PolarHBondContact O-N 3.41Å; V37-M40 WeakPolarHBondContact O-CB 3.17Å; V37-M40 PolarHBondContact O-N 2.74Å; V37-M40 VanDerWaalsContact O-N 3.11Å; A38-M40 VanDerWaalsContact C-N 3.3Å; A38-M40 PolarHBondContact O-N 3.42Å
41F70.7Confident69.3Low44 Ų4482.7 Ų82.719%0.19348%0.482CS..Hα-helixtrans-91.1-13.6178.5-60.9-53.2000113.8I11 L26 V37 A38 S39 V43I11-F41 HydrophobicContact CD1-CD1 4.33Å; I11-F41 HydrophobicContact CD1-CE1 3.16Å; I11-F41 HydrophobicContact CD1-CE2 4.32Å; I11-F41 HydrophobicContact CD1-CZ 3.15Å; L26-F41 HydrophobicContact CD2-CE2 3.59Å; L26-F41 HydrophobicContact CD2-CZ 3.92Å; V37-F41 HydrophobicContact CG1-CD2 3.91Å; V37-F41 HydrophobicContact CG1-CE2 3.38Å; V37-F41 HydrophobicContact CG1-CZ 4.42Å; V37-F41 WeakPolarHBondContact O-CD2 3.49Å; V37-F41 PolarHBondContact O-N 3.36Å; A38-F41 CarbonylContact O-C 3.5Å; A38-F41 PolarHBondContact O-N 3.33Å; A38-F41 VanDerWaalsContact O-N 3.15Å; S39-F41 VanDerWaalsContact C-N 3.32Å; F41-V43 PolarHBondContact O-N 3.37Å
42W68.2Low69.7Low193 Ų19382.3 Ų82.373%0.73147%0.469SS*.  trans-72.771.2170-164.1-86.9000109.8A38A38-W42 PolarHBondContact O-N 3.43Å
43V61.2Low70Confident72 Ų7283.5 Ų83.544%0.43647%0.47SS..  trans-82.6124.5166.2-175.10000106F41 A45 L47F41-V43 PolarHBondContact O-N 3.37Å; V43-A45 PolarHBondContact O-N 3.37Å; V43-L47 HydrophobicContact CG1-CD1 4.37Å
44D56.9Low70.4Confident101 Ų10185 Ų8554%0.5448%0.478SS..  trans-51.9126.5-176.5-135.1-36000110.2E46 L47D44-E46 PolarHBondContact O-N 3.47Å; D44-L47 PolarHBondContact O-N 3.5Å
45A53Low70.8Confident88 Ų8884.6 Ų84.673%0.72748%0.483SS*.G310 helixtrans-60.7-14.9-172.500000112.8V43 L47 G48V43-A45 PolarHBondContact O-N 3.37Å; A45-L47 PolarHBondContact O-N 3.27Å; A45-G48 PolarHBondContact O-N 2.7Å
46E50.8Low71Confident181 Ų18187.3 Ų87.385%0.84649%0.487SS*.G310 helixtrans-61.3-18170.9-100179.8165.700114.1D44D44-E46 PolarHBondContact O-N 3.47Å
47L49.2Very low71.5Confident140 Ų14092.7 Ų92.773%0.73351%0.51SS*.G310 helixtrans-95.81.9-179.1-74.9166000114.8V43 D44 A45V43-L47 HydrophobicContact CG1-CD1 4.37Å; D44-L47 PolarHBondContact O-N 3.5Å; A45-L47 PolarHBondContact O-N 3.27Å
48G53.6Low71.9Confident62 Ų6296 Ų9664%0.63953%0.53SS*.  trans65.441.3176.100000113.3A45 D50A45-G48 PolarHBondContact O-N 2.7Å; G48-D50 PolarHBondContact O-N 2.94Å
49S63.6Low72.1Confident51 Ų51103 Ų10336%0.35756%0.564SS.*  trans-64129.3178.959.50000111.1I51S49-I51 PolarHBondContact O-N 3.08Å; S49-I51 VanDerWaalsContact O-N 3.1Å; S49-I51 PolarHBondContact OG-O 3.35Å
50D73.1Confident72.4Confident117 Ų117104 Ų10463%0.62657%0.566SS**SBendtrans-68.5-2.9175.6-84.3-50.6000113.9M15 K18 G48M15-D50 HydrophobicContact CE-CB 3.68Å; K18-D50 VanDerWaalsContact NZ-CG 3.34Å; K18-D50 IonicContact NZ-OD1 2.68Å; K18-D50 PolarHBondContact NZ-OD1 3.06Å; G48-D50 PolarHBondContact O-N 2.94Å
51I76.3Confident73Confident55 Ų55105.3 Ų105.328%0.28258%0.575SS.*  trans-129.6138.3-178.4-55.7167.8000107.9I11 M15 S49I11-I51 HydrophobicContact CG2-CD1 3.41Å; I11-I51 VanDerWaalsContact CG2-CD1 3.41Å; M15-I51 HydrophobicContact CE-CD1 4.11Å; M15-I51 HydrophobicContact CE-CG1 3.58Å; M15-I51 HydrophobicContact CG-CD1 3.31Å; M15-I51 HydrophobicContact CG-CG1 3.9Å; M15-I51 HydrophobicContact SD-CD1 3.49Å; M15-I51 WeakPolarHBondContact SD-CD1 3.34Å; M15-I51 HydrophobicContact SD-CG1 3.44Å; M15-I51 WeakPolarHBondContact SD-CG1 3.41Å; S49-I51 PolarHBondContact O-N 3.08Å; S49-I51 VanDerWaalsContact O-N 3.1Å; S49-I51 PolarHBondContact OG-O 3.35Å
52Y79.6Confident73.7Confident168 Ų168109 Ų10966%0.65961%0.606SS**  trans-136157.4171.665.8-82.5000109.6D54Y52-D54 HydrophobicContact CE2-CB 4.22Å; Y52-D54 PolarHBondContact O-N 3.44Å
53L83.9Confident74.4Confident66 Ų66107.3 Ų107.335%0.34660%0.604SS.*  trans-81.2111.8174.2179.866.1000109.2A38 I56A38-L53 HydrophobicContact CB-CD2 3.78Å; L53-I56 HydrophobicContact CD2-CD1 4.38Å; L53-I56 HydrophobicContact CD2-CG1 4.22Å
54D86.8Confident75.4Confident133 Ų133109.6 Ų109.671%0.71161%0.606SS**  trans-75.4-46.8176-177.765.1000112Y52Y52-D54 HydrophobicContact CE2-CB 4.22Å; Y52-D54 PolarHBondContact O-N 3.44Å
55G86.8Confident75.9Confident44 Ų44105.8 Ų105.845%0.45459%0.59SS.*  trans-171.3163.4179.500000114.3
56I87.3Confident76.6Confident96 Ų96108.8 Ų108.849%0.49259%0.593SS.*  trans-111.1114.4172.9-57.9176.6000107.9P34 A38 L53P34-I56 HydrophobicContact CB-CG2 4.13Å; A38-I56 HydrophobicContact CB-CD1 3.84Å; L53-I56 HydrophobicContact CD2-CD1 4.38Å; L53-I56 HydrophobicContact CD2-CG1 4.22Å
57I89.1Confident77.2Confident148 Ų148108.7 Ų108.776%0.75959%0.59SS**  trans-100.8124.9-179.8-56.1176.9000108.8
58T86.6Confident77.8Confident104 Ų104106 Ų10664%0.63859%0.587SS**  trans-116125175.7-55.80000110.1V60T58-V60 HydrophobicContact CG2-CG2 4.08Å
59I85.7Confident77.9Confident162 Ų162109.7 Ų109.783%0.83159%0.586SS**  trans-92.1126.1172.7-58.4176.6000108.1
60V84.3Confident77.3Confident99 Ų99114.8 Ų114.860%0.661%0.609SS**  trans-118.4129.1179.4-177.50000109.2T58 S62T58-V60 HydrophobicContact CG2-CG2 4.08Å; V60-S62 PolarHBondContact O-N 2.93Å
61D85.7Confident76.3Confident87 Ų87119 Ų11947%0.46562%0.617SS.*  trans-68.5123.5171-178.5-60.3000109.7K63 Y64 G65D61-K63 VanDerWaalsContact C-N 3.29Å; D61-K63 PolarHBondContact O-N 3.42Å; D61-K63 VanDerWaalsContact OD1-CA 3.31Å; D61-K63 WeakPolarHBondContact OD1-CA 3.24Å; D61-K63 VanDerWaalsContact OD1-CB 3.24Å; D61-K63 WeakPolarHBondContact OD1-CB 3.31Å; D61-K63 PolarHBondContact OD1-N 2.73Å; D61-Y64 PolarHBondContact O-N 3.36Å; D61-Y64 WeakPolarHBondContact OD1-CD2 3.24Å; D61-Y64 PolarHBondContact OD1-N 2.79Å; D61-G65 WeakPolarHBondContact O-CA 3.44Å; D61-G65 PolarHBondContact O-N 2.98Å
62S86.3Confident74.8Confident123 Ų123122.1 Ų122.186%0.8664%0.638SS**THydrogen-bonded Turntrans-69.4-24.2-176.559.30000114.1V60V60-S62 PolarHBondContact O-N 2.93Å
63K83.4Confident73.2Confident156 Ų156124.2 Ų124.268%0.67867%0.669SS**THydrogen-bonded Turntrans-81.8-33.7178.8-178-179.8178.1-1690111.6D61D61-K63 VanDerWaalsContact C-N 3.29Å; D61-K63 PolarHBondContact O-N 3.42Å; D61-K63 VanDerWaalsContact OD1-CA 3.31Å; D61-K63 WeakPolarHBondContact OD1-CA 3.24Å; D61-K63 VanDerWaalsContact OD1-CB 3.24Å; D61-K63 WeakPolarHBondContact OD1-CB 3.31Å; D61-K63 PolarHBondContact OD1-N 2.73Å
64Y81.8Confident72.7Confident121 Ų121127.2 Ų127.248%0.47569%0.685SS.*THydrogen-bonded Turntrans-112.8-9.6-174.9-58.1-72.1000114.5D61 L66 K67 A68D61-Y64 PolarHBondContact O-N 3.36Å; D61-Y64 WeakPolarHBondContact OD1-CD2 3.24Å; D61-Y64 PolarHBondContact OD1-N 2.79Å; Y64-L66 VanDerWaalsContact C-N 3.31Å; Y64-L66 PolarHBondContact O-N 3.24Å; Y64-K67 WeakPolarHBondContact O-CA 3.26Å; Y64-K67 WeakPolarHBondContact O-CB 3.27Å; Y64-K67 PolarHBondContact O-N 2.85Å; Y64-A68 PolarHBondContact O-N 3.25Å; Y64-A68 VanDerWaalsContact O-N 3.08Å
65G67.8Low71.9Confident20 Ų20126.8 Ų126.821%0.20668%0.684CS.*Hα-helixtrans-60-36.8-173.100000114.1D61 K67 A68D61-G65 WeakPolarHBondContact O-CA 3.44Å; D61-G65 PolarHBondContact O-N 2.98Å; G65-K67 VanDerWaalsContact C-N 3.32Å; G65-K67 PolarHBondContact O-N 3.36Å; G65-A68 PolarHBondContact O-N 2.95Å
66L67.8Low71.1Confident152 Ų152131.4 Ų131.480%0.79670%0.697SS**Hα-helixtrans-74.3-20175.5-67.1170.7000113.5Y64 K69Y64-L66 VanDerWaalsContact C-N 3.31Å; Y64-L66 PolarHBondContact O-N 3.24Å; L66-K69 VanDerWaalsContact O-O 3.11Å
67K63.4Low70.2Confident179 Ų179133.5 Ų133.578%0.77871%0.709SS**Hα-helixtrans-85-29.3174.4-95.3-176.1174.7-1780112.4Y64 G65Y64-K67 WeakPolarHBondContact O-CA 3.26Å; Y64-K67 WeakPolarHBondContact O-CB 3.27Å; Y64-K67 PolarHBondContact O-N 2.85Å; G65-K67 VanDerWaalsContact C-N 3.32Å; G65-K67 PolarHBondContact O-N 3.36Å
68A61.3Low69Low83 Ų83132.6 Ų132.669%0.68671%0.705SS**Hα-helixtrans-76.5-21.7-173.700000113.4Y64 G65Y64-A68 PolarHBondContact O-N 3.25Å; Y64-A68 VanDerWaalsContact O-N 3.08Å; G65-A68 PolarHBondContact O-N 2.95Å
69K56.2Low67.8Low139 Ų139134.5 Ų134.560%0.60471%0.71SS**SBendtrans-133.2134.8170.8-65.6-156.8176-1730108.3L66 W71L66-K69 VanDerWaalsContact O-O 3.11Å; K69-W71 HydrophobicContact CB-CB 4.41Å; K69-W71 HydrophobicContact CB-CE3 4.3Å; K69-W71 HydrophobicContact CD-CE3 4.29Å; K69-W71 HydrophobicContact CD-CZ3 4.42Å; K69-W71 PolarHBondContact O-N 3.06Å
70N50.6Low66.5Low159 Ų159132.6 Ų132.685%0.8570%0.701SS**  trans-6557.5168.1-75.81.1000110.4T72N70-T72 PolarHBondContact O-N 2.68Å
71W52Low65.2Low205 Ų205135.2 Ų135.278%0.77771%0.709SS**  trans-85.848.3178.6-146.1-36.4000108.8K69K69-W71 HydrophobicContact CB-CB 4.41Å; K69-W71 HydrophobicContact CB-CE3 4.3Å; K69-W71 HydrophobicContact CD-CE3 4.29Å; K69-W71 HydrophobicContact CD-CZ3 4.42Å; K69-W71 PolarHBondContact O-N 3.06Å
72T44.1Very low63.5Low121 Ų121139.2 Ų139.274%0.74273%0.729SS**  trans-90.6123162.230.20000106.6N70N70-T72 PolarHBondContact O-N 2.68Å
73T46.8Very low61.4Low212 Ų212140.6 Ų140.6100%1.30172%0.718SS**  trans-41.10177.7-36.90000114.2

Retrieved 73 of 73 residues in 73.7 ms (Link to these results)