X6RHF8_HUMAN Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession X6RHF8, Species HUMAN (Homo sapiens, Human), Gene PDIK1L, Length 191 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
1M41.8Very low72.2Confident244 Ų24498.3 Ų98.3100%1.20254%0.538SS*.  01260-69.4178.2-166.900107.8S3M1-S3 PolarHBondContact O-N 3.38Å
2V46.5Very low74.2Confident111 Ų111100.9 Ų100.967%0.67353%0.534SS*.  trans-76.3114.3175.3-179.70000107.1
3S49.3Very low75.9Confident70 Ų7099.2 Ų99.249%0.4952%0.522SS..  trans-83.5122.8176.5175.50000109.1M1 Q5M1-S3 PolarHBondContact O-N 3.38Å; S3-Q5 VanDerWaalsContact C-N 3.32Å; S3-Q5 PolarHBondContact OG-O 3.39Å
4S51.4Low77.2Confident123 Ų12396.6 Ų96.686%0.8651%0.511SS*.SBendtrans-76.7-17.1177.355.20000113.6
5Q59.9Low78Confident150 Ų15092.1 Ų92.170%0.70150%0.498SS*.SBendtrans-102135.1175.4-70.1-172.5-8.200111.3S3 K7S3-Q5 VanDerWaalsContact C-N 3.32Å; S3-Q5 PolarHBondContact OG-O 3.39Å; Q5-K7 PolarHBondContact O-N 2.82Å
6P77Confident78.8Confident73 Ų7396.6 Ų96.647%0.47451%0.505SS..  trans-66122.3177.625.2-31000110Y8 R28P6-Y8 VanDerWaalsContact C-N 3.28Å; P6-Y8 PolarHBondContact O-N 3.26Å; P6-R28 WeakPolarHBondContact O-CD 3.46Å; P6-R28 PolarHBondContact O-NE 3.31Å; P6-R28 VanDerWaalsContact O-NE 3.16Å
7K90.2Very high78.6Confident91 Ų9193.8 Ų93.840%0.39651%0.505SS..SBendtrans-68.7-27.7179.5-180176.9173-1700112.8Q5 R28 E72Q5-K7 PolarHBondContact O-N 2.82Å; K7-R28 PolarHBondContact O-N 3.49Å; K7-E72 IonicContact NZ-OE1 3.47Å; K7-E72 PolarHBondContact NZ-OE1 2.69Å
8Y93.6Very high78.4Confident11 Ų1194.6 Ų94.64%0.04352%0.519CS..EExtended strand (participates in β ladder)trans-124.7140.3-172.1-56-82.8000111.1P6 V26 I27 V34 E72 I74 V118P6-Y8 VanDerWaalsContact C-N 3.28Å; P6-Y8 PolarHBondContact O-N 3.26Å; Y8-V26 WeakPolarHBondContact CA-O 3.34Å; Y8-I27 HydrophobicContact CD1-CG1 3.95Å; Y8-I27 HydrophobicContact CE1-CD1 4.39Å; Y8-I27 HydrophobicContact CE1-CG1 3.69Å; Y8-V34 HydrophobicContact CD1-CG2 3.8Å; Y8-V34 HydrophobicContact CE1-CG2 4.04Å; Y8-E72 VanDerWaalsContact OH-CD 3.25Å; Y8-E72 WeakPolarHBondContact OH-CG 3.29Å; Y8-E72 PolarHBondContact OH-OE1 3.46Å; Y8-I74 HydrophobicContact CD2-CD1 4.03Å; Y8-I74 HydrophobicContact CE2-CD1 3.6Å; Y8-V118 HydrophobicContact CD1-CG1 4.32Å; Y8-V118 HydrophobicContact CD2-CG2 4.38Å; Y8-V118 HydrophobicContact CE1-CG1 3.52Å; Y8-V118 HydrophobicContact CE1-CG2 4.27Å; Y8-V118 HydrophobicContact CE2-CG2 3.85Å
9D94.2Very high78.4Confident51 Ų5196.2 Ų96.227%0.27352%0.518SS..EExtended strand (participates in β ladder)trans-107.9113.8170.9-71.9-22.6000110I11 A25 V26 R28D9-I11 PolarHBondContact O-N 3.43Å; D9-A25 CarbonylContact O-C 3.51Å; D9-A25 WeakPolarHBondContact O-CA 3.41Å; D9-A25 VanDerWaalsContact O-CB 3.25Å; D9-A25 WeakPolarHBondContact O-CB 3.43Å; D9-V26 HydrophobicContact CB-CG2 3.91Å; D9-V26 PolarHBondContact N-O 2.93Å; D9-V26 PolarHBondContact O-N 3.39Å; D9-R28 VanDerWaalsContact CG-CZ 3.45Å; D9-R28 VanDerWaalsContact CG-NE 3.28Å; D9-R28 IonicContact OD1-CZ 2.92Å; D9-R28 IonicContact OD1-NE 3.96Å; D9-R28 PolarHBondContact OD1-NE 3.11Å; D9-R28 IonicContact OD1-NH1 2.6Å; D9-R28 IonicContact OD1-NH2 2.88Å; D9-R28 PolarHBondContact OD1-NH2 3.36Å; D9-R28 VanDerWaalsContact OD2-CG 3.31Å; D9-R28 WeakPolarHBondContact OD2-CG 3.21Å; D9-R28 IonicContact OD2-CZ 2.75Å; D9-R28 VanDerWaalsContact OD2-CZ 3.23Å; D9-R28 IonicContact OD2-NE 3.69Å; D9-R28 PolarHBondContact OD2-NE 2.94Å; D9-R28 VanDerWaalsContact OD2-NE 3.16Å; D9-R28 IonicContact OD2-NH1 3.56Å; D9-R28 IonicContact OD2-NH2 3.23Å
10L94.8Very high79Confident64 Ų6492 Ų9234%0.33550%0.497SS..EExtended strand (participates in β ladder)trans-72.1124.5175.2-53.1-175.8000108.6Y23 A25 V36 W116L10-Y23 HydrophobicContact CB-CD1 4.41Å; L10-Y23 HydrophobicContact CD1-CD1 4.42Å; L10-Y23 HydrophobicContact CD1-CD2 4.32Å; L10-Y23 HydrophobicContact CD1-CG 4.23Å; L10-Y23 HydrophobicContact CD2-CG 4.44Å; L10-A25 HydrophobicContact CD2-CB 3.81Å; L10-V36 HydrophobicContact CD2-CB 3.94Å; L10-V36 HydrophobicContact CD2-CG1 4.07Å; L10-V36 HydrophobicContact CD2-CG2 4.06Å; L10-W116 HydrophobicContact CD1-CH2 4.38Å; L10-W116 HydrophobicContact CD2-CZ3 4.33Å
11I95.8Very high79.8Confident93 Ų9388.4 Ų88.448%0.47748%0.479SS..EExtended strand (participates in β ladder)trans-94.8-60.1-176.2-63175.4000110D9 E24 V26D9-I11 PolarHBondContact O-N 3.43Å; I11-E24 WeakPolarHBondContact CB-O 3.34Å; I11-E24 HydrophobicContact CD1-CG 4.35Å; I11-E24 PolarHBondContact N-O 2.85Å; I11-V26 HydrophobicContact CD1-CB 4.25Å; I11-V26 HydrophobicContact CD1-CG1 3.52Å; I11-V26 HydrophobicContact CD1-CG2 3.97Å; I11-V26 HydrophobicContact CG1-CG2 4.31Å
12R96.2Very high82.3Confident130 Ų13078.4 Ų78.449%0.49143%0.431SS..EExtended strand (participates in β ladder)trans-153153.7-175.964.4-179.8-179.4103.64.6111.2V14 Y23 E24R12-V14 HydrophobicContact CG-CG1 4.28Å; R12-Y23 CarbonylContact O-C 3.47Å; R12-Y23 VanDerWaalsContact O-CA 3.24Å; R12-Y23 WeakPolarHBondContact O-CA 3.12Å; R12-E24 HydrophobicContact CG-CB 4.07Å; R12-E24 IonicContact CZ-OE2 2.81Å; R12-E24 PolarHBondContact N-O 2.71Å; R12-E24 IonicContact NE-OE2 3.18Å; R12-E24 PolarHBondContact NE-OE2 3.04Å; R12-E24 IonicContact NH2-OE2 2.8Å; R12-E24 PolarHBondContact NH2-OE2 3.42Å; R12-E24 PolarHBondContact O-N 3.2Å
13E96.4Very high84.7Confident79 Ų7975.8 Ų75.837%0.36941%0.41SS..EExtended strand (participates in β ladder)trans-67.4130.8166.5-178.1167.4157.300109.2R16 V21 Y23E13-R16 VanDerWaalsContact CD-NH2 3.29Å; E13-R16 WeakPolarHBondContact OE1-CB 3.29Å; E13-R16 IonicContact OE1-CZ 3.71Å; E13-R16 IonicContact OE1-NE 3.94Å; E13-R16 PolarHBondContact OE1-NE 2.93Å; E13-R16 IonicContact OE1-NH2 2.71Å; E13-R16 PolarHBondContact OE1-NH2 2.83Å; E13-R16 VanDerWaalsContact OE1-NH2 3.09Å; E13-R16 IonicContact OE2-CZ 2.74Å; E13-R16 IonicContact OE2-NE 3.09Å; E13-R16 IonicContact OE2-NH2 3.35Å; E13-R16 PolarHBondContact OE2-NH2 3.32Å; E13-V21 HydrophobicContact CB-CG1 4.34Å; E13-V21 HydrophobicContact CG-CG1 3.52Å; E13-V21 WeakPolarHBondContact OE2-CG1 3.26Å; E13-Y23 HydrophobicContact CB-CD1 4.4Å; E13-Y23 HydrophobicContact CB-CE1 4.3Å
14V93.5Very high87Confident62 Ų6273.1 Ų73.138%0.37639%0.39SS..EExtended strand (participates in β ladder)trans-111.4-18.2175.7-64.50000112.5R12 V22 E24 F121R12-V14 HydrophobicContact CG-CG1 4.28Å; V14-V22 HydrophobicContact CG2-CB 3.94Å; V14-V22 HydrophobicContact CG2-CG1 3.6Å; V14-V22 WeakPolarHBondContact CG2-O 3.23Å; V14-V22 PolarHBondContact N-O 2.81Å; V14-E24 HydrophobicContact CG1-CB 3.65Å; V14-F121 HydrophobicContact CG1-CE2 4.21Å
15G89.7Confident89.2Confident30 Ų3067.3 Ų67.331%0.30935%0.349SS..EExtended strand (participates in β ladder)trans-170.4156.8176.400000112V22G15-V22 PolarHBondContact N-O 2.72Å; G15-V22 PolarHBondContact O-N 3.49Å
16R90.3Very high90.9Very high164 Ų16461.6 Ų61.662%0.61932%0.324SS*.EExtended strand (participates in β ladder)trans-133.2114.3176.4-175.2173.5-64.8-106.31.8109E13 V21E13-R16 VanDerWaalsContact CD-NH2 3.29Å; E13-R16 WeakPolarHBondContact OE1-CB 3.29Å; E13-R16 IonicContact OE1-CZ 3.71Å; E13-R16 IonicContact OE1-NE 3.94Å; E13-R16 PolarHBondContact OE1-NE 2.93Å; E13-R16 IonicContact OE1-NH2 2.71Å; E13-R16 PolarHBondContact OE1-NH2 2.83Å; E13-R16 VanDerWaalsContact OE1-NH2 3.09Å; E13-R16 IonicContact OE2-CZ 2.74Å; E13-R16 IonicContact OE2-NE 3.09Å; E13-R16 IonicContact OE2-NH2 3.35Å; E13-R16 PolarHBondContact OE2-NH2 3.32Å; R16-V21 HydrophobicContact CG-CG2 4.32Å; R16-V21 VanDerWaalsContact CZ-CG2 3.49Å
17G76.2Confident91.8Very high49 Ų4959.4 Ų59.451%0.50531%0.308SS..  trans-91.2-178.3171.500000111.1Y19 G20G17-Y19 PolarHBondContact O-N 3.01Å; G17-G20 PolarHBondContact N-O 2.89Å
18S74Confident91.9Very high107 Ų10761.6 Ų61.675%0.74831%0.314SS*.SBendtrans-60.4-26.8178-49.10000113.5
19Y79.4Confident91.8Very high126 Ų12670.8 Ų70.849%0.49435%0.354SS..SBendtrans-121.8-4.8-167.3-47.7-66.7000113.9G17 I39 L49G17-Y19 PolarHBondContact O-N 3.01Å; Y19-I39 WeakPolarHBondContact O-CG2 3.49Å; Y19-L49 HydrophobicContact CD1-CD1 3.26Å; Y19-L49 HydrophobicContact CD2-CD1 3.84Å; Y19-L49 HydrophobicContact CE1-CD1 3.27Å; Y19-L49 HydrophobicContact CE2-CD1 3.85Å; Y19-L49 HydrophobicContact CG-CD1 3.54Å
20G89.9Confident91.8Very high11 Ų1172.8 Ų72.811%0.11337%0.368CS..EExtended strand (participates in β ladder)trans-172.4170.9-17400000113.8G17 K38G17-G20 PolarHBondContact N-O 2.89Å; G20-K38 VanDerWaalsContact CA-O 3.28Å; G20-K38 WeakPolarHBondContact CA-O 3.33Å
21V94.8Very high91.7Very high17 Ų1774.1 Ų74.110%0.10338%0.383CS..EExtended strand (participates in β ladder)trans-116.7131180-172.80000108.5E13 R16 Y23 K38E13-V21 HydrophobicContact CB-CG1 4.34Å; E13-V21 HydrophobicContact CG-CG1 3.52Å; E13-V21 WeakPolarHBondContact OE2-CG1 3.26Å; R16-V21 HydrophobicContact CG-CG2 4.32Å; R16-V21 VanDerWaalsContact CZ-CG2 3.49Å; V21-Y23 HydrophobicContact CB-CD2 4.44Å; V21-Y23 HydrophobicContact CB-CE2 3.64Å; V21-Y23 HydrophobicContact CG1-CD2 4.14Å; V21-Y23 HydrophobicContact CG1-CE1 4.19Å; V21-Y23 HydrophobicContact CG1-CE2 3.49Å; V21-Y23 VanDerWaalsContact CG1-CE2 3.49Å; V21-K38 PolarHBondContact N-O 3.16Å; V21-K38 PolarHBondContact O-N 3.31Å
22V95.9Very high91.6Very high34 Ų3471.8 Ų71.821%0.20638%0.377CS..EExtended strand (participates in β ladder)trans-98.5128175.7-170.90000108.5V14 G15 A35 V36 K37V14-V22 HydrophobicContact CG2-CB 3.94Å; V14-V22 HydrophobicContact CG2-CG1 3.6Å; V14-V22 WeakPolarHBondContact CG2-O 3.23Å; V14-V22 PolarHBondContact N-O 2.81Å; G15-V22 PolarHBondContact N-O 2.72Å; G15-V22 PolarHBondContact O-N 3.49Å; V22-A35 HydrophobicContact CG1-CB 4.33Å; V22-V36 WeakPolarHBondContact CA-O 3.26Å; V22-K37 HydrophobicContact CG2-CB 4.11Å; V22-K37 HydrophobicContact CG2-CD 4.32Å; V22-K37 HydrophobicContact CG2-CG 3.96Å
23Y97.3Very high91.6Very high56 Ų5669.6 Ų69.622%0.2237%0.369CS..EExtended strand (participates in β ladder)trans-112.5141.6176.9-62.8-94000110.3L10 R12 E13 V21 A35 V36 K38L10-Y23 HydrophobicContact CB-CD1 4.41Å; L10-Y23 HydrophobicContact CD1-CD1 4.42Å; L10-Y23 HydrophobicContact CD1-CD2 4.32Å; L10-Y23 HydrophobicContact CD1-CG 4.23Å; L10-Y23 HydrophobicContact CD2-CG 4.44Å; R12-Y23 CarbonylContact O-C 3.47Å; R12-Y23 VanDerWaalsContact O-CA 3.24Å; R12-Y23 WeakPolarHBondContact O-CA 3.12Å; E13-Y23 HydrophobicContact CB-CD1 4.4Å; E13-Y23 HydrophobicContact CB-CE1 4.3Å; V21-Y23 HydrophobicContact CB-CD2 4.44Å; V21-Y23 HydrophobicContact CB-CE2 3.64Å; V21-Y23 HydrophobicContact CG1-CD2 4.14Å; V21-Y23 HydrophobicContact CG1-CE1 4.19Å; V21-Y23 HydrophobicContact CG1-CE2 3.49Å; V21-Y23 VanDerWaalsContact CG1-CE2 3.49Å; Y23-A35 CarbonylContact O-C 3.51Å; Y23-A35 WeakPolarHBondContact O-CA 3.33Å; Y23-V36 PolarHBondContact N-O 2.85Å; Y23-V36 PolarHBondContact O-N 3.23Å; Y23-K38 HydrophobicContact CD2-CB 4.42Å; Y23-K38 HydrophobicContact CE2-CB 4.16Å; Y23-K38 HydrophobicContact CE2-CD 4.49Å
24E97Very high91.6Very high15 Ų1566.4 Ų66.47%0.0736%0.355CS..EExtended strand (participates in β ladder)trans-71.4133154.3178.7175176.800108I11 R12 V14 R33 F121I11-E24 WeakPolarHBondContact CB-O 3.34Å; I11-E24 HydrophobicContact CD1-CG 4.35Å; I11-E24 PolarHBondContact N-O 2.85Å; R12-E24 HydrophobicContact CG-CB 4.07Å; R12-E24 IonicContact CZ-OE2 2.81Å; R12-E24 PolarHBondContact N-O 2.71Å; R12-E24 IonicContact NE-OE2 3.18Å; R12-E24 PolarHBondContact NE-OE2 3.04Å; R12-E24 IonicContact NH2-OE2 2.8Å; R12-E24 PolarHBondContact NH2-OE2 3.42Å; R12-E24 PolarHBondContact O-N 3.2Å; V14-E24 HydrophobicContact CG1-CB 3.65Å; E24-R33 VanDerWaalsContact CD-NH2 3.28Å; E24-R33 IonicContact OE1-CZ 2.79Å; E24-R33 IonicContact OE1-NE 2.72Å; E24-R33 PolarHBondContact OE1-NE 3.06Å; E24-R33 IonicContact OE1-NH2 3.41Å; E24-R33 PolarHBondContact OE1-NH2 2.79Å; E24-R33 IonicContact OE2-NH2 3.15Å; E24-R33 PolarHBondContact OE2-NH2 2.95Å; E24-F121 HydrophobicContact CB-CD2 4.29Å; E24-F121 HydrophobicContact CB-CE2 3.66Å; E24-F121 HydrophobicContact CB-CZ 4.27Å; E24-F121 HydrophobicContact CG-CD2 4.12Å; E24-F121 HydrophobicContact CG-CE2 3.7Å; E24-F121 HydrophobicContact CG-CZ 4.04Å
25A97Very high91.8Very high0 Ų063.9 Ų63.90%034%0.341CS..EExtended strand (participates in β ladder)trans-139.8164.5177.700000111.4D9 L10 R33 V34 V36D9-A25 CarbonylContact O-C 3.51Å; D9-A25 WeakPolarHBondContact O-CA 3.41Å; D9-A25 VanDerWaalsContact O-CB 3.25Å; D9-A25 WeakPolarHBondContact O-CB 3.43Å; L10-A25 HydrophobicContact CD2-CB 3.81Å; A25-R33 CarbonylContact O-C 3.36Å; A25-R33 WeakPolarHBondContact O-CA 3.43Å; A25-V34 HydrophobicContact CB-CG2 3.96Å; A25-V34 PolarHBondContact N-O 3.28Å; A25-V34 PolarHBondContact O-N 2.72Å; A25-V36 HydrophobicContact CB-CG2 3.68Å
26V96.3Very high92.1Very high31 Ų3162.5 Ų62.519%0.18833%0.326CS..EExtended strand (participates in β ladder)trans-122.1141.3173.6-740000111.5Y8 D9 I11 R28 A32 R33Y8-V26 WeakPolarHBondContact CA-O 3.34Å; D9-V26 HydrophobicContact CB-CG2 3.91Å; D9-V26 PolarHBondContact N-O 2.93Å; D9-V26 PolarHBondContact O-N 3.39Å; I11-V26 HydrophobicContact CD1-CB 4.25Å; I11-V26 HydrophobicContact CD1-CG1 3.52Å; I11-V26 HydrophobicContact CD1-CG2 3.97Å; I11-V26 HydrophobicContact CG1-CG2 4.31Å; V26-R28 PolarHBondContact O-N 3.44Å; V26-A32 WeakPolarHBondContact CA-O 3.24Å; V26-R33 HydrophobicContact CG1-CG 4.1Å
27I94.9Very high92.4Very high27 Ų2756 Ų5614%0.13830%0.302CS..EExtended strand (participates in β ladder)trans-74117.2171.7-61.2173.6000107.8Y8 K29 T30 S31 A32 V34Y8-I27 HydrophobicContact CD1-CG1 3.95Å; Y8-I27 HydrophobicContact CE1-CD1 4.39Å; Y8-I27 HydrophobicContact CE1-CG1 3.69Å; I27-K29 PolarHBondContact O-N 2.98Å; I27-T30 WeakPolarHBondContact CB-OG1 3.3Å; I27-T30 PolarHBondContact O-N 3.12Å; I27-T30 VanDerWaalsContact O-N 3.13Å; I27-S31 WeakPolarHBondContact O-CA 3.24Å; I27-S31 PolarHBondContact O-N 2.87Å; I27-A32 HydrophobicContact CD1-CB 4.26Å; I27-A32 PolarHBondContact N-O 2.87Å; I27-V34 HydrophobicContact CD1-CG1 3.82Å; I27-V34 HydrophobicContact CG1-CG1 3.96Å; I27-V34 HydrophobicContact CG1-CG2 4.46Å
28R92.1Very high93.3Very high137 Ų13755.6 Ų55.652%0.51729%0.287SS..THydrogen-bonded Turntrans-53.2-37.2-174.4-73.4-162.5179.6-123.7-0.1114.5P6 K7 D9 V26P6-R28 WeakPolarHBondContact O-CD 3.46Å; P6-R28 PolarHBondContact O-NE 3.31Å; P6-R28 VanDerWaalsContact O-NE 3.16Å; K7-R28 PolarHBondContact O-N 3.49Å; D9-R28 VanDerWaalsContact CG-CZ 3.45Å; D9-R28 VanDerWaalsContact CG-NE 3.28Å; D9-R28 IonicContact OD1-CZ 2.92Å; D9-R28 IonicContact OD1-NE 3.96Å; D9-R28 PolarHBondContact OD1-NE 3.11Å; D9-R28 IonicContact OD1-NH1 2.6Å; D9-R28 IonicContact OD1-NH2 2.88Å; D9-R28 PolarHBondContact OD1-NH2 3.36Å; D9-R28 VanDerWaalsContact OD2-CG 3.31Å; D9-R28 WeakPolarHBondContact OD2-CG 3.21Å; D9-R28 IonicContact OD2-CZ 2.75Å; D9-R28 VanDerWaalsContact OD2-CZ 3.23Å; D9-R28 IonicContact OD2-NE 3.69Å; D9-R28 PolarHBondContact OD2-NE 2.94Å; D9-R28 VanDerWaalsContact OD2-NE 3.16Å; D9-R28 IonicContact OD2-NH1 3.56Å; D9-R28 IonicContact OD2-NH2 3.23Å; V26-R28 PolarHBondContact O-N 3.44Å
29K92.6Very high94.3Very high204 Ų20450.6 Ų50.689%0.88725%0.252SS*.THydrogen-bonded Turntrans-75.2-32.4-176-68-171.9177.5-174.90113.7I27I27-K29 PolarHBondContact O-N 2.98Å
30T93.9Very high95Very high92 Ų9251 Ų5156%0.56425%0.252SS*.THydrogen-bonded Turntrans-118.2-11-170.159.20000113.2I27 A32I27-T30 WeakPolarHBondContact CB-OG1 3.3Å; I27-T30 PolarHBondContact O-N 3.12Å; I27-T30 VanDerWaalsContact O-N 3.13Å; T30-A32 PolarHBondContact O-N 2.8Å; T30-A32 VanDerWaalsContact O-N 3.08Å; T30-A32 WeakPolarHBondContact OG1-CB 3.4Å; T30-A32 PolarHBondContact OG1-N 2.76Å
31S93.6Very high95.1Very high92 Ų9250.6 Ų50.664%0.64325%0.248SC*.  trans56.513.7-168.1-53.40000114.2I27I27-S31 WeakPolarHBondContact O-CA 3.24Å; I27-S31 PolarHBondContact O-N 2.87Å
32A93.6Very high95Very high44 Ų4455 Ų5536%0.36427%0.267SS..  trans-69.4137.417700000110.1V26 I27 T30V26-A32 WeakPolarHBondContact CA-O 3.24Å; I27-A32 HydrophobicContact CD1-CB 4.26Å; I27-A32 PolarHBondContact N-O 2.87Å; T30-A32 PolarHBondContact O-N 2.8Å; T30-A32 VanDerWaalsContact O-N 3.08Å; T30-A32 WeakPolarHBondContact OG1-CB 3.4Å; T30-A32 PolarHBondContact OG1-N 2.76Å
33R95.6Very high94.8Very high84 Ų8454.5 Ų54.532%0.31727%0.266SS..EExtended strand (participates in β ladder)trans-79.3138.1-179.5-64.1169.174.7-153.612.8110.4E24 A25 V26 F121E24-R33 VanDerWaalsContact CD-NH2 3.28Å; E24-R33 IonicContact OE1-CZ 2.79Å; E24-R33 IonicContact OE1-NE 2.72Å; E24-R33 PolarHBondContact OE1-NE 3.06Å; E24-R33 IonicContact OE1-NH2 3.41Å; E24-R33 PolarHBondContact OE1-NH2 2.79Å; E24-R33 IonicContact OE2-NH2 3.15Å; E24-R33 PolarHBondContact OE2-NH2 2.95Å; A25-R33 CarbonylContact O-C 3.36Å; A25-R33 WeakPolarHBondContact O-CA 3.43Å; V26-R33 HydrophobicContact CG1-CG 4.1Å; R33-F121 HydrophobicContact CB-CB 4.19Å; R33-F121 HydrophobicContact CB-CD1 4.36Å; R33-F121 HydrophobicContact CB-CG 4.32Å
34V96.9Very high94.6Very high12 Ų1252.9 Ų52.97%0.07326%0.263CS..EExtended strand (participates in β ladder)trans-138.1156.3175.9-63.70000109.8Y8 A25 I27 V36 V118 M119Y8-V34 HydrophobicContact CD1-CG2 3.8Å; Y8-V34 HydrophobicContact CE1-CG2 4.04Å; A25-V34 HydrophobicContact CB-CG2 3.96Å; A25-V34 PolarHBondContact N-O 3.28Å; A25-V34 PolarHBondContact O-N 2.72Å; I27-V34 HydrophobicContact CD1-CG1 3.82Å; I27-V34 HydrophobicContact CG1-CG1 3.96Å; I27-V34 HydrophobicContact CG1-CG2 4.46Å; V34-V36 HydrophobicContact CG2-CG2 4.2Å; V34-V118 HydrophobicContact CB-CG1 4.04Å; V34-V118 HydrophobicContact CG1-CG1 4.28Å; V34-V118 HydrophobicContact CG2-CG1 4.03Å; V34-M119 WeakPolarHBondContact CB-O 3.21Å
35A97.1Very high94.5Very high10 Ų1057.8 Ų57.88%0.08329%0.286CS..EExtended strand (participates in β ladder)trans-93.113616700000109.2V22 Y23 V118 M119 F121V22-A35 HydrophobicContact CG1-CB 4.33Å; Y23-A35 CarbonylContact O-C 3.51Å; Y23-A35 WeakPolarHBondContact O-CA 3.33Å; A35-V118 WeakPolarHBondContact O-CA 3.39Å; A35-M119 HydrophobicContact CB-CB 4.48Å; A35-M119 PolarHBondContact N-O 3.41Å; A35-M119 PolarHBondContact O-N 2.81Å; A35-F121 HydrophobicContact CB-CD2 4.22Å
36V96.8Very high94.3Very high0 Ų058.8 Ų58.80%029%0.291CS..EExtended strand (participates in β ladder)trans-121.7104.8175.7179.80000109L10 V22 Y23 A25 V34 W116 F117 V118L10-V36 HydrophobicContact CD2-CB 3.94Å; L10-V36 HydrophobicContact CD2-CG1 4.07Å; L10-V36 HydrophobicContact CD2-CG2 4.06Å; V22-V36 WeakPolarHBondContact CA-O 3.26Å; Y23-V36 PolarHBondContact N-O 2.85Å; Y23-V36 PolarHBondContact O-N 3.23Å; A25-V36 HydrophobicContact CB-CG2 3.68Å; V34-V36 HydrophobicContact CG2-CG2 4.2Å; V36-W116 HydrophobicContact CG1-CB 4.15Å; V36-W116 HydrophobicContact CG1-CD2 4.14Å; V36-W116 HydrophobicContact CG1-CE3 3.74Å; V36-W116 HydrophobicContact CG1-CG 4.36Å; V36-W116 HydrophobicContact CG1-CZ3 4.49Å; V36-F117 WeakPolarHBondContact CA-O 3.43Å; V36-V118 HydrophobicContact CG2-CG2 4.44Å
37K95.6Very high94.2Very high27 Ų2757.3 Ų57.312%0.11728%0.282CS..EExtended strand (participates in β ladder)trans-86.2117.2171.5-174.9173.3-178.9-173.40109V22 E53 W116 F117 M119 D190V22-K37 HydrophobicContact CG2-CB 4.11Å; V22-K37 HydrophobicContact CG2-CD 4.32Å; V22-K37 HydrophobicContact CG2-CG 3.96Å; K37-E53 WeakPolarHBondContact CD-OE1 3.42Å; K37-E53 WeakPolarHBondContact CE-OE1 3.41Å; K37-E53 WeakPolarHBondContact CE-OE2 3.46Å; K37-E53 IonicContact NZ-OE1 2.71Å; K37-E53 PolarHBondContact NZ-OE1 3.41Å; K37-E53 IonicContact NZ-OE2 2.78Å; K37-E53 PolarHBondContact NZ-OE2 3.18Å; K37-W116 CarbonylContact O-C 3.56Å; K37-W116 WeakPolarHBondContact O-CA 3.32Å; K37-F117 HydrophobicContact CB-CB 4.25Å; K37-F117 HydrophobicContact CB-CD2 4.46Å; K37-F117 PolarHBondContact N-O 3.49Å; K37-F117 PolarHBondContact O-N 2.82Å; K37-M119 HydrophobicContact CB-CE 3.76Å; K37-M119 HydrophobicContact CD-CE 4.38Å; K37-D190 IonicContact NZ-OD1 3.8Å; K37-D190 PolarHBondContact NZ-OD1 3.5Å
38K95Very high94.1Very high42 Ų4261 Ų6118%0.18330%0.299CS..EExtended strand (participates in β ladder)trans-109.5116.7-176.8-172.8173.4-180173.80110G20 V21 Y23 Y114 L115 W116G20-K38 VanDerWaalsContact CA-O 3.28Å; G20-K38 WeakPolarHBondContact CA-O 3.33Å; V21-K38 PolarHBondContact N-O 3.16Å; V21-K38 PolarHBondContact O-N 3.31Å; Y23-K38 HydrophobicContact CD2-CB 4.42Å; Y23-K38 HydrophobicContact CE2-CB 4.16Å; Y23-K38 HydrophobicContact CE2-CD 4.49Å; K38-Y114 HydrophobicContact CD-CD1 4.16Å; K38-Y114 HydrophobicContact CG-CD1 3.91Å; K38-Y114 HydrophobicContact CG-CG 4.37Å; K38-L115 WeakPolarHBondContact CA-O 3.37Å; K38-W116 HydrophobicContact CD-CZ2 4.39Å
39I94.8Very high94.1Very high2 Ų256 Ų561%0.0128%0.282CS..EExtended strand (participates in β ladder)trans-109.8130.8178.3-59.4-177.3000109Y19 A50 Y114 L115 F117Y19-I39 WeakPolarHBondContact O-CG2 3.49Å; I39-A50 HydrophobicContact CB-CB 4.37Å; I39-A50 HydrophobicContact CD1-CB 3.99Å; I39-A50 HydrophobicContact CG2-CB 4.01Å; I39-Y114 CarbonylContact O-C 3.53Å; I39-Y114 WeakPolarHBondContact O-CA 3.4Å; I39-L115 PolarHBondContact N-O 2.84Å; I39-L115 PolarHBondContact O-N 3.49Å; I39-F117 HydrophobicContact CD1-CD2 4.41Å; I39-F117 HydrophobicContact CD1-CE2 3.75Å; I39-F117 HydrophobicContact CG1-CE2 4.23Å
40R93.8Very high94.1Very high133 Ų13346.3 Ų46.350%0.50224%0.24SC..EExtended strand (participates in β ladder)trans-89.9115.8177.1-172.5-179.1-179.2-179.4-0.2110.2H42 Y114R40-H42 HydrophobicContact CG-CB 4.15Å; R40-H42 PolarHBondContact O-N 3.28Å; R40-H42 PolarHBondContact O-ND1 2.89Å; R40-Y114 HydrophobicContact CB-CD1 3.86Å; R40-Y114 HydrophobicContact CB-CE1 3.67Å; R40-Y114 HydrophobicContact CG-CD1 4.08Å; R40-Y114 HydrophobicContact CG-CE1 3.62Å
41C93.1Very high94.1Very high3 Ų341.9 Ų41.92%0.0221%0.213CC..  trans-84.175.6179.3-62.20000110.5V47 L96 F107 Y113C41-V47 HydrophobicContact CB-CG2 3.72Å; C41-L96 HydrophobicContact CB-CD2 4.19Å; C41-F107 HydrophobicContact CB-CZ 4.19Å; C41-F107 WeakPolarHBondContact O-CE2 3.25Å; C41-F107 VanDerWaalsContact O-CZ 3.28Å; C41-F107 WeakPolarHBondContact O-CZ 3.48Å; C41-Y113 PolarHBondContact N-O 2.86Å
42H91.6Very high94Very high111 Ų11145.2 Ų45.251%0.51421%0.211SC..  trans-118-6.6-177.266.2-76.7000114.1R40 N46R40-H42 HydrophobicContact CG-CB 4.15Å; R40-H42 PolarHBondContact O-N 3.28Å; R40-H42 PolarHBondContact O-ND1 2.89Å; H42-N46 PolarHBondContact CE1-ND2 2.74Å; H42-N46 PolarHBondContact ND1-ND2 3.39Å; H42-N46 PolarHBondContact NE2-ND2 3.12Å
43A92.4Very high93.9Very high22 Ų2244.5 Ų44.518%0.18220%0.201CC..SBendtrans-142.5151.417400000108.7E45 N46 V47A43-E45 VanDerWaalsContact CB-OE2 3.25Å; A43-E45 WeakPolarHBondContact CB-OE2 3.45Å; A43-E45 PolarHBondContact O-N 3.33Å; A43-N46 WeakPolarHBondContact O-CB 3.4Å; A43-N46 PolarHBondContact O-N 3.48Å; A43-N46 VanDerWaalsContact O-N 3.13Å; A43-V47 PolarHBondContact O-N 3Å
44P93.9Very high93.8Very high22 Ų2240.6 Ų40.614%0.14319%0.186CC..Hα-helixtrans-54.1-38.3-179.6-25.134000113.8N46 V47 E48 T99 G103 I105P44-N46 VanDerWaalsContact C-N 3.34Å; P44-N46 PolarHBondContact O-N 3.17Å; P44-V47 WeakPolarHBondContact O-CB 3.41Å; P44-V47 PolarHBondContact O-N 2.98Å; P44-V47 VanDerWaalsContact O-N 3.13Å; P44-E48 PolarHBondContact O-N 3.48Å; P44-T99 HydrophobicContact CB-CG2 4.31Å; P44-T99 HydrophobicContact CG-CG2 4.49Å; P44-G103 VanDerWaalsContact CG-O 3.24Å; P44-G103 WeakPolarHBondContact CG-O 3.46Å; P44-I105 HydrophobicContact CG-CD1 4.39Å
45E93.5Very high93.6Very high118 Ų11844.8 Ų44.855%0.55120%0.2SC*.Hα-helixtrans-64.8-39.8-179.7-53.778.3-172.600111.2A43 V47 E48 L49A43-E45 VanDerWaalsContact CB-OE2 3.25Å; A43-E45 WeakPolarHBondContact CB-OE2 3.45Å; A43-E45 PolarHBondContact O-N 3.33Å; E45-V47 VanDerWaalsContact C-N 3.3Å; E45-V47 PolarHBondContact O-N 3.4Å; E45-E48 PolarHBondContact O-N 2.79Å; E45-L49 WeakPolarHBondContact O-CB 3.4Å; E45-L49 VanDerWaalsContact O-CG 3.25Å; E45-L49 WeakPolarHBondContact O-CG 3.24Å; E45-L49 PolarHBondContact O-N 2.85Å
46N93Very high93.3Very high22 Ų2245.2 Ų45.212%0.11820%0.204CC..Hα-helixtrans-66.7-35.1175.9-65.6-47.4000111.6H42 A43 P44 A50H42-N46 PolarHBondContact CE1-ND2 2.74Å; H42-N46 PolarHBondContact ND1-ND2 3.39Å; H42-N46 PolarHBondContact NE2-ND2 3.12Å; A43-N46 WeakPolarHBondContact O-CB 3.4Å; A43-N46 PolarHBondContact O-N 3.48Å; A43-N46 VanDerWaalsContact O-N 3.13Å; P44-N46 VanDerWaalsContact C-N 3.34Å; P44-N46 PolarHBondContact O-N 3.17Å; N46-A50 WeakPolarHBondContact O-CB 3.2Å; N46-A50 PolarHBondContact O-N 3.43Å; N46-A50 VanDerWaalsContact O-N 3.12Å
47V94.4Very high93.2Very high0 Ų045.9 Ų45.90%021%0.207CC..Hα-helixtrans-69.5-46.1176.6174.70000110.7C41 A43 P44 E45 L49 A50 L51 L96 T99 F107C41-V47 HydrophobicContact CB-CG2 3.72Å; A43-V47 PolarHBondContact O-N 3Å; P44-V47 WeakPolarHBondContact O-CB 3.41Å; P44-V47 PolarHBondContact O-N 2.98Å; P44-V47 VanDerWaalsContact O-N 3.13Å; E45-V47 VanDerWaalsContact C-N 3.3Å; E45-V47 PolarHBondContact O-N 3.4Å; V47-L49 PolarHBondContact O-N 3.45Å; V47-A50 PolarHBondContact O-N 2.74Å; V47-L51 HydrophobicContact CG1-CD1 3.99Å; V47-L51 HydrophobicContact CG1-CG 4.32Å; V47-L51 WeakPolarHBondContact O-CB 3.48Å; V47-L51 WeakPolarHBondContact O-CG 3.4Å; V47-L51 PolarHBondContact O-N 3.09Å; V47-L96 HydrophobicContact CG1-CB 3.97Å; V47-L96 HydrophobicContact CG1-CD2 3.94Å; V47-L96 WeakPolarHBondContact CG1-O 3.26Å; V47-L96 HydrophobicContact CG2-CD2 4.12Å; V47-T99 HydrophobicContact CB-CG2 4.04Å; V47-T99 HydrophobicContact CG1-CG2 4.17Å; V47-T99 HydrophobicContact CG2-CG2 3.87Å; V47-F107 HydrophobicContact CG2-CE1 4.31Å; V47-F107 HydrophobicContact CG2-CZ 4.25Å
48E93.8Very high93Very high105 Ų10546.6 Ų46.649%0.49122%0.216SC..Hα-helixtrans-57.1-48.9176.8-175.7-173.2162.200111.3P44 E45 A50 L51 R52P44-E48 PolarHBondContact O-N 3.48Å; E45-E48 PolarHBondContact O-N 2.79Å; E48-A50 VanDerWaalsContact C-N 3.35Å; E48-A50 PolarHBondContact O-N 2.71Å; E48-L51 PolarHBondContact O-N 2.82Å; E48-R52 WeakPolarHBondContact O-CB 3.36Å; E48-R52 PolarHBondContact O-N 2.8Å
49L91Very high92.8Very high31 Ų3147.2 Ų47.216%0.16223%0.225CC..Hα-helixtrans-61.2-43.4178.8-70.9169.8000112.1Y19 E45 V47 R52 E53Y19-L49 HydrophobicContact CD1-CD1 3.26Å; Y19-L49 HydrophobicContact CD2-CD1 3.84Å; Y19-L49 HydrophobicContact CE1-CD1 3.27Å; Y19-L49 HydrophobicContact CE2-CD1 3.85Å; Y19-L49 HydrophobicContact CG-CD1 3.54Å; E45-L49 WeakPolarHBondContact O-CB 3.4Å; E45-L49 VanDerWaalsContact O-CG 3.25Å; E45-L49 WeakPolarHBondContact O-CG 3.24Å; E45-L49 PolarHBondContact O-N 2.85Å; V47-L49 PolarHBondContact O-N 3.45Å; L49-R52 PolarHBondContact O-N 3.41Å; L49-E53 PolarHBondContact O-N 2.72Å; L49-E53 VanDerWaalsContact O-N 3.07Å
50A93.2Very high92.7Very high0 Ų048.8 Ų48.80%023%0.233CC..Hα-helixtrans-66.7-38.7177.700000112.4I39 N46 V47 E48 E53 F54 L115 F117I39-A50 HydrophobicContact CB-CB 4.37Å; I39-A50 HydrophobicContact CD1-CB 3.99Å; I39-A50 HydrophobicContact CG2-CB 4.01Å; N46-A50 WeakPolarHBondContact O-CB 3.2Å; N46-A50 PolarHBondContact O-N 3.43Å; N46-A50 VanDerWaalsContact O-N 3.12Å; V47-A50 PolarHBondContact O-N 2.74Å; E48-A50 VanDerWaalsContact C-N 3.35Å; E48-A50 PolarHBondContact O-N 2.71Å; A50-E53 PolarHBondContact O-N 3.5Å; A50-F54 WeakPolarHBondContact O-CB 3.32Å; A50-F54 PolarHBondContact O-N 3.09Å; A50-L115 HydrophobicContact CB-CB 4.43Å; A50-L115 HydrophobicContact CB-CD1 3.44Å; A50-L115 VanDerWaalsContact CB-CD1 3.44Å; A50-F117 HydrophobicContact CB-CZ 4.42Å; A50-F117 WeakPolarHBondContact O-CZ 3.21Å
51L93.3Very high92.5Very high0 Ų051.9 Ų51.90%025%0.25CS..Hα-helixtrans-66.7-39.7175.4-75176.9000111.9V47 E48 E53 F54 W55 Y93 L96 V97V47-L51 HydrophobicContact CG1-CD1 3.99Å; V47-L51 HydrophobicContact CG1-CG 4.32Å; V47-L51 WeakPolarHBondContact O-CB 3.48Å; V47-L51 WeakPolarHBondContact O-CG 3.4Å; V47-L51 PolarHBondContact O-N 3.09Å; E48-L51 PolarHBondContact O-N 2.82Å; L51-E53 VanDerWaalsContact C-N 3.35Å; L51-E53 PolarHBondContact O-N 3.18Å; L51-F54 PolarHBondContact O-N 3.34Å; L51-W55 HydrophobicContact CB-CH2 4.17Å; L51-W55 HydrophobicContact CB-CZ2 4.18Å; L51-W55 HydrophobicContact CB-CZ3 4.33Å; L51-W55 HydrophobicContact CD1-CH2 4.36Å; L51-W55 HydrophobicContact CD1-CZ2 4.32Å; L51-W55 HydrophobicContact CD2-CZ2 4.44Å; L51-W55 WeakPolarHBondContact O-CB 3.23Å; L51-W55 VanDerWaalsContact O-CD2 3.32Å; L51-W55 VanDerWaalsContact O-CG 3.22Å; L51-W55 PolarHBondContact O-N 2.86Å; L51-Y93 HydrophobicContact CD2-CE2 4Å; L51-L96 HydrophobicContact CD1-CB 4.38Å; L51-L96 HydrophobicContact CD2-CB 4.33Å; L51-V97 HydrophobicContact CD1-CG2 4.19Å
52R91.8Very high92.5Very high162 Ų16255 Ų5561%0.61127%0.272SS*.Hα-helixtrans-58.4-48.3174.8-171.8179.574.7-169.84.7111.1E48 L49 W55 A56E48-R52 WeakPolarHBondContact O-CB 3.36Å; E48-R52 PolarHBondContact O-N 2.8Å; L49-R52 PolarHBondContact O-N 3.41Å; R52-W55 PolarHBondContact O-N 3.03Å; R52-A56 WeakPolarHBondContact O-CB 3.49Å; R52-A56 PolarHBondContact O-N 3.02Å
53E91.8Very high92.7Very high29 Ų2956.4 Ų56.414%0.13628%0.279CS..Hα-helixtrans-63.4-43.2177.3-174.6163.7-178.700111.7K37 L49 A50 L51 W55 A56 L57 F117K37-E53 WeakPolarHBondContact CD-OE1 3.42Å; K37-E53 WeakPolarHBondContact CE-OE1 3.41Å; K37-E53 WeakPolarHBondContact CE-OE2 3.46Å; K37-E53 IonicContact NZ-OE1 2.71Å; K37-E53 PolarHBondContact NZ-OE1 3.41Å; K37-E53 IonicContact NZ-OE2 2.78Å; K37-E53 PolarHBondContact NZ-OE2 3.18Å; L49-E53 PolarHBondContact O-N 2.72Å; L49-E53 VanDerWaalsContact O-N 3.07Å; A50-E53 PolarHBondContact O-N 3.5Å; L51-E53 VanDerWaalsContact C-N 3.35Å; L51-E53 PolarHBondContact O-N 3.18Å; E53-W55 PolarHBondContact O-N 2.83Å; E53-A56 PolarHBondContact O-N 2.77Å; E53-L57 HydrophobicContact CG-CD1 3.78Å; E53-L57 HydrophobicContact CG-CG 4.49Å; E53-L57 WeakPolarHBondContact O-CB 3.28Å; E53-L57 WeakPolarHBondContact O-CG 3.35Å; E53-L57 PolarHBondContact O-N 2.96Å; E53-F117 HydrophobicContact CB-CE1 4.33Å; E53-F117 HydrophobicContact CB-CZ 4.24Å; E53-F117 HydrophobicContact CG-CD1 4.36Å; E53-F117 HydrophobicContact CG-CE1 4.1Å; E53-F117 HydrophobicContact CG-CZ 4.29Å
54F93Very high92.9Very high2 Ų256.7 Ų56.71%0.00928%0.277CS..Hα-helixtrans-59.1-45.9175.1175.3-113.8000112.6A50 L51 S58 C73 M84 Y93 F117A50-F54 WeakPolarHBondContact O-CB 3.32Å; A50-F54 PolarHBondContact O-N 3.09Å; L51-F54 PolarHBondContact O-N 3.34Å; F54-S58 VanDerWaalsContact CD2-OG 3.32Å; F54-S58 WeakPolarHBondContact CD2-OG 3.1Å; F54-S58 WeakPolarHBondContact CE2-OG 3.49Å; F54-S58 WeakPolarHBondContact O-CB 3.25Å; F54-S58 PolarHBondContact O-N 2.79Å; F54-S58 PolarHBondContact O-OG 3Å; F54-C73 HydrophobicContact CD2-CB 3.56Å; F54-C73 HydrophobicContact CE2-CB 3.63Å; F54-M84 HydrophobicContact CB-CE 4.38Å; F54-M84 HydrophobicContact CD1-CE 3.59Å; F54-M84 HydrophobicContact CD2-CE 3.7Å; F54-M84 HydrophobicContact CE1-CE 3.69Å; F54-M84 HydrophobicContact CE2-CB 3.87Å; F54-M84 HydrophobicContact CE2-CE 3.8Å; F54-M84 HydrophobicContact CG-CE 3.6Å; F54-M84 HydrophobicContact CZ-CB 3.88Å; F54-M84 HydrophobicContact CZ-CE 3.79Å; F54-Y93 HydrophobicContact CD1-CE2 4.27Å; F54-Y93 AromaticContact CE1-CE2 3.94Å; F54-Y93 HydrophobicContact CE1-CE2 3.94Å; F54-F117 HydrophobicContact CB-CE1 3.82Å; F54-F117 HydrophobicContact CB-CZ 4.27Å
55W92.1Very high92.9Very high100 Ų10059.7 Ų59.738%0.37930%0.296SS..Hα-helixtrans-68.6-41.7-179.7-66.3-26.1000112.3L51 R52 E53 S59 H86 Y93 V97L51-W55 HydrophobicContact CB-CH2 4.17Å; L51-W55 HydrophobicContact CB-CZ2 4.18Å; L51-W55 HydrophobicContact CB-CZ3 4.33Å; L51-W55 HydrophobicContact CD1-CH2 4.36Å; L51-W55 HydrophobicContact CD1-CZ2 4.32Å; L51-W55 HydrophobicContact CD2-CZ2 4.44Å; L51-W55 WeakPolarHBondContact O-CB 3.23Å; L51-W55 VanDerWaalsContact O-CD2 3.32Å; L51-W55 VanDerWaalsContact O-CG 3.22Å; L51-W55 PolarHBondContact O-N 2.86Å; R52-W55 PolarHBondContact O-N 3.03Å; E53-W55 PolarHBondContact O-N 2.83Å; W55-S59 VanDerWaalsContact O-CB 3.3Å; W55-S59 WeakPolarHBondContact O-CB 3.34Å; W55-S59 PolarHBondContact O-N 2.91Å; W55-H86 AromaticContact CD1-CE1 3.64Å; W55-H86 AromaticContact CD1-ND1 3.54Å; W55-H86 AromaticContact NE1-CE1 3.97Å; W55-H86 AromaticContact NE1-ND1 3.98Å; W55-Y93 PolarHBondContact NE1-OH 3.18Å; W55-V97 HydrophobicContact CZ2-CG2 4.34Å
56A92.1Very high93.1Very high18 Ų1854.7 Ų54.715%0.14927%0.273CS..Hα-helixtrans-59.2-54.8176.100000111R52 E53 S58 S59 F191R52-A56 WeakPolarHBondContact O-CB 3.49Å; R52-A56 PolarHBondContact O-N 3.02Å; E53-A56 PolarHBondContact O-N 2.77Å; A56-S58 PolarHBondContact O-N 2.89Å; A56-S59 PolarHBondContact O-N 2.76Å; A56-S59 PolarHBondContact O-OG 2.88Å; A56-F191 HydrophobicContact CB-CD2 4.39Å; A56-F191 HydrophobicContact CB-CE2 4.46Å
57L93.3Very high93.3Very high14 Ų1453.9 Ų53.97%0.07327%0.269CS..Hα-helixtrans-66-39.6-178-69.4170.6000112.6E53 S59 I60 I68 L70 F117 M119 F191E53-L57 HydrophobicContact CG-CD1 3.78Å; E53-L57 HydrophobicContact CG-CG 4.49Å; E53-L57 WeakPolarHBondContact O-CB 3.28Å; E53-L57 WeakPolarHBondContact O-CG 3.35Å; E53-L57 PolarHBondContact O-N 2.96Å; L57-S59 VanDerWaalsContact C-N 3.29Å; L57-S59 PolarHBondContact O-N 2.74Å; L57-I60 PolarHBondContact O-N 3.15Å; L57-I68 HydrophobicContact CD2-CG2 4.1Å; L57-L70 HydrophobicContact CB-CB 3.92Å; L57-L70 HydrophobicContact CB-CD2 3.59Å; L57-L70 HydrophobicContact CB-CG 4.26Å; L57-L70 HydrophobicContact CD1-CB 4.42Å; L57-L70 HydrophobicContact CD1-CD1 4.24Å; L57-L70 HydrophobicContact CD1-CD2 4.45Å; L57-L70 HydrophobicContact CD2-CB 4.46Å; L57-F117 HydrophobicContact CD1-CD1 3.98Å; L57-M119 HydrophobicContact CD1-SD 4.36Å; L57-F191 HydrophobicContact CD2-CE1 4.27Å; L57-F191 HydrophobicContact CD2-CE2 4.11Å; L57-F191 HydrophobicContact CD2-CZ 3.63Å
58S92Very high93.4Very high42 Ų4254.2 Ų54.229%0.29427%0.271SS..Hα-helixtrans-75.5-16.1-179.4-56.20000113.7F54 A56 I60F54-S58 VanDerWaalsContact CD2-OG 3.32Å; F54-S58 WeakPolarHBondContact CD2-OG 3.1Å; F54-S58 WeakPolarHBondContact CE2-OG 3.49Å; F54-S58 WeakPolarHBondContact O-CB 3.25Å; F54-S58 PolarHBondContact O-N 2.79Å; F54-S58 PolarHBondContact O-OG 3Å; A56-S58 PolarHBondContact O-N 2.89Å; S58-I60 VanDerWaalsContact C-N 3.29Å
59S92.1Very high93.5Very high55 Ų5551.3 Ų51.339%0.38526%0.257SS..Hα-helixtrans-74.5-21.1177.374.50000112.9W55 A56 L57 K61W55-S59 VanDerWaalsContact O-CB 3.3Å; W55-S59 WeakPolarHBondContact O-CB 3.34Å; W55-S59 PolarHBondContact O-N 2.91Å; A56-S59 PolarHBondContact O-N 2.76Å; A56-S59 PolarHBondContact O-OG 2.88Å; L57-S59 VanDerWaalsContact C-N 3.29Å; L57-S59 PolarHBondContact O-N 2.74Å; S59-K61 PolarHBondContact O-N 3.23Å
60I92.5Very high93.7Very high35 Ų3551 Ų5118%0.17926%0.256CS..  trans-77114.8179.7-64.8175.4000109.6L57 S58 S62 V67 F154 L155 I160 F191L57-I60 PolarHBondContact O-N 3.15Å; S58-I60 VanDerWaalsContact C-N 3.29Å; I60-S62 WeakPolarHBondContact CG2-O 3.37Å; I60-V67 HydrophobicContact CD1-CG1 4.25Å; I60-F154 HydrophobicContact CD1-CE1 4.45Å; I60-F154 HydrophobicContact CG2-CE1 3.87Å; I60-F154 HydrophobicContact CG2-CZ 3.84Å; I60-L155 HydrophobicContact CD1-CD2 4.09Å; I60-I160 HydrophobicContact CD1-CD1 3.88Å; I60-I160 HydrophobicContact CG1-CD1 3.62Å; I60-F191 HydrophobicContact CD1-CE1 4.5Å; I60-F191 HydrophobicContact CD1-CE2 3.53Å; I60-F191 HydrophobicContact CD1-CZ 3.36Å
61K88.9Confident93.7Very high198 Ų19855.5 Ų55.586%0.86128%0.276SS*.  trans-93.4-16.4-175.8-61.2-174.3-178.51790114.5S59S59-K61 PolarHBondContact O-N 3.23Å
62S93.6Very high93.7Very high68 Ų6856.3 Ų56.348%0.47628%0.28SS..SBendtrans-130.9149.2-179.758.10000110.8I60 F154I60-S62 WeakPolarHBondContact CG2-O 3.37Å; S62-F154 VanDerWaalsContact O-CZ 3.25Å; S62-F154 WeakPolarHBondContact O-CZ 3.47Å
63Q94.3Very high93.8Very high141 Ų14148.7 Ų48.766%0.65925%0.252SS*.  trans-78.7146.8177.9-65.9-176.4-300111H69Q63-H69 VanDerWaalsContact CG-CD2 3.49Å; Q63-H69 WeakPolarHBondContact CG-CD2 3.45Å; Q63-H69 PolarHBondContact NE2-CD2 2.94Å; Q63-H69 VanDerWaalsContact NE2-CD2 3.33Å; Q63-H69 PolarHBondContact NE2-CE1 2.92Å; Q63-H69 VanDerWaalsContact NE2-CE1 3.31Å; Q63-H69 PolarHBondContact NE2-NE2 3.37Å
64H96.6Very high93.9Very high29 Ų2947.9 Ų47.913%0.13425%0.248CC..  trans-128.2135.3169.9-176.2-84000109N66 V67 S150 F154H64-N66 PolarHBondContact CE1-OD1 3.49Å; H64-N66 PolarHBondContact ND1-N 3.01Å; H64-N66 PolarHBondContact O-N 3.34Å; H64-N66 VanDerWaalsContact O-N 3.12Å; H64-V67 HydrophobicContact CB-CB 4.2Å; H64-V67 HydrophobicContact CB-CG2 4.14Å; H64-V67 PolarHBondContact O-N 2.83Å; H64-S150 PolarHBondContact CE1-OG 3.17Å; H64-S150 PolarHBondContact NE2-OG 3.27Å; H64-F154 HydrophobicContact CB-CB 4.42Å; H64-F154 HydrophobicContact CB-CD1 3.73Å; H64-F154 HydrophobicContact CB-CD2 3.85Å; H64-F154 HydrophobicContact CB-CE1 3.88Å; H64-F154 HydrophobicContact CB-CE2 4Å; H64-F154 HydrophobicContact CB-CG 3.71Å; H64-F154 HydrophobicContact CB-CZ 4.02Å; H64-F154 AromaticContact CD2-CD2 3.79Å; H64-F154 AromaticContact CD2-CG 3.73Å; H64-F154 AromaticContact CG-CG 3.77Å
65P95.8Very high93.9Very high85 Ų8547.9 Ų47.955%0.55225%0.248SC*.THydrogen-bonded Turntrans-57.8-32.2-174.921.4-34000113.4K187P65-K187 WeakPolarHBondContact O-CE 3.21Å; P65-K187 WeakPolarHBondContact O-CG 3.29Å; P65-K187 PolarHBondContact O-NZ 3.05Å
66N97.3Very high93.9Very high13 Ų1344.5 Ų44.57%0.0724%0.236CC..THydrogen-bonded Turntrans-102.717.2-177.5-49.9115.4000115.6H64 Q147 A151 L186 K187 V188H64-N66 PolarHBondContact CE1-OD1 3.49Å; H64-N66 PolarHBondContact ND1-N 3.01Å; H64-N66 PolarHBondContact O-N 3.34Å; H64-N66 VanDerWaalsContact O-N 3.12Å; N66-Q147 HydrophobicContact CB-CB 4.48Å; N66-Q147 PolarHBondContact ND2-OE1 3.33Å; N66-A151 HydrophobicContact CB-CB 3.82Å; N66-A151 VanDerWaalsContact O-CB 3.24Å; N66-A151 WeakPolarHBondContact O-CB 3.28Å; N66-L186 WeakPolarHBondContact CA-O 3.44Å; N66-L186 HydrophobicContact CB-CD1 4.09Å; N66-L186 WeakPolarHBondContact CB-O 3.3Å; N66-L186 PolarHBondContact ND2-O 2.97Å; N66-K187 WeakPolarHBondContact O-CA 3.33Å; N66-V188 PolarHBondContact O-N 3.48Å
67V97.4Very high93.8Very high5 Ų546.5 Ų46.53%0.0324%0.242CC..BIsolated β-bridgetrans-123.4141172.3179.50000108.1I60 H64 H69 A151 F154 L155 F191I60-V67 HydrophobicContact CD1-CG1 4.25Å; H64-V67 HydrophobicContact CB-CB 4.2Å; H64-V67 HydrophobicContact CB-CG2 4.14Å; H64-V67 PolarHBondContact O-N 2.83Å; V67-H69 PolarHBondContact O-N 3.31Å; V67-A151 HydrophobicContact CG2-CB 3.88Å; V67-F154 HydrophobicContact CG2-CD1 3.87Å; V67-F154 HydrophobicContact CG2-CE1 4.5Å; V67-L155 HydrophobicContact CG1-CD2 3.96Å; V67-L155 HydrophobicContact CG2-CD2 4.32Å; V67-L155 HydrophobicContact CG2-CG 4.23Å; V67-F191 HydrophobicContact CG1-CD1 4.38Å; V67-F191 HydrophobicContact CG1-CE1 3.43Å; V67-F191 VanDerWaalsContact CG1-CE1 3.43Å; V67-F191 HydrophobicContact CG1-CZ 3.76Å
68I96.1Very high93.4Very high7 Ų750.3 Ų50.34%0.03626%0.262CS..  trans-63.2131.9177.5-159.970.2000109.7L57 M119 D120 L171 K187 V188 A189 F191L57-I68 HydrophobicContact CD2-CG2 4.1Å; I68-M119 HydrophobicContact CG1-CB 4.08Å; I68-M119 HydrophobicContact CG1-SD 4.25Å; I68-D120 HydrophobicContact CD1-CB 3.89Å; I68-L171 HydrophobicContact CD1-CD1 4.18Å; I68-K187 HydrophobicContact CD1-CD 4.36Å; I68-V188 PolarHBondContact N-O 3.09Å; I68-A189 HydrophobicContact CB-CB 4.16Å; I68-A189 HydrophobicContact CG2-CB 4.03Å; I68-F191 HydrophobicContact CG2-CE1 4Å
69H95.4Very high92.8Very high44 Ų4450.9 Ų50.920%0.20428%0.275CS..  trans-95.3133.9178.6171.7-103.5000110.5Q63 V67 E71 M119 D120Q63-H69 VanDerWaalsContact CG-CD2 3.49Å; Q63-H69 WeakPolarHBondContact CG-CD2 3.45Å; Q63-H69 PolarHBondContact NE2-CD2 2.94Å; Q63-H69 VanDerWaalsContact NE2-CD2 3.33Å; Q63-H69 PolarHBondContact NE2-CE1 2.92Å; Q63-H69 VanDerWaalsContact NE2-CE1 3.31Å; Q63-H69 PolarHBondContact NE2-NE2 3.37Å; V67-H69 PolarHBondContact O-N 3.31Å; H69-E71 IonicContact CE1-OE2 2.62Å; H69-E71 PolarHBondContact CE1-OE2 3.24Å; H69-M119 WeakPolarHBondContact O-CA 3.48Å; H69-M119 WeakPolarHBondContact O-CB 3.49Å; H69-D120 WeakPolarHBondContact CB-OD2 3.22Å; H69-D120 IonicContact ND1-OD1 2.59Å; H69-D120 PolarHBondContact O-N 3.44Å
70L95.3Very high92.4Very high25 Ų2554.9 Ų54.913%0.13129%0.289CS..EExtended strand (participates in β ladder)trans-91.6112168.5177.572.6000109.3L57 E72 F117 M119L57-L70 HydrophobicContact CB-CB 3.92Å; L57-L70 HydrophobicContact CB-CD2 3.59Å; L57-L70 HydrophobicContact CB-CG 4.26Å; L57-L70 HydrophobicContact CD1-CB 4.42Å; L57-L70 HydrophobicContact CD1-CD1 4.24Å; L57-L70 HydrophobicContact CD1-CD2 4.45Å; L57-L70 HydrophobicContact CD2-CB 4.46Å; L70-E72 WeakPolarHBondContact CD1-O 3.37Å; L70-F117 HydrophobicContact CD1-CB 4.06Å; L70-F117 HydrophobicContact CD1-CD1 4.14Å; L70-M119 HydrophobicContact CD1-CG 4.23Å
71E93.3Very high92.2Very high93 Ų9355.2 Ų55.244%0.43529%0.293SS..EExtended strand (participates in β ladder)trans-73.9-48.2174.7175.166.5-17000111.1H69 V118H69-E71 IonicContact CE1-OE2 2.62Å; H69-E71 PolarHBondContact CE1-OE2 3.24Å; E71-V118 HydrophobicContact CB-CB 4.44Å; E71-V118 HydrophobicContact CB-CG1 4.22Å; E71-V118 PolarHBondContact N-O 3.34Å
72E93.7Very high92.2Very high18 Ų1848.7 Ų48.78%0.08427%0.265CS..EExtended strand (participates in β ladder)trans-161.7158.117362.3-176.291.600112.3K7 Y8 L70 I74 K83 V118K7-E72 IonicContact NZ-OE1 3.47Å; K7-E72 PolarHBondContact NZ-OE1 2.69Å; Y8-E72 VanDerWaalsContact OH-CD 3.25Å; Y8-E72 WeakPolarHBondContact OH-CG 3.29Å; Y8-E72 PolarHBondContact OH-OE1 3.46Å; L70-E72 WeakPolarHBondContact CD1-O 3.37Å; E72-I74 HydrophobicContact CG-CD1 4.25Å; E72-I74 HydrophobicContact CG-CG1 4.19Å; E72-I74 WeakPolarHBondContact OE2-CG1 3.46Å; E72-K83 HydrophobicContact CB-CD 4.18Å; E72-K83 HydrophobicContact CB-CG 4.48Å; E72-V118 HydrophobicContact CG-CB 4.01Å; E72-V118 HydrophobicContact CG-CG2 3.88Å; E72-V118 PolarHBondContact N-O 3.05Å; E72-V118 WeakPolarHBondContact O-CB 3.39Å; E72-V118 PolarHBondContact O-N 2.91Å
73C94.3Very high92Very high2 Ų251.3 Ų51.31%0.01427%0.268CS..EExtended strand (participates in β ladder)trans-110.2133.8166.9-174.10000109.4F54 M84 W116F54-C73 HydrophobicContact CD2-CB 3.56Å; F54-C73 HydrophobicContact CE2-CB 3.63Å; C73-M84 HydrophobicContact CB-CB 4.21Å; C73-M84 PolarHBondContact O-N 2.8Å; C73-W116 CarbonylContact C-O 3.58Å; C73-W116 VanDerWaalsContact CA-O 3.25Å; C73-W116 WeakPolarHBondContact CA-O 3.31Å
74I93.6Very high91.7Very high12 Ų1245 Ų456%0.06224%0.239CC..EExtended strand (participates in β ladder)trans-121128.7-179.1-59.2162.7000109.1Y8 E72 V81 Q82 W116 V118Y8-I74 HydrophobicContact CD2-CD1 4.03Å; Y8-I74 HydrophobicContact CE2-CD1 3.6Å; E72-I74 HydrophobicContact CG-CD1 4.25Å; E72-I74 HydrophobicContact CG-CG1 4.19Å; E72-I74 WeakPolarHBondContact OE2-CG1 3.46Å; I74-V81 HydrophobicContact CG2-CB 3.75Å; I74-V81 HydrophobicContact CG2-CG1 4.06Å; I74-Q82 WeakPolarHBondContact CA-O 3.42Å; I74-W116 HydrophobicContact CB-CB 4.14Å; I74-W116 PolarHBondContact N-O 2.95Å; I74-W116 PolarHBondContact O-N 3.4Å; I74-V118 HydrophobicContact CD1-CG2 4.14Å
75L92.4Very high90.9Very high1 Ų146.9 Ų46.91%0.00526%0.255CS..EExtended strand (participates in β ladder)trans-92.9121.6167.5-178.554000109.3V81 Q82 M84 L92 L96 Y113 L115L75-V81 WeakPolarHBondContact O-CA 3.44Å; L75-Q82 PolarHBondContact N-O 2.92Å; L75-Q82 PolarHBondContact O-N 2.79Å; L75-M84 HydrophobicContact CB-CG 3.9Å; L75-M84 HydrophobicContact CB-SD 4.04Å; L75-M84 HydrophobicContact CD2-SD 4.34Å; L75-L92 HydrophobicContact CD2-CB 3.51Å; L75-L92 HydrophobicContact CD2-CD1 4.41Å; L75-L96 HydrophobicContact CD1-CD1 3.89Å; L75-L96 HydrophobicContact CD2-CD1 3.81Å; L75-L96 HydrophobicContact CG-CD1 4.49Å; L75-Y113 HydrophobicContact CD1-CD1 4.48Å; L75-L115 HydrophobicContact CB-CD2 4.1Å; L75-L115 HydrophobicContact CD1-CD2 3.88Å; L75-L115 HydrophobicContact CD1-CG 4.22Å
76Q91.5Very high89.8Confident29 Ų2948.9 Ų48.914%0.13626%0.257CS..EExtended strand (participates in β ladder)trans-107.4130.2175.5-174-17213.700110M80 V81 Y113 Y114 W116Q76-M80 CarbonylContact C-O 3.57Å; Q76-M80 WeakPolarHBondContact CA-O 3.43Å; Q76-V81 HydrophobicContact CB-CG1 4.27Å; Q76-V81 HydrophobicContact CG-CG1 4.08Å; Q76-Y113 WeakPolarHBondContact O-CA 3.5Å; Q76-Y114 PolarHBondContact N-O 3.22Å; Q76-Y114 PolarHBondContact O-N 2.89Å; Q76-W116 VanDerWaalsContact OE1-CE2 3.26Å
77K90.1Very high88.4Confident60 Ų6050.9 Ų50.926%0.26128%0.281SS..EExtended strand (participates in β ladder)trans-129.2117.3169.8179-173.3177.4166.20109.1G79 M80 L92 S111 Y113K77-G79 PolarHBondContact O-N 2.84Å; K77-M80 PolarHBondContact N-O 3.31Å; K77-M80 WeakPolarHBondContact O-CA 3.35Å; K77-M80 WeakPolarHBondContact O-CB 3.44Å; K77-M80 PolarHBondContact O-N 3.02Å; K77-L92 HydrophobicContact CD-CD2 4.14Å; K77-S111 WeakPolarHBondContact CE-OG 3.44Å; K77-Y113 HydrophobicContact CB-CD1 4.15Å; K77-Y113 HydrophobicContact CB-CE1 3.96Å; K77-Y113 HydrophobicContact CD-CE1 3.71Å; K77-Y113 HydrophobicContact CD-CE2 4.44Å; K77-Y113 WeakPolarHBondContact CD-OH 3.42Å; K77-Y113 WeakPolarHBondContact CE-OH 3.44Å; K77-Y113 HydrophobicContact CG-CD1 4.26Å; K77-Y113 HydrophobicContact CG-CE1 3.76Å; K77-Y113 HydrophobicContact CG-CE2 4.31Å; K77-Y113 PolarHBondContact NZ-OH 2.85Å
78D85.1Confident87Confident94 Ų9451.6 Ų51.650%0.50329%0.286SS..THydrogen-bonded Turntrans48.839.8174.3-55-35.3000114.1M80 S111 A112D78-M80 VanDerWaalsContact C-N 3.3Å; D78-M80 PolarHBondContact O-N 2.86Å; D78-S111 VanDerWaalsContact OD1-CA 3.31Å; D78-S111 WeakPolarHBondContact OD1-CA 3.33Å; D78-S111 WeakPolarHBondContact OD2-CB 3.47Å; D78-S111 PolarHBondContact OD2-OG 3.13Å; D78-A112 PolarHBondContact N-O 3.08Å; D78-A112 PolarHBondContact OD1-N 2.89Å
79G79.3Confident85.8Confident54 Ų5458.7 Ų58.756%0.55732%0.324SS*.THydrogen-bonded Turntrans88-18.8-17800000115.1K77K77-G79 PolarHBondContact O-N 2.84Å
80M84.9Confident85.2Confident140 Ų14057.5 Ų57.569%0.6932%0.321SS*.EExtended strand (participates in β ladder)trans-74.4136.9170.3-59.8-170.1177.300110.1Q76 K77 D78Q76-M80 CarbonylContact C-O 3.57Å; Q76-M80 WeakPolarHBondContact CA-O 3.43Å; K77-M80 PolarHBondContact N-O 3.31Å; K77-M80 WeakPolarHBondContact O-CA 3.35Å; K77-M80 WeakPolarHBondContact O-CB 3.44Å; K77-M80 PolarHBondContact O-N 3.02Å; D78-M80 VanDerWaalsContact C-N 3.3Å; D78-M80 PolarHBondContact O-N 2.86Å
81V87.4Confident84.7Confident42 Ų4260.3 Ų60.326%0.25534%0.342SS..EExtended strand (participates in β ladder)trans-119.1138.2-179.6-670000111.1I74 L75 Q76I74-V81 HydrophobicContact CG2-CB 3.75Å; I74-V81 HydrophobicContact CG2-CG1 4.06Å; L75-V81 WeakPolarHBondContact O-CA 3.44Å; Q76-V81 HydrophobicContact CB-CG1 4.27Å; Q76-V81 HydrophobicContact CG-CG1 4.08Å
82Q88.3Confident84.3Confident61 Ų6157.4 Ų57.429%0.28533%0.33SS..EExtended strand (participates in β ladder)trans-136126.7175.9-171.4-168.4-5400109.6I74 L75 M84 S90I74-Q82 WeakPolarHBondContact CA-O 3.42Å; L75-Q82 PolarHBondContact N-O 2.92Å; L75-Q82 PolarHBondContact O-N 2.79Å; Q82-M84 PolarHBondContact O-N 2.97Å; Q82-S90 PolarHBondContact NE2-OG 3.42Å; Q82-S90 PolarHBondContact OE1-OG 2.78Å
83K90Very high84.1Confident122 Ų12257.5 Ų57.553%0.5333%0.329SS..EExtended strand (participates in β ladder)trans-64.8132170.4-177.2167.3-179.7161.40109.8E72E72-K83 HydrophobicContact CB-CD 4.18Å; E72-K83 HydrophobicContact CB-CG 4.48Å
84M88.2Confident83.9Confident9 Ų961.7 Ų61.74%0.04435%0.351CS..  trans-84.3143.1173.3-61-128.5-55.700110.3F54 C73 L75 Q82 Y93 L96 L115F54-M84 HydrophobicContact CB-CE 4.38Å; F54-M84 HydrophobicContact CD1-CE 3.59Å; F54-M84 HydrophobicContact CD2-CE 3.7Å; F54-M84 HydrophobicContact CE1-CE 3.69Å; F54-M84 HydrophobicContact CE2-CB 3.87Å; F54-M84 HydrophobicContact CE2-CE 3.8Å; F54-M84 HydrophobicContact CG-CE 3.6Å; F54-M84 HydrophobicContact CZ-CB 3.88Å; F54-M84 HydrophobicContact CZ-CE 3.79Å; C73-M84 HydrophobicContact CB-CB 4.21Å; C73-M84 PolarHBondContact O-N 2.8Å; L75-M84 HydrophobicContact CB-CG 3.9Å; L75-M84 HydrophobicContact CB-SD 4.04Å; L75-M84 HydrophobicContact CD2-SD 4.34Å; Q82-M84 PolarHBondContact O-N 2.97Å; M84-Y93 HydrophobicContact CE-CD2 4.13Å; M84-Y93 HydrophobicContact CE-CE2 4.4Å; M84-Y93 HydrophobicContact SD-CD2 3.94Å; M84-L96 HydrophobicContact SD-CD1 4.42Å; M84-L115 HydrophobicContact CE-CD2 3.63Å; M84-L115 HydrophobicContact CG-CD2 4.27Å; M84-L115 HydrophobicContact SD-CD2 3.66Å
85S80.4Confident83.8Confident68 Ų6863.7 Ų63.748%0.47636%0.36SS..  trans-129.6141.5164.853.20000109.2G87 S88S85-G87 PolarHBondContact O-N 2.84Å; S85-S88 VanDerWaalsContact O-CB 3.29Å; S85-S88 WeakPolarHBondContact O-CB 3.24Å; S85-S88 PolarHBondContact O-N 2.81Å; S85-S88 WeakPolarHBondContact OG-CB 3.3Å
86H71.9Confident83.8Confident127 Ų12763.7 Ų63.759%0.58836%0.36SS*.THydrogen-bonded Turntrans-61.1131.4175.3-167.974.2000109.3W55 S88W55-H86 AromaticContact CD1-CE1 3.64Å; W55-H86 AromaticContact CD1-ND1 3.54Å; W55-H86 AromaticContact NE1-CE1 3.97Å; W55-H86 AromaticContact NE1-ND1 3.98Å; H86-S88 VanDerWaalsContact C-N 3.31Å; H86-S88 PolarHBondContact O-N 2.83Å
87G67.4Low83.8Confident56 Ų5663.7 Ų63.758%0.57736%0.362SS*.THydrogen-bonded Turntrans73.515.8-174.400000115S85 N89S85-G87 PolarHBondContact O-N 2.84Å; G87-N89 PolarHBondContact O-N 3.46Å
88S68.4Low84Confident19 Ų1964.4 Ų64.413%0.13337%0.367CS..  trans-66.6134.1172.787.50000110.8S85 H86 S90 Y93S85-S88 VanDerWaalsContact O-CB 3.29Å; S85-S88 WeakPolarHBondContact O-CB 3.24Å; S85-S88 PolarHBondContact O-N 2.81Å; S85-S88 WeakPolarHBondContact OG-CB 3.3Å; H86-S88 VanDerWaalsContact C-N 3.31Å; H86-S88 PolarHBondContact O-N 2.83Å; S88-S90 PolarHBondContact O-N 2.89Å; S88-S90 VanDerWaalsContact O-N 3.09Å; S88-S90 WeakPolarHBondContact OG-CB 3.47Å; S88-S90 PolarHBondContact OG-N 2.71Å; S88-Y93 WeakPolarHBondContact O-CD1 3.41Å
89N71Confident84.5Confident156 Ų15660 Ų6083%0.83434%0.343SS*.  trans-79.627169.7-68.3-22.7000112.1G87 S91G87-N89 PolarHBondContact O-N 3.46Å; N89-S91 PolarHBondContact O-N 2.75Å
90S83.2Confident85.2Confident20 Ų2058.7 Ų58.714%0.1433%0.325CS..  trans-68.4127.7175.6175.30000109.3Q82 S88 L92 Y93 L94Q82-S90 PolarHBondContact NE2-OG 3.42Å; Q82-S90 PolarHBondContact OE1-OG 2.78Å; S88-S90 PolarHBondContact O-N 2.89Å; S88-S90 VanDerWaalsContact O-N 3.09Å; S88-S90 WeakPolarHBondContact OG-CB 3.47Å; S88-S90 PolarHBondContact OG-N 2.71Å; S90-L92 PolarHBondContact O-N 2.92Å; S90-L92 PolarHBondContact OG-N 3.06Å; S90-Y93 PolarHBondContact O-N 3.26Å; S90-Y93 VanDerWaalsContact O-N 3.08Å; S90-L94 PolarHBondContact O-N 3.5Å
91S84.7Confident85.6Confident83 Ų8358.8 Ų58.858%0.5833%0.328SS*.Hα-helixtrans-53-38.5175.553.70000112.1N89 L94 Q95N89-S91 PolarHBondContact O-N 2.75Å; S91-L94 PolarHBondContact O-N 3.04Å; S91-Q95 VanDerWaalsContact O-CG 3.3Å; S91-Q95 WeakPolarHBondContact O-CG 3.49Å; S91-Q95 PolarHBondContact O-N 3.12Å
92L85.6Confident85.9Confident32 Ų3263.1 Ų63.117%0.16834%0.343CS..Hα-helixtrans-67.6-39.1179.6-60.8176.4000112.6L75 K77 S90 Q95 L96 Y113L75-L92 HydrophobicContact CD2-CB 3.51Å; L75-L92 HydrophobicContact CD2-CD1 4.41Å; K77-L92 HydrophobicContact CD-CD2 4.14Å; S90-L92 PolarHBondContact O-N 2.92Å; S90-L92 PolarHBondContact OG-N 3.06Å; L92-Q95 PolarHBondContact O-N 3.24Å; L92-L96 PolarHBondContact O-N 3.41Å; L92-Y113 HydrophobicContact CD2-CE1 4.17Å
93Y88.6Confident86.2Confident21 Ų2162.4 Ų62.48%0.08235%0.352CS..Hα-helixtrans-65.8-44.3174.6172.3-103.3000111L51 F54 W55 M84 S88 S90 Q95 L96 V97L51-Y93 HydrophobicContact CD2-CE2 4Å; F54-Y93 HydrophobicContact CD1-CE2 4.27Å; F54-Y93 AromaticContact CE1-CE2 3.94Å; F54-Y93 HydrophobicContact CE1-CE2 3.94Å; W55-Y93 PolarHBondContact NE1-OH 3.18Å; M84-Y93 HydrophobicContact CE-CD2 4.13Å; M84-Y93 HydrophobicContact CE-CE2 4.4Å; M84-Y93 HydrophobicContact SD-CD2 3.94Å; S88-Y93 WeakPolarHBondContact O-CD1 3.41Å; S90-Y93 PolarHBondContact O-N 3.26Å; S90-Y93 VanDerWaalsContact O-N 3.08Å; Y93-Q95 VanDerWaalsContact C-N 3.29Å; Y93-Q95 PolarHBondContact O-N 2.85Å; Y93-L96 WeakPolarHBondContact O-CB 3.36Å; Y93-L96 PolarHBondContact O-N 3.17Å; Y93-L96 VanDerWaalsContact O-N 3.11Å; Y93-V97 HydrophobicContact CD1-CG2 4.31Å; Y93-V97 HydrophobicContact CE1-CG2 3.79Å; Y93-V97 HydrophobicContact CE2-CG2 4.07Å; Y93-V97 PolarHBondContact O-N 2.85Å
94L90.4Very high86.3Confident89 Ų8963.2 Ų63.247%0.46636%0.358SS..Hα-helixtrans-61.5-37.2177.7-67175.7000112.1S90 S91 L96 V97 E98S90-L94 PolarHBondContact O-N 3.5Å; S91-L94 PolarHBondContact O-N 3.04Å; L94-L96 VanDerWaalsContact C-N 3.34Å; L94-L96 PolarHBondContact O-N 3.4Å; L94-V97 PolarHBondContact O-N 3.48Å; L94-E98 VanDerWaalsContact O-CB 3.29Å; L94-E98 WeakPolarHBondContact O-CB 3.09Å; L94-E98 PolarHBondContact O-N 2.94Å
95Q91.6Very high86.6Confident54 Ų5465.4 Ų65.425%0.25237%0.369SS..Hα-helixtrans-63.5-36173.9-75177.3-46.400113S91 L92 Y93 T99 A106 F107S91-Q95 VanDerWaalsContact O-CG 3.3Å; S91-Q95 WeakPolarHBondContact O-CG 3.49Å; S91-Q95 PolarHBondContact O-N 3.12Å; L92-Q95 PolarHBondContact O-N 3.24Å; Y93-Q95 VanDerWaalsContact C-N 3.29Å; Y93-Q95 PolarHBondContact O-N 2.85Å; Q95-T99 WeakPolarHBondContact O-CB 3.44Å; Q95-T99 PolarHBondContact O-N 2.97Å; Q95-T99 PolarHBondContact O-OG1 2.96Å; Q95-A106 PolarHBondContact NE2-O 3.06Å; Q95-F107 HydrophobicContact CB-CB 4.5Å; Q95-F107 HydrophobicContact CB-CD1 4.4Å
96L91.9Very high87.1Confident1 Ų163.4 Ų63.41%0.00536%0.357CS..Hα-helixtrans-66.2-45.7173.6-67.6171000110.9C41 V47 L51 L75 M84 L92 Y93 L94 E98 T99 S100 F107 L115C41-L96 HydrophobicContact CB-CD2 4.19Å; V47-L96 HydrophobicContact CG1-CB 3.97Å; V47-L96 HydrophobicContact CG1-CD2 3.94Å; V47-L96 WeakPolarHBondContact CG1-O 3.26Å; V47-L96 HydrophobicContact CG2-CD2 4.12Å; L51-L96 HydrophobicContact CD1-CB 4.38Å; L51-L96 HydrophobicContact CD2-CB 4.33Å; L75-L96 HydrophobicContact CD1-CD1 3.89Å; L75-L96 HydrophobicContact CD2-CD1 3.81Å; L75-L96 HydrophobicContact CG-CD1 4.49Å; M84-L96 HydrophobicContact SD-CD1 4.42Å; L92-L96 PolarHBondContact O-N 3.41Å; Y93-L96 WeakPolarHBondContact O-CB 3.36Å; Y93-L96 PolarHBondContact O-N 3.17Å; Y93-L96 VanDerWaalsContact O-N 3.11Å; L94-L96 VanDerWaalsContact C-N 3.34Å; L94-L96 PolarHBondContact O-N 3.4Å; L96-E98 PolarHBondContact O-N 2.83Å; L96-T99 WeakPolarHBondContact O-CB 3.37Å; L96-T99 PolarHBondContact O-N 3.44Å; L96-S100 PolarHBondContact O-N 3.35Å; L96-F107 HydrophobicContact CD2-CE1 3.9Å; L96-L115 HydrophobicContact CD1-CD1 4.15Å; L96-L115 HydrophobicContact CD1-CD2 4.26Å; L96-L115 HydrophobicContact CD1-CG 4.38Å
97V92.3Very high87.9Confident30 Ų3058 Ų5818%0.18233%0.332CS..Hα-helixtrans-61.6-46.1177.4176.50000110.6L51 W55 Y93 L94 T99 S100 L101L51-V97 HydrophobicContact CD1-CG2 4.19Å; W55-V97 HydrophobicContact CZ2-CG2 4.34Å; Y93-V97 HydrophobicContact CD1-CG2 4.31Å; Y93-V97 HydrophobicContact CE1-CG2 3.79Å; Y93-V97 HydrophobicContact CE2-CG2 4.07Å; Y93-V97 PolarHBondContact O-N 2.85Å; L94-V97 PolarHBondContact O-N 3.48Å; V97-T99 VanDerWaalsContact C-N 3.29Å; V97-T99 PolarHBondContact O-N 3.42Å; V97-S100 PolarHBondContact O-N 2.94Å; V97-L101 HydrophobicContact CG1-CD1 3.96Å; V97-L101 HydrophobicContact CG1-CG 4.38Å; V97-L101 WeakPolarHBondContact O-CG 3.31Å; V97-L101 PolarHBondContact O-N 3.48Å
98E93.8Very high88.8Confident75 Ų7558.9 Ų58.935%0.3532%0.323SS..Hα-helixtrans-58.6-41.8175.7-177.1177.4-175.200111.7L94 L96 S100 L101 K102 A106L94-E98 VanDerWaalsContact O-CB 3.29Å; L94-E98 WeakPolarHBondContact O-CB 3.09Å; L94-E98 PolarHBondContact O-N 2.94Å; L96-E98 PolarHBondContact O-N 2.83Å; E98-S100 VanDerWaalsContact C-N 3.34Å; E98-S100 PolarHBondContact O-N 2.6Å; E98-L101 PolarHBondContact O-N 3.25Å; E98-K102 HydrophobicContact CG-CD 3.8Å; E98-K102 HydrophobicContact CG-CG 4.25Å; E98-K102 WeakPolarHBondContact O-CB 3.31Å; E98-K102 WeakPolarHBondContact O-CG 3.4Å; E98-K102 PolarHBondContact O-N 2.93Å; E98-K102 WeakPolarHBondContact OE1-CE 3.34Å; E98-K102 IonicContact OE1-NZ 3.16Å; E98-K102 PolarHBondContact OE1-NZ 3.16Å; E98-A106 HydrophobicContact CB-CB 4.01Å; E98-A106 HydrophobicContact CG-CB 3.76Å
99T94.4Very high89.4Confident0 Ų063.3 Ų63.30%035%0.351CS..Hα-helixtrans-59.6-45176.6-630000111.9P44 V47 Q95 L96 V97 G103 E104 I105 A106 F107P44-T99 HydrophobicContact CB-CG2 4.31Å; P44-T99 HydrophobicContact CG-CG2 4.49Å; V47-T99 HydrophobicContact CB-CG2 4.04Å; V47-T99 HydrophobicContact CG1-CG2 4.17Å; V47-T99 HydrophobicContact CG2-CG2 3.87Å; Q95-T99 WeakPolarHBondContact O-CB 3.44Å; Q95-T99 PolarHBondContact O-N 2.97Å; Q95-T99 PolarHBondContact O-OG1 2.96Å; L96-T99 WeakPolarHBondContact O-CB 3.37Å; L96-T99 PolarHBondContact O-N 3.44Å; V97-T99 VanDerWaalsContact C-N 3.29Å; V97-T99 PolarHBondContact O-N 3.42Å; T99-G103 PolarHBondContact O-N 3.32Å; T99-G103 VanDerWaalsContact O-N 3.07Å; T99-E104 VanDerWaalsContact CA-O 3.25Å; T99-E104 WeakPolarHBondContact CA-O 3.43Å; T99-E104 PolarHBondContact O-N 3.16Å; T99-I105 HydrophobicContact CG2-CD1 3.69Å; T99-A106 WeakPolarHBondContact OG1-CB 3.18Å; T99-A106 PolarHBondContact OG1-N 2.91Å; T99-F107 HydrophobicContact CG2-CE1 4.18Å; T99-F107 WeakPolarHBondContact OG1-CE1 3.43Å
100S94Very high90.1Very high28 Ų2866.8 Ų66.820%0.19635%0.353CS..Hα-helixtrans-66.6-37.2177.6176.40000112.4L96 V97 E98L96-S100 PolarHBondContact O-N 3.35Å; V97-S100 PolarHBondContact O-N 2.94Å; E98-S100 VanDerWaalsContact C-N 3.34Å; E98-S100 PolarHBondContact O-N 2.6Å
101L93.6Very high90.3Very high142 Ų14266.7 Ų66.774%0.74335%0.352SS*.Hα-helixtrans-75.9-38-179.2-68.8175.2000113.3V97 E98V97-L101 HydrophobicContact CG1-CD1 3.96Å; V97-L101 HydrophobicContact CG1-CG 4.38Å; V97-L101 WeakPolarHBondContact O-CG 3.31Å; V97-L101 PolarHBondContact O-N 3.48Å; E98-L101 PolarHBondContact O-N 3.25Å
102K94.4Very high90.5Very high132 Ų13264.1 Ų64.157%0.57434%0.336SS*.Hα-helixtrans-81.1-22.8-179.4-71.8-174.6172.7178.90113E98 E104E98-K102 HydrophobicContact CG-CD 3.8Å; E98-K102 HydrophobicContact CG-CG 4.25Å; E98-K102 WeakPolarHBondContact O-CB 3.31Å; E98-K102 WeakPolarHBondContact O-CG 3.4Å; E98-K102 PolarHBondContact O-N 2.93Å; E98-K102 WeakPolarHBondContact OE1-CE 3.34Å; E98-K102 IonicContact OE1-NZ 3.16Å; E98-K102 PolarHBondContact OE1-NZ 3.16Å; K102-E104 HydrophobicContact CB-CB 4.48Å; K102-E104 PolarHBondContact O-N 2.73Å
103G93.8Very high90.8Very high46 Ų4662.9 Ų62.947%0.47433%0.329SS..THydrogen-bonded Turntrans69.322.6-169.400000112.6P44 T99P44-G103 VanDerWaalsContact CG-O 3.24Å; P44-G103 WeakPolarHBondContact CG-O 3.46Å; T99-G103 PolarHBondContact O-N 3.32Å; T99-G103 VanDerWaalsContact O-N 3.07Å
104E93.6Very high91Very high139 Ų13964.4 Ų64.465%0.6534%0.335SS*.SBendtrans-144.2145-179.1-66.8-177.8-179.600109.7T99 K102 A106T99-E104 VanDerWaalsContact CA-O 3.25Å; T99-E104 WeakPolarHBondContact CA-O 3.43Å; T99-E104 PolarHBondContact O-N 3.16Å; K102-E104 HydrophobicContact CB-CB 4.48Å; K102-E104 PolarHBondContact O-N 2.73Å; E104-A106 PolarHBondContact O-N 3.45Å
105I92.8Very high91.1Very high55 Ų5560.2 Ų60.228%0.28231%0.313SS..  trans-65.5118.3-178.6-61.6-58.7000110.9P44 T99 F107P44-I105 HydrophobicContact CG-CD1 4.39Å; T99-I105 HydrophobicContact CG2-CD1 3.69Å; I105-F107 HydrophobicContact CD1-CE1 4.41Å; I105-F107 HydrophobicContact CD1-CE2 4.3Å; I105-F107 HydrophobicContact CD1-CZ 3.84Å; I105-F107 HydrophobicContact CG2-CD1 4.16Å; I105-F107 HydrophobicContact CG2-CD2 3.46Å; I105-F107 VanDerWaalsContact CG2-CD2 3.46Å; I105-F107 HydrophobicContact CG2-CE1 4.12Å; I105-F107 HydrophobicContact CG2-CE2 3.45Å; I105-F107 VanDerWaalsContact CG2-CE2 3.45Å; I105-F107 HydrophobicContact CG2-CG 3.85Å; I105-F107 HydrophobicContact CG2-CZ 3.8Å; I105-F107 WeakPolarHBondContact CG2-O 3.46Å
106A90.8Very high91.3Very high27 Ų2759 Ų5922%0.22331%0.307CS..  trans-96.314-179.200000114.1Q95 E98 T99 E104Q95-A106 PolarHBondContact NE2-O 3.06Å; E98-A106 HydrophobicContact CB-CB 4.01Å; E98-A106 HydrophobicContact CG-CB 3.76Å; T99-A106 WeakPolarHBondContact OG1-CB 3.18Å; T99-A106 PolarHBondContact OG1-N 2.91Å; E104-A106 PolarHBondContact O-N 3.45Å
107F88.9Confident91.5Very high14 Ų1459 Ų596%0.06131%0.306CS..SBendtrans-131171.5179.847.2-99.7000111.4C41 V47 Q95 L96 T99 I105 P109 Y113C41-F107 HydrophobicContact CB-CZ 4.19Å; C41-F107 WeakPolarHBondContact O-CE2 3.25Å; C41-F107 VanDerWaalsContact O-CZ 3.28Å; C41-F107 WeakPolarHBondContact O-CZ 3.48Å; V47-F107 HydrophobicContact CG2-CE1 4.31Å; V47-F107 HydrophobicContact CG2-CZ 4.25Å; Q95-F107 HydrophobicContact CB-CB 4.5Å; Q95-F107 HydrophobicContact CB-CD1 4.4Å; L96-F107 HydrophobicContact CD2-CE1 3.9Å; T99-F107 HydrophobicContact CG2-CE1 4.18Å; T99-F107 WeakPolarHBondContact OG1-CE1 3.43Å; I105-F107 HydrophobicContact CD1-CE1 4.41Å; I105-F107 HydrophobicContact CD1-CE2 4.3Å; I105-F107 HydrophobicContact CD1-CZ 3.84Å; I105-F107 HydrophobicContact CG2-CD1 4.16Å; I105-F107 HydrophobicContact CG2-CD2 3.46Å; I105-F107 VanDerWaalsContact CG2-CD2 3.46Å; I105-F107 HydrophobicContact CG2-CE1 4.12Å; I105-F107 HydrophobicContact CG2-CE2 3.45Å; I105-F107 VanDerWaalsContact CG2-CE2 3.45Å; I105-F107 HydrophobicContact CG2-CG 3.85Å; I105-F107 HydrophobicContact CG2-CZ 3.8Å; I105-F107 WeakPolarHBondContact CG2-O 3.46Å; F107-P109 VanDerWaalsContact O-CD 3.24Å; F107-P109 WeakPolarHBondContact O-CD 3.25Å; F107-P109 VanDerWaalsContact O-N 3.11Å; F107-Y113 HydrophobicContact CB-CE1 4.3Å; F107-Y113 HydrophobicContact CB-CE2 3.81Å; F107-Y113 WeakPolarHBondContact CB-OH 3.45Å; F107-Y113 AromaticContact CD2-CD2 3.26Å; F107-Y113 HydrophobicContact CD2-CD2 3.26Å; F107-Y113 HydrophobicContact CD2-CE1 4.47Å; F107-Y113 AromaticContact CD2-CE2 3.23Å; F107-Y113 HydrophobicContact CD2-CE2 3.23Å; F107-Y113 AromaticContact CD2-CG 3.95Å; F107-Y113 HydrophobicContact CD2-CG 3.95Å; F107-Y113 AromaticContact CD2-CZ 3.88Å; F107-Y113 AromaticContact CE2-CD2 3.5Å; F107-Y113 HydrophobicContact CE2-CD2 3.5Å; F107-Y113 VanDerWaalsContact CE2-CD2 3.5Å; F107-Y113 AromaticContact CE2-CE2 3.98Å; F107-Y113 HydrophobicContact CE2-CE2 3.98Å; F107-Y113 AromaticContact CE2-CG 3.93Å; F107-Y113 HydrophobicContact CE2-CG 3.93Å; F107-Y113 HydrophobicContact CG-CD2 4.05Å; F107-Y113 HydrophobicContact CG-CE1 4.33Å; F107-Y113 AromaticContact CG-CE2 3.74Å; F107-Y113 HydrophobicContact CG-CE2 3.74Å; F107-Y113 HydrophobicContact CG-CG 4.47Å; F107-Y113 AromaticContact CG-CZ 3.89Å; F107-Y113 HydrophobicContact CZ-CD2 4.44Å; F107-Y113 HydrophobicContact CZ-CG 4.48Å
108D87.8Confident91.7Very high74 Ų7457.6 Ų57.640%0.39630%0.298SS..  trans-60.7115.3-178.6-177-3.5000110.4R110 S111D108-R110 PolarHBondContact O-N 3.39Å; D108-R110 VanDerWaalsContact OD1-CB 3.32Å; D108-R110 WeakPolarHBondContact OD1-CB 3.38Å; D108-R110 PolarHBondContact OD1-N 3.05Å; D108-S111 WeakPolarHBondContact O-CB 3.48Å; D108-S111 PolarHBondContact O-N 2.78Å; D108-S111 VanDerWaalsContact O-N 3.14Å
109P80.6Confident91.8Very high111 Ų11154.9 Ų54.972%0.72129%0.285SS*.THydrogen-bonded Turntrans-69-14.1-178.629.3-35.9000112.9F107F107-P109 VanDerWaalsContact O-CD 3.24Å; F107-P109 WeakPolarHBondContact O-CD 3.25Å; F107-P109 VanDerWaalsContact O-N 3.11Å
110R85.6Confident91.8Very high230 Ų23057.2 Ų57.287%0.86830%0.298SS*.THydrogen-bonded Turntrans-80.5-25.6175.2-59.4178.4178.6176.60.7112.1D108D108-R110 PolarHBondContact O-N 3.39Å; D108-R110 VanDerWaalsContact OD1-CB 3.32Å; D108-R110 WeakPolarHBondContact OD1-CB 3.38Å; D108-R110 PolarHBondContact OD1-N 3.05Å
111S88Confident91.9Very high17 Ų1757.4 Ų57.412%0.11930%0.295CS..SBendtrans-77.3142.5176.9-76.40000111K77 D78 D108 Y113K77-S111 WeakPolarHBondContact CE-OG 3.44Å; D78-S111 VanDerWaalsContact OD1-CA 3.31Å; D78-S111 WeakPolarHBondContact OD1-CA 3.33Å; D78-S111 WeakPolarHBondContact OD2-CB 3.47Å; D78-S111 PolarHBondContact OD2-OG 3.13Å; D108-S111 WeakPolarHBondContact O-CB 3.48Å; D108-S111 PolarHBondContact O-N 2.78Å; D108-S111 VanDerWaalsContact O-N 3.14Å; S111-Y113 WeakPolarHBondContact O-CD2 3.39Å
112A87.8Confident92Very high30 Ų3051.3 Ų51.325%0.24826%0.264CS..  trans-93112.4176.200000110.4D78 Y114D78-A112 PolarHBondContact N-O 3.08Å; D78-A112 PolarHBondContact OD1-N 2.89Å; A112-Y114 HydrophobicContact CB-CE2 3.71Å
113Y91.5Very high91.9Very high5 Ų546.8 Ų46.82%0.0225%0.246CC..EExtended strand (participates in β ladder)trans-101.5131.3177.6-71-97.1000111.5C41 L75 Q76 K77 L92 F107 S111C41-Y113 PolarHBondContact N-O 2.86Å; L75-Y113 HydrophobicContact CD1-CD1 4.48Å; Q76-Y113 WeakPolarHBondContact O-CA 3.5Å; K77-Y113 HydrophobicContact CB-CD1 4.15Å; K77-Y113 HydrophobicContact CB-CE1 3.96Å; K77-Y113 HydrophobicContact CD-CE1 3.71Å; K77-Y113 HydrophobicContact CD-CE2 4.44Å; K77-Y113 WeakPolarHBondContact CD-OH 3.42Å; K77-Y113 WeakPolarHBondContact CE-OH 3.44Å; K77-Y113 HydrophobicContact CG-CD1 4.26Å; K77-Y113 HydrophobicContact CG-CE1 3.76Å; K77-Y113 HydrophobicContact CG-CE2 4.31Å; K77-Y113 PolarHBondContact NZ-OH 2.85Å; L92-Y113 HydrophobicContact CD2-CE1 4.17Å; F107-Y113 HydrophobicContact CB-CE1 4.3Å; F107-Y113 HydrophobicContact CB-CE2 3.81Å; F107-Y113 WeakPolarHBondContact CB-OH 3.45Å; F107-Y113 AromaticContact CD2-CD2 3.26Å; F107-Y113 HydrophobicContact CD2-CD2 3.26Å; F107-Y113 HydrophobicContact CD2-CE1 4.47Å; F107-Y113 AromaticContact CD2-CE2 3.23Å; F107-Y113 HydrophobicContact CD2-CE2 3.23Å; F107-Y113 AromaticContact CD2-CG 3.95Å; F107-Y113 HydrophobicContact CD2-CG 3.95Å; F107-Y113 AromaticContact CD2-CZ 3.88Å; F107-Y113 AromaticContact CE2-CD2 3.5Å; F107-Y113 HydrophobicContact CE2-CD2 3.5Å; F107-Y113 VanDerWaalsContact CE2-CD2 3.5Å; F107-Y113 AromaticContact CE2-CE2 3.98Å; F107-Y113 HydrophobicContact CE2-CE2 3.98Å; F107-Y113 AromaticContact CE2-CG 3.93Å; F107-Y113 HydrophobicContact CE2-CG 3.93Å; F107-Y113 HydrophobicContact CG-CD2 4.05Å; F107-Y113 HydrophobicContact CG-CE1 4.33Å; F107-Y113 AromaticContact CG-CE2 3.74Å; F107-Y113 HydrophobicContact CG-CE2 3.74Å; F107-Y113 HydrophobicContact CG-CG 4.47Å; F107-Y113 AromaticContact CG-CZ 3.89Å; F107-Y113 HydrophobicContact CZ-CD2 4.44Å; F107-Y113 HydrophobicContact CZ-CG 4.48Å; S111-Y113 WeakPolarHBondContact O-CD2 3.39Å
114Y92.8Very high91.8Very high54 Ų5445.2 Ų45.221%0.21223%0.23CC..EExtended strand (participates in β ladder)trans-134.4138.6174.7-58.1-91.1000111.7K38 I39 R40 Q76 A112K38-Y114 HydrophobicContact CD-CD1 4.16Å; K38-Y114 HydrophobicContact CG-CD1 3.91Å; K38-Y114 HydrophobicContact CG-CG 4.37Å; I39-Y114 CarbonylContact O-C 3.53Å; I39-Y114 WeakPolarHBondContact O-CA 3.4Å; R40-Y114 HydrophobicContact CB-CD1 3.86Å; R40-Y114 HydrophobicContact CB-CE1 3.67Å; R40-Y114 HydrophobicContact CG-CD1 4.08Å; R40-Y114 HydrophobicContact CG-CE1 3.62Å; Q76-Y114 PolarHBondContact N-O 3.22Å; Q76-Y114 PolarHBondContact O-N 2.89Å; A112-Y114 HydrophobicContact CB-CE2 3.71Å
115L94.4Very high91.8Very high0 Ų039.8 Ų39.80%021%0.211CC..EExtended strand (participates in β ladder)trans-99.7130.3163.8-78.5171.2000109.7K38 I39 A50 L75 M84 L96 F117K38-L115 WeakPolarHBondContact CA-O 3.37Å; I39-L115 PolarHBondContact N-O 2.84Å; I39-L115 PolarHBondContact O-N 3.49Å; A50-L115 HydrophobicContact CB-CB 4.43Å; A50-L115 HydrophobicContact CB-CD1 3.44Å; A50-L115 VanDerWaalsContact CB-CD1 3.44Å; L75-L115 HydrophobicContact CB-CD2 4.1Å; L75-L115 HydrophobicContact CD1-CD2 3.88Å; L75-L115 HydrophobicContact CD1-CG 4.22Å; M84-L115 HydrophobicContact CE-CD2 3.63Å; M84-L115 HydrophobicContact CG-CD2 4.27Å; M84-L115 HydrophobicContact SD-CD2 3.66Å; L96-L115 HydrophobicContact CD1-CD1 4.15Å; L96-L115 HydrophobicContact CD1-CD2 4.26Å; L96-L115 HydrophobicContact CD1-CG 4.38Å; L115-F117 HydrophobicContact CB-CE2 4.03Å; L115-F117 HydrophobicContact CB-CZ 4.34Å
116W95.4Very high91.9Very high30 Ų3039.2 Ų39.211%0.11421%0.209CC..EExtended strand (participates in β ladder)trans-113.9124178.3-61.332.5000108L10 V36 K37 K38 C73 I74 Q76L10-W116 HydrophobicContact CD1-CH2 4.38Å; L10-W116 HydrophobicContact CD2-CZ3 4.33Å; V36-W116 HydrophobicContact CG1-CB 4.15Å; V36-W116 HydrophobicContact CG1-CD2 4.14Å; V36-W116 HydrophobicContact CG1-CE3 3.74Å; V36-W116 HydrophobicContact CG1-CG 4.36Å; V36-W116 HydrophobicContact CG1-CZ3 4.49Å; K37-W116 CarbonylContact O-C 3.56Å; K37-W116 WeakPolarHBondContact O-CA 3.32Å; K38-W116 HydrophobicContact CD-CZ2 4.39Å; C73-W116 CarbonylContact C-O 3.58Å; C73-W116 VanDerWaalsContact CA-O 3.25Å; C73-W116 WeakPolarHBondContact CA-O 3.31Å; I74-W116 HydrophobicContact CB-CB 4.14Å; I74-W116 PolarHBondContact N-O 2.95Å; I74-W116 PolarHBondContact O-N 3.4Å; Q76-W116 VanDerWaalsContact OE1-CE2 3.26Å
117F95.6Very high92Very high0 Ų038.9 Ų38.90%020%0.203CC..EExtended strand (participates in β ladder)trans-103.4110.8171.7-57.2-92.5000108V36 K37 I39 A50 E53 F54 L57 L70 L115 M119V36-F117 WeakPolarHBondContact CA-O 3.43Å; K37-F117 HydrophobicContact CB-CB 4.25Å; K37-F117 HydrophobicContact CB-CD2 4.46Å; K37-F117 PolarHBondContact N-O 3.49Å; K37-F117 PolarHBondContact O-N 2.82Å; I39-F117 HydrophobicContact CD1-CD2 4.41Å; I39-F117 HydrophobicContact CD1-CE2 3.75Å; I39-F117 HydrophobicContact CG1-CE2 4.23Å; A50-F117 HydrophobicContact CB-CZ 4.42Å; A50-F117 WeakPolarHBondContact O-CZ 3.21Å; E53-F117 HydrophobicContact CB-CE1 4.33Å; E53-F117 HydrophobicContact CB-CZ 4.24Å; E53-F117 HydrophobicContact CG-CD1 4.36Å; E53-F117 HydrophobicContact CG-CE1 4.1Å; E53-F117 HydrophobicContact CG-CZ 4.29Å; F54-F117 HydrophobicContact CB-CE1 3.82Å; F54-F117 HydrophobicContact CB-CZ 4.27Å; L57-F117 HydrophobicContact CD1-CD1 3.98Å; L70-F117 HydrophobicContact CD1-CB 4.06Å; L70-F117 HydrophobicContact CD1-CD1 4.14Å; L115-F117 HydrophobicContact CB-CE2 4.03Å; L115-F117 HydrophobicContact CB-CZ 4.34Å; F117-M119 HydrophobicContact CB-CE 4.36Å; F117-M119 HydrophobicContact CB-CG 4.39Å; F117-M119 HydrophobicContact CB-SD 4.35Å
118V96.3Very high92.3Very high0 Ų041.4 Ų41.40%022%0.217CC..EExtended strand (participates in β ladder)trans-91.4117.3177.3-173.90000108.1Y8 V34 A35 V36 E71 E72 I74Y8-V118 HydrophobicContact CD1-CG1 4.32Å; Y8-V118 HydrophobicContact CD2-CG2 4.38Å; Y8-V118 HydrophobicContact CE1-CG1 3.52Å; Y8-V118 HydrophobicContact CE1-CG2 4.27Å; Y8-V118 HydrophobicContact CE2-CG2 3.85Å; V34-V118 HydrophobicContact CB-CG1 4.04Å; V34-V118 HydrophobicContact CG1-CG1 4.28Å; V34-V118 HydrophobicContact CG2-CG1 4.03Å; A35-V118 WeakPolarHBondContact O-CA 3.39Å; V36-V118 HydrophobicContact CG2-CG2 4.44Å; E71-V118 HydrophobicContact CB-CB 4.44Å; E71-V118 HydrophobicContact CB-CG1 4.22Å; E71-V118 PolarHBondContact N-O 3.34Å; E72-V118 HydrophobicContact CG-CB 4.01Å; E72-V118 HydrophobicContact CG-CG2 3.88Å; E72-V118 PolarHBondContact N-O 3.05Å; E72-V118 WeakPolarHBondContact O-CB 3.39Å; E72-V118 PolarHBondContact O-N 2.91Å; I74-V118 HydrophobicContact CD1-CG2 4.14Å
119M96.1Very high92.5Very high18 Ų1843.7 Ų43.79%0.08923%0.226CC..EExtended strand (participates in β ladder)trans-132.4168.5-171-61177.1-66.500111.6V34 A35 K37 L57 I68 H69 L70 F117 F121V34-M119 WeakPolarHBondContact CB-O 3.21Å; A35-M119 HydrophobicContact CB-CB 4.48Å; A35-M119 PolarHBondContact N-O 3.41Å; A35-M119 PolarHBondContact O-N 2.81Å; K37-M119 HydrophobicContact CB-CE 3.76Å; K37-M119 HydrophobicContact CD-CE 4.38Å; L57-M119 HydrophobicContact CD1-SD 4.36Å; I68-M119 HydrophobicContact CG1-CB 4.08Å; I68-M119 HydrophobicContact CG1-SD 4.25Å; H69-M119 WeakPolarHBondContact O-CA 3.48Å; H69-M119 WeakPolarHBondContact O-CB 3.49Å; L70-M119 HydrophobicContact CD1-CG 4.23Å; F117-M119 HydrophobicContact CB-CE 4.36Å; F117-M119 HydrophobicContact CB-CG 4.39Å; F117-M119 HydrophobicContact CB-SD 4.35Å; M119-F121 PolarHBondContact O-N 3.13Å
120D94.9Very high93.1Very high50 Ų5039.6 Ų39.627%0.26720%0.196SC..EExtended strand (participates in β ladder)trans-53.3138169.1-67.1-14.1000110.9I68 H69 K187I68-D120 HydrophobicContact CD1-CB 3.89Å; H69-D120 WeakPolarHBondContact CB-OD2 3.22Å; H69-D120 IonicContact ND1-OD1 2.59Å; H69-D120 PolarHBondContact O-N 3.44Å; D120-K187 IonicContact OD2-NZ 3.15Å; D120-K187 PolarHBondContact OD2-NZ 3.08Å
121F95.7Very high93.3Very high31 Ų3132.3 Ų32.314%0.13617%0.174CC..PPolyproline II helixtrans-89.7120.1171.9-173.3-95.2000110.7V14 E24 R33 A35 M119 D123V14-F121 HydrophobicContact CG1-CE2 4.21Å; E24-F121 HydrophobicContact CB-CD2 4.29Å; E24-F121 HydrophobicContact CB-CE2 3.66Å; E24-F121 HydrophobicContact CB-CZ 4.27Å; E24-F121 HydrophobicContact CG-CD2 4.12Å; E24-F121 HydrophobicContact CG-CE2 3.7Å; E24-F121 HydrophobicContact CG-CZ 4.04Å; R33-F121 HydrophobicContact CB-CB 4.19Å; R33-F121 HydrophobicContact CB-CD1 4.36Å; R33-F121 HydrophobicContact CB-CG 4.32Å; A35-F121 HydrophobicContact CB-CD2 4.22Å; M119-F121 PolarHBondContact O-N 3.13Å; F121-D123 HydrophobicContact CD1-CB 4.08Å; F121-D123 HydrophobicContact CE1-CB 3.65Å
122C95Very high93.5Very high15 Ų1538 Ų3810%0.10120%0.202CC..PPolyproline II helixtrans-97.4117.3173.3-63.70000109.3L171 I172C122-L171 HydrophobicContact CB-CB 3.69Å; C122-L171 HydrophobicContact CB-CD1 4.33Å; C122-I172 CarbonylContact C-O 3.55Å; C122-I172 WeakPolarHBondContact CB-O 3.32Å
123D92.8Very high93.6Very high36 Ų3640.8 Ų40.819%0.19322%0.22CC..THydrogen-bonded Turntrans-93.7-0.6-170.170.9-29000115.2F121 I172 Q174 R176F121-D123 HydrophobicContact CD1-CB 4.08Å; F121-D123 HydrophobicContact CE1-CB 3.65Å; D123-I172 PolarHBondContact N-O 3.26Å; D123-Q174 PolarHBondContact OD1-N 2.88Å; D123-R176 IonicContact OD2-CZ 2.76Å; D123-R176 VanDerWaalsContact OD2-CZ 3.28Å; D123-R176 IonicContact OD2-NE 3.06Å; D123-R176 PolarHBondContact OD2-NE 2.98Å; D123-R176 IonicContact OD2-NH2 3.28Å; D123-R176 PolarHBondContact OD2-NH2 3.27Å
124G92.1Very high93.4Very high13 Ų1344 Ų4413%0.13423%0.232CC..THydrogen-bonded Turntrans-101.211.4-179.900000115.4I172G124-I172 WeakPolarHBondContact CA-O 3.37Å; G124-I172 PolarHBondContact N-O 3.02Å
125G92.9Very high93.2Very high25 Ų2550.3 Ų50.326%0.25826%0.26SS..  trans75-164-177.100000113.1I172G125-I172 PolarHBondContact O-N 3.46Å
126D94.6Very high92.9Very high44 Ų4455.7 Ų55.724%0.23530%0.295CS..BIsolated β-bridgetrans-89.5167.6171.565.857.2000111.9N128 E129 Y130 I170 L171D126-N128 VanDerWaalsContact C-N 3.27Å; D126-N128 PolarHBondContact O-N 3.46Å; D126-N128 WeakPolarHBondContact OD1-CA 3.35Å; D126-N128 WeakPolarHBondContact OD1-CB 3.37Å; D126-N128 PolarHBondContact OD1-N 3.43Å; D126-E129 PolarHBondContact OD1-N 3.07Å; D126-Y130 VanDerWaalsContact O-CB 3.26Å; D126-Y130 WeakPolarHBondContact O-CB 3.33Å; D126-Y130 PolarHBondContact O-N 3.19Å; D126-I170 CarbonylContact C-O 3.56Å; D126-I170 WeakPolarHBondContact CA-O 3.25Å; D126-L171 HydrophobicContact CB-CD2 4.22Å
127M94.5Very high92.6Very high20 Ų2057.6 Ų57.610%0.09931%0.308CS..Hα-helixtrans-67.4-28.4-178177.2172.2-80.400111.9Y130 L131 F144 P167 I170 I172 L186M127-Y130 PolarHBondContact O-N 3.3Å; M127-L131 HydrophobicContact CG-CD1 3.66Å; M127-L131 HydrophobicContact CG-CG 3.92Å; M127-L131 VanDerWaalsContact O-CB 3.29Å; M127-L131 WeakPolarHBondContact O-CB 3.38Å; M127-L131 WeakPolarHBondContact O-CG 3.28Å; M127-L131 PolarHBondContact O-N 3.44Å; M127-L131 HydrophobicContact SD-CD1 4.34Å; M127-F144 HydrophobicContact CE-CB 4.22Å; M127-F144 HydrophobicContact CE-CD2 3.56Å; M127-F144 HydrophobicContact CE-CE2 3.98Å; M127-F144 HydrophobicContact CE-CG 3.97Å; M127-P167 HydrophobicContact CB-CB 4.31Å; M127-P167 WeakPolarHBondContact CB-O 3.44Å; M127-P167 HydrophobicContact CG-CB 4.37Å; M127-P167 PolarHBondContact N-O 3.49Å; M127-I170 HydrophobicContact CB-CB 3.85Å; M127-I170 HydrophobicContact CB-CG2 4.06Å; M127-I170 WeakPolarHBondContact CB-O 3.47Å; M127-I170 HydrophobicContact CE-CB 4.44Å; M127-I170 HydrophobicContact CE-CD1 4.37Å; M127-I170 HydrophobicContact CE-CG2 3.66Å; M127-I170 PolarHBondContact N-O 3.12Å; M127-I170 HydrophobicContact SD-CB 4.31Å; M127-I170 HydrophobicContact SD-CD1 3.82Å; M127-I170 HydrophobicContact SD-CG2 4.16Å; M127-I172 HydrophobicContact CB-CD1 4.36Å; M127-I172 HydrophobicContact CE-CD1 4.3Å; M127-L186 HydrophobicContact CE-CD2 3.97Å
128N93.9Very high92.5Very high67 Ų6767.9 Ų67.936%0.35835%0.347SS..Hα-helixtrans-64.6-53.7177.2-175.552.2000110.4D126 Y130 L131 L132 P167D126-N128 VanDerWaalsContact C-N 3.27Å; D126-N128 PolarHBondContact O-N 3.46Å; D126-N128 WeakPolarHBondContact OD1-CA 3.35Å; D126-N128 WeakPolarHBondContact OD1-CB 3.37Å; D126-N128 PolarHBondContact OD1-N 3.43Å; N128-Y130 VanDerWaalsContact C-N 3.31Å; N128-Y130 PolarHBondContact O-N 3.49Å; N128-L131 PolarHBondContact O-N 3.29Å; N128-L132 VanDerWaalsContact O-CG 3.29Å; N128-L132 WeakPolarHBondContact O-CG 3.49Å; N128-L132 PolarHBondContact O-N 3.38Å; N128-P167 HydrophobicContact CB-CB 3.9Å
129E92.8Very high92.2Very high121 Ų12173.7 Ų73.757%0.56537%0.372SS*.Hα-helixtrans-58.9-44.4174.7-173.6-179.7-171.200111D126 L131 L132 S133D126-E129 PolarHBondContact OD1-N 3.07Å; E129-L131 PolarHBondContact O-N 3.39Å; E129-L132 PolarHBondContact O-N 2.9Å; E129-S133 WeakPolarHBondContact O-CB 3.24Å; E129-S133 PolarHBondContact O-N 3.26Å; E129-S133 PolarHBondContact O-OG 2.82Å
130Y91.9Very high91.9Very high26 Ų2673 Ų7310%0.10237%0.369CS..Hα-helixtrans-58.7-45.4179.3-169.6-95.8000112.4D126 M127 N128 S133 R134 F144 I172 P184D126-Y130 VanDerWaalsContact O-CB 3.26Å; D126-Y130 WeakPolarHBondContact O-CB 3.33Å; D126-Y130 PolarHBondContact O-N 3.19Å; M127-Y130 PolarHBondContact O-N 3.3Å; N128-Y130 VanDerWaalsContact C-N 3.31Å; N128-Y130 PolarHBondContact O-N 3.49Å; Y130-S133 PolarHBondContact O-OG 3.47Å; Y130-R134 VanDerWaalsContact CE1-CZ 3.41Å; Y130-R134 VanDerWaalsContact CE1-NE 3.27Å; Y130-R134 WeakPolarHBondContact O-CG 3.45Å; Y130-R134 PolarHBondContact OH-NH1 3.23Å; Y130-F144 AromaticContact CD1-CE2 3.82Å; Y130-F144 HydrophobicContact CD1-CE2 3.82Å; Y130-F144 HydrophobicContact CD1-CZ 4.08Å; Y130-F144 AromaticContact CE1-CE2 3.68Å; Y130-F144 HydrophobicContact CE1-CE2 3.68Å; Y130-F144 AromaticContact CE1-CZ 3.68Å; Y130-F144 HydrophobicContact CE1-CZ 3.68Å; Y130-I172 HydrophobicContact CD2-CB 4.33Å; Y130-I172 HydrophobicContact CD2-CG1 4.13Å; Y130-I172 HydrophobicContact CD2-CG2 3.91Å; Y130-I172 HydrophobicContact CE2-CG2 3.99Å; Y130-I172 HydrophobicContact CG-CG1 3.95Å; Y130-I172 HydrophobicContact CG-CG2 4.48Å; Y130-P184 WeakPolarHBondContact OH-CG 3.32Å
131L90.9Very high91.8Very high76 Ų7673.5 Ų73.540%0.39837%0.371SS..Hα-helixtrans-69.1-37.2179.3-71.4172.7000112.2M127 N128 E129M127-L131 HydrophobicContact CG-CD1 3.66Å; M127-L131 HydrophobicContact CG-CG 3.92Å; M127-L131 VanDerWaalsContact O-CB 3.29Å; M127-L131 WeakPolarHBondContact O-CB 3.38Å; M127-L131 WeakPolarHBondContact O-CG 3.28Å; M127-L131 PolarHBondContact O-N 3.44Å; M127-L131 HydrophobicContact SD-CD1 4.34Å; N128-L131 PolarHBondContact O-N 3.29Å; E129-L131 PolarHBondContact O-N 3.39Å
132L92.1Very high91.8Very high136 Ų13675.8 Ų75.871%0.71239%0.388SS*.Hα-helixtrans-72.8-28.6178.9-68.4173.2000112.8N128 E129 R134N128-L132 VanDerWaalsContact O-CG 3.29Å; N128-L132 WeakPolarHBondContact O-CG 3.49Å; N128-L132 PolarHBondContact O-N 3.38Å; E129-L132 PolarHBondContact O-N 2.9Å; L132-R134 VanDerWaalsContact C-N 3.29Å; L132-R134 PolarHBondContact O-N 3.38Å
133S90.7Very high91.7Very high89 Ų8976.3 Ų76.362%0.62239%0.392SS*.THydrogen-bonded Turntrans-74.1-12.9-178.3730000114.7E129 Y130E129-S133 WeakPolarHBondContact O-CB 3.24Å; E129-S133 PolarHBondContact O-N 3.26Å; E129-S133 PolarHBondContact O-OG 2.82Å; Y130-S133 PolarHBondContact O-OG 3.47Å
134R86.6Confident91.8Very high73 Ų7375.1 Ų75.128%0.27539%0.385SS..SBendtrans-147.1162.6-170.373.9-173.5-141.214711.7113.3Y130 L132 T140Y130-R134 VanDerWaalsContact CE1-CZ 3.41Å; Y130-R134 VanDerWaalsContact CE1-NE 3.27Å; Y130-R134 WeakPolarHBondContact O-CG 3.45Å; Y130-R134 PolarHBondContact OH-NH1 3.23Å; L132-R134 VanDerWaalsContact C-N 3.29Å; L132-R134 PolarHBondContact O-N 3.38Å; R134-T140 PolarHBondContact NH2-OG1 3.45Å
135K89.1Confident92Very high186 Ų18680 Ų8081%0.80941%0.406SS*.  trans-72.7145.5171.6-67.4-172.3179.7179.80111N137K135-N137 PolarHBondContact O-N 2.87Å
136P87.9Confident92.2Very high113 Ų11384.6 Ų84.673%0.73442%0.424SS*.  trans-54.1134.3173.5-26.734.7000112
137N89.3Confident92.4Very high70 Ų7083.7 Ų83.737%0.37442%0.418SS..  trans-122.3120.1176.3178.9-48.1000108.3K135 K139 T140 N141K135-N137 PolarHBondContact O-N 2.87Å; N137-K139 VanDerWaalsContact C-N 3.31Å; N137-K139 PolarHBondContact O-N 3.25Å; N137-K139 WeakPolarHBondContact OD1-CA 3.16Å; N137-K139 VanDerWaalsContact OD1-CB 3.3Å; N137-K139 WeakPolarHBondContact OD1-CB 3.39Å; N137-K139 PolarHBondContact OD1-N 2.97Å; N137-T140 PolarHBondContact O-N 3.4Å; N137-T140 PolarHBondContact OD1-N 3.31Å; N137-N141 WeakPolarHBondContact O-CB 3.46Å; N137-N141 PolarHBondContact O-N 3.07Å; N137-N141 PolarHBondContact O-OD1 2.59Å; N137-N141 VanDerWaalsContact O-OD1 3.12Å
138R91.8Very high92.5Very high217 Ų21783.9 Ų83.982%0.81942%0.419SS*.Hα-helixtrans-57.6-41.8-176.6-174.8177.3173.7-175.7-1.6112.7N141 T142R138-N141 PolarHBondContact O-N 2.86Å; R138-T142 PolarHBondContact O-N 3.37Å; R138-T142 PolarHBondContact O-OG1 2.9Å; R138-T142 VanDerWaalsContact O-OG1 3.11Å
139K90.8Very high92.7Very high122 Ų12283.9 Ų83.953%0.5342%0.424SS..Hα-helixtrans-62.9-50.3179.6-176.1-172.4171.9-140.80110.6N137 N141 T142 S143 E183N137-K139 VanDerWaalsContact C-N 3.31Å; N137-K139 PolarHBondContact O-N 3.25Å; N137-K139 WeakPolarHBondContact OD1-CA 3.16Å; N137-K139 VanDerWaalsContact OD1-CB 3.3Å; N137-K139 WeakPolarHBondContact OD1-CB 3.39Å; N137-K139 PolarHBondContact OD1-N 2.97Å; K139-N141 PolarHBondContact O-N 2.88Å; K139-T142 PolarHBondContact O-N 2.97Å; K139-S143 PolarHBondContact O-N 2.99Å; K139-E183 WeakPolarHBondContact CD-OE1 3.48Å; K139-E183 VanDerWaalsContact CE-OE1 3.23Å; K139-E183 WeakPolarHBondContact CE-OE1 3.38Å; K139-E183 IonicContact NZ-OE1 2.73Å; K139-E183 PolarHBondContact NZ-OE1 3.28Å
140T90.6Very high93Very high3 Ų380.6 Ų80.62%0.01842%0.415CS..Hα-helixtrans-65.4-39.7178-490000112R134 N137 T142 S143 F144 E183 P184R134-T140 PolarHBondContact NH2-OG1 3.45Å; N137-T140 PolarHBondContact O-N 3.4Å; N137-T140 PolarHBondContact OD1-N 3.31Å; T140-T142 VanDerWaalsContact C-N 3.33Å; T140-T142 PolarHBondContact O-N 2.94Å; T140-S143 WeakPolarHBondContact O-CB 3.4Å; T140-S143 PolarHBondContact O-N 2.87Å; T140-S143 VanDerWaalsContact O-N 3.17Å; T140-F144 HydrophobicContact CG2-CD1 4.13Å; T140-F144 HydrophobicContact CG2-CD2 4Å; T140-F144 HydrophobicContact CG2-CE1 3.88Å; T140-F144 HydrophobicContact CG2-CE2 3.73Å; T140-F144 HydrophobicContact CG2-CG 4.22Å; T140-F144 HydrophobicContact CG2-CZ 3.67Å; T140-F144 WeakPolarHBondContact O-CB 3.45Å; T140-F144 WeakPolarHBondContact O-CG 3.07Å; T140-F144 PolarHBondContact O-N 2.94Å; T140-E183 VanDerWaalsContact CA-OE2 3.24Å; T140-E183 WeakPolarHBondContact CA-OE2 3.47Å; T140-E183 VanDerWaalsContact CB-OE2 3.26Å; T140-E183 WeakPolarHBondContact CB-OE2 3.45Å; T140-E183 WeakPolarHBondContact CG2-OE2 3.36Å; T140-E183 PolarHBondContact OG1-OE2 3.27Å; T140-P184 HydrophobicContact CG2-CG 4.02Å
141N92.1Very high93.3Very high61 Ų6179.4 Ų79.433%0.32641%0.41SS..Hα-helixtrans-60.8-44.7177.8-68.53000110.8N137 R138 K139 F144 M145N137-N141 WeakPolarHBondContact O-CB 3.46Å; N137-N141 PolarHBondContact O-N 3.07Å; N137-N141 PolarHBondContact O-OD1 2.59Å; N137-N141 VanDerWaalsContact O-OD1 3.12Å; R138-N141 PolarHBondContact O-N 2.86Å; K139-N141 PolarHBondContact O-N 2.88Å; N141-F144 PolarHBondContact O-N 2.81Å; N141-M145 WeakPolarHBondContact O-CG 3.3Å; N141-M145 PolarHBondContact O-N 2.91Å
142T94.9Very high93.7Very high78 Ų7877.6 Ų77.648%0.47940%0.401SS..Hα-helixtrans-62.2-43.9173.9-61.70000111.6R138 K139 T140 F144 M145 L146R138-T142 PolarHBondContact O-N 3.37Å; R138-T142 PolarHBondContact O-OG1 2.9Å; R138-T142 VanDerWaalsContact O-OG1 3.11Å; K139-T142 PolarHBondContact O-N 2.97Å; T140-T142 VanDerWaalsContact C-N 3.33Å; T140-T142 PolarHBondContact O-N 2.94Å; T142-F144 PolarHBondContact O-N 2.92Å; T142-M145 PolarHBondContact O-N 2.82Å; T142-L146 HydrophobicContact CG2-CD1 4.36Å; T142-L146 WeakPolarHBondContact O-CG 3.08Å; T142-L146 PolarHBondContact O-N 3.14Å; T142-L146 VanDerWaalsContact O-N 3.09Å
143S94Very high94Very high27 Ų2773.9 Ų73.919%0.18939%0.39CS..Hα-helixtrans-57.9-47.6175.6-177.40000111.9K139 T140 M145 L146 Q147K139-S143 PolarHBondContact O-N 2.99Å; T140-S143 WeakPolarHBondContact O-CB 3.4Å; T140-S143 PolarHBondContact O-N 2.87Å; T140-S143 VanDerWaalsContact O-N 3.17Å; S143-M145 PolarHBondContact O-N 2.79Å; S143-L146 PolarHBondContact O-N 2.87Å; S143-Q147 VanDerWaalsContact O-CG 3.32Å; S143-Q147 WeakPolarHBondContact O-CG 3.37Å; S143-Q147 PolarHBondContact O-N 2.96Å; S143-Q147 PolarHBondContact OG-NE2 3.21Å
144F95Very high94.3Very high10 Ų1070.9 Ų70.94%0.04437%0.366CS..Hα-helixtrans-62.7-42.2177.6-74.4-9.7000112.6M127 Y130 T140 N141 T142 L146 Q147 L148 I172 P184 L186M127-F144 HydrophobicContact CE-CB 4.22Å; M127-F144 HydrophobicContact CE-CD2 3.56Å; M127-F144 HydrophobicContact CE-CE2 3.98Å; M127-F144 HydrophobicContact CE-CG 3.97Å; Y130-F144 AromaticContact CD1-CE2 3.82Å; Y130-F144 HydrophobicContact CD1-CE2 3.82Å; Y130-F144 HydrophobicContact CD1-CZ 4.08Å; Y130-F144 AromaticContact CE1-CE2 3.68Å; Y130-F144 HydrophobicContact CE1-CE2 3.68Å; Y130-F144 AromaticContact CE1-CZ 3.68Å; Y130-F144 HydrophobicContact CE1-CZ 3.68Å; T140-F144 HydrophobicContact CG2-CD1 4.13Å; T140-F144 HydrophobicContact CG2-CD2 4Å; T140-F144 HydrophobicContact CG2-CE1 3.88Å; T140-F144 HydrophobicContact CG2-CE2 3.73Å; T140-F144 HydrophobicContact CG2-CG 4.22Å; T140-F144 HydrophobicContact CG2-CZ 3.67Å; T140-F144 WeakPolarHBondContact O-CB 3.45Å; T140-F144 WeakPolarHBondContact O-CG 3.07Å; T140-F144 PolarHBondContact O-N 2.94Å; N141-F144 PolarHBondContact O-N 2.81Å; T142-F144 PolarHBondContact O-N 2.92Å; F144-L146 VanDerWaalsContact C-N 3.29Å; F144-L146 PolarHBondContact O-N 2.81Å; F144-Q147 PolarHBondContact O-N 3.31Å; F144-L148 VanDerWaalsContact O-CB 3.23Å; F144-L148 WeakPolarHBondContact O-CB 3.38Å; F144-L148 PolarHBondContact O-N 2.88Å; F144-I172 HydrophobicContact CE1-CD1 4.38Å; F144-I172 HydrophobicContact CE2-CD1 4.31Å; F144-I172 HydrophobicContact CZ-CD1 3.86Å; F144-P184 HydrophobicContact CE1-CB 4.13Å; F144-P184 HydrophobicContact CE1-CG 3.56Å; F144-P184 HydrophobicContact CZ-CB 4.21Å; F144-P184 HydrophobicContact CZ-CG 3.57Å; F144-L186 HydrophobicContact CB-CD2 3.84Å; F144-L186 HydrophobicContact CD1-CD2 3.89Å; F144-L186 HydrophobicContact CG-CD2 4.01Å; F144-L186 WeakPolarHBondContact O-CD2 3.46Å
145M96.1Very high94.8Very high116 Ų11667.4 Ų67.457%0.57135%0.353SS*.Hα-helixtrans-61.8-38.1176.3-70.6-53-5800112.3N141 T142 S143 S149N141-M145 WeakPolarHBondContact O-CG 3.3Å; N141-M145 PolarHBondContact O-N 2.91Å; T142-M145 PolarHBondContact O-N 2.82Å; S143-M145 PolarHBondContact O-N 2.79Å; M145-S149 VanDerWaalsContact O-CB 3.28Å; M145-S149 WeakPolarHBondContact O-CB 3.17Å; M145-S149 PolarHBondContact O-N 3.19Å; M145-S149 PolarHBondContact O-OG 3.48Å
146L97.4Very high95.2Very high121 Ų12163.2 Ų63.263%0.63434%0.336SS*.Hα-helixtrans-67.1-48175.3-69.5171.7000111.6T142 S143 F144 L148 S149 S150T142-L146 HydrophobicContact CG2-CD1 4.36Å; T142-L146 WeakPolarHBondContact O-CG 3.08Å; T142-L146 PolarHBondContact O-N 3.14Å; T142-L146 VanDerWaalsContact O-N 3.09Å; S143-L146 PolarHBondContact O-N 2.87Å; F144-L146 VanDerWaalsContact C-N 3.29Å; F144-L146 PolarHBondContact O-N 2.81Å; L146-L148 PolarHBondContact O-N 3.13Å; L146-S149 PolarHBondContact O-N 2.87Å; L146-S150 WeakPolarHBondContact O-CB 3.25Å; L146-S150 PolarHBondContact O-N 3.47Å
147Q97.6Very high95.7Very high25 Ų2566.1 Ų66.112%0.11734%0.337CS..Hα-helixtrans-61.3-44.6178.9-71.9-178.557.900112.1N66 S143 F144 S150 A151 P184 T185 L186N66-Q147 HydrophobicContact CB-CB 4.48Å; N66-Q147 PolarHBondContact ND2-OE1 3.33Å; S143-Q147 VanDerWaalsContact O-CG 3.32Å; S143-Q147 WeakPolarHBondContact O-CG 3.37Å; S143-Q147 PolarHBondContact O-N 2.96Å; S143-Q147 PolarHBondContact OG-NE2 3.21Å; F144-Q147 PolarHBondContact O-N 3.31Å; Q147-S150 WeakPolarHBondContact O-CB 3.34Å; Q147-S150 PolarHBondContact O-N 3.47Å; Q147-A151 PolarHBondContact O-N 2.91Å; Q147-P184 PolarHBondContact NE2-O 2.86Å; Q147-P184 VanDerWaalsContact NE2-O 3.12Å; Q147-T185 VanDerWaalsContact OE1-CA 3.3Å; Q147-L186 HydrophobicContact CB-CD1 4.13Å; Q147-L186 HydrophobicContact CB-CD2 3.77Å; Q147-L186 HydrophobicContact CB-CG 3.68Å
148L98Very high96Very high24 Ų2465 Ų6513%0.12633%0.331CS..Hα-helixtrans-64.3-43.8177.4179.359.3000111.2F144 L146 S150 A151 L152 L165 I170 L186 V188F144-L148 VanDerWaalsContact O-CB 3.23Å; F144-L148 WeakPolarHBondContact O-CB 3.38Å; F144-L148 PolarHBondContact O-N 2.88Å; L146-L148 PolarHBondContact O-N 3.13Å; L148-S150 VanDerWaalsContact C-N 3.3Å; L148-S150 PolarHBondContact O-N 2.89Å; L148-A151 WeakPolarHBondContact O-CB 3.47Å; L148-A151 PolarHBondContact O-N 3.43Å; L148-L152 HydrophobicContact CD1-CD1 4.34Å; L148-L152 HydrophobicContact CD1-CG 4.26Å; L148-L152 HydrophobicContact CG-CD1 4.28Å; L148-L152 WeakPolarHBondContact O-CG 3.35Å; L148-L152 PolarHBondContact O-N 3.05Å; L148-L165 HydrophobicContact CD1-CD1 3.97Å; L148-L165 HydrophobicContact CD1-CD2 4.4Å; L148-I170 HydrophobicContact CD1-CD1 4.01Å; L148-I170 HydrophobicContact CD2-CD1 4.15Å; L148-L186 HydrophobicContact CB-CD1 4.46Å; L148-L186 HydrophobicContact CB-CD2 4.21Å; L148-V188 HydrophobicContact CD1-CG2 3.7Å
149S98.3Very high96.1Very high67 Ų6763 Ų6347%0.46933%0.331SS..Hα-helixtrans-62.3-40176.6-590000111.5M145 L146 L152 A153M145-S149 VanDerWaalsContact O-CB 3.28Å; M145-S149 WeakPolarHBondContact O-CB 3.17Å; M145-S149 PolarHBondContact O-N 3.19Å; M145-S149 PolarHBondContact O-OG 3.48Å; L146-S149 PolarHBondContact O-N 2.87Å; S149-L152 PolarHBondContact O-N 3.45Å; S149-A153 VanDerWaalsContact O-CB 3.31Å; S149-A153 WeakPolarHBondContact O-CB 3.18Å; S149-A153 PolarHBondContact O-N 3.37Å
150S98.4Very high96.3Very high53 Ų5357.9 Ų57.937%0.37131%0.309SS..Hα-helixtrans-62.9-45174.9-1660000111.6H64 L146 Q147 L148 A153 F154H64-S150 PolarHBondContact CE1-OG 3.17Å; H64-S150 PolarHBondContact NE2-OG 3.27Å; L146-S150 WeakPolarHBondContact O-CB 3.25Å; L146-S150 PolarHBondContact O-N 3.47Å; Q147-S150 WeakPolarHBondContact O-CB 3.34Å; Q147-S150 PolarHBondContact O-N 3.47Å; L148-S150 VanDerWaalsContact C-N 3.3Å; L148-S150 PolarHBondContact O-N 2.89Å; S150-A153 PolarHBondContact O-N 2.86Å; S150-F154 WeakPolarHBondContact O-CB 3.34Å; S150-F154 PolarHBondContact O-N 3.29Å
151A98.3Very high96.5Very high0 Ų062.6 Ų62.60%033%0.333CS..Hα-helixtrans-59.4-48.4176.700000111.9N66 V67 Q147 L148 F154 L155 V188N66-A151 HydrophobicContact CB-CB 3.82Å; N66-A151 VanDerWaalsContact O-CB 3.24Å; N66-A151 WeakPolarHBondContact O-CB 3.28Å; V67-A151 HydrophobicContact CG2-CB 3.88Å; Q147-A151 PolarHBondContact O-N 2.91Å; L148-A151 WeakPolarHBondContact O-CB 3.47Å; L148-A151 PolarHBondContact O-N 3.43Å; A151-F154 WeakPolarHBondContact O-CB 3.49Å; A151-F154 PolarHBondContact O-N 2.97Å; A151-L155 WeakPolarHBondContact O-CG 3.34Å; A151-L155 PolarHBondContact O-N 2.74Å; A151-V188 HydrophobicContact CB-CB 4.26Å; A151-V188 HydrophobicContact CB-CG2 3.51Å
152L98.2Very high96.7Very high38 Ų3860.1 Ų60.120%0.19932%0.32CS..Hα-helixtrans-66-41.7180-66.8177.2000111.9L148 S149 F154 L155 H156 L165L148-L152 HydrophobicContact CD1-CD1 4.34Å; L148-L152 HydrophobicContact CD1-CG 4.26Å; L148-L152 HydrophobicContact CG-CD1 4.28Å; L148-L152 WeakPolarHBondContact O-CG 3.35Å; L148-L152 PolarHBondContact O-N 3.05Å; S149-L152 PolarHBondContact O-N 3.45Å; L152-F154 VanDerWaalsContact C-N 3.26Å; L152-F154 PolarHBondContact O-N 3.01Å; L152-L155 PolarHBondContact O-N 3.37Å; L152-H156 WeakPolarHBondContact O-CB 3.43Å; L152-H156 PolarHBondContact O-N 2.58Å; L152-H156 PolarHBondContact O-ND1 2.83Å; L152-L165 HydrophobicContact CD1-CD2 3.85Å; L152-L165 HydrophobicContact CD2-CD1 4.47Å; L152-L165 HydrophobicContact CD2-CD2 4.21Å
153A98.3Very high96.6Very high59 Ų5966.9 Ų66.949%0.48834%0.336SS..Hα-helixtrans-59.3-40.5174.200000111.5S149 S150 K157S149-A153 VanDerWaalsContact O-CB 3.31Å; S149-A153 WeakPolarHBondContact O-CB 3.18Å; S149-A153 PolarHBondContact O-N 3.37Å; S150-A153 PolarHBondContact O-N 2.86Å; A153-K157 WeakPolarHBondContact O-CB 3.24Å; A153-K157 PolarHBondContact O-N 2.9Å
154F98.3Very high96.5Very high25 Ų2569.2 Ų69.211%0.1135%0.347CS..Hα-helixtrans-63.8-48.1174.3175.8-92000112.4I60 S62 H64 V67 S150 A151 L152 H156 K157 N158I60-F154 HydrophobicContact CD1-CE1 4.45Å; I60-F154 HydrophobicContact CG2-CE1 3.87Å; I60-F154 HydrophobicContact CG2-CZ 3.84Å; S62-F154 VanDerWaalsContact O-CZ 3.25Å; S62-F154 WeakPolarHBondContact O-CZ 3.47Å; H64-F154 HydrophobicContact CB-CB 4.42Å; H64-F154 HydrophobicContact CB-CD1 3.73Å; H64-F154 HydrophobicContact CB-CD2 3.85Å; H64-F154 HydrophobicContact CB-CE1 3.88Å; H64-F154 HydrophobicContact CB-CE2 4Å; H64-F154 HydrophobicContact CB-CG 3.71Å; H64-F154 HydrophobicContact CB-CZ 4.02Å; H64-F154 AromaticContact CD2-CD2 3.79Å; H64-F154 AromaticContact CD2-CG 3.73Å; H64-F154 AromaticContact CG-CG 3.77Å; V67-F154 HydrophobicContact CG2-CD1 3.87Å; V67-F154 HydrophobicContact CG2-CE1 4.5Å; S150-F154 WeakPolarHBondContact O-CB 3.34Å; S150-F154 PolarHBondContact O-N 3.29Å; A151-F154 WeakPolarHBondContact O-CB 3.49Å; A151-F154 PolarHBondContact O-N 2.97Å; L152-F154 VanDerWaalsContact C-N 3.26Å; L152-F154 PolarHBondContact O-N 3.01Å; F154-H156 PolarHBondContact O-N 3.48Å; F154-K157 WeakPolarHBondContact O-CB 3.47Å; F154-K157 PolarHBondContact O-N 3.42Å; F154-N158 WeakPolarHBondContact CZ-ND2 3.38Å; F154-N158 PolarHBondContact O-N 3.32Å; F154-N158 PolarHBondContact O-ND2 3.47Å
155L97.5Very high96.5Very high0 Ų072.5 Ų72.50%036%0.364CS..Hα-helixtrans-60.1-46.8177.6-70.6176.9000111.3I60 V67 A151 L152 K157 N158 Q159 I160 V188 F191I60-L155 HydrophobicContact CD1-CD2 4.09Å; V67-L155 HydrophobicContact CG1-CD2 3.96Å; V67-L155 HydrophobicContact CG2-CD2 4.32Å; V67-L155 HydrophobicContact CG2-CG 4.23Å; A151-L155 WeakPolarHBondContact O-CG 3.34Å; A151-L155 PolarHBondContact O-N 2.74Å; L152-L155 PolarHBondContact O-N 3.37Å; L155-K157 VanDerWaalsContact C-N 3.33Å; L155-K157 PolarHBondContact O-N 3.3Å; L155-N158 CarbonylContact O-C 3.48Å; L155-N158 WeakPolarHBondContact O-CA 3.1Å; L155-N158 PolarHBondContact O-N 2.99Å; L155-Q159 PolarHBondContact O-N 3.29Å; L155-I160 CarbonylContact C-O 3.46Å; L155-I160 VanDerWaalsContact C-O 3.25Å; L155-I160 HydrophobicContact CB-CB 4.29Å; L155-I160 HydrophobicContact CB-CG2 4.45Å; L155-I160 HydrophobicContact CD2-CB 4.36Å; L155-I160 HydrophobicContact CD2-CD1 4.33Å; L155-I160 HydrophobicContact CD2-CG2 4.14Å; L155-I160 PolarHBondContact O-N 3.43Å; L155-V188 HydrophobicContact CD1-CG1 4.09Å; L155-F191 HydrophobicContact CD1-CB 4.19Å; L155-F191 HydrophobicContact CD1-CD1 4.11Å; L155-F191 HydrophobicContact CD1-CG 4.1Å; L155-F191 HydrophobicContact CD2-CD1 4.11Å; L155-F191 HydrophobicContact CD2-CD2 3.99Å; L155-F191 HydrophobicContact CD2-CE1 4.07Å; L155-F191 HydrophobicContact CD2-CE2 3.94Å; L155-F191 HydrophobicContact CD2-CG 4.06Å; L155-F191 HydrophobicContact CD2-CZ 3.97Å
156H97.3Very high96.4Very high98 Ų9870.6 Ų70.645%0.45435%0.353SS..Hα-helixtrans-62.3-38.2178.2-64.5167.3000112.4L152 F154 N158 Q159 I160L152-H156 WeakPolarHBondContact O-CB 3.43Å; L152-H156 PolarHBondContact O-N 2.58Å; L152-H156 PolarHBondContact O-ND1 2.83Å; F154-H156 PolarHBondContact O-N 3.48Å; H156-N158 PolarHBondContact O-N 2.83Å; H156-Q159 PolarHBondContact O-N 3.44Å; H156-I160 PolarHBondContact CD2-O 3.22Å; H156-I160 PolarHBondContact N-O 2.95Å
157K97Very high96.3Very high175 Ų17567.4 Ų67.476%0.76134%0.339SS*.Hα-helixtrans-60.4-31.4173.2-176177.3178179.50112.1A153 F154 L155 Q159A153-K157 WeakPolarHBondContact O-CB 3.24Å; A153-K157 PolarHBondContact O-N 2.9Å; F154-K157 WeakPolarHBondContact O-CB 3.47Å; F154-K157 PolarHBondContact O-N 3.42Å; L155-K157 VanDerWaalsContact C-N 3.33Å; L155-K157 PolarHBondContact O-N 3.3Å; K157-Q159 VanDerWaalsContact C-N 3.31Å
158N95.7Very high96.1Very high47 Ų4770 Ų7025%0.25135%0.354SS..THydrogen-bonded Turntrans-89.714175.1-69.2-83.3000113.4F154 L155 H156 I160F154-N158 WeakPolarHBondContact CZ-ND2 3.38Å; F154-N158 PolarHBondContact O-N 3.32Å; F154-N158 PolarHBondContact O-ND2 3.47Å; L155-N158 CarbonylContact O-C 3.48Å; L155-N158 WeakPolarHBondContact O-CA 3.1Å; L155-N158 PolarHBondContact O-N 2.99Å; H156-N158 PolarHBondContact O-N 2.83Å; N158-I160 HydrophobicContact CB-CD1 4.33Å; N158-I160 PolarHBondContact O-N 3Å
159Q95.1Very high95.9Very high173 Ų17369.4 Ų69.481%0.80835%0.351SS*.THydrogen-bonded Turntrans61.725.3-179.3-55.2-62.5-60.700114.3L155 H156 K157L155-Q159 PolarHBondContact O-N 3.29Å; H156-Q159 PolarHBondContact O-N 3.44Å; K157-Q159 VanDerWaalsContact C-N 3.31Å
160I95Very high95.9Very high15 Ų1566.5 Ų66.58%0.07733%0.33CS..  trans-104.9125.7176.7-62.2169.3000108.5I60 L155 H156 N158 F191I60-I160 HydrophobicContact CD1-CD1 3.88Å; I60-I160 HydrophobicContact CG1-CD1 3.62Å; L155-I160 CarbonylContact C-O 3.46Å; L155-I160 VanDerWaalsContact C-O 3.25Å; L155-I160 HydrophobicContact CB-CB 4.29Å; L155-I160 HydrophobicContact CB-CG2 4.45Å; L155-I160 HydrophobicContact CD2-CB 4.36Å; L155-I160 HydrophobicContact CD2-CD1 4.33Å; L155-I160 HydrophobicContact CD2-CG2 4.14Å; L155-I160 PolarHBondContact O-N 3.43Å; H156-I160 PolarHBondContact CD2-O 3.22Å; H156-I160 PolarHBondContact N-O 2.95Å; N158-I160 HydrophobicContact CB-CD1 4.33Å; N158-I160 PolarHBondContact O-N 3Å; I160-F191 HydrophobicContact CD1-CD2 4.4Å; I160-F191 HydrophobicContact CD1-CE2 4.1Å; I160-F191 HydrophobicContact CG2-CB 4.31Å; I160-F191 HydrophobicContact CG2-CD2 3.58Å; I160-F191 HydrophobicContact CG2-CE2 4.32Å; I160-F191 HydrophobicContact CG2-CG 4.26Å
161I94.9Very high95.8Very high103 Ų10366.3 Ų66.353%0.52832%0.324SS..  trans-108.8122.7169.6-55.6173.1000106.5R163I161-R163 HydrophobicContact CB-CG 4.29Å; I161-R163 HydrophobicContact CG2-CG 3.9Å; I161-R163 WeakPolarHBondContact O-CG 3.25Å; I161-R163 PolarHBondContact O-N 3.46Å
162H94.6Very high95.6Very high8 Ų866.3 Ų66.34%0.03732%0.324CS..  trans-61.3-38.2-174.4-174.3-25.8000114D164 V188 A189 D190 F191H162-D164 PolarHBondContact CE1-O 3.37Å; H162-D164 VanDerWaalsContact CE1-O 3.23Å; H162-D164 PolarHBondContact ND1-N 3.25Å; H162-D164 PolarHBondContact O-N 3.11Å; H162-V188 WeakPolarHBondContact CD2-CG1 3.29Å; H162-A189 PolarHBondContact CE1-O 3.49Å; H162-A189 VanDerWaalsContact CE1-O 3.24Å; H162-A189 PolarHBondContact NE2-O 3.05Å; H162-D190 PolarHBondContact CE1-O 2.81Å; H162-D190 PolarHBondContact ND1-O 2.62Å; H162-F191 HydrophobicContact CB-CB 3.91Å
163R93.2Very high95.4Very high221 Ų22166 Ų6683%0.83433%0.325SS*.SBendtrans60.9-13.7178.1-61.3172.8-173.9-170.32.4117.7I161I161-R163 HydrophobicContact CB-CG 4.29Å; I161-R163 HydrophobicContact CG2-CG 3.9Å; I161-R163 WeakPolarHBondContact O-CG 3.25Å; I161-R163 PolarHBondContact O-N 3.46Å
164D92.1Very high94.7Very high76 Ų7667.8 Ų67.841%0.40632%0.324SS..  trans-134.243.6177.3-169.933.4000110.7H162 K166 N169H162-D164 PolarHBondContact CE1-O 3.37Å; H162-D164 VanDerWaalsContact CE1-O 3.23Å; H162-D164 PolarHBondContact ND1-N 3.25Å; H162-D164 PolarHBondContact O-N 3.11Å; D164-K166 VanDerWaalsContact CG-NZ 3.34Å; D164-K166 PolarHBondContact O-N 3.06Å; D164-K166 VanDerWaalsContact O-N 3.17Å; D164-K166 IonicContact OD1-NZ 2.74Å; D164-K166 PolarHBondContact OD1-NZ 3.47Å; D164-K166 VanDerWaalsContact OD1-NZ 3.15Å; D164-K166 IonicContact OD2-NZ 2.82Å; D164-K166 PolarHBondContact OD2-NZ 2.7Å; D164-N169 PolarHBondContact O-ND2 3.07Å; D164-N169 PolarHBondContact OD2-ND2 2.92Å
165L94.9Very high93.1Very high78 Ų7869.4 Ų69.441%0.40834%0.336SS..  trans-72.7111.6-179.6-174.870.8000110.2L148 L152 I170L148-L165 HydrophobicContact CD1-CD1 3.97Å; L148-L165 HydrophobicContact CD1-CD2 4.4Å; L152-L165 HydrophobicContact CD1-CD2 3.85Å; L152-L165 HydrophobicContact CD2-CD1 4.47Å; L152-L165 HydrophobicContact CD2-CD2 4.21Å; L165-I170 HydrophobicContact CD1-CD1 4.24Å; L165-I170 HydrophobicContact CD1-CG1 4.3Å
166K94.6Very high91.1Very high77 Ų7777.6 Ų77.634%0.33537%0.367SS..SBendtrans-149.8163.2178.364.9-172.9176.2-142.20110.4D164 D168 N169D164-K166 VanDerWaalsContact CG-NZ 3.34Å; D164-K166 PolarHBondContact O-N 3.06Å; D164-K166 VanDerWaalsContact O-N 3.17Å; D164-K166 IonicContact OD1-NZ 2.74Å; D164-K166 PolarHBondContact OD1-NZ 3.47Å; D164-K166 VanDerWaalsContact OD1-NZ 3.15Å; D164-K166 IonicContact OD2-NZ 2.82Å; D164-K166 PolarHBondContact OD2-NZ 2.7Å; K166-D168 HydrophobicContact CD-CB 4.27Å; K166-D168 HydrophobicContact CG-CB 4.1Å; K166-D168 PolarHBondContact O-N 3.21Å; K166-N169 HydrophobicContact CG-CB 4.3Å; K166-N169 PolarHBondContact O-N 3.05Å
167P94.9Very high88.9Confident53 Ų5378.5 Ų78.534%0.34437%0.374SS..G310 helixtrans-54.4-34.9-179.1-28.938000114.3M127 N128 N169 I170M127-P167 HydrophobicContact CB-CB 4.31Å; M127-P167 WeakPolarHBondContact CB-O 3.44Å; M127-P167 HydrophobicContact CG-CB 4.37Å; M127-P167 PolarHBondContact N-O 3.49Å; N128-P167 HydrophobicContact CB-CB 3.9Å; P167-N169 PolarHBondContact O-N 3.48Å; P167-I170 PolarHBondContact O-N 3.45Å; P167-I170 VanDerWaalsContact O-N 3.16Å
168D93.5Very high86.6Confident80 Ų8078.5 Ų78.543%0.42838%0.383SS..G310 helixtrans-62.4-28.8178.3-46.1-112.8000113.1K166K166-D168 HydrophobicContact CD-CB 4.27Å; K166-D168 HydrophobicContact CG-CB 4.1Å; K166-D168 PolarHBondContact O-N 3.21Å
169N94.7Very high84.5Confident11 Ų1180.1 Ų80.16%0.05939%0.394CS..G310 helixtrans-957.3-178.9-68.1-9000112.5D164 K166 P167 A189 D190D164-N169 PolarHBondContact O-ND2 3.07Å; D164-N169 PolarHBondContact OD2-ND2 2.92Å; K166-N169 HydrophobicContact CG-CB 4.3Å; K166-N169 PolarHBondContact O-N 3.05Å; P167-N169 PolarHBondContact O-N 3.48Å; N169-A189 PolarHBondContact O-N 2.71Å; N169-D190 HydrophobicContact CB-CB 4.42Å
170I96.9Very high82.5Confident7 Ų777.8 Ų77.84%0.03640%0.397CS..EExtended strand (participates in β ladder)trans-110.6108.1174.8-58.5173.8000108D126 M127 L148 L165 P167 L186D126-I170 CarbonylContact C-O 3.56Å; D126-I170 WeakPolarHBondContact CA-O 3.25Å; M127-I170 HydrophobicContact CB-CB 3.85Å; M127-I170 HydrophobicContact CB-CG2 4.06Å; M127-I170 WeakPolarHBondContact CB-O 3.47Å; M127-I170 HydrophobicContact CE-CB 4.44Å; M127-I170 HydrophobicContact CE-CD1 4.37Å; M127-I170 HydrophobicContact CE-CG2 3.66Å; M127-I170 PolarHBondContact N-O 3.12Å; M127-I170 HydrophobicContact SD-CB 4.31Å; M127-I170 HydrophobicContact SD-CD1 3.82Å; M127-I170 HydrophobicContact SD-CG2 4.16Å; L148-I170 HydrophobicContact CD1-CD1 4.01Å; L148-I170 HydrophobicContact CD2-CD1 4.15Å; L165-I170 HydrophobicContact CD1-CD1 4.24Å; L165-I170 HydrophobicContact CD1-CG1 4.3Å; P167-I170 PolarHBondContact O-N 3.45Å; P167-I170 VanDerWaalsContact O-N 3.16Å; I170-L186 HydrophobicContact CG2-CB 3.79Å; I170-L186 HydrophobicContact CG2-CD1 4.08Å; I170-L186 HydrophobicContact CG2-CD2 4.31Å; I170-L186 HydrophobicContact CG2-CG 4.28Å
171L96.5Very high80.8Confident48 Ų4883 Ų8325%0.25143%0.425SS..EExtended strand (participates in β ladder)trans-89.8147.7-178.8-57-179.1000111.3I68 C122 D126 L186 K187 A189I68-L171 HydrophobicContact CD1-CD1 4.18Å; C122-L171 HydrophobicContact CB-CB 3.69Å; C122-L171 HydrophobicContact CB-CD1 4.33Å; D126-L171 HydrophobicContact CB-CD2 4.22Å; L171-L186 CarbonylContact O-C 3.25Å; L171-L186 VanDerWaalsContact O-CA 3.26Å; L171-L186 WeakPolarHBondContact O-CA 3.36Å; L171-K187 PolarHBondContact N-O 3.39Å; L171-K187 PolarHBondContact O-N 3.38Å; L171-A189 HydrophobicContact CD1-CB 4Å; L171-A189 HydrophobicContact CG-CB 4.17Å
172I95.3Very high79.6Confident0 Ų082.3 Ų82.30%042%0.422CS..EExtended strand (participates in β ladder)trans-110.1126.5-179.5-53.5-58000109.9C122 D123 G124 G125 M127 Y130 F144 P184 L186C122-I172 CarbonylContact C-O 3.55Å; C122-I172 WeakPolarHBondContact CB-O 3.32Å; D123-I172 PolarHBondContact N-O 3.26Å; G124-I172 WeakPolarHBondContact CA-O 3.37Å; G124-I172 PolarHBondContact N-O 3.02Å; G125-I172 PolarHBondContact O-N 3.46Å; M127-I172 HydrophobicContact CB-CD1 4.36Å; M127-I172 HydrophobicContact CE-CD1 4.3Å; Y130-I172 HydrophobicContact CD2-CB 4.33Å; Y130-I172 HydrophobicContact CD2-CG1 4.13Å; Y130-I172 HydrophobicContact CD2-CG2 3.91Å; Y130-I172 HydrophobicContact CE2-CG2 3.99Å; Y130-I172 HydrophobicContact CG-CG1 3.95Å; Y130-I172 HydrophobicContact CG-CG2 4.48Å; F144-I172 HydrophobicContact CE1-CD1 4.38Å; F144-I172 HydrophobicContact CE2-CD1 4.31Å; F144-I172 HydrophobicContact CZ-CD1 3.86Å; I172-P184 HydrophobicContact CG2-CB 3.87Å; I172-L186 HydrophobicContact CD1-CB 3.97Å
173S92.7Very high79.1Confident31 Ų3184.2 Ų84.222%0.21743%0.431CS..EExtended strand (participates in β ladder)trans-105.1121.8169.3-167.80000108.8T185S173-T185 PolarHBondContact N-O 3.23Å; S173-T185 PolarHBondContact O-N 3.29Å
174Q83.8Confident79Confident97 Ų9774.3 Ų74.345%0.45340%0.395SS..  trans-85.6132174.9-63-176.5-5.900109.2D123 R176D123-Q174 PolarHBondContact OD1-N 2.88Å; Q174-R176 PolarHBondContact O-N 3.25Å
175T66.1Low79.1Confident59 Ų5972.7 Ų72.736%0.36239%0.388SS..  trans-80.5104.2173.8-44.70000108L177 L182T175-L177 HydrophobicContact CG2-CD1 4.33Å; T175-L177 PolarHBondContact O-N 3.5Å; T175-L182 HydrophobicContact CG2-CD1 3.8Å
176R54.8Low79.2Confident172 Ų17269 Ų6965%0.64937%0.369SS*.  trans-77.445179.1-62.5-175.3-177.8-172.1-10.3113.5D123 Q174D123-R176 IonicContact OD2-CZ 2.76Å; D123-R176 VanDerWaalsContact OD2-CZ 3.28Å; D123-R176 IonicContact OD2-NE 3.06Å; D123-R176 PolarHBondContact OD2-NE 2.98Å; D123-R176 IonicContact OD2-NH2 3.28Å; D123-R176 PolarHBondContact OD2-NH2 3.27Å; Q174-R176 PolarHBondContact O-N 3.25Å
177L51.3Low79.3Confident118 Ų11866.7 Ų66.762%0.61836%0.359SS*.SBendtrans-102.2130.6165.4-71167.6000106.2T175 T179 L182T175-L177 HydrophobicContact CG2-CD1 4.33Å; T175-L177 PolarHBondContact O-N 3.5Å; L177-T179 PolarHBondContact O-N 2.99Å; L177-L182 HydrophobicContact CB-CD1 3.83Å; L177-L182 HydrophobicContact CD1-CD1 4.2Å
178D48.1Very low79.4Confident175 Ų17564.1 Ų64.194%0.93634%0.342SS*.SBendtrans-6634.2-176.1-60.9-46.3000113.6
179T50.9Low79.4Confident81 Ų8160.7 Ų60.750%0.49733%0.325SS..  trans-108.5115.9171.257.10000108L177 D181 L182L177-T179 PolarHBondContact O-N 2.99Å; T179-D181 PolarHBondContact O-N 3.45Å; T179-L182 PolarHBondContact O-N 3.2Å; T179-L182 VanDerWaalsContact OG1-CD1 3.24Å; T179-L182 WeakPolarHBondContact OG1-CD1 3.4Å
180S54.6Low79.2Confident123 Ų12363.6 Ų63.686%0.8634%0.341SS*.THydrogen-bonded Turntrans-60.13.1-178.351.30000115.6
181D58.9Low78.7Confident126 Ų12665 Ų6567%0.67435%0.347SS*.THydrogen-bonded Turntrans-111.3-7.1-169.2-69.4-31.2000114.6T179 E183T179-D181 PolarHBondContact O-N 3.45Å; D181-E183 PolarHBondContact O-N 3.38Å
182L70.2Confident77.8Confident88 Ų8865.9 Ų65.946%0.46135%0.351SS..PPolyproline II helixtrans-81.4116.4-179.2-72166000110.9T175 L177 T179T175-L182 HydrophobicContact CG2-CD1 3.8Å; L177-L182 HydrophobicContact CB-CD1 3.83Å; L177-L182 HydrophobicContact CD1-CD1 4.2Å; T179-L182 PolarHBondContact O-N 3.2Å; T179-L182 VanDerWaalsContact OG1-CD1 3.24Å; T179-L182 WeakPolarHBondContact OG1-CD1 3.4Å
183E83.6Confident76.9Confident47 Ų4769.4 Ų69.422%0.2237%0.37CS..PPolyproline II helixtrans-66.5144.5173.4-66.1-70.2143.500110.4K139 T140 D181K139-E183 WeakPolarHBondContact CD-OE1 3.48Å; K139-E183 VanDerWaalsContact CE-OE1 3.23Å; K139-E183 WeakPolarHBondContact CE-OE1 3.38Å; K139-E183 IonicContact NZ-OE1 2.73Å; K139-E183 PolarHBondContact NZ-OE1 3.28Å; T140-E183 VanDerWaalsContact CA-OE2 3.24Å; T140-E183 WeakPolarHBondContact CA-OE2 3.47Å; T140-E183 VanDerWaalsContact CB-OE2 3.26Å; T140-E183 WeakPolarHBondContact CB-OE2 3.45Å; T140-E183 WeakPolarHBondContact CG2-OE2 3.36Å; T140-E183 PolarHBondContact OG1-OE2 3.27Å; D181-E183 PolarHBondContact O-N 3.38Å
184P91.1Very high76.1Confident14 Ų1471.5 Ų71.59%0.09138%0.378CS..PPolyproline II helixtrans-59.4149.5172.627.3-38.3000112.1Y130 T140 F144 Q147 I172Y130-P184 WeakPolarHBondContact OH-CG 3.32Å; T140-P184 HydrophobicContact CG2-CG 4.02Å; F144-P184 HydrophobicContact CE1-CB 4.13Å; F144-P184 HydrophobicContact CE1-CG 3.56Å; F144-P184 HydrophobicContact CZ-CB 4.21Å; F144-P184 HydrophobicContact CZ-CG 3.57Å; Q147-P184 PolarHBondContact NE2-O 2.86Å; Q147-P184 VanDerWaalsContact NE2-O 3.12Å; I172-P184 HydrophobicContact CG2-CB 3.87Å
185T93.9Very high75.6Confident42 Ų4270 Ų7026%0.25837%0.374SS..EExtended strand (participates in β ladder)trans-99.1129.1172.5-570000109.4Q147 S173Q147-T185 VanDerWaalsContact OE1-CA 3.3Å; S173-T185 PolarHBondContact N-O 3.23Å; S173-T185 PolarHBondContact O-N 3.29Å
186L96Very high76.2Confident0 Ų070.7 Ų70.70%038%0.375CS..EExtended strand (participates in β ladder)trans-91.2150.5168.871.983.6000110.8N66 M127 F144 Q147 L148 I170 L171 I172 V188N66-L186 WeakPolarHBondContact CA-O 3.44Å; N66-L186 HydrophobicContact CB-CD1 4.09Å; N66-L186 WeakPolarHBondContact CB-O 3.3Å; N66-L186 PolarHBondContact ND2-O 2.97Å; M127-L186 HydrophobicContact CE-CD2 3.97Å; F144-L186 HydrophobicContact CB-CD2 3.84Å; F144-L186 HydrophobicContact CD1-CD2 3.89Å; F144-L186 HydrophobicContact CG-CD2 4.01Å; F144-L186 WeakPolarHBondContact O-CD2 3.46Å; Q147-L186 HydrophobicContact CB-CD1 4.13Å; Q147-L186 HydrophobicContact CB-CD2 3.77Å; Q147-L186 HydrophobicContact CB-CG 3.68Å; L148-L186 HydrophobicContact CB-CD1 4.46Å; L148-L186 HydrophobicContact CB-CD2 4.21Å; I170-L186 HydrophobicContact CG2-CB 3.79Å; I170-L186 HydrophobicContact CG2-CD1 4.08Å; I170-L186 HydrophobicContact CG2-CD2 4.31Å; I170-L186 HydrophobicContact CG2-CG 4.28Å; L171-L186 CarbonylContact O-C 3.25Å; L171-L186 VanDerWaalsContact O-CA 3.26Å; L171-L186 WeakPolarHBondContact O-CA 3.36Å; I172-L186 HydrophobicContact CD1-CB 3.97Å; L186-V188 HydrophobicContact CD1-CG2 4.23Å
187K97.3Very high77.6Confident28 Ų2863.9 Ų63.912%0.12236%0.356CS..EExtended strand (participates in β ladder)trans-131.2123.3171.8-77.6171.8173.7-86.90109.6P65 N66 I68 D120 L171P65-K187 WeakPolarHBondContact O-CE 3.21Å; P65-K187 WeakPolarHBondContact O-CG 3.29Å; P65-K187 PolarHBondContact O-NZ 3.05Å; N66-K187 WeakPolarHBondContact O-CA 3.33Å; I68-K187 HydrophobicContact CD1-CD 4.36Å; D120-K187 IonicContact OD2-NZ 3.15Å; D120-K187 PolarHBondContact OD2-NZ 3.08Å; L171-K187 PolarHBondContact N-O 3.39Å; L171-K187 PolarHBondContact O-N 3.38Å
188V97.3Very high79.5Confident0 Ų060.1 Ų60.10%034%0.338CS..EExtended strand (participates in β ladder)trans-74.4129.6173.8178.60000109.5N66 I68 L148 A151 L155 H162 L186 F191N66-V188 PolarHBondContact O-N 3.48Å; I68-V188 PolarHBondContact N-O 3.09Å; L148-V188 HydrophobicContact CD1-CG2 3.7Å; A151-V188 HydrophobicContact CB-CB 4.26Å; A151-V188 HydrophobicContact CB-CG2 3.51Å; L155-V188 HydrophobicContact CD1-CG1 4.09Å; H162-V188 WeakPolarHBondContact CD2-CG1 3.29Å; L186-V188 HydrophobicContact CD1-CG2 4.23Å; V188-F191 HydrophobicContact CG1-CD1 4.38Å
189A94.2Very high81.9Confident7 Ų751.2 Ų51.26%0.05829%0.292CS..  trans-125.8175.9-18000000111.3I68 H162 N169 L171 F191I68-A189 HydrophobicContact CB-CB 4.16Å; I68-A189 HydrophobicContact CG2-CB 4.03Å; H162-A189 PolarHBondContact CE1-O 3.49Å; H162-A189 VanDerWaalsContact CE1-O 3.24Å; H162-A189 PolarHBondContact NE2-O 3.05Å; N169-A189 PolarHBondContact O-N 2.71Å; L171-A189 HydrophobicContact CD1-CB 4Å; L171-A189 HydrophobicContact CG-CB 4.17Å; A189-F191 PolarHBondContact O-N 3.36Å
190D89.8Confident84.5Confident73 Ų7348.8 Ų48.839%0.3928%0.275SS..  trans51.843.8173.4-69.1-19.3000115.2K37 H162 N169K37-D190 IonicContact NZ-OD1 3.8Å; K37-D190 PolarHBondContact NZ-OD1 3.5Å; H162-D190 PolarHBondContact CE1-O 2.81Å; H162-D190 PolarHBondContact ND1-O 2.62Å; N169-D190 HydrophobicContact CB-CB 4.42Å
191F87.3Confident87.2Confident37 Ų3742 Ų4216%0.16222%0.221CC..  trans-98.50177.756.2-102.7000114.7A56 L57 I60 V67 I68 L155 I160 H162 V188 A189A56-F191 HydrophobicContact CB-CD2 4.39Å; A56-F191 HydrophobicContact CB-CE2 4.46Å; L57-F191 HydrophobicContact CD2-CE1 4.27Å; L57-F191 HydrophobicContact CD2-CE2 4.11Å; L57-F191 HydrophobicContact CD2-CZ 3.63Å; I60-F191 HydrophobicContact CD1-CE1 4.5Å; I60-F191 HydrophobicContact CD1-CE2 3.53Å; I60-F191 HydrophobicContact CD1-CZ 3.36Å; V67-F191 HydrophobicContact CG1-CD1 4.38Å; V67-F191 HydrophobicContact CG1-CE1 3.43Å; V67-F191 VanDerWaalsContact CG1-CE1 3.43Å; V67-F191 HydrophobicContact CG1-CZ 3.76Å; I68-F191 HydrophobicContact CG2-CE1 4Å; L155-F191 HydrophobicContact CD1-CB 4.19Å; L155-F191 HydrophobicContact CD1-CD1 4.11Å; L155-F191 HydrophobicContact CD1-CG 4.1Å; L155-F191 HydrophobicContact CD2-CD1 4.11Å; L155-F191 HydrophobicContact CD2-CD2 3.99Å; L155-F191 HydrophobicContact CD2-CE1 4.07Å; L155-F191 HydrophobicContact CD2-CE2 3.94Å; L155-F191 HydrophobicContact CD2-CG 4.06Å; L155-F191 HydrophobicContact CD2-CZ 3.97Å; I160-F191 HydrophobicContact CD1-CD2 4.4Å; I160-F191 HydrophobicContact CD1-CE2 4.1Å; I160-F191 HydrophobicContact CG2-CB 4.31Å; I160-F191 HydrophobicContact CG2-CD2 3.58Å; I160-F191 HydrophobicContact CG2-CE2 4.32Å; I160-F191 HydrophobicContact CG2-CG 4.26Å; H162-F191 HydrophobicContact CB-CB 3.91Å; V188-F191 HydrophobicContact CG1-CD1 4.38Å; A189-F191 PolarHBondContact O-N 3.36Å

Retrieved 191 of 191 residues in 41 ms (Link to these results)

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